USER MOD reduce.3.24.130724 H: found=0, std=0, add=888, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 889 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 107 ASN : amide:sc= 0.116 K(o=1.3,f=-14!) USER MOD Set 1.2: B 111 LYS NZ :NH3+ 168:sc= 1.16 (180deg=-0.162) USER MOD Set 2.1: B 106 GLN : amide:sc= 0.407 K(o=1.6,f=-1.1) USER MOD Set 2.2: B 110 TYR OH : rot -87:sc= 1.2 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -179:sc= 0 (180deg=-0.00112) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= -0.185 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 TYR OH : rot 150:sc= 0 USER MOD Single : A 14 GLN : amide:sc= -0.0124 X(o=-0.012,f=-0.05) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 THR OG1 : rot 80:sc= 0.17 USER MOD Single : A 20 ASN : amide:sc= -1.31 K(o=-1.3,f=-3.3!) USER MOD Single : A 22 GLN : amide:sc= -0.321 K(o=-0.32,f=-4.1!) USER MOD Single : A 24 GLN : amide:sc= 1.07 K(o=1.1,f=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= -0.213 X(o=-0.21,f=-0.063) USER MOD Single : A 30 LYS NZ :NH3+ -174:sc= -0.0747 (180deg=-0.193) USER MOD Single : A 33 LYS NZ :NH3+ -173:sc=-0.00161 (180deg=-0.0771) USER MOD Single : A 39 GLN : amide:sc= -1.33! K(o=-1.3!,f=-0.016) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= -0.0592 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 88 SER OG : rot 180:sc= 0 USER MOD Single : B 100 GLN : amide:sc= 0 X(o=0,f=0.006) USER MOD Single : B 101 TYR OH : rot 180:sc= 0 USER MOD Single : B 112 LYS NZ :NH3+ 142:sc= -0.784 (180deg=-2.79!) USER MOD Single : B 115 GLN : amide:sc= -0.642 K(o=-0.64,f=0) USER MOD Single : B 123 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.0037) USER MOD Single : B 130 SER OG : rot 180:sc= -0.0561 USER MOD Single : B 133 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 28.415 -4.345 9.354 1.00 0.00 N ATOM 2 CA MET A 1 29.668 -3.628 9.023 1.00 0.00 C ATOM 3 C MET A 1 29.488 -2.124 9.199 1.00 0.00 C ATOM 4 O MET A 1 29.428 -1.373 8.223 1.00 0.00 O ATOM 5 CB MET A 1 30.109 -3.937 7.587 1.00 0.00 C ATOM 6 CG MET A 1 30.500 -5.389 7.372 1.00 0.00 C ATOM 7 SD MET A 1 31.762 -5.940 8.535 1.00 0.00 S ATOM 8 CE MET A 1 31.949 -7.654 8.045 1.00 0.00 C ATOM 0 H1 MET A 1 28.562 -5.369 9.245 1.00 0.00 H new ATOM 0 H2 MET A 1 28.145 -4.137 10.337 1.00 0.00 H new ATOM 0 H3 MET A 1 27.657 -4.034 8.713 1.00 0.00 H new ATOM 0 HA MET A 1 30.443 -3.973 9.708 1.00 0.00 H new ATOM 0 HB2 MET A 1 29.299 -3.682 6.904 1.00 0.00 H new ATOM 0 HB3 MET A 1 30.955 -3.299 7.330 1.00 0.00 H new ATOM 0 HG2 MET A 1 29.616 -6.019 7.473 1.00 0.00 H new ATOM 0 HG3 MET A 1 30.868 -5.517 6.354 1.00 0.00 H new ATOM 0 HE1 MET A 1 32.699 -8.133 8.675 1.00 0.00 H new ATOM 0 HE2 MET A 1 30.996 -8.171 8.159 1.00 0.00 H new ATOM 0 HE3 MET A 1 32.266 -7.702 7.003 1.00 0.00 H new ATOM 20 N ASP A 2 29.433 -1.690 10.451 1.00 0.00 N ATOM 21 CA ASP A 2 29.151 -0.294 10.776 1.00 0.00 C ATOM 22 C ASP A 2 30.413 0.556 10.691 1.00 0.00 C ATOM 23 O ASP A 2 30.347 1.785 10.695 1.00 0.00 O ATOM 24 CB ASP A 2 28.541 -0.179 12.178 1.00 0.00 C ATOM 25 CG ASP A 2 27.240 -0.944 12.318 1.00 0.00 C ATOM 26 OD1 ASP A 2 27.260 -2.064 12.869 1.00 0.00 O ATOM 27 OD2 ASP A 2 26.194 -0.436 11.874 1.00 0.00 O ATOM 0 H ASP A 2 29.581 -2.287 11.265 1.00 0.00 H new ATOM 0 HA ASP A 2 28.434 0.077 10.044 1.00 0.00 H new ATOM 0 HB2 ASP A 2 29.256 -0.551 12.912 1.00 0.00 H new ATOM 0 HB3 ASP A 2 28.366 0.872 12.408 1.00 0.00 H new ATOM 32 N SER A 3 31.564 -0.100 10.621 1.00 0.00 N ATOM 33 CA SER A 3 32.834 0.603 10.504 1.00 0.00 C ATOM 34 C SER A 3 32.956 1.265 9.134 1.00 0.00 C ATOM 35 O SER A 3 33.538 2.342 8.997 1.00 0.00 O ATOM 36 CB SER A 3 33.994 -0.366 10.727 1.00 0.00 C ATOM 37 OG SER A 3 33.887 -0.997 11.994 1.00 0.00 O ATOM 0 H SER A 3 31.644 -1.117 10.643 1.00 0.00 H new ATOM 0 HA SER A 3 32.871 1.380 11.267 1.00 0.00 H new ATOM 0 HB2 SER A 3 34.001 -1.120 9.940 1.00 0.00 H new ATOM 0 HB3 SER A 3 34.940 0.171 10.662 1.00 0.00 H new ATOM 0 HG SER A 3 34.638 -1.614 12.116 1.00 0.00 H new ATOM 43 N ALA A 4 32.387 0.620 8.127 1.00 0.00 N ATOM 44 CA ALA A 4 32.414 1.150 6.776 1.00 0.00 C ATOM 45 C ALA A 4 31.220 2.062 6.544 1.00 0.00 C ATOM 46 O ALA A 4 31.372 3.232 6.204 1.00 0.00 O ATOM 47 CB ALA A 4 32.426 0.018 5.763 1.00 0.00 C ATOM 0 H ALA A 4 31.901 -0.272 8.222 1.00 0.00 H new ATOM 0 HA ALA A 4 33.325 1.734 6.649 1.00 0.00 H new ATOM 0 HB1 ALA A 4 32.446 0.432 4.755 1.00 0.00 H new ATOM 0 HB2 ALA A 4 33.310 -0.601 5.919 1.00 0.00 H new ATOM 0 HB3 ALA A 4 31.531 -0.591 5.887 1.00 0.00 H new ATOM 53 N ILE A 5 30.027 1.522 6.743 1.00 0.00 N ATOM 54 CA ILE A 5 28.809 2.289 6.560 1.00 0.00 C ATOM 55 C ILE A 5 28.534 3.140 7.794 1.00 0.00 C ATOM 56 O ILE A 5 28.174 2.623 8.850 1.00 0.00 O ATOM 57 CB ILE A 5 27.610 1.360 6.286 1.00 0.00 C ATOM 58 CG1 ILE A 5 27.941 0.419 5.124 1.00 0.00 C ATOM 59 CG2 ILE A 5 26.363 2.180 5.978 1.00 0.00 C ATOM 60 CD1 ILE A 5 26.875 -0.617 4.848 1.00 0.00 C ATOM 0 H ILE A 5 29.879 0.555 7.031 1.00 0.00 H new ATOM 0 HA ILE A 5 28.944 2.941 5.697 1.00 0.00 H new ATOM 0 HB ILE A 5 27.410 0.762 7.175 1.00 0.00 H new ATOM 0 HG12 ILE A 5 28.098 1.012 4.223 1.00 0.00 H new ATOM 0 HG13 ILE A 5 28.881 -0.090 5.339 1.00 0.00 H new ATOM 0 HG21 ILE A 5 25.525 1.510 5.787 1.00 0.00 H new ATOM 0 HG22 ILE A 5 26.129 2.820 6.829 1.00 0.00 H new ATOM 0 HG23 ILE A 5 26.542 2.798 5.098 1.00 0.00 H new ATOM 0 HD11 ILE A 5 27.185 -1.244 4.012 1.00 0.00 H new ATOM 0 HD12 ILE A 5 26.733 -1.237 5.733 1.00 0.00 H new ATOM 0 HD13 ILE A 5 25.938 -0.118 4.600 1.00 0.00 H new ATOM 72 N SER A 6 28.725 4.442 7.656 1.00 0.00 N ATOM 73 CA SER A 6 28.545 5.364 8.763 1.00 0.00 C ATOM 74 C SER A 6 27.083 5.790 8.839 1.00 0.00 C ATOM 75 O SER A 6 26.278 5.392 7.990 1.00 0.00 O ATOM 76 CB SER A 6 29.467 6.580 8.564 1.00 0.00 C ATOM 77 OG SER A 6 29.362 7.514 9.627 1.00 0.00 O ATOM 0 H SER A 6 29.007 4.885 6.782 1.00 0.00 H new ATOM 0 HA SER A 6 28.808 4.879 9.703 1.00 0.00 H new ATOM 0 HB2 SER A 6 30.500 6.241 8.482 1.00 0.00 H new ATOM 0 HB3 SER A 6 29.218 7.073 7.624 1.00 0.00 H new ATOM 0 HG SER A 6 29.965 8.268 9.460 1.00 0.00 H new ATOM 83 N LYS A 7 26.726 6.598 9.835 1.00 0.00 N ATOM 84 CA LYS A 7 25.374 7.126 9.923 1.00 0.00 C ATOM 85 C LYS A 7 25.075 8.016 8.725 1.00 0.00 C ATOM 86 O LYS A 7 23.925 8.344 8.453 1.00 0.00 O ATOM 87 CB LYS A 7 25.157 7.903 11.219 1.00 0.00 C ATOM 88 CG LYS A 7 24.933 7.017 12.434 1.00 0.00 C ATOM 89 CD LYS A 7 24.127 7.737 13.505 1.00 0.00 C ATOM 90 CE LYS A 7 24.823 8.996 13.995 1.00 0.00 C ATOM 91 NZ LYS A 7 23.928 9.828 14.839 1.00 0.00 N ATOM 0 H LYS A 7 27.350 6.897 10.584 1.00 0.00 H new ATOM 0 HA LYS A 7 24.688 6.279 9.921 1.00 0.00 H new ATOM 0 HB2 LYS A 7 26.023 8.540 11.400 1.00 0.00 H new ATOM 0 HB3 LYS A 7 24.297 8.562 11.097 1.00 0.00 H new ATOM 0 HG2 LYS A 7 24.411 6.109 12.133 1.00 0.00 H new ATOM 0 HG3 LYS A 7 25.895 6.710 12.845 1.00 0.00 H new ATOM 0 HD2 LYS A 7 23.146 7.997 13.106 1.00 0.00 H new ATOM 0 HD3 LYS A 7 23.961 7.064 14.346 1.00 0.00 H new ATOM 0 HE2 LYS A 7 25.710 8.722 14.566 1.00 0.00 H new ATOM 0 HE3 LYS A 7 25.162 9.580 13.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 24.439 10.678 15.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 23.094 10.111 14.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 23.624 9.279 15.669 1.00 0.00 H new ATOM 105 N GLU A 8 26.126 8.398 8.016 1.00 0.00 N ATOM 106 CA GLU A 8 26.000 9.125 6.789 1.00 0.00 C ATOM 107 C GLU A 8 25.132 8.342 5.807 1.00 0.00 C ATOM 108 O GLU A 8 24.058 8.788 5.413 1.00 0.00 O ATOM 109 CB GLU A 8 27.398 9.335 6.229 1.00 0.00 C ATOM 110 CG GLU A 8 27.425 10.115 4.945 1.00 0.00 C ATOM 111 CD GLU A 8 26.921 11.533 5.114 1.00 0.00 C ATOM 112 OE1 GLU A 8 25.724 11.782 4.850 1.00 0.00 O ATOM 113 OE2 GLU A 8 27.720 12.404 5.520 1.00 0.00 O ATOM 0 H GLU A 8 27.090 8.205 8.288 1.00 0.00 H new ATOM 0 HA GLU A 8 25.521 10.089 6.958 1.00 0.00 H new ATOM 0 HB2 GLU A 8 28.003 9.855 6.972 1.00 0.00 H new ATOM 0 HB3 GLU A 8 27.863 8.363 6.063 1.00 0.00 H new ATOM 0 HG2 GLU A 8 28.445 10.139 4.560 1.00 0.00 H new ATOM 0 HG3 GLU A 8 26.815 9.603 4.200 1.00 0.00 H new ATOM 120 N ASP A 9 25.586 7.151 5.455 1.00 0.00 N ATOM 121 CA ASP A 9 24.858 6.309 4.517 1.00 0.00 C ATOM 122 C ASP A 9 23.674 5.633 5.191 1.00 0.00 C ATOM 123 O ASP A 9 22.567 5.618 4.653 1.00 0.00 O ATOM 124 CB ASP A 9 25.784 5.252 3.918 1.00 0.00 C ATOM 125 CG ASP A 9 25.065 4.351 2.935 1.00 0.00 C ATOM 126 OD1 ASP A 9 24.265 4.871 2.128 1.00 0.00 O ATOM 127 OD2 ASP A 9 25.324 3.127 2.944 1.00 0.00 O ATOM 0 H ASP A 9 26.454 6.744 5.803 1.00 0.00 H new ATOM 0 HA ASP A 9 24.482 6.949 3.719 1.00 0.00 H new ATOM 0 HB2 ASP A 9 26.617 5.744 3.415 1.00 0.00 H new ATOM 0 HB3 ASP A 9 26.208 4.647 4.719 1.00 0.00 H new ATOM 132 N GLU A 10 23.906 5.106 6.386 1.00 0.00 N ATOM 133 CA GLU A 10 22.899 4.320 7.079 1.00 0.00 C ATOM 134 C GLU A 10 21.650 5.138 7.357 1.00 0.00 C ATOM 135 O GLU A 10 20.582 4.832 6.838 1.00 0.00 O ATOM 136 CB GLU A 10 23.454 3.756 8.388 1.00 0.00 C ATOM 137 CG GLU A 10 22.429 2.963 9.176 1.00 0.00 C ATOM 138 CD GLU A 10 22.956 2.465 10.501 1.00 0.00 C ATOM 139 OE1 GLU A 10 24.077 1.926 10.535 1.00 0.00 O ATOM 140 OE2 GLU A 10 22.241 2.593 11.517 1.00 0.00 O ATOM 0 H GLU A 10 24.784 5.210 6.894 1.00 0.00 H new ATOM 0 HA GLU A 10 22.627 3.492 6.424 1.00 0.00 H new ATOM 0 HB2 GLU A 10 24.308 3.116 8.168 1.00 0.00 H new ATOM 0 HB3 GLU A 10 23.821 4.577 9.004 1.00 0.00 H new ATOM 0 HG2 GLU A 10 21.553 3.587 9.352 1.00 0.00 H new ATOM 0 HG3 GLU A 10 22.100 2.112 8.580 1.00 0.00 H new ATOM 147 N GLU A 11 21.791 6.179 8.167 1.00 0.00 N ATOM 148 CA GLU A 11 20.662 7.006 8.553 1.00 0.00 C ATOM 149 C GLU A 11 19.924 7.562 7.340 1.00 0.00 C ATOM 150 O GLU A 11 18.708 7.725 7.383 1.00 0.00 O ATOM 151 CB GLU A 11 21.123 8.148 9.453 1.00 0.00 C ATOM 152 CG GLU A 11 21.627 7.689 10.811 1.00 0.00 C ATOM 153 CD GLU A 11 20.520 7.162 11.704 1.00 0.00 C ATOM 154 OE1 GLU A 11 20.401 5.929 11.848 1.00 0.00 O ATOM 155 OE2 GLU A 11 19.770 7.984 12.273 1.00 0.00 O ATOM 0 H GLU A 11 22.682 6.469 8.570 1.00 0.00 H new ATOM 0 HA GLU A 11 19.967 6.372 9.103 1.00 0.00 H new ATOM 0 HB2 GLU A 11 21.916 8.699 8.948 1.00 0.00 H new ATOM 0 HB3 GLU A 11 20.295 8.842 9.598 1.00 0.00 H new ATOM 0 HG2 GLU A 11 22.376 6.909 10.671 1.00 0.00 H new ATOM 0 HG3 GLU A 11 22.123 8.522 11.309 1.00 0.00 H new ATOM 162 N ARG A 12 20.643 7.839 6.252 1.00 0.00 N ATOM 163 CA ARG A 12 19.992 8.372 5.058 1.00 0.00 C ATOM 164 C ARG A 12 19.086 7.328 4.412 1.00 0.00 C ATOM 165 O ARG A 12 17.994 7.653 3.943 1.00 0.00 O ATOM 166 CB ARG A 12 21.007 8.889 4.039 1.00 0.00 C ATOM 167 CG ARG A 12 21.690 10.193 4.437 1.00 0.00 C ATOM 168 CD ARG A 12 20.695 11.250 4.894 1.00 0.00 C ATOM 169 NE ARG A 12 20.373 11.124 6.317 1.00 0.00 N ATOM 170 CZ ARG A 12 19.190 11.429 6.850 1.00 0.00 C ATOM 171 NH1 ARG A 12 18.188 11.844 6.081 1.00 0.00 N ATOM 172 NH2 ARG A 12 19.008 11.317 8.158 1.00 0.00 N ATOM 0 H ARG A 12 21.651 7.707 6.173 1.00 0.00 H new ATOM 0 HA ARG A 12 19.380 9.214 5.381 1.00 0.00 H new ATOM 0 HB2 ARG A 12 21.770 8.126 3.885 1.00 0.00 H new ATOM 0 HB3 ARG A 12 20.503 9.034 3.083 1.00 0.00 H new ATOM 0 HG2 ARG A 12 22.403 9.997 5.238 1.00 0.00 H new ATOM 0 HG3 ARG A 12 22.260 10.575 3.590 1.00 0.00 H new ATOM 0 HD2 ARG A 12 21.106 12.241 4.702 1.00 0.00 H new ATOM 0 HD3 ARG A 12 19.781 11.165 4.307 1.00 0.00 H new ATOM 0 HE ARG A 12 21.102 10.780 6.942 1.00 0.00 H new ATOM 0 HH11 ARG A 12 18.321 11.931 5.073 1.00 0.00 H new ATOM 0 HH12 ARG A 12 17.286 12.075 6.499 1.00 0.00 H new ATOM 0 HH21 ARG A 12 19.772 10.998 8.754 1.00 0.00 H new ATOM 0 HH22 ARG A 12 18.104 11.550 8.569 1.00 0.00 H new ATOM 186 N TYR A 13 19.531 6.077 4.398 1.00 0.00 N ATOM 187 CA TYR A 13 18.720 4.996 3.861 1.00 0.00 C ATOM 188 C TYR A 13 17.627 4.602 4.851 1.00 0.00 C ATOM 189 O TYR A 13 16.466 4.441 4.479 1.00 0.00 O ATOM 190 CB TYR A 13 19.594 3.785 3.524 1.00 0.00 C ATOM 191 CG TYR A 13 18.803 2.515 3.312 1.00 0.00 C ATOM 192 CD1 TYR A 13 19.040 1.395 4.094 1.00 0.00 C ATOM 193 CD2 TYR A 13 17.801 2.451 2.352 1.00 0.00 C ATOM 194 CE1 TYR A 13 18.303 0.240 3.925 1.00 0.00 C ATOM 195 CE2 TYR A 13 17.060 1.301 2.174 1.00 0.00 C ATOM 196 CZ TYR A 13 17.314 0.197 2.966 1.00 0.00 C ATOM 197 OH TYR A 13 16.574 -0.952 2.801 1.00 0.00 O ATOM 0 H TYR A 13 20.444 5.789 4.751 1.00 0.00 H new ATOM 0 HA TYR A 13 18.246 5.347 2.944 1.00 0.00 H new ATOM 0 HB2 TYR A 13 20.169 4.001 2.624 1.00 0.00 H new ATOM 0 HB3 TYR A 13 20.311 3.628 4.330 1.00 0.00 H new ATOM 0 HD1 TYR A 13 19.813 1.427 4.847 1.00 0.00 H new ATOM 0 HD2 TYR A 13 17.599 3.315 1.736 1.00 0.00 H new ATOM 0 HE1 TYR A 13 18.500 -0.625 4.541 1.00 0.00 H new ATOM 0 HE2 TYR A 13 16.287 1.264 1.421 1.00 0.00 H new ATOM 0 HH TYR A 13 15.675 -0.720 2.486 1.00 0.00 H new ATOM 207 N GLN A 14 18.015 4.457 6.109 1.00 0.00 N ATOM 208 CA GLN A 14 17.093 4.077 7.177 1.00 0.00 C ATOM 209 C GLN A 14 15.896 5.007 7.231 1.00 0.00 C ATOM 210 O GLN A 14 14.750 4.572 7.156 1.00 0.00 O ATOM 211 CB GLN A 14 17.815 4.114 8.518 1.00 0.00 C ATOM 212 CG GLN A 14 18.878 3.047 8.658 1.00 0.00 C ATOM 213 CD GLN A 14 18.294 1.668 8.873 1.00 0.00 C ATOM 214 OE1 GLN A 14 18.014 0.941 7.920 1.00 0.00 O ATOM 215 NE2 GLN A 14 18.119 1.295 10.130 1.00 0.00 N ATOM 0 H GLN A 14 18.976 4.598 6.421 1.00 0.00 H new ATOM 0 HA GLN A 14 16.738 3.068 6.969 1.00 0.00 H new ATOM 0 HB2 GLN A 14 18.275 5.094 8.648 1.00 0.00 H new ATOM 0 HB3 GLN A 14 17.085 3.996 9.319 1.00 0.00 H new ATOM 0 HG2 GLN A 14 19.499 3.039 7.762 1.00 0.00 H new ATOM 0 HG3 GLN A 14 19.529 3.296 9.496 1.00 0.00 H new ATOM 0 HE21 GLN A 14 18.365 1.930 10.889 1.00 0.00 H new ATOM 0 HE22 GLN A 14 17.738 0.372 10.340 1.00 0.00 H new ATOM 224 N LYS A 15 16.167 6.294 7.356 1.00 0.00 N ATOM 225 CA LYS A 15 15.107 7.282 7.418 1.00 0.00 C ATOM 226 C LYS A 15 14.248 7.261 6.155 1.00 0.00 C ATOM 227 O LYS A 15 13.067 7.597 6.202 1.00 0.00 O ATOM 228 CB LYS A 15 15.676 8.678 7.666 1.00 0.00 C ATOM 229 CG LYS A 15 16.274 8.834 9.053 1.00 0.00 C ATOM 230 CD LYS A 15 15.210 8.686 10.128 1.00 0.00 C ATOM 231 CE LYS A 15 15.827 8.387 11.478 1.00 0.00 C ATOM 232 NZ LYS A 15 14.794 8.207 12.532 1.00 0.00 N ATOM 0 H LYS A 15 17.110 6.678 7.416 1.00 0.00 H new ATOM 0 HA LYS A 15 14.464 7.022 8.259 1.00 0.00 H new ATOM 0 HB2 LYS A 15 16.441 8.891 6.920 1.00 0.00 H new ATOM 0 HB3 LYS A 15 14.886 9.416 7.531 1.00 0.00 H new ATOM 0 HG2 LYS A 15 17.053 8.086 9.203 1.00 0.00 H new ATOM 0 HG3 LYS A 15 16.749 9.811 9.140 1.00 0.00 H new ATOM 0 HD2 LYS A 15 14.623 9.602 10.189 1.00 0.00 H new ATOM 0 HD3 LYS A 15 14.523 7.885 9.855 1.00 0.00 H new ATOM 0 HE2 LYS A 15 16.435 7.485 11.408 1.00 0.00 H new ATOM 0 HE3 LYS A 15 16.495 9.201 11.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 15.257 8.004 13.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 14.230 9.077 12.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 14.171 7.414 12.276 1.00 0.00 H new ATOM 246 N LEU A 16 14.832 6.833 5.039 1.00 0.00 N ATOM 247 CA LEU A 16 14.096 6.728 3.784 1.00 0.00 C ATOM 248 C LEU A 16 13.078 5.600 3.862 1.00 0.00 C ATOM 249 O LEU A 16 11.914 5.780 3.504 1.00 0.00 O ATOM 250 CB LEU A 16 15.049 6.490 2.611 1.00 0.00 C ATOM 251 CG LEU A 16 14.444 6.701 1.221 1.00 0.00 C ATOM 252 CD1 LEU A 16 13.743 8.047 1.144 1.00 0.00 C ATOM 253 CD2 LEU A 16 15.533 6.608 0.171 1.00 0.00 C ATOM 0 H LEU A 16 15.811 6.554 4.979 1.00 0.00 H new ATOM 0 HA LEU A 16 13.573 7.670 3.619 1.00 0.00 H new ATOM 0 HB2 LEU A 16 15.906 7.155 2.720 1.00 0.00 H new ATOM 0 HB3 LEU A 16 15.427 5.470 2.673 1.00 0.00 H new ATOM 0 HG LEU A 16 13.704 5.923 1.034 1.00 0.00 H new ATOM 0 HD11 LEU A 16 13.319 8.180 0.149 1.00 0.00 H new ATOM 0 HD12 LEU A 16 12.946 8.085 1.886 1.00 0.00 H new ATOM 0 HD13 LEU A 16 14.461 8.843 1.342 1.00 0.00 H new ATOM 0 HD21 LEU A 16 15.099 6.759 -0.818 1.00 0.00 H new ATOM 0 HD22 LEU A 16 16.285 7.375 0.358 1.00 0.00 H new ATOM 0 HD23 LEU A 16 15.999 5.624 0.216 1.00 0.00 H new ATOM 265 N VAL A 17 13.516 4.435 4.337 1.00 0.00 N ATOM 266 CA VAL A 17 12.605 3.307 4.522 1.00 0.00 C ATOM 267 C VAL A 17 11.570 3.675 5.563 1.00 0.00 C ATOM 268 O VAL A 17 10.419 3.268 5.481 1.00 0.00 O ATOM 269 CB VAL A 17 13.332 2.006 4.947 1.00 0.00 C ATOM 270 CG1 VAL A 17 14.676 1.916 4.270 1.00 0.00 C ATOM 271 CG2 VAL A 17 13.487 1.894 6.460 1.00 0.00 C ATOM 0 H VAL A 17 14.484 4.248 4.598 1.00 0.00 H new ATOM 0 HA VAL A 17 12.135 3.105 3.560 1.00 0.00 H new ATOM 0 HB VAL A 17 12.711 1.169 4.628 1.00 0.00 H new ATOM 0 HG11 VAL A 17 15.177 0.998 4.577 1.00 0.00 H new ATOM 0 HG12 VAL A 17 14.539 1.911 3.189 1.00 0.00 H new ATOM 0 HG13 VAL A 17 15.285 2.774 4.555 1.00 0.00 H new ATOM 0 HG21 VAL A 17 14.002 0.965 6.705 1.00 0.00 H new ATOM 0 HG22 VAL A 17 14.067 2.739 6.830 1.00 0.00 H new ATOM 0 HG23 VAL A 17 12.503 1.897 6.928 1.00 0.00 H new ATOM 281 N THR A 18 11.996 4.478 6.524 1.00 0.00 N ATOM 282 CA THR A 18 11.131 4.973 7.545 1.00 0.00 C ATOM 283 C THR A 18 9.999 5.773 6.915 1.00 0.00 C ATOM 284 O THR A 18 8.828 5.456 7.112 1.00 0.00 O ATOM 285 CB THR A 18 11.944 5.834 8.521 1.00 0.00 C ATOM 286 OG1 THR A 18 12.709 4.998 9.403 1.00 0.00 O ATOM 287 CG2 THR A 18 11.053 6.752 9.307 1.00 0.00 C ATOM 0 H THR A 18 12.961 4.798 6.605 1.00 0.00 H new ATOM 0 HA THR A 18 10.691 4.144 8.098 1.00 0.00 H new ATOM 0 HB THR A 18 12.629 6.451 7.939 1.00 0.00 H new ATOM 0 HG1 THR A 18 13.513 4.683 8.940 1.00 0.00 H new ATOM 0 HG21 THR A 18 11.657 7.349 9.990 1.00 0.00 H new ATOM 0 HG22 THR A 18 10.518 7.412 8.624 1.00 0.00 H new ATOM 0 HG23 THR A 18 10.336 6.162 9.878 1.00 0.00 H new ATOM 295 N GLU A 19 10.367 6.770 6.111 1.00 0.00 N ATOM 296 CA GLU A 19 9.396 7.572 5.379 1.00 0.00 C ATOM 297 C GLU A 19 8.466 6.674 4.586 1.00 0.00 C ATOM 298 O GLU A 19 7.249 6.840 4.618 1.00 0.00 O ATOM 299 CB GLU A 19 10.111 8.539 4.429 1.00 0.00 C ATOM 300 CG GLU A 19 10.987 9.545 5.153 1.00 0.00 C ATOM 301 CD GLU A 19 11.563 10.597 4.228 1.00 0.00 C ATOM 302 OE1 GLU A 19 10.871 11.609 3.967 1.00 0.00 O ATOM 303 OE2 GLU A 19 12.710 10.430 3.767 1.00 0.00 O ATOM 0 H GLU A 19 11.338 7.040 5.952 1.00 0.00 H new ATOM 0 HA GLU A 19 8.812 8.147 6.098 1.00 0.00 H new ATOM 0 HB2 GLU A 19 10.724 7.968 3.732 1.00 0.00 H new ATOM 0 HB3 GLU A 19 9.368 9.073 3.837 1.00 0.00 H new ATOM 0 HG2 GLU A 19 10.402 10.034 5.932 1.00 0.00 H new ATOM 0 HG3 GLU A 19 11.802 9.019 5.649 1.00 0.00 H new ATOM 310 N ASN A 20 9.072 5.703 3.920 1.00 0.00 N ATOM 311 CA ASN A 20 8.380 4.775 3.039 1.00 0.00 C ATOM 312 C ASN A 20 7.330 3.949 3.793 1.00 0.00 C ATOM 313 O ASN A 20 6.202 3.790 3.324 1.00 0.00 O ATOM 314 CB ASN A 20 9.426 3.867 2.391 1.00 0.00 C ATOM 315 CG ASN A 20 8.937 3.143 1.157 1.00 0.00 C ATOM 316 OD1 ASN A 20 7.982 3.559 0.508 1.00 0.00 O ATOM 317 ND2 ASN A 20 9.625 2.065 0.810 1.00 0.00 N ATOM 0 H ASN A 20 10.076 5.535 3.978 1.00 0.00 H new ATOM 0 HA ASN A 20 7.841 5.336 2.275 1.00 0.00 H new ATOM 0 HB2 ASN A 20 10.297 4.466 2.126 1.00 0.00 H new ATOM 0 HB3 ASN A 20 9.756 3.131 3.124 1.00 0.00 H new ATOM 0 HD21 ASN A 20 9.368 1.544 -0.028 1.00 0.00 H new ATOM 0 HD22 ASN A 20 10.412 1.757 1.381 1.00 0.00 H new ATOM 324 N GLU A 21 7.699 3.423 4.955 1.00 0.00 N ATOM 325 CA GLU A 21 6.785 2.632 5.769 1.00 0.00 C ATOM 326 C GLU A 21 5.631 3.464 6.322 1.00 0.00 C ATOM 327 O GLU A 21 4.477 3.033 6.286 1.00 0.00 O ATOM 328 CB GLU A 21 7.557 2.008 6.916 1.00 0.00 C ATOM 329 CG GLU A 21 8.668 1.108 6.436 1.00 0.00 C ATOM 330 CD GLU A 21 8.169 -0.251 6.002 1.00 0.00 C ATOM 331 OE1 GLU A 21 7.804 -1.063 6.879 1.00 0.00 O ATOM 332 OE2 GLU A 21 8.130 -0.515 4.783 1.00 0.00 O ATOM 0 H GLU A 21 8.631 3.531 5.356 1.00 0.00 H new ATOM 0 HA GLU A 21 6.352 1.861 5.131 1.00 0.00 H new ATOM 0 HB2 GLU A 21 7.976 2.797 7.541 1.00 0.00 H new ATOM 0 HB3 GLU A 21 6.873 1.435 7.542 1.00 0.00 H new ATOM 0 HG2 GLU A 21 9.182 1.585 5.602 1.00 0.00 H new ATOM 0 HG3 GLU A 21 9.401 0.984 7.234 1.00 0.00 H new ATOM 339 N GLN A 22 5.947 4.651 6.830 1.00 0.00 N ATOM 340 CA GLN A 22 4.953 5.489 7.503 1.00 0.00 C ATOM 341 C GLN A 22 3.789 5.832 6.584 1.00 0.00 C ATOM 342 O GLN A 22 2.630 5.558 6.895 1.00 0.00 O ATOM 343 CB GLN A 22 5.568 6.804 7.991 1.00 0.00 C ATOM 344 CG GLN A 22 6.843 6.643 8.802 1.00 0.00 C ATOM 345 CD GLN A 22 7.470 7.975 9.158 1.00 0.00 C ATOM 346 OE1 GLN A 22 8.263 8.522 8.393 1.00 0.00 O ATOM 347 NE2 GLN A 22 7.138 8.497 10.326 1.00 0.00 N ATOM 0 H GLN A 22 6.882 5.057 6.790 1.00 0.00 H new ATOM 0 HA GLN A 22 4.593 4.906 8.351 1.00 0.00 H new ATOM 0 HB2 GLN A 22 5.780 7.434 7.127 1.00 0.00 H new ATOM 0 HB3 GLN A 22 4.832 7.332 8.597 1.00 0.00 H new ATOM 0 HG2 GLN A 22 6.622 6.092 9.716 1.00 0.00 H new ATOM 0 HG3 GLN A 22 7.558 6.047 8.235 1.00 0.00 H new ATOM 0 HE21 GLN A 22 6.476 8.012 10.932 1.00 0.00 H new ATOM 0 HE22 GLN A 22 7.543 9.385 10.621 1.00 0.00 H new ATOM 356 N LEU A 23 4.105 6.419 5.439 1.00 0.00 N ATOM 357 CA LEU A 23 3.088 7.073 4.635 1.00 0.00 C ATOM 358 C LEU A 23 2.259 6.087 3.819 1.00 0.00 C ATOM 359 O LEU A 23 1.127 6.394 3.458 1.00 0.00 O ATOM 360 CB LEU A 23 3.711 8.167 3.756 1.00 0.00 C ATOM 361 CG LEU A 23 4.251 7.755 2.386 1.00 0.00 C ATOM 362 CD1 LEU A 23 4.832 8.964 1.689 1.00 0.00 C ATOM 363 CD2 LEU A 23 5.301 6.667 2.490 1.00 0.00 C ATOM 0 H LEU A 23 5.047 6.455 5.050 1.00 0.00 H new ATOM 0 HA LEU A 23 2.390 7.550 5.323 1.00 0.00 H new ATOM 0 HB2 LEU A 23 2.960 8.942 3.602 1.00 0.00 H new ATOM 0 HB3 LEU A 23 4.528 8.622 4.316 1.00 0.00 H new ATOM 0 HG LEU A 23 3.420 7.352 1.808 1.00 0.00 H new ATOM 0 HD11 LEU A 23 5.217 8.671 0.712 1.00 0.00 H new ATOM 0 HD12 LEU A 23 4.056 9.718 1.561 1.00 0.00 H new ATOM 0 HD13 LEU A 23 5.643 9.376 2.290 1.00 0.00 H new ATOM 0 HD21 LEU A 23 5.655 6.407 1.493 1.00 0.00 H new ATOM 0 HD22 LEU A 23 6.137 7.025 3.090 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.866 5.786 2.962 1.00 0.00 H new ATOM 375 N GLN A 24 2.787 4.895 3.560 1.00 0.00 N ATOM 376 CA GLN A 24 2.009 3.884 2.849 1.00 0.00 C ATOM 377 C GLN A 24 0.898 3.361 3.753 1.00 0.00 C ATOM 378 O GLN A 24 -0.170 2.962 3.287 1.00 0.00 O ATOM 379 CB GLN A 24 2.896 2.739 2.354 1.00 0.00 C ATOM 380 CG GLN A 24 3.563 1.949 3.462 1.00 0.00 C ATOM 381 CD GLN A 24 4.424 0.823 2.933 1.00 0.00 C ATOM 382 OE1 GLN A 24 3.959 -0.304 2.757 1.00 0.00 O ATOM 383 NE2 GLN A 24 5.683 1.120 2.667 1.00 0.00 N ATOM 0 H GLN A 24 3.729 4.608 3.824 1.00 0.00 H new ATOM 0 HA GLN A 24 1.563 4.348 1.969 1.00 0.00 H new ATOM 0 HB2 GLN A 24 2.292 2.060 1.751 1.00 0.00 H new ATOM 0 HB3 GLN A 24 3.666 3.147 1.699 1.00 0.00 H new ATOM 0 HG2 GLN A 24 4.177 2.620 4.063 1.00 0.00 H new ATOM 0 HG3 GLN A 24 2.799 1.539 4.122 1.00 0.00 H new ATOM 0 HE21 GLN A 24 6.029 2.066 2.827 1.00 0.00 H new ATOM 0 HE22 GLN A 24 6.310 0.403 2.301 1.00 0.00 H new ATOM 392 N ARG A 25 1.151 3.409 5.056 1.00 0.00 N ATOM 393 CA ARG A 25 0.158 3.068 6.051 1.00 0.00 C ATOM 394 C ARG A 25 -0.922 4.141 6.067 1.00 0.00 C ATOM 395 O ARG A 25 -2.116 3.851 6.122 1.00 0.00 O ATOM 396 CB ARG A 25 0.843 2.973 7.416 1.00 0.00 C ATOM 397 CG ARG A 25 -0.008 3.484 8.558 1.00 0.00 C ATOM 398 CD ARG A 25 0.841 3.862 9.761 1.00 0.00 C ATOM 399 NE ARG A 25 1.686 2.755 10.204 1.00 0.00 N ATOM 400 CZ ARG A 25 2.703 2.883 11.057 1.00 0.00 C ATOM 401 NH1 ARG A 25 2.994 4.072 11.577 1.00 0.00 N ATOM 402 NH2 ARG A 25 3.424 1.820 11.392 1.00 0.00 N ATOM 0 H ARG A 25 2.052 3.686 5.446 1.00 0.00 H new ATOM 0 HA ARG A 25 -0.305 2.110 5.817 1.00 0.00 H new ATOM 0 HB2 ARG A 25 1.108 1.933 7.608 1.00 0.00 H new ATOM 0 HB3 ARG A 25 1.774 3.539 7.386 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -0.579 4.352 8.227 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -0.729 2.719 8.846 1.00 0.00 H new ATOM 0 HD2 ARG A 25 1.467 4.718 9.508 1.00 0.00 H new ATOM 0 HD3 ARG A 25 0.192 4.173 10.580 1.00 0.00 H new ATOM 0 HE ARG A 25 1.485 1.825 9.837 1.00 0.00 H new ATOM 0 HH11 ARG A 25 2.439 4.889 11.324 1.00 0.00 H new ATOM 0 HH12 ARG A 25 3.773 4.167 12.229 1.00 0.00 H new ATOM 0 HH21 ARG A 25 3.200 0.907 10.997 1.00 0.00 H new ATOM 0 HH22 ARG A 25 4.202 1.917 12.044 1.00 0.00 H new ATOM 416 N LEU A 26 -0.477 5.388 6.000 1.00 0.00 N ATOM 417 CA LEU A 26 -1.370 6.534 5.991 1.00 0.00 C ATOM 418 C LEU A 26 -2.254 6.502 4.755 1.00 0.00 C ATOM 419 O LEU A 26 -3.427 6.864 4.809 1.00 0.00 O ATOM 420 CB LEU A 26 -0.538 7.817 6.055 1.00 0.00 C ATOM 421 CG LEU A 26 0.315 7.926 7.327 1.00 0.00 C ATOM 422 CD1 LEU A 26 1.274 9.102 7.256 1.00 0.00 C ATOM 423 CD2 LEU A 26 -0.578 8.043 8.553 1.00 0.00 C ATOM 0 H LEU A 26 0.512 5.632 5.950 1.00 0.00 H new ATOM 0 HA LEU A 26 -2.026 6.502 6.861 1.00 0.00 H new ATOM 0 HB2 LEU A 26 0.115 7.862 5.183 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.205 8.677 5.999 1.00 0.00 H new ATOM 0 HG LEU A 26 0.911 7.017 7.408 1.00 0.00 H new ATOM 0 HD11 LEU A 26 1.861 9.148 8.173 1.00 0.00 H new ATOM 0 HD12 LEU A 26 1.941 8.976 6.403 1.00 0.00 H new ATOM 0 HD13 LEU A 26 0.708 10.026 7.141 1.00 0.00 H new ATOM 0 HD21 LEU A 26 0.040 8.119 9.447 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -1.201 8.933 8.466 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -1.214 7.161 8.626 1.00 0.00 H new ATOM 435 N ILE A 27 -1.683 6.041 3.652 1.00 0.00 N ATOM 436 CA ILE A 27 -2.443 5.803 2.436 1.00 0.00 C ATOM 437 C ILE A 27 -3.520 4.759 2.684 1.00 0.00 C ATOM 438 O ILE A 27 -4.705 5.019 2.492 1.00 0.00 O ATOM 439 CB ILE A 27 -1.535 5.305 1.298 1.00 0.00 C ATOM 440 CG1 ILE A 27 -0.522 6.376 0.930 1.00 0.00 C ATOM 441 CG2 ILE A 27 -2.351 4.901 0.076 1.00 0.00 C ATOM 442 CD1 ILE A 27 0.484 5.904 -0.085 1.00 0.00 C ATOM 0 H ILE A 27 -0.689 5.823 3.575 1.00 0.00 H new ATOM 0 HA ILE A 27 -2.896 6.751 2.145 1.00 0.00 H new ATOM 0 HB ILE A 27 -1.004 4.421 1.651 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -1.047 7.246 0.537 1.00 0.00 H new ATOM 0 HG13 ILE A 27 0.001 6.699 1.830 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -1.681 4.554 -0.710 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -3.039 4.100 0.346 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -2.918 5.760 -0.283 1.00 0.00 H new ATOM 0 HD11 ILE A 27 1.181 6.711 -0.309 1.00 0.00 H new ATOM 0 HD12 ILE A 27 1.032 5.051 0.316 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -0.032 5.607 -0.998 1.00 0.00 H new ATOM 454 N THR A 28 -3.081 3.586 3.133 1.00 0.00 N ATOM 455 CA THR A 28 -3.962 2.442 3.336 1.00 0.00 C ATOM 456 C THR A 28 -5.159 2.798 4.232 1.00 0.00 C ATOM 457 O THR A 28 -6.271 2.323 3.999 1.00 0.00 O ATOM 458 CB THR A 28 -3.169 1.235 3.913 1.00 0.00 C ATOM 459 OG1 THR A 28 -3.548 0.028 3.243 1.00 0.00 O ATOM 460 CG2 THR A 28 -3.379 1.061 5.414 1.00 0.00 C ATOM 0 H THR A 28 -2.105 3.403 3.366 1.00 0.00 H new ATOM 0 HA THR A 28 -4.362 2.155 2.363 1.00 0.00 H new ATOM 0 HB THR A 28 -2.113 1.445 3.745 1.00 0.00 H new ATOM 0 HG1 THR A 28 -3.041 -0.725 3.613 1.00 0.00 H new ATOM 0 HG21 THR A 28 -2.803 0.205 5.765 1.00 0.00 H new ATOM 0 HG22 THR A 28 -3.047 1.959 5.934 1.00 0.00 H new ATOM 0 HG23 THR A 28 -4.437 0.894 5.616 1.00 0.00 H new ATOM 468 N GLN A 29 -4.928 3.652 5.229 1.00 0.00 N ATOM 469 CA GLN A 29 -5.987 4.099 6.132 1.00 0.00 C ATOM 470 C GLN A 29 -7.012 4.942 5.397 1.00 0.00 C ATOM 471 O GLN A 29 -8.203 4.634 5.374 1.00 0.00 O ATOM 472 CB GLN A 29 -5.395 4.936 7.261 1.00 0.00 C ATOM 473 CG GLN A 29 -4.509 4.159 8.205 1.00 0.00 C ATOM 474 CD GLN A 29 -5.280 3.117 8.990 1.00 0.00 C ATOM 475 OE1 GLN A 29 -5.811 3.401 10.061 1.00 0.00 O ATOM 476 NE2 GLN A 29 -5.347 1.907 8.464 1.00 0.00 N ATOM 0 H GLN A 29 -4.011 4.050 5.432 1.00 0.00 H new ATOM 0 HA GLN A 29 -6.473 3.210 6.535 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -4.818 5.754 6.829 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -6.208 5.386 7.830 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -3.717 3.671 7.637 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -4.026 4.849 8.897 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -4.892 1.713 7.572 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -5.854 1.167 8.950 1.00 0.00 H new ATOM 485 N LYS A 30 -6.527 6.025 4.823 1.00 0.00 N ATOM 486 CA LYS A 30 -7.371 6.946 4.078 1.00 0.00 C ATOM 487 C LYS A 30 -8.136 6.215 2.976 1.00 0.00 C ATOM 488 O LYS A 30 -9.354 6.342 2.878 1.00 0.00 O ATOM 489 CB LYS A 30 -6.513 8.071 3.498 1.00 0.00 C ATOM 490 CG LYS A 30 -5.747 8.834 4.569 1.00 0.00 C ATOM 491 CD LYS A 30 -4.776 9.838 3.975 1.00 0.00 C ATOM 492 CE LYS A 30 -3.996 10.559 5.064 1.00 0.00 C ATOM 493 NZ LYS A 30 -4.885 11.338 5.967 1.00 0.00 N ATOM 0 H LYS A 30 -5.543 6.293 4.858 1.00 0.00 H new ATOM 0 HA LYS A 30 -8.108 7.378 4.755 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -5.807 7.652 2.781 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -7.151 8.764 2.950 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -6.453 9.354 5.217 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -5.200 8.128 5.194 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -4.084 9.327 3.306 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -5.322 10.565 3.374 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -3.434 9.831 5.649 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -3.269 11.229 4.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -4.307 11.893 6.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -5.477 11.980 5.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -5.494 10.686 6.501 1.00 0.00 H new ATOM 507 N GLU A 31 -7.416 5.430 2.180 1.00 0.00 N ATOM 508 CA GLU A 31 -8.011 4.653 1.091 1.00 0.00 C ATOM 509 C GLU A 31 -9.213 3.832 1.549 1.00 0.00 C ATOM 510 O GLU A 31 -10.304 3.968 0.996 1.00 0.00 O ATOM 511 CB GLU A 31 -6.962 3.730 0.474 1.00 0.00 C ATOM 512 CG GLU A 31 -5.962 4.454 -0.408 1.00 0.00 C ATOM 513 CD GLU A 31 -6.530 4.795 -1.770 1.00 0.00 C ATOM 514 OE1 GLU A 31 -7.416 5.669 -1.860 1.00 0.00 O ATOM 515 OE2 GLU A 31 -6.082 4.189 -2.766 1.00 0.00 O ATOM 0 H GLU A 31 -6.407 5.313 2.269 1.00 0.00 H new ATOM 0 HA GLU A 31 -8.367 5.365 0.346 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -6.426 3.218 1.273 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -7.466 2.963 -0.115 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -5.641 5.370 0.088 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -5.076 3.832 -0.533 1.00 0.00 H new ATOM 522 N GLU A 32 -9.023 2.992 2.565 1.00 0.00 N ATOM 523 CA GLU A 32 -10.089 2.098 3.014 1.00 0.00 C ATOM 524 C GLU A 32 -11.284 2.886 3.546 1.00 0.00 C ATOM 525 O GLU A 32 -12.435 2.487 3.362 1.00 0.00 O ATOM 526 CB GLU A 32 -9.587 1.115 4.082 1.00 0.00 C ATOM 527 CG GLU A 32 -8.969 1.773 5.306 1.00 0.00 C ATOM 528 CD GLU A 32 -8.809 0.816 6.468 1.00 0.00 C ATOM 529 OE1 GLU A 32 -9.760 0.685 7.265 1.00 0.00 O ATOM 530 OE2 GLU A 32 -7.738 0.183 6.588 1.00 0.00 O ATOM 0 H GLU A 32 -8.151 2.912 3.088 1.00 0.00 H new ATOM 0 HA GLU A 32 -10.411 1.523 2.146 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -10.421 0.491 4.403 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -8.849 0.453 3.630 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -7.994 2.181 5.040 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -9.592 2.612 5.615 1.00 0.00 H new ATOM 537 N LYS A 33 -11.008 4.016 4.180 1.00 0.00 N ATOM 538 CA LYS A 33 -12.054 4.831 4.776 1.00 0.00 C ATOM 539 C LYS A 33 -12.830 5.585 3.694 1.00 0.00 C ATOM 540 O LYS A 33 -14.046 5.764 3.796 1.00 0.00 O ATOM 541 CB LYS A 33 -11.443 5.806 5.782 1.00 0.00 C ATOM 542 CG LYS A 33 -12.443 6.361 6.784 1.00 0.00 C ATOM 543 CD LYS A 33 -11.785 7.330 7.758 1.00 0.00 C ATOM 544 CE LYS A 33 -10.651 6.675 8.537 1.00 0.00 C ATOM 545 NZ LYS A 33 -11.120 5.525 9.357 1.00 0.00 N ATOM 0 H LYS A 33 -10.066 4.389 4.295 1.00 0.00 H new ATOM 0 HA LYS A 33 -12.753 4.180 5.300 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -10.643 5.301 6.323 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -10.988 6.635 5.240 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -13.247 6.869 6.252 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -12.897 5.540 7.338 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -11.399 8.189 7.209 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -12.533 7.707 8.455 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -9.885 6.334 7.841 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -10.184 7.415 9.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -10.342 5.187 9.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -11.914 5.827 9.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -11.433 4.756 8.730 1.00 0.00 H new ATOM 559 N ILE A 34 -12.122 6.014 2.652 1.00 0.00 N ATOM 560 CA ILE A 34 -12.748 6.702 1.527 1.00 0.00 C ATOM 561 C ILE A 34 -13.690 5.759 0.777 1.00 0.00 C ATOM 562 O ILE A 34 -14.717 6.188 0.247 1.00 0.00 O ATOM 563 CB ILE A 34 -11.691 7.283 0.555 1.00 0.00 C ATOM 564 CG1 ILE A 34 -10.911 8.399 1.242 1.00 0.00 C ATOM 565 CG2 ILE A 34 -12.345 7.809 -0.716 1.00 0.00 C ATOM 566 CD1 ILE A 34 -9.556 8.667 0.615 1.00 0.00 C ATOM 0 H ILE A 34 -11.113 5.897 2.564 1.00 0.00 H new ATOM 0 HA ILE A 34 -13.325 7.533 1.932 1.00 0.00 H new ATOM 0 HB ILE A 34 -11.006 6.482 0.277 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -11.502 9.314 1.215 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -10.772 8.141 2.292 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -11.579 8.211 -1.380 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -12.870 6.996 -1.218 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -13.054 8.597 -0.461 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -9.058 9.472 1.155 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -8.947 7.765 0.666 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -9.688 8.957 -0.427 1.00 0.00 H new ATOM 578 N ARG A 35 -13.352 4.470 0.764 1.00 0.00 N ATOM 579 CA ARG A 35 -14.192 3.462 0.120 1.00 0.00 C ATOM 580 C ARG A 35 -15.585 3.476 0.726 1.00 0.00 C ATOM 581 O ARG A 35 -16.590 3.420 0.016 1.00 0.00 O ATOM 582 CB ARG A 35 -13.596 2.063 0.277 1.00 0.00 C ATOM 583 CG ARG A 35 -12.203 1.910 -0.309 1.00 0.00 C ATOM 584 CD ARG A 35 -11.739 0.463 -0.269 1.00 0.00 C ATOM 585 NE ARG A 35 -11.846 -0.121 1.070 1.00 0.00 N ATOM 586 CZ ARG A 35 -11.239 -1.249 1.441 1.00 0.00 C ATOM 587 NH1 ARG A 35 -10.480 -1.914 0.580 1.00 0.00 N ATOM 588 NH2 ARG A 35 -11.397 -1.712 2.674 1.00 0.00 N ATOM 0 H ARG A 35 -12.503 4.100 1.192 1.00 0.00 H new ATOM 0 HA ARG A 35 -14.246 3.706 -0.941 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -13.562 1.812 1.337 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -14.260 1.342 -0.200 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -12.199 2.266 -1.339 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -11.503 2.534 0.247 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -12.333 -0.126 -0.968 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -10.704 0.407 -0.605 1.00 0.00 H new ATOM 0 HE ARG A 35 -12.419 0.364 1.760 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -10.359 -1.563 -0.370 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -10.018 -2.776 0.868 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -11.983 -1.205 3.338 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -10.933 -2.575 2.958 1.00 0.00 H new ATOM 602 N VAL A 36 -15.632 3.571 2.045 1.00 0.00 N ATOM 603 CA VAL A 36 -16.892 3.601 2.766 1.00 0.00 C ATOM 604 C VAL A 36 -17.654 4.878 2.452 1.00 0.00 C ATOM 605 O VAL A 36 -18.876 4.865 2.291 1.00 0.00 O ATOM 606 CB VAL A 36 -16.671 3.510 4.281 1.00 0.00 C ATOM 607 CG1 VAL A 36 -17.996 3.297 4.995 1.00 0.00 C ATOM 608 CG2 VAL A 36 -15.682 2.402 4.603 1.00 0.00 C ATOM 0 H VAL A 36 -14.806 3.629 2.640 1.00 0.00 H new ATOM 0 HA VAL A 36 -17.472 2.737 2.442 1.00 0.00 H new ATOM 0 HB VAL A 36 -16.248 4.450 4.636 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -17.824 3.234 6.070 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -18.662 4.133 4.782 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -18.453 2.371 4.646 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -15.534 2.348 5.682 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -16.072 1.450 4.242 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -14.729 2.612 4.116 1.00 0.00 H new ATOM 618 N LEU A 37 -16.921 5.983 2.360 1.00 0.00 N ATOM 619 CA LEU A 37 -17.507 7.259 1.969 1.00 0.00 C ATOM 620 C LEU A 37 -18.178 7.137 0.623 1.00 0.00 C ATOM 621 O LEU A 37 -19.268 7.644 0.427 1.00 0.00 O ATOM 622 CB LEU A 37 -16.450 8.363 1.922 1.00 0.00 C ATOM 623 CG LEU A 37 -16.455 9.306 3.120 1.00 0.00 C ATOM 624 CD1 LEU A 37 -17.590 10.308 2.997 1.00 0.00 C ATOM 625 CD2 LEU A 37 -16.579 8.508 4.406 1.00 0.00 C ATOM 0 H LEU A 37 -15.920 6.020 2.551 1.00 0.00 H new ATOM 0 HA LEU A 37 -18.251 7.528 2.719 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -15.466 7.901 1.846 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -16.598 8.950 1.015 1.00 0.00 H new ATOM 0 HG LEU A 37 -15.515 9.857 3.143 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -17.582 10.975 3.859 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -17.463 10.892 2.085 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -18.541 9.777 2.958 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -16.582 9.188 5.258 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -17.509 7.939 4.393 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -15.736 7.823 4.492 1.00 0.00 H new ATOM 637 N ARG A 38 -17.521 6.443 -0.288 1.00 0.00 N ATOM 638 CA ARG A 38 -18.055 6.235 -1.630 1.00 0.00 C ATOM 639 C ARG A 38 -19.422 5.557 -1.575 1.00 0.00 C ATOM 640 O ARG A 38 -20.356 5.991 -2.241 1.00 0.00 O ATOM 641 CB ARG A 38 -17.081 5.411 -2.473 1.00 0.00 C ATOM 642 CG ARG A 38 -15.756 6.115 -2.715 1.00 0.00 C ATOM 643 CD ARG A 38 -14.778 5.239 -3.480 1.00 0.00 C ATOM 644 NE ARG A 38 -15.258 4.910 -4.819 1.00 0.00 N ATOM 645 CZ ARG A 38 -14.460 4.626 -5.847 1.00 0.00 C ATOM 646 NH1 ARG A 38 -13.137 4.673 -5.704 1.00 0.00 N ATOM 647 NH2 ARG A 38 -14.986 4.313 -7.023 1.00 0.00 N ATOM 0 H ARG A 38 -16.612 6.010 -0.126 1.00 0.00 H new ATOM 0 HA ARG A 38 -18.180 7.211 -2.100 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -16.894 4.460 -1.975 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -17.544 5.183 -3.433 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -15.931 7.035 -3.272 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -15.317 6.400 -1.759 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -13.818 5.751 -3.556 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -14.605 4.319 -2.922 1.00 0.00 H new ATOM 0 HE ARG A 38 -16.266 4.897 -4.977 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -12.730 4.927 -4.804 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -12.531 4.455 -6.494 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -15.999 4.290 -7.139 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -14.378 4.095 -7.812 1.00 0.00 H new ATOM 661 N GLN A 39 -19.536 4.510 -0.760 1.00 0.00 N ATOM 662 CA GLN A 39 -20.808 3.812 -0.569 1.00 0.00 C ATOM 663 C GLN A 39 -21.855 4.753 0.006 1.00 0.00 C ATOM 664 O GLN A 39 -23.023 4.722 -0.385 1.00 0.00 O ATOM 665 CB GLN A 39 -20.622 2.633 0.386 1.00 0.00 C ATOM 666 CG GLN A 39 -19.501 1.690 -0.011 1.00 0.00 C ATOM 667 CD GLN A 39 -19.838 0.834 -1.220 1.00 0.00 C ATOM 668 OE1 GLN A 39 -18.957 0.477 -2.002 1.00 0.00 O ATOM 669 NE2 GLN A 39 -21.105 0.484 -1.374 1.00 0.00 N ATOM 0 H GLN A 39 -18.761 4.125 -0.220 1.00 0.00 H new ATOM 0 HA GLN A 39 -21.145 3.451 -1.541 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -20.423 3.017 1.387 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -21.554 2.071 0.439 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -18.604 2.272 -0.225 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -19.266 1.040 0.832 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -21.806 0.800 -0.704 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -21.380 -0.102 -2.162 1.00 0.00 H new ATOM 678 N ARG A 40 -21.422 5.581 0.940 1.00 0.00 N ATOM 679 CA ARG A 40 -22.279 6.580 1.545 1.00 0.00 C ATOM 680 C ARG A 40 -22.710 7.612 0.507 1.00 0.00 C ATOM 681 O ARG A 40 -23.866 8.035 0.471 1.00 0.00 O ATOM 682 CB ARG A 40 -21.532 7.244 2.697 1.00 0.00 C ATOM 683 CG ARG A 40 -21.429 6.357 3.932 1.00 0.00 C ATOM 684 CD ARG A 40 -20.437 6.902 4.950 1.00 0.00 C ATOM 685 NE ARG A 40 -20.411 6.094 6.172 1.00 0.00 N ATOM 686 CZ ARG A 40 -19.370 6.023 7.009 1.00 0.00 C ATOM 687 NH1 ARG A 40 -18.255 6.699 6.760 1.00 0.00 N ATOM 688 NH2 ARG A 40 -19.447 5.271 8.098 1.00 0.00 N ATOM 0 H ARG A 40 -20.467 5.578 1.299 1.00 0.00 H new ATOM 0 HA ARG A 40 -23.180 6.104 1.931 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -20.529 7.513 2.365 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -22.038 8.171 2.964 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -22.411 6.268 4.396 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -21.126 5.354 3.633 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -19.440 6.926 4.509 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -20.700 7.930 5.200 1.00 0.00 H new ATOM 0 HE ARG A 40 -21.243 5.549 6.400 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -18.186 7.279 5.924 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -17.467 6.638 7.405 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -20.299 4.747 8.297 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -18.654 5.216 8.737 1.00 0.00 H new ATOM 702 N LEU A 41 -21.772 8.001 -0.345 1.00 0.00 N ATOM 703 CA LEU A 41 -22.057 8.919 -1.439 1.00 0.00 C ATOM 704 C LEU A 41 -23.009 8.286 -2.443 1.00 0.00 C ATOM 705 O LEU A 41 -23.728 8.990 -3.130 1.00 0.00 O ATOM 706 CB LEU A 41 -20.787 9.335 -2.182 1.00 0.00 C ATOM 707 CG LEU A 41 -19.628 9.840 -1.325 1.00 0.00 C ATOM 708 CD1 LEU A 41 -18.439 10.155 -2.208 1.00 0.00 C ATOM 709 CD2 LEU A 41 -20.021 11.064 -0.514 1.00 0.00 C ATOM 0 H LEU A 41 -20.801 7.693 -0.299 1.00 0.00 H new ATOM 0 HA LEU A 41 -22.513 9.801 -0.990 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -20.436 8.481 -2.761 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -21.050 10.117 -2.895 1.00 0.00 H new ATOM 0 HG LEU A 41 -19.360 9.053 -0.621 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -17.614 10.515 -1.593 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -18.130 9.254 -2.738 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -18.715 10.923 -2.930 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -19.170 11.394 0.083 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -20.324 11.865 -1.188 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -20.851 10.812 0.146 1.00 0.00 H new ATOM 721 N VAL A 42 -22.996 6.958 -2.547 1.00 0.00 N ATOM 722 CA VAL A 42 -23.907 6.258 -3.450 1.00 0.00 C ATOM 723 C VAL A 42 -25.359 6.603 -3.123 1.00 0.00 C ATOM 724 O VAL A 42 -26.163 6.884 -4.016 1.00 0.00 O ATOM 725 CB VAL A 42 -23.710 4.725 -3.372 1.00 0.00 C ATOM 726 CG1 VAL A 42 -24.785 3.997 -4.162 1.00 0.00 C ATOM 727 CG2 VAL A 42 -22.326 4.328 -3.864 1.00 0.00 C ATOM 0 H VAL A 42 -22.369 6.349 -2.021 1.00 0.00 H new ATOM 0 HA VAL A 42 -23.678 6.586 -4.464 1.00 0.00 H new ATOM 0 HB VAL A 42 -23.798 4.432 -2.326 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -24.623 2.921 -4.091 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -25.766 4.244 -3.755 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -24.738 4.302 -5.207 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -22.213 3.246 -3.799 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -22.204 4.644 -4.900 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -21.568 4.810 -3.246 1.00 0.00 H new ATOM 737 N GLU A 43 -25.674 6.609 -1.837 1.00 0.00 N ATOM 738 CA GLU A 43 -27.017 6.934 -1.372 1.00 0.00 C ATOM 739 C GLU A 43 -27.327 8.417 -1.577 1.00 0.00 C ATOM 740 O GLU A 43 -28.486 8.812 -1.690 1.00 0.00 O ATOM 741 CB GLU A 43 -27.156 6.570 0.106 1.00 0.00 C ATOM 742 CG GLU A 43 -26.857 5.110 0.395 1.00 0.00 C ATOM 743 CD GLU A 43 -26.874 4.795 1.874 1.00 0.00 C ATOM 744 OE1 GLU A 43 -27.900 4.278 2.365 1.00 0.00 O ATOM 745 OE2 GLU A 43 -25.864 5.063 2.554 1.00 0.00 O ATOM 0 H GLU A 43 -25.014 6.391 -1.091 1.00 0.00 H new ATOM 0 HA GLU A 43 -27.731 6.355 -1.957 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -26.482 7.195 0.692 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -28.170 6.798 0.436 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -27.590 4.485 -0.114 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -25.880 4.855 -0.016 1.00 0.00 H new ATOM 752 N ARG A 44 -26.285 9.233 -1.625 1.00 0.00 N ATOM 753 CA ARG A 44 -26.443 10.671 -1.810 1.00 0.00 C ATOM 754 C ARG A 44 -26.452 11.030 -3.293 1.00 0.00 C ATOM 755 O ARG A 44 -27.102 11.986 -3.719 1.00 0.00 O ATOM 756 CB ARG A 44 -25.310 11.417 -1.102 1.00 0.00 C ATOM 757 CG ARG A 44 -25.182 11.058 0.368 1.00 0.00 C ATOM 758 CD ARG A 44 -24.062 11.831 1.041 1.00 0.00 C ATOM 759 NE ARG A 44 -23.886 11.421 2.434 1.00 0.00 N ATOM 760 CZ ARG A 44 -23.284 12.163 3.362 1.00 0.00 C ATOM 761 NH1 ARG A 44 -22.850 13.382 3.067 1.00 0.00 N ATOM 762 NH2 ARG A 44 -23.137 11.694 4.595 1.00 0.00 N ATOM 0 H ARG A 44 -25.317 8.924 -1.538 1.00 0.00 H new ATOM 0 HA ARG A 44 -27.398 10.969 -1.377 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -24.369 11.197 -1.606 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -25.478 12.490 -1.194 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -26.124 11.266 0.876 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -24.996 9.989 0.466 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -23.132 11.674 0.495 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -24.280 12.898 1.000 1.00 0.00 H new ATOM 0 HE ARG A 44 -24.247 10.509 2.713 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -22.977 13.755 2.126 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -22.390 13.946 3.781 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -23.485 10.765 4.832 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -22.676 12.263 5.305 1.00 0.00 H new ATOM 776 N GLY A 45 -25.737 10.234 -4.067 1.00 0.00 N ATOM 777 CA GLY A 45 -25.569 10.488 -5.476 1.00 0.00 C ATOM 778 C GLY A 45 -24.239 11.155 -5.755 1.00 0.00 C ATOM 779 O GLY A 45 -24.159 12.377 -5.859 1.00 0.00 O ATOM 0 H GLY A 45 -25.260 9.397 -3.733 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -25.632 9.550 -6.028 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -26.380 11.123 -5.833 1.00 0.00 H new ATOM 783 N ASP A 46 -23.190 10.348 -5.864 1.00 0.00 N ATOM 784 CA ASP A 46 -21.844 10.851 -6.078 1.00 0.00 C ATOM 785 C ASP A 46 -21.726 11.524 -7.444 1.00 0.00 C ATOM 786 O ASP A 46 -20.819 12.320 -7.682 1.00 0.00 O ATOM 787 CB ASP A 46 -20.836 9.704 -5.959 1.00 0.00 C ATOM 788 CG ASP A 46 -20.623 8.950 -7.259 1.00 0.00 C ATOM 789 OD1 ASP A 46 -21.389 8.002 -7.540 1.00 0.00 O ATOM 790 OD2 ASP A 46 -19.686 9.299 -8.007 1.00 0.00 O ATOM 0 H ASP A 46 -23.251 9.331 -5.806 1.00 0.00 H new ATOM 0 HA ASP A 46 -21.626 11.598 -5.314 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -19.881 10.104 -5.619 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -21.180 9.006 -5.195 1.00 0.00 H new ATOM 795 N ALA A 47 -22.670 11.209 -8.328 1.00 0.00 N ATOM 796 CA ALA A 47 -22.705 11.783 -9.668 1.00 0.00 C ATOM 797 C ALA A 47 -22.947 13.289 -9.628 1.00 0.00 C ATOM 798 O ALA A 47 -22.711 13.990 -10.611 1.00 0.00 O ATOM 799 CB ALA A 47 -23.777 11.099 -10.499 1.00 0.00 C ATOM 0 H ALA A 47 -23.427 10.553 -8.136 1.00 0.00 H new ATOM 0 HA ALA A 47 -21.731 11.617 -10.129 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -23.796 11.534 -11.498 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -23.557 10.034 -10.571 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -24.749 11.237 -10.025 1.00 0.00 H new ATOM 805 N LYS A 48 -23.416 13.783 -8.486 1.00 0.00 N ATOM 806 CA LYS A 48 -23.656 15.211 -8.309 1.00 0.00 C ATOM 807 C LYS A 48 -22.335 15.972 -8.215 1.00 0.00 C ATOM 808 O LYS A 48 -22.289 17.185 -8.422 1.00 0.00 O ATOM 809 CB LYS A 48 -24.485 15.462 -7.046 1.00 0.00 C ATOM 810 CG LYS A 48 -25.862 14.801 -7.039 1.00 0.00 C ATOM 811 CD LYS A 48 -26.849 15.499 -7.964 1.00 0.00 C ATOM 812 CE LYS A 48 -26.851 14.902 -9.357 1.00 0.00 C ATOM 813 NZ LYS A 48 -27.818 15.589 -10.252 1.00 0.00 N ATOM 0 H LYS A 48 -23.638 13.215 -7.669 1.00 0.00 H new ATOM 0 HA LYS A 48 -24.210 15.570 -9.177 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -23.923 15.106 -6.183 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -24.613 16.537 -6.921 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -25.762 13.758 -7.340 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -26.257 14.803 -6.023 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -27.851 15.431 -7.540 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -26.600 16.558 -8.025 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -25.850 14.971 -9.783 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -27.100 13.843 -9.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -27.789 15.152 -11.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -28.777 15.502 -9.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -27.565 16.595 -10.329 1.00 0.00 H new ATOM 827 N GLY A 49 -21.265 15.248 -7.912 1.00 0.00 N ATOM 828 CA GLY A 49 -19.967 15.869 -7.757 1.00 0.00 C ATOM 829 C GLY A 49 -19.655 16.160 -6.305 1.00 0.00 C ATOM 830 O GLY A 49 -20.562 16.405 -5.509 1.00 0.00 O ATOM 0 H GLY A 49 -21.275 14.238 -7.771 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -19.199 15.215 -8.170 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -19.937 16.797 -8.329 1.00 0.00 H new ATOM 834 N THR A 50 -18.384 16.110 -5.947 1.00 0.00 N ATOM 835 CA THR A 50 -17.969 16.401 -4.587 1.00 0.00 C ATOM 836 C THR A 50 -16.588 17.051 -4.566 1.00 0.00 C ATOM 837 O THR A 50 -15.566 16.368 -4.490 1.00 0.00 O ATOM 838 CB THR A 50 -17.938 15.123 -3.728 1.00 0.00 C ATOM 839 OG1 THR A 50 -19.139 14.364 -3.931 1.00 0.00 O ATOM 840 CG2 THR A 50 -17.799 15.467 -2.251 1.00 0.00 C ATOM 0 H THR A 50 -17.621 15.870 -6.580 1.00 0.00 H new ATOM 0 HA THR A 50 -18.700 17.093 -4.169 1.00 0.00 H new ATOM 0 HB THR A 50 -17.076 14.530 -4.033 1.00 0.00 H new ATOM 0 HG1 THR A 50 -19.110 13.553 -3.382 1.00 0.00 H new ATOM 0 HG21 THR A 50 -17.779 14.549 -1.664 1.00 0.00 H new ATOM 0 HG22 THR A 50 -16.873 16.020 -2.092 1.00 0.00 H new ATOM 0 HG23 THR A 50 -18.645 16.079 -1.939 1.00 0.00 H new ATOM 848 N GLU A 51 -16.564 18.370 -4.650 1.00 0.00 N ATOM 849 CA GLU A 51 -15.327 19.116 -4.518 1.00 0.00 C ATOM 850 C GLU A 51 -15.413 19.992 -3.284 1.00 0.00 C ATOM 851 O GLU A 51 -16.140 20.988 -3.262 1.00 0.00 O ATOM 852 CB GLU A 51 -15.063 19.983 -5.744 1.00 0.00 C ATOM 853 CG GLU A 51 -13.656 20.548 -5.790 1.00 0.00 C ATOM 854 CD GLU A 51 -13.446 21.520 -6.933 1.00 0.00 C ATOM 855 OE1 GLU A 51 -13.515 22.745 -6.697 1.00 0.00 O ATOM 856 OE2 GLU A 51 -13.204 21.072 -8.071 1.00 0.00 O ATOM 0 H GLU A 51 -17.390 18.947 -4.809 1.00 0.00 H new ATOM 0 HA GLU A 51 -14.503 18.408 -4.427 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -15.239 19.392 -6.643 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -15.778 20.806 -5.759 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -13.442 21.052 -4.848 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -12.944 19.728 -5.882 1.00 0.00 H new ATOM 863 N LEU A 52 -14.685 19.611 -2.258 1.00 0.00 N ATOM 864 CA LEU A 52 -14.756 20.294 -0.976 1.00 0.00 C ATOM 865 C LEU A 52 -13.428 20.960 -0.643 1.00 0.00 C ATOM 866 O LEU A 52 -12.883 20.766 0.442 1.00 0.00 O ATOM 867 CB LEU A 52 -15.144 19.303 0.124 1.00 0.00 C ATOM 868 CG LEU A 52 -16.436 18.517 -0.129 1.00 0.00 C ATOM 869 CD1 LEU A 52 -16.696 17.544 1.009 1.00 0.00 C ATOM 870 CD2 LEU A 52 -17.617 19.460 -0.301 1.00 0.00 C ATOM 0 H LEU A 52 -14.032 18.828 -2.283 1.00 0.00 H new ATOM 0 HA LEU A 52 -15.518 21.070 -1.040 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -14.327 18.594 0.256 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -15.248 19.849 1.062 1.00 0.00 H new ATOM 0 HG LEU A 52 -16.315 17.950 -1.052 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -17.617 16.994 0.814 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -15.864 16.844 1.086 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -16.794 18.096 1.944 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -18.523 18.880 -0.479 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -17.740 20.057 0.603 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -17.435 20.120 -1.150 1.00 0.00 H new ATOM 882 N ASN A 53 -12.918 21.744 -1.591 1.00 0.00 N ATOM 883 CA ASN A 53 -11.662 22.479 -1.417 1.00 0.00 C ATOM 884 C ASN A 53 -10.485 21.526 -1.231 1.00 0.00 C ATOM 885 O ASN A 53 -10.135 21.157 -0.109 1.00 0.00 O ATOM 886 CB ASN A 53 -11.743 23.444 -0.227 1.00 0.00 C ATOM 887 CG ASN A 53 -12.843 24.479 -0.377 1.00 0.00 C ATOM 888 OD1 ASN A 53 -13.974 24.269 0.057 1.00 0.00 O ATOM 889 ND2 ASN A 53 -12.518 25.605 -0.990 1.00 0.00 N ATOM 0 H ASN A 53 -13.360 21.889 -2.499 1.00 0.00 H new ATOM 0 HA ASN A 53 -11.501 23.059 -2.326 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -11.911 22.873 0.686 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -10.786 23.953 -0.113 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -13.217 26.337 -1.117 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -11.568 25.741 -1.336 1.00 0.00 H new TER 896 ASN A 53 ATOM 897 N GLY B 84 33.214 -4.737 3.483 1.00 0.00 N ATOM 898 CA GLY B 84 31.775 -4.816 3.346 1.00 0.00 C ATOM 899 C GLY B 84 31.292 -6.207 2.976 1.00 0.00 C ATOM 900 O GLY B 84 31.998 -7.194 3.195 1.00 0.00 O ATOM 0 HA2 GLY B 84 31.309 -4.512 4.283 1.00 0.00 H new ATOM 0 HA3 GLY B 84 31.448 -4.109 2.584 1.00 0.00 H new ATOM 904 N PRO B 85 30.085 -6.315 2.408 1.00 0.00 N ATOM 905 CA PRO B 85 29.491 -7.593 2.043 1.00 0.00 C ATOM 906 C PRO B 85 29.931 -8.062 0.660 1.00 0.00 C ATOM 907 O PRO B 85 30.839 -7.483 0.060 1.00 0.00 O ATOM 908 CB PRO B 85 28.002 -7.276 2.063 1.00 0.00 C ATOM 909 CG PRO B 85 27.932 -5.876 1.565 1.00 0.00 C ATOM 910 CD PRO B 85 29.189 -5.192 2.060 1.00 0.00 C ATOM 0 HA PRO B 85 29.784 -8.403 2.712 1.00 0.00 H new ATOM 0 HB2 PRO B 85 27.439 -7.957 1.424 1.00 0.00 H new ATOM 0 HB3 PRO B 85 27.587 -7.365 3.067 1.00 0.00 H new ATOM 0 HG2 PRO B 85 27.878 -5.852 0.477 1.00 0.00 H new ATOM 0 HG3 PRO B 85 27.041 -5.373 1.940 1.00 0.00 H new ATOM 0 HD2 PRO B 85 29.626 -4.554 1.292 1.00 0.00 H new ATOM 0 HD3 PRO B 85 28.987 -4.559 2.924 1.00 0.00 H new ATOM 918 N LEU B 86 29.301 -9.126 0.184 1.00 0.00 N ATOM 919 CA LEU B 86 29.586 -9.690 -1.133 1.00 0.00 C ATOM 920 C LEU B 86 29.460 -8.646 -2.251 1.00 0.00 C ATOM 921 O LEU B 86 28.366 -8.351 -2.734 1.00 0.00 O ATOM 922 CB LEU B 86 28.680 -10.907 -1.440 1.00 0.00 C ATOM 923 CG LEU B 86 27.287 -10.981 -0.762 1.00 0.00 C ATOM 924 CD1 LEU B 86 27.394 -11.504 0.664 1.00 0.00 C ATOM 925 CD2 LEU B 86 26.555 -9.639 -0.789 1.00 0.00 C ATOM 0 H LEU B 86 28.576 -9.626 0.699 1.00 0.00 H new ATOM 0 HA LEU B 86 30.622 -10.027 -1.103 1.00 0.00 H new ATOM 0 HB2 LEU B 86 28.526 -10.942 -2.519 1.00 0.00 H new ATOM 0 HB3 LEU B 86 29.230 -11.807 -1.167 1.00 0.00 H new ATOM 0 HG LEU B 86 26.694 -11.686 -1.345 1.00 0.00 H new ATOM 0 HD11 LEU B 86 26.401 -11.544 1.112 1.00 0.00 H new ATOM 0 HD12 LEU B 86 27.828 -12.504 0.653 1.00 0.00 H new ATOM 0 HD13 LEU B 86 28.029 -10.839 1.249 1.00 0.00 H new ATOM 0 HD21 LEU B 86 25.585 -9.744 -0.302 1.00 0.00 H new ATOM 0 HD22 LEU B 86 27.147 -8.891 -0.262 1.00 0.00 H new ATOM 0 HD23 LEU B 86 26.410 -9.324 -1.822 1.00 0.00 H new ATOM 937 N GLY B 87 30.593 -8.112 -2.678 1.00 0.00 N ATOM 938 CA GLY B 87 30.593 -7.120 -3.732 1.00 0.00 C ATOM 939 C GLY B 87 30.341 -7.736 -5.091 1.00 0.00 C ATOM 940 O GLY B 87 29.901 -7.058 -6.016 1.00 0.00 O ATOM 0 H GLY B 87 31.515 -8.349 -2.312 1.00 0.00 H new ATOM 0 HA2 GLY B 87 29.828 -6.372 -3.526 1.00 0.00 H new ATOM 0 HA3 GLY B 87 31.552 -6.601 -3.741 1.00 0.00 H new ATOM 944 N SER B 88 30.591 -9.033 -5.199 1.00 0.00 N ATOM 945 CA SER B 88 30.458 -9.738 -6.465 1.00 0.00 C ATOM 946 C SER B 88 28.996 -10.016 -6.818 1.00 0.00 C ATOM 947 O SER B 88 28.701 -10.494 -7.913 1.00 0.00 O ATOM 948 CB SER B 88 31.249 -11.045 -6.418 1.00 0.00 C ATOM 949 OG SER B 88 32.622 -10.798 -6.154 1.00 0.00 O ATOM 0 H SER B 88 30.889 -9.621 -4.420 1.00 0.00 H new ATOM 0 HA SER B 88 30.862 -9.094 -7.246 1.00 0.00 H new ATOM 0 HB2 SER B 88 30.838 -11.696 -5.646 1.00 0.00 H new ATOM 0 HB3 SER B 88 31.146 -11.571 -7.367 1.00 0.00 H new ATOM 0 HG SER B 88 33.108 -11.649 -6.127 1.00 0.00 H new ATOM 955 N ARG B 89 28.076 -9.723 -5.905 1.00 0.00 N ATOM 956 CA ARG B 89 26.661 -9.915 -6.195 1.00 0.00 C ATOM 957 C ARG B 89 26.112 -8.757 -7.012 1.00 0.00 C ATOM 958 O ARG B 89 25.814 -8.910 -8.196 1.00 0.00 O ATOM 959 CB ARG B 89 25.836 -10.084 -4.920 1.00 0.00 C ATOM 960 CG ARG B 89 25.886 -11.484 -4.334 1.00 0.00 C ATOM 961 CD ARG B 89 24.808 -11.678 -3.280 1.00 0.00 C ATOM 962 NE ARG B 89 23.468 -11.442 -3.819 1.00 0.00 N ATOM 963 CZ ARG B 89 22.391 -11.210 -3.067 1.00 0.00 C ATOM 964 NH1 ARG B 89 22.482 -11.226 -1.741 1.00 0.00 N ATOM 965 NH2 ARG B 89 21.218 -10.974 -3.644 1.00 0.00 N ATOM 0 H ARG B 89 28.280 -9.358 -4.974 1.00 0.00 H new ATOM 0 HA ARG B 89 26.579 -10.833 -6.776 1.00 0.00 H new ATOM 0 HB2 ARG B 89 26.192 -9.375 -4.172 1.00 0.00 H new ATOM 0 HB3 ARG B 89 24.798 -9.827 -5.134 1.00 0.00 H new ATOM 0 HG2 ARG B 89 25.757 -12.219 -5.129 1.00 0.00 H new ATOM 0 HG3 ARG B 89 26.866 -11.661 -3.892 1.00 0.00 H new ATOM 0 HD2 ARG B 89 24.866 -12.692 -2.884 1.00 0.00 H new ATOM 0 HD3 ARG B 89 24.989 -10.999 -2.447 1.00 0.00 H new ATOM 0 HE ARG B 89 23.350 -11.456 -4.832 1.00 0.00 H new ATOM 0 HH11 ARG B 89 23.379 -11.416 -1.294 1.00 0.00 H new ATOM 0 HH12 ARG B 89 21.655 -11.048 -1.171 1.00 0.00 H new ATOM 0 HH21 ARG B 89 21.142 -10.970 -4.661 1.00 0.00 H new ATOM 0 HH22 ARG B 89 20.394 -10.796 -3.070 1.00 0.00 H new ATOM 979 N ARG B 90 25.987 -7.599 -6.383 1.00 0.00 N ATOM 980 CA ARG B 90 25.439 -6.427 -7.052 1.00 0.00 C ATOM 981 C ARG B 90 26.287 -5.200 -6.766 1.00 0.00 C ATOM 982 O ARG B 90 25.922 -4.081 -7.136 1.00 0.00 O ATOM 983 CB ARG B 90 24.005 -6.168 -6.582 1.00 0.00 C ATOM 984 CG ARG B 90 23.057 -7.326 -6.829 1.00 0.00 C ATOM 985 CD ARG B 90 21.704 -7.080 -6.185 1.00 0.00 C ATOM 986 NE ARG B 90 21.799 -6.986 -4.729 1.00 0.00 N ATOM 987 CZ ARG B 90 20.941 -6.308 -3.970 1.00 0.00 C ATOM 988 NH1 ARG B 90 19.945 -5.637 -4.531 1.00 0.00 N ATOM 989 NH2 ARG B 90 21.088 -6.292 -2.653 1.00 0.00 N ATOM 0 H ARG B 90 26.257 -7.444 -5.412 1.00 0.00 H new ATOM 0 HA ARG B 90 25.441 -6.621 -8.125 1.00 0.00 H new ATOM 0 HB2 ARG B 90 24.018 -5.943 -5.515 1.00 0.00 H new ATOM 0 HB3 ARG B 90 23.621 -5.283 -7.089 1.00 0.00 H new ATOM 0 HG2 ARG B 90 22.930 -7.472 -7.902 1.00 0.00 H new ATOM 0 HG3 ARG B 90 23.490 -8.244 -6.431 1.00 0.00 H new ATOM 0 HD2 ARG B 90 21.276 -6.159 -6.581 1.00 0.00 H new ATOM 0 HD3 ARG B 90 21.023 -7.888 -6.452 1.00 0.00 H new ATOM 0 HE ARG B 90 22.569 -7.469 -4.267 1.00 0.00 H new ATOM 0 HH11 ARG B 90 19.836 -5.640 -5.545 1.00 0.00 H new ATOM 0 HH12 ARG B 90 19.288 -5.118 -3.949 1.00 0.00 H new ATOM 0 HH21 ARG B 90 21.859 -6.800 -2.220 1.00 0.00 H new ATOM 0 HH22 ARG B 90 20.430 -5.772 -2.073 1.00 0.00 H new ATOM 1003 N PHE B 91 27.429 -5.427 -6.111 1.00 0.00 N ATOM 1004 CA PHE B 91 28.284 -4.348 -5.621 1.00 0.00 C ATOM 1005 C PHE B 91 27.555 -3.544 -4.544 1.00 0.00 C ATOM 1006 O PHE B 91 26.326 -3.465 -4.527 1.00 0.00 O ATOM 1007 CB PHE B 91 28.732 -3.432 -6.770 1.00 0.00 C ATOM 1008 CG PHE B 91 29.526 -4.142 -7.830 1.00 0.00 C ATOM 1009 CD1 PHE B 91 30.893 -4.313 -7.693 1.00 0.00 C ATOM 1010 CD2 PHE B 91 28.903 -4.640 -8.965 1.00 0.00 C ATOM 1011 CE1 PHE B 91 31.624 -4.968 -8.666 1.00 0.00 C ATOM 1012 CE2 PHE B 91 29.628 -5.294 -9.940 1.00 0.00 C ATOM 1013 CZ PHE B 91 30.991 -5.460 -9.790 1.00 0.00 C ATOM 0 H PHE B 91 27.784 -6.361 -5.907 1.00 0.00 H new ATOM 0 HA PHE B 91 29.177 -4.793 -5.182 1.00 0.00 H new ATOM 0 HB2 PHE B 91 27.852 -2.981 -7.228 1.00 0.00 H new ATOM 0 HB3 PHE B 91 29.332 -2.618 -6.362 1.00 0.00 H new ATOM 0 HD1 PHE B 91 31.394 -3.930 -6.816 1.00 0.00 H new ATOM 0 HD2 PHE B 91 27.837 -4.514 -9.087 1.00 0.00 H new ATOM 0 HE1 PHE B 91 32.690 -5.095 -8.547 1.00 0.00 H new ATOM 0 HE2 PHE B 91 29.130 -5.676 -10.819 1.00 0.00 H new ATOM 0 HZ PHE B 91 31.560 -5.974 -10.550 1.00 0.00 H new ATOM 1023 N VAL B 92 28.320 -2.955 -3.639 1.00 0.00 N ATOM 1024 CA VAL B 92 27.750 -2.185 -2.538 1.00 0.00 C ATOM 1025 C VAL B 92 27.020 -0.959 -3.080 1.00 0.00 C ATOM 1026 O VAL B 92 26.189 -0.357 -2.407 1.00 0.00 O ATOM 1027 CB VAL B 92 28.843 -1.753 -1.533 1.00 0.00 C ATOM 1028 CG1 VAL B 92 28.232 -1.085 -0.308 1.00 0.00 C ATOM 1029 CG2 VAL B 92 29.690 -2.950 -1.120 1.00 0.00 C ATOM 0 H VAL B 92 29.339 -2.994 -3.643 1.00 0.00 H new ATOM 0 HA VAL B 92 27.040 -2.822 -2.011 1.00 0.00 H new ATOM 0 HB VAL B 92 29.485 -1.024 -2.028 1.00 0.00 H new ATOM 0 HG11 VAL B 92 29.025 -0.792 0.380 1.00 0.00 H new ATOM 0 HG12 VAL B 92 27.674 -0.201 -0.616 1.00 0.00 H new ATOM 0 HG13 VAL B 92 27.559 -1.783 0.190 1.00 0.00 H new ATOM 0 HG21 VAL B 92 30.454 -2.628 -0.413 1.00 0.00 H new ATOM 0 HG22 VAL B 92 29.054 -3.701 -0.651 1.00 0.00 H new ATOM 0 HG23 VAL B 92 30.168 -3.379 -2.001 1.00 0.00 H new ATOM 1039 N VAL B 93 27.329 -0.613 -4.321 1.00 0.00 N ATOM 1040 CA VAL B 93 26.690 0.505 -4.991 1.00 0.00 C ATOM 1041 C VAL B 93 25.200 0.242 -5.218 1.00 0.00 C ATOM 1042 O VAL B 93 24.365 1.111 -4.967 1.00 0.00 O ATOM 1043 CB VAL B 93 27.366 0.798 -6.345 1.00 0.00 C ATOM 1044 CG1 VAL B 93 26.727 2.003 -7.022 1.00 0.00 C ATOM 1045 CG2 VAL B 93 28.861 1.013 -6.159 1.00 0.00 C ATOM 0 H VAL B 93 28.026 -1.097 -4.887 1.00 0.00 H new ATOM 0 HA VAL B 93 26.800 1.372 -4.339 1.00 0.00 H new ATOM 0 HB VAL B 93 27.221 -0.067 -6.993 1.00 0.00 H new ATOM 0 HG11 VAL B 93 27.221 2.189 -7.975 1.00 0.00 H new ATOM 0 HG12 VAL B 93 25.669 1.805 -7.194 1.00 0.00 H new ATOM 0 HG13 VAL B 93 26.832 2.879 -6.381 1.00 0.00 H new ATOM 0 HG21 VAL B 93 29.322 1.219 -7.125 1.00 0.00 H new ATOM 0 HG22 VAL B 93 29.027 1.858 -5.491 1.00 0.00 H new ATOM 0 HG23 VAL B 93 29.307 0.117 -5.728 1.00 0.00 H new ATOM 1055 N ASP B 94 24.861 -0.965 -5.668 1.00 0.00 N ATOM 1056 CA ASP B 94 23.481 -1.266 -6.032 1.00 0.00 C ATOM 1057 C ASP B 94 22.593 -1.427 -4.808 1.00 0.00 C ATOM 1058 O ASP B 94 21.505 -0.868 -4.752 1.00 0.00 O ATOM 1059 CB ASP B 94 23.405 -2.511 -6.907 1.00 0.00 C ATOM 1060 CG ASP B 94 21.989 -2.881 -7.305 1.00 0.00 C ATOM 1061 OD1 ASP B 94 21.506 -2.372 -8.340 1.00 0.00 O ATOM 1062 OD2 ASP B 94 21.359 -3.691 -6.598 1.00 0.00 O ATOM 0 H ASP B 94 25.514 -1.739 -5.788 1.00 0.00 H new ATOM 0 HA ASP B 94 23.110 -0.415 -6.602 1.00 0.00 H new ATOM 0 HB2 ASP B 94 23.997 -2.350 -7.808 1.00 0.00 H new ATOM 0 HB3 ASP B 94 23.856 -3.349 -6.375 1.00 0.00 H new ATOM 1067 N ASP B 95 23.043 -2.170 -3.812 1.00 0.00 N ATOM 1068 CA ASP B 95 22.220 -2.346 -2.623 1.00 0.00 C ATOM 1069 C ASP B 95 22.046 -1.016 -1.900 1.00 0.00 C ATOM 1070 O ASP B 95 21.019 -0.770 -1.279 1.00 0.00 O ATOM 1071 CB ASP B 95 22.777 -3.419 -1.672 1.00 0.00 C ATOM 1072 CG ASP B 95 24.120 -3.074 -1.054 1.00 0.00 C ATOM 1073 OD1 ASP B 95 24.163 -2.210 -0.153 1.00 0.00 O ATOM 1074 OD2 ASP B 95 25.127 -3.709 -1.433 1.00 0.00 O ATOM 0 H ASP B 95 23.944 -2.648 -3.797 1.00 0.00 H new ATOM 0 HA ASP B 95 21.244 -2.701 -2.955 1.00 0.00 H new ATOM 0 HB2 ASP B 95 22.056 -3.588 -0.872 1.00 0.00 H new ATOM 0 HB3 ASP B 95 22.873 -4.357 -2.219 1.00 0.00 H new ATOM 1079 N ARG B 96 23.012 -0.126 -2.050 1.00 0.00 N ATOM 1080 CA ARG B 96 22.973 1.141 -1.334 1.00 0.00 C ATOM 1081 C ARG B 96 22.247 2.198 -2.148 1.00 0.00 C ATOM 1082 O ARG B 96 21.107 2.544 -1.853 1.00 0.00 O ATOM 1083 CB ARG B 96 24.388 1.628 -1.011 1.00 0.00 C ATOM 1084 CG ARG B 96 24.439 3.071 -0.528 1.00 0.00 C ATOM 1085 CD ARG B 96 25.863 3.592 -0.477 1.00 0.00 C ATOM 1086 NE ARG B 96 26.624 3.004 0.620 1.00 0.00 N ATOM 1087 CZ ARG B 96 27.920 2.722 0.560 1.00 0.00 C ATOM 1088 NH1 ARG B 96 28.604 2.957 -0.553 1.00 0.00 N ATOM 1089 NH2 ARG B 96 28.540 2.216 1.619 1.00 0.00 N ATOM 0 H ARG B 96 23.825 -0.253 -2.653 1.00 0.00 H new ATOM 0 HA ARG B 96 22.433 0.977 -0.402 1.00 0.00 H new ATOM 0 HB2 ARG B 96 24.820 0.982 -0.247 1.00 0.00 H new ATOM 0 HB3 ARG B 96 25.010 1.529 -1.901 1.00 0.00 H new ATOM 0 HG2 ARG B 96 23.845 3.699 -1.192 1.00 0.00 H new ATOM 0 HG3 ARG B 96 23.990 3.140 0.463 1.00 0.00 H new ATOM 0 HD2 ARG B 96 26.362 3.374 -1.421 1.00 0.00 H new ATOM 0 HD3 ARG B 96 25.848 4.676 -0.367 1.00 0.00 H new ATOM 0 HE ARG B 96 26.129 2.797 1.488 1.00 0.00 H new ATOM 0 HH11 ARG B 96 28.134 3.356 -1.366 1.00 0.00 H new ATOM 0 HH12 ARG B 96 29.600 2.739 -0.595 1.00 0.00 H new ATOM 0 HH21 ARG B 96 28.021 2.043 2.480 1.00 0.00 H new ATOM 0 HH22 ARG B 96 29.536 2.000 1.572 1.00 0.00 H new ATOM 1103 N ARG B 97 22.896 2.655 -3.210 1.00 0.00 N ATOM 1104 CA ARG B 97 22.396 3.766 -3.999 1.00 0.00 C ATOM 1105 C ARG B 97 21.159 3.341 -4.764 1.00 0.00 C ATOM 1106 O ARG B 97 20.184 4.080 -4.850 1.00 0.00 O ATOM 1107 CB ARG B 97 23.495 4.248 -4.959 1.00 0.00 C ATOM 1108 CG ARG B 97 23.211 5.575 -5.660 1.00 0.00 C ATOM 1109 CD ARG B 97 22.245 5.428 -6.829 1.00 0.00 C ATOM 1110 NE ARG B 97 22.067 6.696 -7.537 1.00 0.00 N ATOM 1111 CZ ARG B 97 21.438 6.825 -8.705 1.00 0.00 C ATOM 1112 NH1 ARG B 97 20.925 5.765 -9.319 1.00 0.00 N ATOM 1113 NH2 ARG B 97 21.320 8.022 -9.264 1.00 0.00 N ATOM 0 H ARG B 97 23.778 2.267 -3.545 1.00 0.00 H new ATOM 0 HA ARG B 97 22.122 4.590 -3.340 1.00 0.00 H new ATOM 0 HB2 ARG B 97 24.427 4.342 -4.401 1.00 0.00 H new ATOM 0 HB3 ARG B 97 23.654 3.482 -5.718 1.00 0.00 H new ATOM 0 HG2 ARG B 97 22.798 6.281 -4.939 1.00 0.00 H new ATOM 0 HG3 ARG B 97 24.148 5.999 -6.020 1.00 0.00 H new ATOM 0 HD2 ARG B 97 22.620 4.673 -7.520 1.00 0.00 H new ATOM 0 HD3 ARG B 97 21.281 5.075 -6.464 1.00 0.00 H new ATOM 0 HE ARG B 97 22.450 7.538 -7.108 1.00 0.00 H new ATOM 0 HH11 ARG B 97 21.010 4.840 -8.897 1.00 0.00 H new ATOM 0 HH12 ARG B 97 20.446 5.876 -10.213 1.00 0.00 H new ATOM 0 HH21 ARG B 97 21.710 8.842 -8.800 1.00 0.00 H new ATOM 0 HH22 ARG B 97 20.839 8.122 -10.158 1.00 0.00 H new ATOM 1127 N GLU B 98 21.199 2.135 -5.292 1.00 0.00 N ATOM 1128 CA GLU B 98 20.142 1.654 -6.155 1.00 0.00 C ATOM 1129 C GLU B 98 18.926 1.154 -5.378 1.00 0.00 C ATOM 1130 O GLU B 98 17.792 1.324 -5.834 1.00 0.00 O ATOM 1131 CB GLU B 98 20.672 0.570 -7.072 1.00 0.00 C ATOM 1132 CG GLU B 98 21.535 1.114 -8.190 1.00 0.00 C ATOM 1133 CD GLU B 98 20.734 1.917 -9.186 1.00 0.00 C ATOM 1134 OE1 GLU B 98 20.728 3.160 -9.088 1.00 0.00 O ATOM 1135 OE2 GLU B 98 20.099 1.305 -10.070 1.00 0.00 O ATOM 0 H GLU B 98 21.955 1.468 -5.137 1.00 0.00 H new ATOM 0 HA GLU B 98 19.803 2.501 -6.752 1.00 0.00 H new ATOM 0 HB2 GLU B 98 21.252 -0.143 -6.486 1.00 0.00 H new ATOM 0 HB3 GLU B 98 19.833 0.022 -7.501 1.00 0.00 H new ATOM 0 HG2 GLU B 98 22.321 1.740 -7.769 1.00 0.00 H new ATOM 0 HG3 GLU B 98 22.027 0.287 -8.703 1.00 0.00 H new ATOM 1142 N LEU B 99 19.126 0.535 -4.215 1.00 0.00 N ATOM 1143 CA LEU B 99 17.986 0.073 -3.446 1.00 0.00 C ATOM 1144 C LEU B 99 17.262 1.265 -2.842 1.00 0.00 C ATOM 1145 O LEU B 99 16.043 1.364 -2.939 1.00 0.00 O ATOM 1146 CB LEU B 99 18.414 -0.940 -2.375 1.00 0.00 C ATOM 1147 CG LEU B 99 17.296 -1.553 -1.517 1.00 0.00 C ATOM 1148 CD1 LEU B 99 16.902 -0.613 -0.396 1.00 0.00 C ATOM 1149 CD2 LEU B 99 16.079 -1.896 -2.361 1.00 0.00 C ATOM 0 H LEU B 99 20.039 0.349 -3.800 1.00 0.00 H new ATOM 0 HA LEU B 99 17.295 -0.447 -4.110 1.00 0.00 H new ATOM 0 HB2 LEU B 99 18.948 -1.752 -2.869 1.00 0.00 H new ATOM 0 HB3 LEU B 99 19.124 -0.451 -1.709 1.00 0.00 H new ATOM 0 HG LEU B 99 17.683 -2.475 -1.083 1.00 0.00 H new ATOM 0 HD11 LEU B 99 16.109 -1.068 0.198 1.00 0.00 H new ATOM 0 HD12 LEU B 99 17.767 -0.421 0.239 1.00 0.00 H new ATOM 0 HD13 LEU B 99 16.546 0.327 -0.818 1.00 0.00 H new ATOM 0 HD21 LEU B 99 15.306 -2.328 -1.726 1.00 0.00 H new ATOM 0 HD22 LEU B 99 15.697 -0.991 -2.834 1.00 0.00 H new ATOM 0 HD23 LEU B 99 16.360 -2.616 -3.130 1.00 0.00 H new ATOM 1161 N GLN B 100 18.010 2.195 -2.253 1.00 0.00 N ATOM 1162 CA GLN B 100 17.401 3.390 -1.685 1.00 0.00 C ATOM 1163 C GLN B 100 16.737 4.190 -2.797 1.00 0.00 C ATOM 1164 O GLN B 100 15.747 4.882 -2.575 1.00 0.00 O ATOM 1165 CB GLN B 100 18.436 4.258 -0.966 1.00 0.00 C ATOM 1166 CG GLN B 100 19.387 4.985 -1.903 1.00 0.00 C ATOM 1167 CD GLN B 100 20.301 5.947 -1.179 1.00 0.00 C ATOM 1168 OE1 GLN B 100 21.392 5.579 -0.750 1.00 0.00 O ATOM 1169 NE2 GLN B 100 19.870 7.191 -1.051 1.00 0.00 N ATOM 0 H GLN B 100 19.024 2.144 -2.158 1.00 0.00 H new ATOM 0 HA GLN B 100 16.657 3.082 -0.950 1.00 0.00 H new ATOM 0 HB2 GLN B 100 17.916 4.992 -0.351 1.00 0.00 H new ATOM 0 HB3 GLN B 100 19.017 3.630 -0.290 1.00 0.00 H new ATOM 0 HG2 GLN B 100 19.990 4.253 -2.441 1.00 0.00 H new ATOM 0 HG3 GLN B 100 18.809 5.531 -2.648 1.00 0.00 H new ATOM 0 HE21 GLN B 100 18.957 7.455 -1.422 1.00 0.00 H new ATOM 0 HE22 GLN B 100 20.450 7.886 -0.582 1.00 0.00 H new ATOM 1178 N TYR B 101 17.293 4.055 -3.998 1.00 0.00 N ATOM 1179 CA TYR B 101 16.792 4.733 -5.186 1.00 0.00 C ATOM 1180 C TYR B 101 15.307 4.454 -5.399 1.00 0.00 C ATOM 1181 O TYR B 101 14.552 5.359 -5.749 1.00 0.00 O ATOM 1182 CB TYR B 101 17.601 4.299 -6.417 1.00 0.00 C ATOM 1183 CG TYR B 101 17.220 5.010 -7.695 1.00 0.00 C ATOM 1184 CD1 TYR B 101 16.220 4.515 -8.524 1.00 0.00 C ATOM 1185 CD2 TYR B 101 17.872 6.174 -8.078 1.00 0.00 C ATOM 1186 CE1 TYR B 101 15.883 5.160 -9.696 1.00 0.00 C ATOM 1187 CE2 TYR B 101 17.539 6.828 -9.247 1.00 0.00 C ATOM 1188 CZ TYR B 101 16.544 6.316 -10.053 1.00 0.00 C ATOM 1189 OH TYR B 101 16.210 6.961 -11.223 1.00 0.00 O ATOM 0 H TYR B 101 18.109 3.468 -4.173 1.00 0.00 H new ATOM 0 HA TYR B 101 16.910 5.807 -5.041 1.00 0.00 H new ATOM 0 HB2 TYR B 101 18.659 4.472 -6.221 1.00 0.00 H new ATOM 0 HB3 TYR B 101 17.474 3.226 -6.561 1.00 0.00 H new ATOM 0 HD1 TYR B 101 15.699 3.611 -8.246 1.00 0.00 H new ATOM 0 HD2 TYR B 101 18.654 6.575 -7.450 1.00 0.00 H new ATOM 0 HE1 TYR B 101 15.105 4.761 -10.331 1.00 0.00 H new ATOM 0 HE2 TYR B 101 18.054 7.735 -9.529 1.00 0.00 H new ATOM 0 HH TYR B 101 16.768 7.760 -11.327 1.00 0.00 H new ATOM 1199 N ARG B 102 14.891 3.212 -5.177 1.00 0.00 N ATOM 1200 CA ARG B 102 13.490 2.844 -5.362 1.00 0.00 C ATOM 1201 C ARG B 102 12.660 3.201 -4.130 1.00 0.00 C ATOM 1202 O ARG B 102 11.450 3.388 -4.228 1.00 0.00 O ATOM 1203 CB ARG B 102 13.343 1.353 -5.688 1.00 0.00 C ATOM 1204 CG ARG B 102 13.722 0.420 -4.549 1.00 0.00 C ATOM 1205 CD ARG B 102 13.578 -1.039 -4.950 1.00 0.00 C ATOM 1206 NE ARG B 102 14.457 -1.391 -6.064 1.00 0.00 N ATOM 1207 CZ ARG B 102 14.481 -2.587 -6.649 1.00 0.00 C ATOM 1208 NH1 ARG B 102 13.695 -3.565 -6.214 1.00 0.00 N ATOM 1209 NH2 ARG B 102 15.304 -2.810 -7.661 1.00 0.00 N ATOM 0 H ARG B 102 15.496 2.449 -4.872 1.00 0.00 H new ATOM 0 HA ARG B 102 13.113 3.417 -6.210 1.00 0.00 H new ATOM 0 HB2 ARG B 102 12.310 1.156 -5.974 1.00 0.00 H new ATOM 0 HB3 ARG B 102 13.963 1.120 -6.554 1.00 0.00 H new ATOM 0 HG2 ARG B 102 14.751 0.615 -4.245 1.00 0.00 H new ATOM 0 HG3 ARG B 102 13.090 0.625 -3.685 1.00 0.00 H new ATOM 0 HD2 ARG B 102 13.806 -1.674 -4.094 1.00 0.00 H new ATOM 0 HD3 ARG B 102 12.543 -1.238 -5.228 1.00 0.00 H new ATOM 0 HE ARG B 102 15.092 -0.675 -6.416 1.00 0.00 H new ATOM 0 HH11 ARG B 102 13.067 -3.403 -5.427 1.00 0.00 H new ATOM 0 HH12 ARG B 102 13.719 -4.478 -6.667 1.00 0.00 H new ATOM 0 HH21 ARG B 102 15.919 -2.066 -7.992 1.00 0.00 H new ATOM 0 HH22 ARG B 102 15.324 -3.726 -8.110 1.00 0.00 H new ATOM 1223 N VAL B 103 13.316 3.322 -2.984 1.00 0.00 N ATOM 1224 CA VAL B 103 12.628 3.653 -1.740 1.00 0.00 C ATOM 1225 C VAL B 103 12.207 5.124 -1.740 1.00 0.00 C ATOM 1226 O VAL B 103 11.088 5.451 -1.359 1.00 0.00 O ATOM 1227 CB VAL B 103 13.521 3.359 -0.511 1.00 0.00 C ATOM 1228 CG1 VAL B 103 12.748 3.458 0.789 1.00 0.00 C ATOM 1229 CG2 VAL B 103 14.167 1.992 -0.617 1.00 0.00 C ATOM 0 H VAL B 103 14.324 3.196 -2.888 1.00 0.00 H new ATOM 0 HA VAL B 103 11.739 3.027 -1.673 1.00 0.00 H new ATOM 0 HB VAL B 103 14.300 4.121 -0.503 1.00 0.00 H new ATOM 0 HG11 VAL B 103 13.414 3.244 1.625 1.00 0.00 H new ATOM 0 HG12 VAL B 103 12.343 4.464 0.896 1.00 0.00 H new ATOM 0 HG13 VAL B 103 11.931 2.737 0.782 1.00 0.00 H new ATOM 0 HG21 VAL B 103 14.788 1.814 0.261 1.00 0.00 H new ATOM 0 HG22 VAL B 103 13.393 1.227 -0.675 1.00 0.00 H new ATOM 0 HG23 VAL B 103 14.785 1.950 -1.514 1.00 0.00 H new ATOM 1239 N GLU B 104 13.103 6.005 -2.184 1.00 0.00 N ATOM 1240 CA GLU B 104 12.786 7.433 -2.284 1.00 0.00 C ATOM 1241 C GLU B 104 11.676 7.714 -3.293 1.00 0.00 C ATOM 1242 O GLU B 104 10.823 8.559 -3.039 1.00 0.00 O ATOM 1243 CB GLU B 104 14.021 8.270 -2.618 1.00 0.00 C ATOM 1244 CG GLU B 104 14.969 7.599 -3.581 1.00 0.00 C ATOM 1245 CD GLU B 104 16.053 8.527 -4.083 1.00 0.00 C ATOM 1246 OE1 GLU B 104 17.105 8.633 -3.419 1.00 0.00 O ATOM 1247 OE2 GLU B 104 15.859 9.154 -5.145 1.00 0.00 O ATOM 0 H GLU B 104 14.048 5.760 -2.479 1.00 0.00 H new ATOM 0 HA GLU B 104 12.426 7.727 -1.298 1.00 0.00 H new ATOM 0 HB2 GLU B 104 13.700 9.221 -3.042 1.00 0.00 H new ATOM 0 HB3 GLU B 104 14.555 8.497 -1.695 1.00 0.00 H new ATOM 0 HG2 GLU B 104 15.430 6.742 -3.091 1.00 0.00 H new ATOM 0 HG3 GLU B 104 14.404 7.215 -4.431 1.00 0.00 H new ATOM 1254 N VAL B 105 11.672 7.029 -4.438 1.00 0.00 N ATOM 1255 CA VAL B 105 10.566 7.198 -5.377 1.00 0.00 C ATOM 1256 C VAL B 105 9.271 6.745 -4.728 1.00 0.00 C ATOM 1257 O VAL B 105 8.266 7.432 -4.822 1.00 0.00 O ATOM 1258 CB VAL B 105 10.776 6.483 -6.743 1.00 0.00 C ATOM 1259 CG1 VAL B 105 11.729 5.318 -6.621 1.00 0.00 C ATOM 1260 CG2 VAL B 105 9.461 6.001 -7.338 1.00 0.00 C ATOM 0 H VAL B 105 12.397 6.373 -4.730 1.00 0.00 H new ATOM 0 HA VAL B 105 10.519 8.261 -5.611 1.00 0.00 H new ATOM 0 HB VAL B 105 11.210 7.225 -7.413 1.00 0.00 H new ATOM 0 HG11 VAL B 105 11.851 4.844 -7.595 1.00 0.00 H new ATOM 0 HG12 VAL B 105 12.697 5.675 -6.268 1.00 0.00 H new ATOM 0 HG13 VAL B 105 11.329 4.593 -5.912 1.00 0.00 H new ATOM 0 HG21 VAL B 105 9.652 5.508 -8.291 1.00 0.00 H new ATOM 0 HG22 VAL B 105 8.988 5.297 -6.653 1.00 0.00 H new ATOM 0 HG23 VAL B 105 8.800 6.853 -7.497 1.00 0.00 H new ATOM 1270 N GLN B 106 9.311 5.618 -4.031 1.00 0.00 N ATOM 1271 CA GLN B 106 8.148 5.142 -3.294 1.00 0.00 C ATOM 1272 C GLN B 106 7.727 6.181 -2.251 1.00 0.00 C ATOM 1273 O GLN B 106 6.551 6.506 -2.128 1.00 0.00 O ATOM 1274 CB GLN B 106 8.459 3.795 -2.637 1.00 0.00 C ATOM 1275 CG GLN B 106 8.604 2.656 -3.633 1.00 0.00 C ATOM 1276 CD GLN B 106 7.324 2.367 -4.394 1.00 0.00 C ATOM 1277 OE1 GLN B 106 6.523 1.532 -3.984 1.00 0.00 O ATOM 1278 NE2 GLN B 106 7.122 3.053 -5.507 1.00 0.00 N ATOM 0 H GLN B 106 10.133 5.018 -3.960 1.00 0.00 H new ATOM 0 HA GLN B 106 7.317 4.999 -3.985 1.00 0.00 H new ATOM 0 HB2 GLN B 106 9.381 3.884 -2.062 1.00 0.00 H new ATOM 0 HB3 GLN B 106 7.665 3.552 -1.931 1.00 0.00 H new ATOM 0 HG2 GLN B 106 9.395 2.900 -4.343 1.00 0.00 H new ATOM 0 HG3 GLN B 106 8.917 1.756 -3.104 1.00 0.00 H new ATOM 0 HE21 GLN B 106 7.811 3.739 -5.816 1.00 0.00 H new ATOM 0 HE22 GLN B 106 6.277 2.896 -6.057 1.00 0.00 H new ATOM 1287 N ASN B 107 8.715 6.712 -1.537 1.00 0.00 N ATOM 1288 CA ASN B 107 8.512 7.795 -0.571 1.00 0.00 C ATOM 1289 C ASN B 107 7.785 8.984 -1.213 1.00 0.00 C ATOM 1290 O ASN B 107 6.848 9.537 -0.642 1.00 0.00 O ATOM 1291 CB ASN B 107 9.874 8.243 -0.026 1.00 0.00 C ATOM 1292 CG ASN B 107 9.777 9.390 0.958 1.00 0.00 C ATOM 1293 OD1 ASN B 107 8.776 9.547 1.653 1.00 0.00 O ATOM 1294 ND2 ASN B 107 10.824 10.200 1.027 1.00 0.00 N ATOM 0 H ASN B 107 9.685 6.404 -1.610 1.00 0.00 H new ATOM 0 HA ASN B 107 7.889 7.425 0.243 1.00 0.00 H new ATOM 0 HB2 ASN B 107 10.359 7.397 0.460 1.00 0.00 H new ATOM 0 HB3 ASN B 107 10.511 8.541 -0.859 1.00 0.00 H new ATOM 0 HD21 ASN B 107 10.817 10.988 1.675 1.00 0.00 H new ATOM 0 HD22 ASN B 107 11.636 10.035 0.433 1.00 0.00 H new ATOM 1301 N ARG B 108 8.221 9.365 -2.407 1.00 0.00 N ATOM 1302 CA ARG B 108 7.636 10.497 -3.120 1.00 0.00 C ATOM 1303 C ARG B 108 6.260 10.153 -3.682 1.00 0.00 C ATOM 1304 O ARG B 108 5.301 10.907 -3.515 1.00 0.00 O ATOM 1305 CB ARG B 108 8.563 10.923 -4.256 1.00 0.00 C ATOM 1306 CG ARG B 108 9.896 11.476 -3.776 1.00 0.00 C ATOM 1307 CD ARG B 108 10.851 11.714 -4.933 1.00 0.00 C ATOM 1308 NE ARG B 108 12.208 11.997 -4.467 1.00 0.00 N ATOM 1309 CZ ARG B 108 13.280 11.291 -4.830 1.00 0.00 C ATOM 1310 NH1 ARG B 108 13.167 10.288 -5.694 1.00 0.00 N ATOM 1311 NH2 ARG B 108 14.472 11.589 -4.331 1.00 0.00 N ATOM 0 H ARG B 108 8.982 8.904 -2.906 1.00 0.00 H new ATOM 0 HA ARG B 108 7.516 11.316 -2.411 1.00 0.00 H new ATOM 0 HB2 ARG B 108 8.746 10.067 -4.905 1.00 0.00 H new ATOM 0 HB3 ARG B 108 8.061 11.679 -4.860 1.00 0.00 H new ATOM 0 HG2 ARG B 108 9.731 12.411 -3.241 1.00 0.00 H new ATOM 0 HG3 ARG B 108 10.346 10.779 -3.069 1.00 0.00 H new ATOM 0 HD2 ARG B 108 10.864 10.837 -5.580 1.00 0.00 H new ATOM 0 HD3 ARG B 108 10.492 12.549 -5.535 1.00 0.00 H new ATOM 0 HE ARG B 108 12.343 12.780 -3.827 1.00 0.00 H new ATOM 0 HH11 ARG B 108 12.255 10.052 -6.085 1.00 0.00 H new ATOM 0 HH12 ARG B 108 13.992 9.754 -5.966 1.00 0.00 H new ATOM 0 HH21 ARG B 108 14.570 12.359 -3.669 1.00 0.00 H new ATOM 0 HH22 ARG B 108 15.291 11.048 -4.609 1.00 0.00 H new ATOM 1325 N VAL B 109 6.175 9.016 -4.358 1.00 0.00 N ATOM 1326 CA VAL B 109 4.928 8.556 -4.958 1.00 0.00 C ATOM 1327 C VAL B 109 3.834 8.414 -3.913 1.00 0.00 C ATOM 1328 O VAL B 109 2.724 8.905 -4.095 1.00 0.00 O ATOM 1329 CB VAL B 109 5.104 7.205 -5.682 1.00 0.00 C ATOM 1330 CG1 VAL B 109 3.768 6.690 -6.206 1.00 0.00 C ATOM 1331 CG2 VAL B 109 6.106 7.338 -6.815 1.00 0.00 C ATOM 0 H VAL B 109 6.965 8.388 -4.506 1.00 0.00 H new ATOM 0 HA VAL B 109 4.639 9.313 -5.687 1.00 0.00 H new ATOM 0 HB VAL B 109 5.487 6.481 -4.963 1.00 0.00 H new ATOM 0 HG11 VAL B 109 3.919 5.737 -6.712 1.00 0.00 H new ATOM 0 HG12 VAL B 109 3.079 6.553 -5.373 1.00 0.00 H new ATOM 0 HG13 VAL B 109 3.350 7.411 -6.908 1.00 0.00 H new ATOM 0 HG21 VAL B 109 6.219 6.376 -7.316 1.00 0.00 H new ATOM 0 HG22 VAL B 109 5.750 8.080 -7.530 1.00 0.00 H new ATOM 0 HG23 VAL B 109 7.069 7.653 -6.414 1.00 0.00 H new ATOM 1341 N TYR B 110 4.152 7.757 -2.812 1.00 0.00 N ATOM 1342 CA TYR B 110 3.174 7.544 -1.758 1.00 0.00 C ATOM 1343 C TYR B 110 2.711 8.874 -1.159 1.00 0.00 C ATOM 1344 O TYR B 110 1.591 8.981 -0.661 1.00 0.00 O ATOM 1345 CB TYR B 110 3.734 6.628 -0.670 1.00 0.00 C ATOM 1346 CG TYR B 110 3.931 5.183 -1.088 1.00 0.00 C ATOM 1347 CD1 TYR B 110 4.857 4.381 -0.433 1.00 0.00 C ATOM 1348 CD2 TYR B 110 3.193 4.617 -2.122 1.00 0.00 C ATOM 1349 CE1 TYR B 110 5.041 3.063 -0.791 1.00 0.00 C ATOM 1350 CE2 TYR B 110 3.374 3.299 -2.486 1.00 0.00 C ATOM 1351 CZ TYR B 110 4.298 2.527 -1.817 1.00 0.00 C ATOM 1352 OH TYR B 110 4.483 1.212 -2.175 1.00 0.00 O ATOM 0 H TYR B 110 5.074 7.363 -2.624 1.00 0.00 H new ATOM 0 HA TYR B 110 2.308 7.054 -2.203 1.00 0.00 H new ATOM 0 HB2 TYR B 110 4.692 7.028 -0.337 1.00 0.00 H new ATOM 0 HB3 TYR B 110 3.062 6.654 0.188 1.00 0.00 H new ATOM 0 HD1 TYR B 110 5.444 4.798 0.372 1.00 0.00 H new ATOM 0 HD2 TYR B 110 2.467 5.219 -2.648 1.00 0.00 H new ATOM 0 HE1 TYR B 110 5.764 2.454 -0.269 1.00 0.00 H new ATOM 0 HE2 TYR B 110 2.794 2.874 -3.292 1.00 0.00 H new ATOM 0 HH TYR B 110 5.213 1.150 -2.826 1.00 0.00 H new ATOM 1362 N LYS B 111 3.568 9.891 -1.221 1.00 0.00 N ATOM 1363 CA LYS B 111 3.186 11.232 -0.790 1.00 0.00 C ATOM 1364 C LYS B 111 2.106 11.796 -1.698 1.00 0.00 C ATOM 1365 O LYS B 111 1.121 12.359 -1.228 1.00 0.00 O ATOM 1366 CB LYS B 111 4.395 12.170 -0.778 1.00 0.00 C ATOM 1367 CG LYS B 111 5.221 12.084 0.492 1.00 0.00 C ATOM 1368 CD LYS B 111 6.516 12.863 0.369 1.00 0.00 C ATOM 1369 CE LYS B 111 7.208 13.011 1.713 1.00 0.00 C ATOM 1370 NZ LYS B 111 7.449 11.701 2.372 1.00 0.00 N ATOM 0 H LYS B 111 4.526 9.812 -1.563 1.00 0.00 H new ATOM 0 HA LYS B 111 2.795 11.157 0.225 1.00 0.00 H new ATOM 0 HB2 LYS B 111 5.032 11.938 -1.632 1.00 0.00 H new ATOM 0 HB3 LYS B 111 4.049 13.196 -0.907 1.00 0.00 H new ATOM 0 HG2 LYS B 111 4.642 12.470 1.331 1.00 0.00 H new ATOM 0 HG3 LYS B 111 5.443 11.040 0.712 1.00 0.00 H new ATOM 0 HD2 LYS B 111 7.181 12.356 -0.330 1.00 0.00 H new ATOM 0 HD3 LYS B 111 6.310 13.850 -0.046 1.00 0.00 H new ATOM 0 HE2 LYS B 111 8.159 13.526 1.575 1.00 0.00 H new ATOM 0 HE3 LYS B 111 6.599 13.637 2.366 1.00 0.00 H new ATOM 0 HZ1 LYS B 111 8.095 11.831 3.177 1.00 0.00 H new ATOM 0 HZ2 LYS B 111 6.546 11.312 2.712 1.00 0.00 H new ATOM 0 HZ3 LYS B 111 7.874 11.042 1.689 1.00 0.00 H new ATOM 1384 N LYS B 112 2.286 11.611 -2.999 1.00 0.00 N ATOM 1385 CA LYS B 112 1.350 12.118 -3.985 1.00 0.00 C ATOM 1386 C LYS B 112 0.007 11.411 -3.834 1.00 0.00 C ATOM 1387 O LYS B 112 -1.052 12.002 -4.058 1.00 0.00 O ATOM 1388 CB LYS B 112 1.940 11.923 -5.377 1.00 0.00 C ATOM 1389 CG LYS B 112 1.409 10.713 -6.098 1.00 0.00 C ATOM 1390 CD LYS B 112 2.336 10.243 -7.213 1.00 0.00 C ATOM 1391 CE LYS B 112 2.363 11.181 -8.414 1.00 0.00 C ATOM 1392 NZ LYS B 112 3.046 12.475 -8.133 1.00 0.00 N ATOM 0 H LYS B 112 3.080 11.108 -3.395 1.00 0.00 H new ATOM 0 HA LYS B 112 1.178 13.184 -3.833 1.00 0.00 H new ATOM 0 HB2 LYS B 112 1.735 12.810 -5.976 1.00 0.00 H new ATOM 0 HB3 LYS B 112 3.023 11.838 -5.294 1.00 0.00 H new ATOM 0 HG2 LYS B 112 1.266 9.902 -5.383 1.00 0.00 H new ATOM 0 HG3 LYS B 112 0.430 10.945 -6.518 1.00 0.00 H new ATOM 0 HD2 LYS B 112 3.347 10.143 -6.817 1.00 0.00 H new ATOM 0 HD3 LYS B 112 2.023 9.252 -7.542 1.00 0.00 H new ATOM 0 HE2 LYS B 112 2.867 10.684 -9.243 1.00 0.00 H new ATOM 0 HE3 LYS B 112 1.340 11.380 -8.735 1.00 0.00 H new ATOM 0 HZ1 LYS B 112 3.594 12.767 -8.967 1.00 0.00 H new ATOM 0 HZ2 LYS B 112 2.335 13.202 -7.914 1.00 0.00 H new ATOM 0 HZ3 LYS B 112 3.686 12.361 -7.321 1.00 0.00 H new ATOM 1406 N GLU B 113 0.070 10.146 -3.432 1.00 0.00 N ATOM 1407 CA GLU B 113 -1.125 9.373 -3.113 1.00 0.00 C ATOM 1408 C GLU B 113 -1.896 10.060 -1.995 1.00 0.00 C ATOM 1409 O GLU B 113 -3.089 10.325 -2.119 1.00 0.00 O ATOM 1410 CB GLU B 113 -0.749 7.956 -2.675 1.00 0.00 C ATOM 1411 CG GLU B 113 0.128 7.220 -3.668 1.00 0.00 C ATOM 1412 CD GLU B 113 -0.640 6.667 -4.849 1.00 0.00 C ATOM 1413 OE1 GLU B 113 -1.023 7.450 -5.740 1.00 0.00 O ATOM 1414 OE2 GLU B 113 -0.859 5.436 -4.897 1.00 0.00 O ATOM 0 H GLU B 113 0.943 9.631 -3.319 1.00 0.00 H new ATOM 0 HA GLU B 113 -1.747 9.311 -4.006 1.00 0.00 H new ATOM 0 HB2 GLU B 113 -0.232 8.007 -1.717 1.00 0.00 H new ATOM 0 HB3 GLU B 113 -1.661 7.381 -2.515 1.00 0.00 H new ATOM 0 HG2 GLU B 113 0.901 7.897 -4.031 1.00 0.00 H new ATOM 0 HG3 GLU B 113 0.635 6.401 -3.157 1.00 0.00 H new ATOM 1421 N ILE B 114 -1.192 10.356 -0.907 1.00 0.00 N ATOM 1422 CA ILE B 114 -1.782 11.015 0.244 1.00 0.00 C ATOM 1423 C ILE B 114 -2.350 12.387 -0.108 1.00 0.00 C ATOM 1424 O ILE B 114 -3.387 12.777 0.415 1.00 0.00 O ATOM 1425 CB ILE B 114 -0.750 11.137 1.377 1.00 0.00 C ATOM 1426 CG1 ILE B 114 -0.321 9.738 1.804 1.00 0.00 C ATOM 1427 CG2 ILE B 114 -1.319 11.915 2.557 1.00 0.00 C ATOM 1428 CD1 ILE B 114 0.751 9.728 2.858 1.00 0.00 C ATOM 0 H ILE B 114 -0.200 10.145 -0.802 1.00 0.00 H new ATOM 0 HA ILE B 114 -2.614 10.397 0.582 1.00 0.00 H new ATOM 0 HB ILE B 114 0.117 11.690 1.016 1.00 0.00 H new ATOM 0 HG12 ILE B 114 -1.191 9.200 2.179 1.00 0.00 H new ATOM 0 HG13 ILE B 114 0.037 9.195 0.929 1.00 0.00 H new ATOM 0 HG21 ILE B 114 -0.567 11.985 3.343 1.00 0.00 H new ATOM 0 HG22 ILE B 114 -1.598 12.917 2.231 1.00 0.00 H new ATOM 0 HG23 ILE B 114 -2.199 11.400 2.942 1.00 0.00 H new ATOM 0 HD11 ILE B 114 1.004 8.698 3.110 1.00 0.00 H new ATOM 0 HD12 ILE B 114 1.638 10.237 2.480 1.00 0.00 H new ATOM 0 HD13 ILE B 114 0.390 10.242 3.749 1.00 0.00 H new ATOM 1440 N GLN B 115 -1.682 13.111 -0.998 1.00 0.00 N ATOM 1441 CA GLN B 115 -2.178 14.412 -1.436 1.00 0.00 C ATOM 1442 C GLN B 115 -3.506 14.256 -2.162 1.00 0.00 C ATOM 1443 O GLN B 115 -4.449 15.012 -1.930 1.00 0.00 O ATOM 1444 CB GLN B 115 -1.171 15.094 -2.344 1.00 0.00 C ATOM 1445 CG GLN B 115 0.213 15.168 -1.742 1.00 0.00 C ATOM 1446 CD GLN B 115 1.112 16.132 -2.482 1.00 0.00 C ATOM 1447 OE1 GLN B 115 2.020 16.726 -1.902 1.00 0.00 O ATOM 1448 NE2 GLN B 115 0.860 16.304 -3.768 1.00 0.00 N ATOM 0 H GLN B 115 -0.803 12.824 -1.428 1.00 0.00 H new ATOM 0 HA GLN B 115 -2.327 15.033 -0.552 1.00 0.00 H new ATOM 0 HB2 GLN B 115 -1.121 14.556 -3.291 1.00 0.00 H new ATOM 0 HB3 GLN B 115 -1.518 16.103 -2.569 1.00 0.00 H new ATOM 0 HG2 GLN B 115 0.137 15.474 -0.699 1.00 0.00 H new ATOM 0 HG3 GLN B 115 0.664 14.176 -1.751 1.00 0.00 H new ATOM 0 HE21 GLN B 115 0.097 15.792 -4.211 1.00 0.00 H new ATOM 0 HE22 GLN B 115 1.428 16.949 -4.317 1.00 0.00 H new ATOM 1457 N ALA B 116 -3.572 13.267 -3.039 1.00 0.00 N ATOM 1458 CA ALA B 116 -4.820 12.940 -3.721 1.00 0.00 C ATOM 1459 C ALA B 116 -5.869 12.505 -2.703 1.00 0.00 C ATOM 1460 O ALA B 116 -7.020 12.938 -2.744 1.00 0.00 O ATOM 1461 CB ALA B 116 -4.591 11.847 -4.754 1.00 0.00 C ATOM 0 H ALA B 116 -2.781 12.677 -3.297 1.00 0.00 H new ATOM 0 HA ALA B 116 -5.182 13.828 -4.240 1.00 0.00 H new ATOM 0 HB1 ALA B 116 -5.532 11.615 -5.253 1.00 0.00 H new ATOM 0 HB2 ALA B 116 -3.864 12.189 -5.491 1.00 0.00 H new ATOM 0 HB3 ALA B 116 -4.213 10.952 -4.259 1.00 0.00 H new ATOM 1467 N LEU B 117 -5.442 11.653 -1.779 1.00 0.00 N ATOM 1468 CA LEU B 117 -6.280 11.199 -0.672 1.00 0.00 C ATOM 1469 C LEU B 117 -6.775 12.379 0.161 1.00 0.00 C ATOM 1470 O LEU B 117 -7.858 12.334 0.726 1.00 0.00 O ATOM 1471 CB LEU B 117 -5.480 10.245 0.226 1.00 0.00 C ATOM 1472 CG LEU B 117 -5.493 8.751 -0.147 1.00 0.00 C ATOM 1473 CD1 LEU B 117 -5.782 8.531 -1.621 1.00 0.00 C ATOM 1474 CD2 LEU B 117 -4.160 8.114 0.211 1.00 0.00 C ATOM 0 H LEU B 117 -4.503 11.255 -1.775 1.00 0.00 H new ATOM 0 HA LEU B 117 -7.143 10.681 -1.090 1.00 0.00 H new ATOM 0 HB2 LEU B 117 -4.443 10.581 0.237 1.00 0.00 H new ATOM 0 HB3 LEU B 117 -5.858 10.342 1.244 1.00 0.00 H new ATOM 0 HG LEU B 117 -6.295 8.282 0.422 1.00 0.00 H new ATOM 0 HD11 LEU B 117 -5.781 7.463 -1.836 1.00 0.00 H new ATOM 0 HD12 LEU B 117 -6.758 8.950 -1.867 1.00 0.00 H new ATOM 0 HD13 LEU B 117 -5.015 9.023 -2.219 1.00 0.00 H new ATOM 0 HD21 LEU B 117 -4.178 7.057 -0.056 1.00 0.00 H new ATOM 0 HD22 LEU B 117 -3.360 8.613 -0.336 1.00 0.00 H new ATOM 0 HD23 LEU B 117 -3.985 8.214 1.282 1.00 0.00 H new ATOM 1486 N ASP B 118 -5.970 13.432 0.219 1.00 0.00 N ATOM 1487 CA ASP B 118 -6.261 14.599 1.047 1.00 0.00 C ATOM 1488 C ASP B 118 -7.510 15.333 0.559 1.00 0.00 C ATOM 1489 O ASP B 118 -8.224 15.951 1.346 1.00 0.00 O ATOM 1490 CB ASP B 118 -5.053 15.537 1.064 1.00 0.00 C ATOM 1491 CG ASP B 118 -5.208 16.688 2.036 1.00 0.00 C ATOM 1492 OD1 ASP B 118 -5.577 17.794 1.596 1.00 0.00 O ATOM 1493 OD2 ASP B 118 -4.940 16.494 3.244 1.00 0.00 O ATOM 0 H ASP B 118 -5.098 13.503 -0.305 1.00 0.00 H new ATOM 0 HA ASP B 118 -6.461 14.258 2.063 1.00 0.00 H new ATOM 0 HB2 ASP B 118 -4.161 14.967 1.325 1.00 0.00 H new ATOM 0 HB3 ASP B 118 -4.895 15.935 0.061 1.00 0.00 H new ATOM 1498 N ALA B 119 -7.777 15.259 -0.741 1.00 0.00 N ATOM 1499 CA ALA B 119 -9.017 15.805 -1.286 1.00 0.00 C ATOM 1500 C ALA B 119 -10.199 14.982 -0.794 1.00 0.00 C ATOM 1501 O ALA B 119 -11.259 15.514 -0.437 1.00 0.00 O ATOM 1502 CB ALA B 119 -8.978 15.820 -2.806 1.00 0.00 C ATOM 0 H ALA B 119 -7.159 14.831 -1.431 1.00 0.00 H new ATOM 0 HA ALA B 119 -9.129 16.833 -0.941 1.00 0.00 H new ATOM 0 HB1 ALA B 119 -9.912 16.231 -3.190 1.00 0.00 H new ATOM 0 HB2 ALA B 119 -8.145 16.437 -3.143 1.00 0.00 H new ATOM 0 HB3 ALA B 119 -8.849 14.803 -3.177 1.00 0.00 H new ATOM 1508 N GLU B 120 -10.005 13.677 -0.760 1.00 0.00 N ATOM 1509 CA GLU B 120 -10.999 12.775 -0.233 1.00 0.00 C ATOM 1510 C GLU B 120 -11.102 12.916 1.286 1.00 0.00 C ATOM 1511 O GLU B 120 -12.137 12.642 1.872 1.00 0.00 O ATOM 1512 CB GLU B 120 -10.666 11.344 -0.627 1.00 0.00 C ATOM 1513 CG GLU B 120 -11.149 10.934 -2.013 1.00 0.00 C ATOM 1514 CD GLU B 120 -10.665 11.843 -3.127 1.00 0.00 C ATOM 1515 OE1 GLU B 120 -9.637 11.524 -3.761 1.00 0.00 O ATOM 1516 OE2 GLU B 120 -11.326 12.870 -3.385 1.00 0.00 O ATOM 0 H GLU B 120 -9.158 13.219 -1.096 1.00 0.00 H new ATOM 0 HA GLU B 120 -11.969 13.032 -0.659 1.00 0.00 H new ATOM 0 HB2 GLU B 120 -9.585 11.211 -0.580 1.00 0.00 H new ATOM 0 HB3 GLU B 120 -11.102 10.669 0.109 1.00 0.00 H new ATOM 0 HG2 GLU B 120 -10.815 9.917 -2.217 1.00 0.00 H new ATOM 0 HG3 GLU B 120 -12.239 10.919 -2.017 1.00 0.00 H new ATOM 1523 N ILE B 121 -10.021 13.320 1.931 1.00 0.00 N ATOM 1524 CA ILE B 121 -10.072 13.640 3.354 1.00 0.00 C ATOM 1525 C ILE B 121 -11.173 14.657 3.632 1.00 0.00 C ATOM 1526 O ILE B 121 -11.843 14.583 4.651 1.00 0.00 O ATOM 1527 CB ILE B 121 -8.709 14.152 3.895 1.00 0.00 C ATOM 1528 CG1 ILE B 121 -7.990 13.036 4.652 1.00 0.00 C ATOM 1529 CG2 ILE B 121 -8.872 15.373 4.792 1.00 0.00 C ATOM 1530 CD1 ILE B 121 -7.629 11.854 3.787 1.00 0.00 C ATOM 0 H ILE B 121 -9.104 13.435 1.500 1.00 0.00 H new ATOM 0 HA ILE B 121 -10.298 12.714 3.883 1.00 0.00 H new ATOM 0 HB ILE B 121 -8.109 14.454 3.036 1.00 0.00 H new ATOM 0 HG12 ILE B 121 -7.081 13.439 5.099 1.00 0.00 H new ATOM 0 HG13 ILE B 121 -8.625 12.696 5.470 1.00 0.00 H new ATOM 0 HG21 ILE B 121 -7.894 15.697 5.147 1.00 0.00 H new ATOM 0 HG22 ILE B 121 -9.338 16.180 4.227 1.00 0.00 H new ATOM 0 HG23 ILE B 121 -9.501 15.117 5.644 1.00 0.00 H new ATOM 0 HD11 ILE B 121 -7.122 11.102 4.392 1.00 0.00 H new ATOM 0 HD12 ILE B 121 -8.536 11.425 3.360 1.00 0.00 H new ATOM 0 HD13 ILE B 121 -6.968 12.179 2.983 1.00 0.00 H new ATOM 1542 N ARG B 122 -11.383 15.575 2.697 1.00 0.00 N ATOM 1543 CA ARG B 122 -12.403 16.587 2.833 1.00 0.00 C ATOM 1544 C ARG B 122 -13.793 15.957 2.886 1.00 0.00 C ATOM 1545 O ARG B 122 -14.640 16.371 3.677 1.00 0.00 O ATOM 1546 CB ARG B 122 -12.290 17.554 1.666 1.00 0.00 C ATOM 1547 CG ARG B 122 -10.922 18.207 1.562 1.00 0.00 C ATOM 1548 CD ARG B 122 -10.638 19.113 2.750 1.00 0.00 C ATOM 1549 NE ARG B 122 -11.445 20.329 2.712 1.00 0.00 N ATOM 1550 CZ ARG B 122 -11.892 20.977 3.790 1.00 0.00 C ATOM 1551 NH1 ARG B 122 -11.721 20.468 5.006 1.00 0.00 N ATOM 1552 NH2 ARG B 122 -12.549 22.120 3.644 1.00 0.00 N ATOM 0 H ARG B 122 -10.850 15.633 1.830 1.00 0.00 H new ATOM 0 HA ARG B 122 -12.257 17.127 3.769 1.00 0.00 H new ATOM 0 HB2 ARG B 122 -12.503 17.022 0.739 1.00 0.00 H new ATOM 0 HB3 ARG B 122 -13.049 18.329 1.770 1.00 0.00 H new ATOM 0 HG2 ARG B 122 -10.154 17.435 1.501 1.00 0.00 H new ATOM 0 HG3 ARG B 122 -10.865 18.787 0.641 1.00 0.00 H new ATOM 0 HD2 ARG B 122 -10.839 18.573 3.675 1.00 0.00 H new ATOM 0 HD3 ARG B 122 -9.581 19.379 2.759 1.00 0.00 H new ATOM 0 HE ARG B 122 -11.684 20.710 1.797 1.00 0.00 H new ATOM 0 HH11 ARG B 122 -11.244 19.574 5.122 1.00 0.00 H new ATOM 0 HH12 ARG B 122 -12.067 20.972 5.823 1.00 0.00 H new ATOM 0 HH21 ARG B 122 -12.711 22.500 2.711 1.00 0.00 H new ATOM 0 HH22 ARG B 122 -12.893 22.619 4.464 1.00 0.00 H new ATOM 1566 N LYS B 123 -14.023 14.951 2.043 1.00 0.00 N ATOM 1567 CA LYS B 123 -15.289 14.211 2.085 1.00 0.00 C ATOM 1568 C LYS B 123 -15.389 13.439 3.400 1.00 0.00 C ATOM 1569 O LYS B 123 -16.456 13.362 4.011 1.00 0.00 O ATOM 1570 CB LYS B 123 -15.431 13.260 0.881 1.00 0.00 C ATOM 1571 CG LYS B 123 -14.661 11.949 1.004 1.00 0.00 C ATOM 1572 CD LYS B 123 -14.180 11.442 -0.345 1.00 0.00 C ATOM 1573 CE LYS B 123 -15.326 11.118 -1.271 1.00 0.00 C ATOM 1574 NZ LYS B 123 -14.913 11.153 -2.700 1.00 0.00 N ATOM 0 H LYS B 123 -13.364 14.632 1.333 1.00 0.00 H new ATOM 0 HA LYS B 123 -16.108 14.928 2.026 1.00 0.00 H new ATOM 0 HB2 LYS B 123 -16.487 13.032 0.739 1.00 0.00 H new ATOM 0 HB3 LYS B 123 -15.094 13.780 -0.016 1.00 0.00 H new ATOM 0 HG2 LYS B 123 -13.805 12.092 1.664 1.00 0.00 H new ATOM 0 HG3 LYS B 123 -15.299 11.196 1.468 1.00 0.00 H new ATOM 0 HD2 LYS B 123 -13.542 12.195 -0.808 1.00 0.00 H new ATOM 0 HD3 LYS B 123 -13.569 10.551 -0.200 1.00 0.00 H new ATOM 0 HE2 LYS B 123 -15.718 10.130 -1.031 1.00 0.00 H new ATOM 0 HE3 LYS B 123 -16.135 11.830 -1.110 1.00 0.00 H new ATOM 0 HZ1 LYS B 123 -15.733 10.942 -3.304 1.00 0.00 H new ATOM 0 HZ2 LYS B 123 -14.546 12.098 -2.932 1.00 0.00 H new ATOM 0 HZ3 LYS B 123 -14.170 10.444 -2.864 1.00 0.00 H new ATOM 1588 N LEU B 124 -14.259 12.890 3.832 1.00 0.00 N ATOM 1589 CA LEU B 124 -14.173 12.191 5.102 1.00 0.00 C ATOM 1590 C LEU B 124 -14.521 13.122 6.252 1.00 0.00 C ATOM 1591 O LEU B 124 -15.347 12.784 7.089 1.00 0.00 O ATOM 1592 CB LEU B 124 -12.763 11.624 5.301 1.00 0.00 C ATOM 1593 CG LEU B 124 -12.382 10.452 4.391 1.00 0.00 C ATOM 1594 CD1 LEU B 124 -10.926 10.066 4.599 1.00 0.00 C ATOM 1595 CD2 LEU B 124 -13.275 9.265 4.668 1.00 0.00 C ATOM 0 H LEU B 124 -13.382 12.918 3.312 1.00 0.00 H new ATOM 0 HA LEU B 124 -14.890 11.370 5.089 1.00 0.00 H new ATOM 0 HB2 LEU B 124 -12.043 12.428 5.147 1.00 0.00 H new ATOM 0 HB3 LEU B 124 -12.664 11.302 6.338 1.00 0.00 H new ATOM 0 HG LEU B 124 -12.516 10.763 3.355 1.00 0.00 H new ATOM 0 HD11 LEU B 124 -10.674 9.232 3.944 1.00 0.00 H new ATOM 0 HD12 LEU B 124 -10.287 10.917 4.365 1.00 0.00 H new ATOM 0 HD13 LEU B 124 -10.772 9.772 5.637 1.00 0.00 H new ATOM 0 HD21 LEU B 124 -12.994 8.438 4.015 1.00 0.00 H new ATOM 0 HD22 LEU B 124 -13.162 8.960 5.708 1.00 0.00 H new ATOM 0 HD23 LEU B 124 -14.313 9.539 4.481 1.00 0.00 H new ATOM 1607 N GLU B 125 -13.908 14.303 6.269 1.00 0.00 N ATOM 1608 CA GLU B 125 -14.092 15.264 7.357 1.00 0.00 C ATOM 1609 C GLU B 125 -15.563 15.594 7.572 1.00 0.00 C ATOM 1610 O GLU B 125 -15.988 15.829 8.699 1.00 0.00 O ATOM 1611 CB GLU B 125 -13.296 16.546 7.090 1.00 0.00 C ATOM 1612 CG GLU B 125 -11.793 16.322 7.038 1.00 0.00 C ATOM 1613 CD GLU B 125 -11.006 17.606 6.867 1.00 0.00 C ATOM 1614 OE1 GLU B 125 -10.529 18.152 7.883 1.00 0.00 O ATOM 1615 OE2 GLU B 125 -10.846 18.071 5.720 1.00 0.00 O ATOM 0 H GLU B 125 -13.274 14.621 5.536 1.00 0.00 H new ATOM 0 HA GLU B 125 -13.716 14.799 8.268 1.00 0.00 H new ATOM 0 HB2 GLU B 125 -13.625 16.979 6.145 1.00 0.00 H new ATOM 0 HB3 GLU B 125 -13.521 17.274 7.870 1.00 0.00 H new ATOM 0 HG2 GLU B 125 -11.474 15.827 7.955 1.00 0.00 H new ATOM 0 HG3 GLU B 125 -11.560 15.648 6.214 1.00 0.00 H new ATOM 1622 N ARG B 126 -16.339 15.588 6.496 1.00 0.00 N ATOM 1623 CA ARG B 126 -17.776 15.829 6.593 1.00 0.00 C ATOM 1624 C ARG B 126 -18.481 14.667 7.289 1.00 0.00 C ATOM 1625 O ARG B 126 -19.539 14.837 7.893 1.00 0.00 O ATOM 1626 CB ARG B 126 -18.385 16.059 5.209 1.00 0.00 C ATOM 1627 CG ARG B 126 -18.003 17.391 4.582 1.00 0.00 C ATOM 1628 CD ARG B 126 -18.363 18.555 5.493 1.00 0.00 C ATOM 1629 NE ARG B 126 -18.342 19.839 4.795 1.00 0.00 N ATOM 1630 CZ ARG B 126 -18.169 21.015 5.397 1.00 0.00 C ATOM 1631 NH1 ARG B 126 -17.880 21.073 6.693 1.00 0.00 N ATOM 1632 NH2 ARG B 126 -18.254 22.135 4.693 1.00 0.00 N ATOM 0 H ARG B 126 -16.001 15.420 5.548 1.00 0.00 H new ATOM 0 HA ARG B 126 -17.920 16.729 7.191 1.00 0.00 H new ATOM 0 HB2 ARG B 126 -18.071 15.253 4.546 1.00 0.00 H new ATOM 0 HB3 ARG B 126 -19.471 16.003 5.287 1.00 0.00 H new ATOM 0 HG2 ARG B 126 -16.933 17.405 4.377 1.00 0.00 H new ATOM 0 HG3 ARG B 126 -18.513 17.504 3.625 1.00 0.00 H new ATOM 0 HD2 ARG B 126 -19.355 18.390 5.913 1.00 0.00 H new ATOM 0 HD3 ARG B 126 -17.664 18.588 6.329 1.00 0.00 H new ATOM 0 HE ARG B 126 -18.468 19.835 3.783 1.00 0.00 H new ATOM 0 HH11 ARG B 126 -17.789 20.213 7.234 1.00 0.00 H new ATOM 0 HH12 ARG B 126 -17.749 21.977 7.146 1.00 0.00 H new ATOM 0 HH21 ARG B 126 -18.451 22.095 3.693 1.00 0.00 H new ATOM 0 HH22 ARG B 126 -18.122 23.037 5.151 1.00 0.00 H new ATOM 1646 N LEU B 127 -17.887 13.487 7.200 1.00 0.00 N ATOM 1647 CA LEU B 127 -18.405 12.310 7.882 1.00 0.00 C ATOM 1648 C LEU B 127 -17.956 12.318 9.344 1.00 0.00 C ATOM 1649 O LEU B 127 -18.730 11.969 10.241 1.00 0.00 O ATOM 1650 CB LEU B 127 -17.946 11.037 7.161 1.00 0.00 C ATOM 1651 CG LEU B 127 -19.075 10.164 6.603 1.00 0.00 C ATOM 1652 CD1 LEU B 127 -19.938 9.624 7.729 1.00 0.00 C ATOM 1653 CD2 LEU B 127 -19.925 10.952 5.617 1.00 0.00 C ATOM 0 H LEU B 127 -17.040 13.318 6.658 1.00 0.00 H new ATOM 0 HA LEU B 127 -19.495 12.329 7.862 1.00 0.00 H new ATOM 0 HB2 LEU B 127 -17.287 11.320 6.340 1.00 0.00 H new ATOM 0 HB3 LEU B 127 -17.354 10.439 7.854 1.00 0.00 H new ATOM 0 HG LEU B 127 -18.626 9.322 6.076 1.00 0.00 H new ATOM 0 HD11 LEU B 127 -20.734 9.007 7.313 1.00 0.00 H new ATOM 0 HD12 LEU B 127 -19.325 9.022 8.401 1.00 0.00 H new ATOM 0 HD13 LEU B 127 -20.375 10.455 8.283 1.00 0.00 H new ATOM 0 HD21 LEU B 127 -20.721 10.314 5.232 1.00 0.00 H new ATOM 0 HD22 LEU B 127 -20.362 11.814 6.121 1.00 0.00 H new ATOM 0 HD23 LEU B 127 -19.302 11.293 4.790 1.00 0.00 H new ATOM 1665 N LEU B 128 -16.697 12.701 9.574 1.00 0.00 N ATOM 1666 CA LEU B 128 -16.208 13.028 10.902 1.00 0.00 C ATOM 1667 C LEU B 128 -17.156 13.995 11.611 1.00 0.00 C ATOM 1668 O LEU B 128 -17.694 13.686 12.677 1.00 0.00 O ATOM 1669 CB LEU B 128 -14.821 13.665 10.785 1.00 0.00 C ATOM 1670 CG LEU B 128 -13.647 12.702 10.572 1.00 0.00 C ATOM 1671 CD1 LEU B 128 -13.786 11.882 9.305 1.00 0.00 C ATOM 1672 CD2 LEU B 128 -12.339 13.474 10.551 1.00 0.00 C ATOM 0 H LEU B 128 -15.994 12.791 8.840 1.00 0.00 H new ATOM 0 HA LEU B 128 -16.151 12.111 11.489 1.00 0.00 H new ATOM 0 HB2 LEU B 128 -14.838 14.372 9.956 1.00 0.00 H new ATOM 0 HB3 LEU B 128 -14.631 14.241 11.691 1.00 0.00 H new ATOM 0 HG LEU B 128 -13.651 12.002 11.408 1.00 0.00 H new ATOM 0 HD11 LEU B 128 -12.927 11.218 9.205 1.00 0.00 H new ATOM 0 HD12 LEU B 128 -14.699 11.289 9.354 1.00 0.00 H new ATOM 0 HD13 LEU B 128 -13.832 12.548 8.444 1.00 0.00 H new ATOM 0 HD21 LEU B 128 -11.511 12.782 10.399 1.00 0.00 H new ATOM 0 HD22 LEU B 128 -12.358 14.201 9.739 1.00 0.00 H new ATOM 0 HD23 LEU B 128 -12.208 13.994 11.500 1.00 0.00 H new ATOM 1684 N GLU B 129 -17.358 15.161 11.000 1.00 0.00 N ATOM 1685 CA GLU B 129 -18.239 16.195 11.550 1.00 0.00 C ATOM 1686 C GLU B 129 -19.658 15.678 11.770 1.00 0.00 C ATOM 1687 O GLU B 129 -20.333 16.080 12.720 1.00 0.00 O ATOM 1688 CB GLU B 129 -18.296 17.403 10.617 1.00 0.00 C ATOM 1689 CG GLU B 129 -16.968 18.111 10.434 1.00 0.00 C ATOM 1690 CD GLU B 129 -17.088 19.315 9.526 1.00 0.00 C ATOM 1691 OE1 GLU B 129 -17.411 20.413 10.028 1.00 0.00 O ATOM 1692 OE2 GLU B 129 -16.872 19.171 8.307 1.00 0.00 O ATOM 0 H GLU B 129 -16.920 15.417 10.115 1.00 0.00 H new ATOM 0 HA GLU B 129 -17.820 16.485 12.514 1.00 0.00 H new ATOM 0 HB2 GLU B 129 -18.659 17.078 9.642 1.00 0.00 H new ATOM 0 HB3 GLU B 129 -19.024 18.115 11.007 1.00 0.00 H new ATOM 0 HG2 GLU B 129 -16.588 18.426 11.406 1.00 0.00 H new ATOM 0 HG3 GLU B 129 -16.240 17.414 10.018 1.00 0.00 H new ATOM 1699 N SER B 130 -20.107 14.795 10.887 1.00 0.00 N ATOM 1700 CA SER B 130 -21.462 14.256 10.951 1.00 0.00 C ATOM 1701 C SER B 130 -21.667 13.420 12.220 1.00 0.00 C ATOM 1702 O SER B 130 -22.798 13.184 12.641 1.00 0.00 O ATOM 1703 CB SER B 130 -21.749 13.419 9.699 1.00 0.00 C ATOM 1704 OG SER B 130 -23.121 13.067 9.603 1.00 0.00 O ATOM 0 H SER B 130 -19.549 14.434 10.113 1.00 0.00 H new ATOM 0 HA SER B 130 -22.163 15.090 10.989 1.00 0.00 H new ATOM 0 HB2 SER B 130 -21.455 13.980 8.812 1.00 0.00 H new ATOM 0 HB3 SER B 130 -21.142 12.514 9.720 1.00 0.00 H new ATOM 0 HG SER B 130 -23.266 12.536 8.793 1.00 0.00 H new ATOM 1710 N GLY B 131 -20.569 12.982 12.827 1.00 0.00 N ATOM 1711 CA GLY B 131 -20.656 12.237 14.070 1.00 0.00 C ATOM 1712 C GLY B 131 -20.695 10.741 13.853 1.00 0.00 C ATOM 1713 O GLY B 131 -21.022 9.978 14.761 1.00 0.00 O ATOM 0 H GLY B 131 -19.621 13.129 12.481 1.00 0.00 H new ATOM 0 HA2 GLY B 131 -19.801 12.486 14.699 1.00 0.00 H new ATOM 0 HA3 GLY B 131 -21.551 12.545 14.611 1.00 0.00 H new ATOM 1717 N LEU B 132 -20.362 10.320 12.647 1.00 0.00 N ATOM 1718 CA LEU B 132 -20.325 8.902 12.320 1.00 0.00 C ATOM 1719 C LEU B 132 -18.910 8.372 12.466 1.00 0.00 C ATOM 1720 O LEU B 132 -18.674 7.361 13.125 1.00 0.00 O ATOM 1721 CB LEU B 132 -20.829 8.647 10.893 1.00 0.00 C ATOM 1722 CG LEU B 132 -22.353 8.653 10.698 1.00 0.00 C ATOM 1723 CD1 LEU B 132 -23.008 7.589 11.562 1.00 0.00 C ATOM 1724 CD2 LEU B 132 -22.943 10.021 10.999 1.00 0.00 C ATOM 0 H LEU B 132 -20.113 10.938 11.875 1.00 0.00 H new ATOM 0 HA LEU B 132 -20.984 8.379 13.014 1.00 0.00 H new ATOM 0 HB2 LEU B 132 -20.397 9.403 10.237 1.00 0.00 H new ATOM 0 HB3 LEU B 132 -20.446 7.682 10.562 1.00 0.00 H new ATOM 0 HG LEU B 132 -22.555 8.424 9.652 1.00 0.00 H new ATOM 0 HD11 LEU B 132 -24.087 7.610 11.409 1.00 0.00 H new ATOM 0 HD12 LEU B 132 -22.621 6.608 11.287 1.00 0.00 H new ATOM 0 HD13 LEU B 132 -22.786 7.785 12.611 1.00 0.00 H new ATOM 0 HD21 LEU B 132 -24.023 9.992 10.852 1.00 0.00 H new ATOM 0 HD22 LEU B 132 -22.725 10.292 12.032 1.00 0.00 H new ATOM 0 HD23 LEU B 132 -22.505 10.761 10.329 1.00 0.00 H new ATOM 1736 N THR B 133 -17.972 9.070 11.856 1.00 0.00 N ATOM 1737 CA THR B 133 -16.580 8.680 11.904 1.00 0.00 C ATOM 1738 C THR B 133 -15.856 9.440 13.014 1.00 0.00 C ATOM 1739 O THR B 133 -15.503 8.814 14.035 1.00 0.00 O ATOM 1740 CB THR B 133 -15.899 8.939 10.550 1.00 0.00 C ATOM 1741 OG1 THR B 133 -16.676 8.339 9.501 1.00 0.00 O ATOM 1742 CG2 THR B 133 -14.489 8.368 10.529 1.00 0.00 C ATOM 1743 OXT THR B 133 -15.682 10.667 12.881 1.00 0.00 O ATOM 0 H THR B 133 -18.153 9.917 11.317 1.00 0.00 H new ATOM 0 HA THR B 133 -16.528 7.612 12.118 1.00 0.00 H new ATOM 0 HB THR B 133 -15.835 10.016 10.397 1.00 0.00 H new ATOM 0 HG1 THR B 133 -16.243 8.505 8.637 1.00 0.00 H new ATOM 0 HG21 THR B 133 -14.031 8.565 9.560 1.00 0.00 H new ATOM 0 HG22 THR B 133 -13.895 8.837 11.313 1.00 0.00 H new ATOM 0 HG23 THR B 133 -14.530 7.292 10.699 1.00 0.00 H new TER 1751 THR B 133