USER MOD reduce.3.24.130724 H: found=0, std=0, add=782, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 785 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 58 HIS : no HE2:sc= -0.299 K(o=-0.3,f=-2) USER MOD Set 1.2: A 79 MET CE :methyl -177:sc= 0 (180deg=0) USER MOD Single : A 30 MET CE :methyl 177:sc= -0.0405 (180deg=-0.0504) USER MOD Single : A 36 GLN : amide:sc=-0.00406 X(o=-0.0041,f=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc= -0.314 K(o=-0.31,f=-7.5!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 SER OG : rot -27:sc= 0.0213 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 THR OG1 : rot 83:sc= 0.416 USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot 102:sc= 0.192 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 SER OG : rot 89:sc= 0.431 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 THR OG1 : rot 81:sc= 1.23 USER MOD Single : A 119 GLN : amide:sc= -0.231 K(o=-0.23,f=-0.87) USER MOD Single : A 120 HIS : no HE2:sc= -0.177 K(o=-0.18,f=-0.84) USER MOD Single : A 121 SER OG : rot 84:sc= 0.126 USER MOD Single : A 122 THR OG1 : rot 90:sc= 0.202 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 MET CE :methyl 162:sc=-0.00339 (180deg=-0.283) USER MOD Single : A 132 SER OG : rot -170:sc= 0 USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 ASN : amide:sc= -0.653 K(o=-0.65,f=-2.3!) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 27 -11.567 27.622 6.176 1.00 0.00 N ATOM 2 CA ASP A 27 -12.676 26.878 6.822 1.00 0.00 C ATOM 3 C ASP A 27 -13.075 25.584 6.041 1.00 0.00 C ATOM 4 O ASP A 27 -13.089 24.529 6.684 1.00 0.00 O ATOM 5 CB ASP A 27 -13.866 27.844 7.089 1.00 0.00 C ATOM 6 CG ASP A 27 -13.667 28.859 8.219 1.00 0.00 C ATOM 7 OD1 ASP A 27 -12.854 29.894 7.840 1.00 0.00 O ATOM 8 OD2 ASP A 27 -14.183 28.747 9.330 1.00 0.00 O ATOM 0 HA ASP A 27 -12.332 26.506 7.787 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -14.078 28.390 6.170 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -14.749 27.247 7.315 1.00 0.00 H new ATOM 15 N ARG A 28 -13.372 25.633 4.712 1.00 0.00 N ATOM 16 CA ARG A 28 -13.816 24.450 3.898 1.00 0.00 C ATOM 17 C ARG A 28 -12.751 23.318 3.731 1.00 0.00 C ATOM 18 O ARG A 28 -13.139 22.148 3.830 1.00 0.00 O ATOM 19 CB ARG A 28 -14.379 24.922 2.518 1.00 0.00 C ATOM 20 CG ARG A 28 -15.784 25.589 2.535 1.00 0.00 C ATOM 21 CD ARG A 28 -16.232 26.123 1.173 1.00 0.00 C ATOM 22 NE ARG A 28 -17.583 26.731 1.274 1.00 0.00 N ATOM 23 CZ ARG A 28 -18.256 27.383 0.292 1.00 0.00 C ATOM 24 NH1 ARG A 28 -17.818 27.599 -0.957 1.00 0.00 N ATOM 25 NH2 ARG A 28 -19.453 27.850 0.595 1.00 0.00 N ATOM 0 H ARG A 28 -13.312 26.494 4.168 1.00 0.00 H new ATOM 0 HA ARG A 28 -14.611 23.979 4.476 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -13.671 25.628 2.084 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -14.418 24.060 1.852 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -16.516 24.863 2.889 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -15.777 26.410 3.252 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -15.519 26.865 0.813 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -16.244 25.313 0.444 1.00 0.00 H new ATOM 0 HE ARG A 28 -18.054 26.650 2.175 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -16.899 27.260 -1.241 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -18.404 28.103 -1.623 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -19.832 27.713 1.532 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -19.999 28.348 -0.108 1.00 0.00 H new ATOM 39 N PHE A 29 -11.467 23.657 3.487 1.00 0.00 N ATOM 40 CA PHE A 29 -10.388 22.667 3.196 1.00 0.00 C ATOM 41 C PHE A 29 -9.774 21.991 4.454 1.00 0.00 C ATOM 42 O PHE A 29 -9.528 20.782 4.361 1.00 0.00 O ATOM 43 CB PHE A 29 -9.317 23.326 2.288 1.00 0.00 C ATOM 44 CG PHE A 29 -9.808 23.707 0.866 1.00 0.00 C ATOM 45 CD1 PHE A 29 -9.770 22.785 -0.173 1.00 0.00 C ATOM 46 CD2 PHE A 29 -10.368 24.961 0.637 1.00 0.00 C ATOM 47 CE1 PHE A 29 -10.229 23.130 -1.429 1.00 0.00 C ATOM 48 CE2 PHE A 29 -10.825 25.298 -0.622 1.00 0.00 C ATOM 49 CZ PHE A 29 -10.749 24.387 -1.656 1.00 0.00 C ATOM 0 H PHE A 29 -11.141 24.624 3.484 1.00 0.00 H new ATOM 0 HA PHE A 29 -10.850 21.836 2.663 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -8.947 24.225 2.781 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -8.472 22.644 2.194 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -9.379 21.794 0.003 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -10.445 25.672 1.446 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -10.181 22.413 -2.236 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -11.243 26.278 -0.798 1.00 0.00 H new ATOM 0 HZ PHE A 29 -11.096 24.658 -2.642 1.00 0.00 H new ATOM 59 N MET A 30 -9.550 22.699 5.597 1.00 0.00 N ATOM 60 CA MET A 30 -9.174 22.054 6.902 1.00 0.00 C ATOM 61 C MET A 30 -10.363 21.266 7.554 1.00 0.00 C ATOM 62 O MET A 30 -10.095 20.135 7.973 1.00 0.00 O ATOM 63 CB MET A 30 -8.547 23.053 7.924 1.00 0.00 C ATOM 64 CG MET A 30 -7.144 23.630 7.616 1.00 0.00 C ATOM 65 SD MET A 30 -6.312 24.056 9.171 1.00 0.00 S ATOM 66 CE MET A 30 -5.010 22.804 9.291 1.00 0.00 C ATOM 0 H MET A 30 -9.622 23.715 5.647 1.00 0.00 H new ATOM 0 HA MET A 30 -8.400 21.331 6.644 1.00 0.00 H new ATOM 0 HB2 MET A 30 -9.235 23.891 8.035 1.00 0.00 H new ATOM 0 HB3 MET A 30 -8.496 22.552 8.891 1.00 0.00 H new ATOM 0 HG2 MET A 30 -6.552 22.901 7.062 1.00 0.00 H new ATOM 0 HG3 MET A 30 -7.233 24.514 6.984 1.00 0.00 H new ATOM 0 HE1 MET A 30 -4.402 22.995 10.175 1.00 0.00 H new ATOM 0 HE2 MET A 30 -5.462 21.815 9.368 1.00 0.00 H new ATOM 0 HE3 MET A 30 -4.381 22.847 8.402 1.00 0.00 H new ATOM 76 N ASP A 31 -11.632 21.777 7.589 1.00 0.00 N ATOM 77 CA ASP A 31 -12.839 20.973 7.993 1.00 0.00 C ATOM 78 C ASP A 31 -13.074 19.662 7.160 1.00 0.00 C ATOM 79 O ASP A 31 -13.416 18.654 7.789 1.00 0.00 O ATOM 80 CB ASP A 31 -14.116 21.856 8.011 1.00 0.00 C ATOM 81 CG ASP A 31 -14.205 22.851 9.174 1.00 0.00 C ATOM 82 OD1 ASP A 31 -14.317 22.216 10.383 1.00 0.00 O ATOM 83 OD2 ASP A 31 -14.185 24.072 9.029 1.00 0.00 O ATOM 0 H ASP A 31 -11.849 22.743 7.343 1.00 0.00 H new ATOM 0 HA ASP A 31 -12.620 20.629 9.004 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -14.168 22.411 7.074 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -14.989 21.204 8.044 1.00 0.00 H new ATOM 88 N GLU A 32 -12.837 19.654 5.815 1.00 0.00 N ATOM 89 CA GLU A 32 -12.803 18.401 4.985 1.00 0.00 C ATOM 90 C GLU A 32 -11.612 17.441 5.360 1.00 0.00 C ATOM 91 O GLU A 32 -11.866 16.235 5.428 1.00 0.00 O ATOM 92 CB GLU A 32 -12.804 18.718 3.456 1.00 0.00 C ATOM 93 CG GLU A 32 -14.134 19.207 2.839 1.00 0.00 C ATOM 94 CD GLU A 32 -13.994 19.515 1.354 1.00 0.00 C ATOM 95 OE1 GLU A 32 -13.639 20.609 0.919 1.00 0.00 O ATOM 96 OE2 GLU A 32 -14.309 18.433 0.575 1.00 0.00 O ATOM 0 H GLU A 32 -12.665 20.503 5.277 1.00 0.00 H new ATOM 0 HA GLU A 32 -13.722 17.865 5.222 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -12.045 19.477 3.267 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -12.495 17.818 2.924 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -14.901 18.446 2.981 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -14.471 20.101 3.365 1.00 0.00 H new ATOM 103 N PHE A 33 -10.385 17.963 5.652 1.00 0.00 N ATOM 104 CA PHE A 33 -9.241 17.190 6.232 1.00 0.00 C ATOM 105 C PHE A 33 -9.520 16.490 7.616 1.00 0.00 C ATOM 106 O PHE A 33 -9.092 15.339 7.751 1.00 0.00 O ATOM 107 CB PHE A 33 -7.998 18.135 6.247 1.00 0.00 C ATOM 108 CG PHE A 33 -6.666 17.527 6.756 1.00 0.00 C ATOM 109 CD1 PHE A 33 -5.861 16.759 5.923 1.00 0.00 C ATOM 110 CD2 PHE A 33 -6.310 17.669 8.094 1.00 0.00 C ATOM 111 CE1 PHE A 33 -4.737 16.137 6.427 1.00 0.00 C ATOM 112 CE2 PHE A 33 -5.176 17.055 8.585 1.00 0.00 C ATOM 113 CZ PHE A 33 -4.392 16.285 7.753 1.00 0.00 C ATOM 0 H PHE A 33 -10.158 18.944 5.490 1.00 0.00 H new ATOM 0 HA PHE A 33 -9.056 16.326 5.593 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -7.838 18.503 5.234 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -8.236 19.000 6.866 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -6.116 16.649 4.879 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -6.926 18.264 8.752 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -4.123 15.530 5.778 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -4.902 17.178 9.623 1.00 0.00 H new ATOM 0 HZ PHE A 33 -3.509 15.798 8.140 1.00 0.00 H new ATOM 123 N PHE A 34 -10.195 17.151 8.593 1.00 0.00 N ATOM 124 CA PHE A 34 -10.573 16.535 9.903 1.00 0.00 C ATOM 125 C PHE A 34 -11.668 15.419 9.817 1.00 0.00 C ATOM 126 O PHE A 34 -11.462 14.366 10.429 1.00 0.00 O ATOM 127 CB PHE A 34 -10.957 17.652 10.924 1.00 0.00 C ATOM 128 CG PHE A 34 -9.794 18.506 11.495 1.00 0.00 C ATOM 129 CD1 PHE A 34 -8.930 17.999 12.462 1.00 0.00 C ATOM 130 CD2 PHE A 34 -9.608 19.813 11.057 1.00 0.00 C ATOM 131 CE1 PHE A 34 -7.878 18.762 12.932 1.00 0.00 C ATOM 132 CE2 PHE A 34 -8.556 20.571 11.531 1.00 0.00 C ATOM 133 CZ PHE A 34 -7.685 20.043 12.460 1.00 0.00 C ATOM 0 H PHE A 34 -10.494 18.122 8.500 1.00 0.00 H new ATOM 0 HA PHE A 34 -9.688 16.006 10.256 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -11.667 18.324 10.442 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -11.478 17.184 11.760 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -9.083 17.002 12.848 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -10.293 20.239 10.339 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -7.205 18.354 13.671 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -8.415 21.580 11.173 1.00 0.00 H new ATOM 0 HZ PHE A 34 -6.853 20.632 12.817 1.00 0.00 H new ATOM 143 N GLU A 35 -12.774 15.630 9.066 1.00 0.00 N ATOM 144 CA GLU A 35 -13.828 14.654 8.758 1.00 0.00 C ATOM 145 C GLU A 35 -13.395 13.371 7.965 1.00 0.00 C ATOM 146 O GLU A 35 -13.925 12.305 8.297 1.00 0.00 O ATOM 147 CB GLU A 35 -14.859 15.574 8.015 1.00 0.00 C ATOM 148 CG GLU A 35 -16.034 16.111 8.853 1.00 0.00 C ATOM 149 CD GLU A 35 -17.040 16.896 8.020 1.00 0.00 C ATOM 150 OE1 GLU A 35 -17.855 16.071 7.291 1.00 0.00 O ATOM 151 OE2 GLU A 35 -17.102 18.124 8.013 1.00 0.00 O ATOM 0 H GLU A 35 -12.958 16.538 8.639 1.00 0.00 H new ATOM 0 HA GLU A 35 -14.216 14.154 9.646 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -14.319 16.425 7.601 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -15.268 15.016 7.173 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -16.542 15.276 9.336 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -15.647 16.751 9.646 1.00 0.00 H new ATOM 158 N GLN A 36 -12.473 13.467 6.972 1.00 0.00 N ATOM 159 CA GLN A 36 -11.935 12.283 6.220 1.00 0.00 C ATOM 160 C GLN A 36 -10.980 11.323 7.006 1.00 0.00 C ATOM 161 O GLN A 36 -11.065 10.117 6.756 1.00 0.00 O ATOM 162 CB GLN A 36 -11.307 12.741 4.868 1.00 0.00 C ATOM 163 CG GLN A 36 -10.012 13.594 4.807 1.00 0.00 C ATOM 164 CD GLN A 36 -9.609 13.944 3.370 1.00 0.00 C ATOM 165 OE1 GLN A 36 -10.109 14.909 2.795 1.00 0.00 O ATOM 166 NE2 GLN A 36 -8.710 13.183 2.762 1.00 0.00 N ATOM 0 H GLN A 36 -12.079 14.356 6.665 1.00 0.00 H new ATOM 0 HA GLN A 36 -12.809 11.657 6.039 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -11.115 11.838 4.289 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -12.077 13.302 4.338 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -10.159 14.513 5.374 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -9.199 13.050 5.287 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -8.303 12.385 3.250 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -8.425 13.395 1.806 1.00 0.00 H new ATOM 175 N VAL A 37 -10.108 11.822 7.925 1.00 0.00 N ATOM 176 CA VAL A 37 -9.168 10.994 8.777 1.00 0.00 C ATOM 177 C VAL A 37 -9.866 9.760 9.486 1.00 0.00 C ATOM 178 O VAL A 37 -9.300 8.669 9.381 1.00 0.00 O ATOM 179 CB VAL A 37 -8.361 11.993 9.748 1.00 0.00 C ATOM 180 CG1 VAL A 37 -7.847 11.449 11.116 1.00 0.00 C ATOM 181 CG2 VAL A 37 -7.144 12.683 9.044 1.00 0.00 C ATOM 0 H VAL A 37 -10.027 12.822 8.108 1.00 0.00 H new ATOM 0 HA VAL A 37 -8.440 10.489 8.142 1.00 0.00 H new ATOM 0 HB VAL A 37 -9.163 12.694 9.980 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -7.325 12.243 11.650 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -8.693 11.106 11.712 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -7.164 10.618 10.943 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -6.641 13.344 9.751 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -6.444 11.922 8.698 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -7.498 13.264 8.193 1.00 0.00 H new ATOM 191 N GLU A 38 -11.026 9.925 10.168 1.00 0.00 N ATOM 192 CA GLU A 38 -11.818 8.784 10.746 1.00 0.00 C ATOM 193 C GLU A 38 -12.342 7.702 9.727 1.00 0.00 C ATOM 194 O GLU A 38 -12.512 6.553 10.149 1.00 0.00 O ATOM 195 CB GLU A 38 -12.968 9.382 11.615 1.00 0.00 C ATOM 196 CG GLU A 38 -13.558 8.478 12.723 1.00 0.00 C ATOM 197 CD GLU A 38 -14.711 9.149 13.458 1.00 0.00 C ATOM 198 OE1 GLU A 38 -15.895 9.014 12.782 1.00 0.00 O ATOM 199 OE2 GLU A 38 -14.581 9.737 14.530 1.00 0.00 O ATOM 0 H GLU A 38 -11.445 10.839 10.338 1.00 0.00 H new ATOM 0 HA GLU A 38 -11.124 8.202 11.352 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -12.598 10.294 12.084 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -13.780 9.673 10.948 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -13.905 7.544 12.281 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -12.775 8.222 13.436 1.00 0.00 H new ATOM 206 N GLU A 39 -12.563 8.060 8.441 1.00 0.00 N ATOM 207 CA GLU A 39 -12.852 7.091 7.317 1.00 0.00 C ATOM 208 C GLU A 39 -11.584 6.264 6.896 1.00 0.00 C ATOM 209 O GLU A 39 -11.693 5.048 6.719 1.00 0.00 O ATOM 210 CB GLU A 39 -13.489 7.734 6.019 1.00 0.00 C ATOM 211 CG GLU A 39 -14.320 9.028 6.072 1.00 0.00 C ATOM 212 CD GLU A 39 -15.686 8.890 6.739 1.00 0.00 C ATOM 213 OE1 GLU A 39 -16.699 8.530 6.143 1.00 0.00 O ATOM 214 OE2 GLU A 39 -15.639 9.215 8.070 1.00 0.00 O ATOM 0 H GLU A 39 -12.549 9.033 8.134 1.00 0.00 H new ATOM 0 HA GLU A 39 -13.604 6.433 7.752 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -12.669 7.915 5.324 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -14.125 6.971 5.570 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -13.748 9.788 6.604 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -14.464 9.391 5.055 1.00 0.00 H new ATOM 221 N ILE A 40 -10.409 6.939 6.782 1.00 0.00 N ATOM 222 CA ILE A 40 -9.042 6.320 6.565 1.00 0.00 C ATOM 223 C ILE A 40 -8.672 5.357 7.764 1.00 0.00 C ATOM 224 O ILE A 40 -8.388 4.181 7.515 1.00 0.00 O ATOM 225 CB ILE A 40 -8.037 7.528 6.201 1.00 0.00 C ATOM 226 CG1 ILE A 40 -8.261 8.064 4.722 1.00 0.00 C ATOM 227 CG2 ILE A 40 -6.520 7.189 6.416 1.00 0.00 C ATOM 228 CD1 ILE A 40 -7.923 9.535 4.380 1.00 0.00 C ATOM 0 H ILE A 40 -10.369 7.957 6.838 1.00 0.00 H new ATOM 0 HA ILE A 40 -8.986 5.634 5.720 1.00 0.00 H new ATOM 0 HB ILE A 40 -8.291 8.314 6.912 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -7.676 7.432 4.054 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -9.310 7.905 4.473 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -5.913 8.054 6.148 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -6.349 6.935 7.462 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -6.244 6.343 5.787 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -8.138 9.723 3.328 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -8.526 10.200 4.998 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -6.866 9.720 4.573 1.00 0.00 H new ATOM 240 N ARG A 41 -8.726 5.871 9.008 1.00 0.00 N ATOM 241 CA ARG A 41 -8.638 5.068 10.280 1.00 0.00 C ATOM 242 C ARG A 41 -9.658 3.873 10.388 1.00 0.00 C ATOM 243 O ARG A 41 -9.304 2.862 11.001 1.00 0.00 O ATOM 244 CB ARG A 41 -8.771 5.964 11.539 1.00 0.00 C ATOM 245 CG ARG A 41 -7.686 7.055 11.802 1.00 0.00 C ATOM 246 CD ARG A 41 -8.081 8.204 12.746 1.00 0.00 C ATOM 247 NE ARG A 41 -8.009 7.842 14.190 1.00 0.00 N ATOM 248 CZ ARG A 41 -8.184 8.678 15.246 1.00 0.00 C ATOM 249 NH1 ARG A 41 -8.455 9.989 15.177 1.00 0.00 N ATOM 250 NH2 ARG A 41 -8.077 8.151 16.451 1.00 0.00 N ATOM 0 H ARG A 41 -8.834 6.871 9.179 1.00 0.00 H new ATOM 0 HA ARG A 41 -7.643 4.626 10.235 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -9.738 6.465 11.487 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -8.798 5.309 12.409 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -6.803 6.565 12.212 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -7.396 7.486 10.844 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -7.427 9.056 12.561 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -9.096 8.524 12.510 1.00 0.00 H new ATOM 0 HE ARG A 41 -7.808 6.866 14.408 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -8.547 10.444 14.269 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -8.569 10.532 16.033 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -7.871 7.158 16.557 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -8.200 8.737 17.277 1.00 0.00 H new ATOM 264 N GLY A 42 -10.871 4.000 9.780 1.00 0.00 N ATOM 265 CA GLY A 42 -11.843 2.884 9.591 1.00 0.00 C ATOM 266 C GLY A 42 -11.350 1.719 8.691 1.00 0.00 C ATOM 267 O GLY A 42 -11.420 0.568 9.136 1.00 0.00 O ATOM 0 H GLY A 42 -11.205 4.888 9.404 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -12.102 2.480 10.570 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -12.759 3.291 9.161 1.00 0.00 H new ATOM 271 N PHE A 43 -10.821 2.030 7.478 1.00 0.00 N ATOM 272 CA PHE A 43 -10.094 1.059 6.604 1.00 0.00 C ATOM 273 C PHE A 43 -8.795 0.473 7.269 1.00 0.00 C ATOM 274 O PHE A 43 -8.656 -0.751 7.232 1.00 0.00 O ATOM 275 CB PHE A 43 -9.761 1.667 5.207 1.00 0.00 C ATOM 276 CG PHE A 43 -10.918 2.199 4.322 1.00 0.00 C ATOM 277 CD1 PHE A 43 -11.729 1.323 3.609 1.00 0.00 C ATOM 278 CD2 PHE A 43 -11.138 3.566 4.192 1.00 0.00 C ATOM 279 CE1 PHE A 43 -12.732 1.804 2.791 1.00 0.00 C ATOM 280 CE2 PHE A 43 -12.141 4.042 3.372 1.00 0.00 C ATOM 281 CZ PHE A 43 -12.939 3.162 2.672 1.00 0.00 C ATOM 0 H PHE A 43 -10.885 2.964 7.074 1.00 0.00 H new ATOM 0 HA PHE A 43 -10.784 0.227 6.465 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -9.063 2.489 5.364 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -9.233 0.905 4.634 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -11.573 0.258 3.696 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -10.518 4.262 4.738 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -13.356 1.114 2.243 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -12.301 5.106 3.278 1.00 0.00 H new ATOM 0 HZ PHE A 43 -13.725 3.536 2.032 1.00 0.00 H new ATOM 291 N ILE A 44 -7.939 1.296 7.954 1.00 0.00 N ATOM 292 CA ILE A 44 -6.772 0.846 8.811 1.00 0.00 C ATOM 293 C ILE A 44 -7.248 -0.167 9.934 1.00 0.00 C ATOM 294 O ILE A 44 -6.594 -1.206 10.067 1.00 0.00 O ATOM 295 CB ILE A 44 -5.944 2.112 9.354 1.00 0.00 C ATOM 296 CG1 ILE A 44 -5.323 3.044 8.217 1.00 0.00 C ATOM 297 CG2 ILE A 44 -4.789 1.722 10.356 1.00 0.00 C ATOM 298 CD1 ILE A 44 -5.102 4.548 8.508 1.00 0.00 C ATOM 0 H ILE A 44 -8.036 2.311 7.931 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.068 0.280 8.201 1.00 0.00 H new ATOM 0 HB ILE A 44 -6.710 2.682 9.879 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -4.359 2.620 7.936 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -5.971 2.971 7.343 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -4.271 2.624 10.683 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -5.214 1.214 11.221 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -4.083 1.059 9.857 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -4.674 5.030 7.629 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -6.056 5.016 8.750 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -4.420 4.659 9.351 1.00 0.00 H new ATOM 310 N ASP A 45 -8.348 0.117 10.678 1.00 0.00 N ATOM 311 CA ASP A 45 -9.014 -0.853 11.611 1.00 0.00 C ATOM 312 C ASP A 45 -9.348 -2.262 11.012 1.00 0.00 C ATOM 313 O ASP A 45 -9.019 -3.264 11.655 1.00 0.00 O ATOM 314 CB ASP A 45 -10.279 -0.182 12.230 1.00 0.00 C ATOM 315 CG ASP A 45 -10.621 -0.667 13.636 1.00 0.00 C ATOM 316 OD1 ASP A 45 -11.194 -1.731 13.866 1.00 0.00 O ATOM 317 OD2 ASP A 45 -10.216 0.222 14.597 1.00 0.00 O ATOM 0 H ASP A 45 -8.807 1.028 10.653 1.00 0.00 H new ATOM 0 HA ASP A 45 -8.277 -1.078 12.382 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -10.127 0.897 12.257 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -11.131 -0.368 11.577 1.00 0.00 H new ATOM 322 N LYS A 46 -9.940 -2.302 9.791 1.00 0.00 N ATOM 323 CA LYS A 46 -10.112 -3.545 8.991 1.00 0.00 C ATOM 324 C LYS A 46 -8.791 -4.147 8.399 1.00 0.00 C ATOM 325 O LYS A 46 -8.807 -5.352 8.131 1.00 0.00 O ATOM 326 CB LYS A 46 -11.210 -3.249 7.921 1.00 0.00 C ATOM 327 CG LYS A 46 -11.873 -4.422 7.154 1.00 0.00 C ATOM 328 CD LYS A 46 -12.969 -5.217 7.902 1.00 0.00 C ATOM 329 CE LYS A 46 -13.587 -6.350 7.071 1.00 0.00 C ATOM 330 NZ LYS A 46 -14.614 -7.053 7.856 1.00 0.00 N ATOM 0 H LYS A 46 -10.313 -1.471 9.331 1.00 0.00 H new ATOM 0 HA LYS A 46 -10.433 -4.351 9.651 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -12.006 -2.693 8.417 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -10.770 -2.582 7.179 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -12.308 -4.025 6.237 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -11.090 -5.120 6.859 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -12.542 -5.638 8.813 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -13.759 -4.530 8.207 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -14.029 -5.944 6.161 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -12.811 -7.051 6.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -15.025 -7.818 7.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -14.182 -7.455 8.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -15.362 -6.383 8.128 1.00 0.00 H new ATOM 344 N ILE A 47 -7.682 -3.371 8.234 1.00 0.00 N ATOM 345 CA ILE A 47 -6.323 -3.900 7.902 1.00 0.00 C ATOM 346 C ILE A 47 -5.744 -4.593 9.193 1.00 0.00 C ATOM 347 O ILE A 47 -5.384 -5.761 9.042 1.00 0.00 O ATOM 348 CB ILE A 47 -5.392 -2.761 7.260 1.00 0.00 C ATOM 349 CG1 ILE A 47 -5.857 -2.091 5.897 1.00 0.00 C ATOM 350 CG2 ILE A 47 -3.904 -3.215 7.098 1.00 0.00 C ATOM 351 CD1 ILE A 47 -6.150 -2.872 4.592 1.00 0.00 C ATOM 0 H ILE A 47 -7.704 -2.356 8.328 1.00 0.00 H new ATOM 0 HA ILE A 47 -6.370 -4.659 7.121 1.00 0.00 H new ATOM 0 HB ILE A 47 -5.498 -1.983 8.016 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -6.767 -1.536 6.128 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -5.092 -1.357 5.645 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -3.322 -2.405 6.659 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -3.493 -3.469 8.075 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -3.859 -4.088 6.447 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -6.450 -2.174 3.810 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -5.253 -3.405 4.278 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -6.954 -3.587 4.768 1.00 0.00 H new ATOM 363 N ALA A 48 -5.607 -3.936 10.380 1.00 0.00 N ATOM 364 CA ALA A 48 -5.020 -4.594 11.580 1.00 0.00 C ATOM 365 C ALA A 48 -5.784 -5.826 12.149 1.00 0.00 C ATOM 366 O ALA A 48 -5.102 -6.779 12.549 1.00 0.00 O ATOM 367 CB ALA A 48 -4.776 -3.536 12.661 1.00 0.00 C ATOM 0 H ALA A 48 -5.890 -2.968 10.529 1.00 0.00 H new ATOM 0 HA ALA A 48 -4.084 -5.035 11.238 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -4.346 -4.010 13.543 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -4.087 -2.781 12.282 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -5.721 -3.063 12.927 1.00 0.00 H new ATOM 373 N GLU A 49 -7.146 -5.842 12.095 1.00 0.00 N ATOM 374 CA GLU A 49 -7.971 -7.054 12.397 1.00 0.00 C ATOM 375 C GLU A 49 -7.794 -8.183 11.323 1.00 0.00 C ATOM 376 O GLU A 49 -7.612 -9.334 11.748 1.00 0.00 O ATOM 377 CB GLU A 49 -9.479 -6.698 12.595 1.00 0.00 C ATOM 378 CG GLU A 49 -9.859 -5.885 13.853 1.00 0.00 C ATOM 379 CD GLU A 49 -11.350 -5.585 13.907 1.00 0.00 C ATOM 380 OE1 GLU A 49 -11.682 -4.497 13.144 1.00 0.00 O ATOM 381 OE2 GLU A 49 -12.152 -6.249 14.563 1.00 0.00 O ATOM 0 H GLU A 49 -7.701 -5.024 11.843 1.00 0.00 H new ATOM 0 HA GLU A 49 -7.596 -7.449 13.341 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -9.811 -6.139 11.720 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -10.045 -7.629 12.612 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -9.568 -6.440 14.745 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -9.300 -4.949 13.863 1.00 0.00 H new ATOM 388 N ASN A 50 -7.772 -7.879 9.985 1.00 0.00 N ATOM 389 CA ASN A 50 -7.528 -8.908 8.932 1.00 0.00 C ATOM 390 C ASN A 50 -6.052 -9.429 8.908 1.00 0.00 C ATOM 391 O ASN A 50 -5.911 -10.652 8.900 1.00 0.00 O ATOM 392 CB ASN A 50 -8.025 -8.366 7.560 1.00 0.00 C ATOM 393 CG ASN A 50 -8.303 -9.451 6.500 1.00 0.00 C ATOM 394 OD1 ASN A 50 -7.418 -9.826 5.735 1.00 0.00 O ATOM 395 ND2 ASN A 50 -9.520 -9.973 6.424 1.00 0.00 N ATOM 0 H ASN A 50 -7.919 -6.938 9.619 1.00 0.00 H new ATOM 0 HA ASN A 50 -8.109 -9.798 9.173 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -8.938 -7.792 7.721 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -7.279 -7.675 7.166 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -9.725 -10.690 5.728 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -10.251 -9.658 7.062 1.00 0.00 H new ATOM 402 N VAL A 51 -5.007 -8.556 8.988 1.00 0.00 N ATOM 403 CA VAL A 51 -3.560 -8.944 9.021 1.00 0.00 C ATOM 404 C VAL A 51 -3.151 -9.836 10.253 1.00 0.00 C ATOM 405 O VAL A 51 -2.520 -10.879 10.066 1.00 0.00 O ATOM 406 CB VAL A 51 -2.739 -7.596 8.780 1.00 0.00 C ATOM 407 CG1 VAL A 51 -2.236 -6.770 9.979 1.00 0.00 C ATOM 408 CG2 VAL A 51 -1.550 -7.824 7.845 1.00 0.00 C ATOM 0 H VAL A 51 -5.146 -7.546 9.032 1.00 0.00 H new ATOM 0 HA VAL A 51 -3.309 -9.645 8.225 1.00 0.00 H new ATOM 0 HB VAL A 51 -3.531 -6.982 8.353 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -1.701 -5.892 9.617 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -3.085 -6.454 10.585 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -1.565 -7.379 10.585 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -1.014 -6.886 7.703 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -0.879 -8.563 8.283 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -1.909 -8.186 6.882 1.00 0.00 H new ATOM 418 N GLU A 52 -3.572 -9.414 11.466 1.00 0.00 N ATOM 419 CA GLU A 52 -3.505 -10.227 12.728 1.00 0.00 C ATOM 420 C GLU A 52 -4.267 -11.595 12.620 1.00 0.00 C ATOM 421 O GLU A 52 -3.784 -12.567 13.210 1.00 0.00 O ATOM 422 CB GLU A 52 -4.001 -9.424 13.969 1.00 0.00 C ATOM 423 CG GLU A 52 -3.060 -8.325 14.512 1.00 0.00 C ATOM 424 CD GLU A 52 -3.670 -7.584 15.694 1.00 0.00 C ATOM 425 OE1 GLU A 52 -3.415 -8.218 16.881 1.00 0.00 O ATOM 426 OE2 GLU A 52 -4.313 -6.541 15.582 1.00 0.00 O ATOM 0 H GLU A 52 -3.975 -8.488 11.611 1.00 0.00 H new ATOM 0 HA GLU A 52 -2.449 -10.457 12.868 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -4.954 -8.959 13.714 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -4.197 -10.131 14.775 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -2.114 -8.775 14.815 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -2.835 -7.615 13.716 1.00 0.00 H new ATOM 433 N GLU A 53 -5.385 -11.664 11.842 1.00 0.00 N ATOM 434 CA GLU A 53 -6.055 -12.953 11.462 1.00 0.00 C ATOM 435 C GLU A 53 -5.190 -13.860 10.512 1.00 0.00 C ATOM 436 O GLU A 53 -5.041 -15.050 10.809 1.00 0.00 O ATOM 437 CB GLU A 53 -7.474 -12.677 10.863 1.00 0.00 C ATOM 438 CG GLU A 53 -8.485 -13.853 10.923 1.00 0.00 C ATOM 439 CD GLU A 53 -9.941 -13.417 10.812 1.00 0.00 C ATOM 440 OE1 GLU A 53 -10.620 -13.067 11.777 1.00 0.00 O ATOM 441 OE2 GLU A 53 -10.392 -13.463 9.519 1.00 0.00 O ATOM 0 H GLU A 53 -5.847 -10.838 11.461 1.00 0.00 H new ATOM 0 HA GLU A 53 -6.167 -13.527 12.382 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -7.908 -11.826 11.388 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -7.354 -12.381 9.821 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -8.262 -14.553 10.118 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -8.347 -14.391 11.861 1.00 0.00 H new ATOM 448 N VAL A 54 -4.603 -13.285 9.428 1.00 0.00 N ATOM 449 CA VAL A 54 -3.571 -13.944 8.534 1.00 0.00 C ATOM 450 C VAL A 54 -2.465 -14.695 9.366 1.00 0.00 C ATOM 451 O VAL A 54 -2.215 -15.856 9.042 1.00 0.00 O ATOM 452 CB VAL A 54 -2.920 -12.940 7.476 1.00 0.00 C ATOM 453 CG1 VAL A 54 -1.978 -13.615 6.429 1.00 0.00 C ATOM 454 CG2 VAL A 54 -3.879 -12.034 6.678 1.00 0.00 C ATOM 0 H VAL A 54 -4.827 -12.335 9.133 1.00 0.00 H new ATOM 0 HA VAL A 54 -4.117 -14.689 7.955 1.00 0.00 H new ATOM 0 HB VAL A 54 -2.357 -12.315 8.170 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -1.583 -12.857 5.753 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -1.153 -14.106 6.945 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -2.540 -14.354 5.857 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -3.304 -11.405 5.998 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -4.570 -12.652 6.104 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.442 -11.404 7.367 1.00 0.00 H new ATOM 464 N LYS A 55 -1.878 -14.047 10.395 1.00 0.00 N ATOM 465 CA LYS A 55 -0.862 -14.676 11.297 1.00 0.00 C ATOM 466 C LYS A 55 -1.366 -15.860 12.176 1.00 0.00 C ATOM 467 O LYS A 55 -0.501 -16.682 12.502 1.00 0.00 O ATOM 468 CB LYS A 55 -0.168 -13.603 12.193 1.00 0.00 C ATOM 469 CG LYS A 55 0.890 -12.694 11.500 1.00 0.00 C ATOM 470 CD LYS A 55 1.563 -11.600 12.367 1.00 0.00 C ATOM 471 CE LYS A 55 0.808 -10.261 12.497 1.00 0.00 C ATOM 472 NZ LYS A 55 1.565 -9.312 13.329 1.00 0.00 N ATOM 0 H LYS A 55 -2.087 -13.077 10.632 1.00 0.00 H new ATOM 0 HA LYS A 55 -0.145 -15.123 10.608 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -0.941 -12.963 12.618 1.00 0.00 H new ATOM 0 HB3 LYS A 55 0.315 -14.115 13.025 1.00 0.00 H new ATOM 0 HG2 LYS A 55 1.674 -13.335 11.097 1.00 0.00 H new ATOM 0 HG3 LYS A 55 0.411 -12.205 10.652 1.00 0.00 H new ATOM 0 HD2 LYS A 55 1.715 -12.004 13.368 1.00 0.00 H new ATOM 0 HD3 LYS A 55 2.550 -11.396 11.952 1.00 0.00 H new ATOM 0 HE2 LYS A 55 0.644 -9.834 11.508 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -0.174 -10.434 12.937 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 1.038 -8.418 13.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 1.700 -9.714 14.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 2.493 -9.132 12.894 1.00 0.00 H new ATOM 486 N ARG A 56 -2.672 -15.980 12.543 1.00 0.00 N ATOM 487 CA ARG A 56 -3.195 -17.241 13.185 1.00 0.00 C ATOM 488 C ARG A 56 -3.504 -18.385 12.156 1.00 0.00 C ATOM 489 O ARG A 56 -3.341 -19.538 12.571 1.00 0.00 O ATOM 490 CB ARG A 56 -4.392 -17.024 14.152 1.00 0.00 C ATOM 491 CG ARG A 56 -5.657 -16.272 13.703 1.00 0.00 C ATOM 492 CD ARG A 56 -6.678 -16.031 14.828 1.00 0.00 C ATOM 493 NE ARG A 56 -7.843 -15.260 14.332 1.00 0.00 N ATOM 494 CZ ARG A 56 -8.951 -14.916 15.039 1.00 0.00 C ATOM 495 NH1 ARG A 56 -9.192 -15.215 16.324 1.00 0.00 N ATOM 496 NH2 ARG A 56 -9.875 -14.223 14.402 1.00 0.00 N ATOM 0 H ARG A 56 -3.371 -15.249 12.415 1.00 0.00 H new ATOM 0 HA ARG A 56 -2.360 -17.573 13.802 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -4.711 -18.010 14.488 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -4.004 -16.500 15.025 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -5.364 -15.311 13.281 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -6.139 -16.837 12.905 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -7.014 -16.987 15.230 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -6.202 -15.491 15.647 1.00 0.00 H new ATOM 0 HE ARG A 56 -7.809 -14.956 13.359 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -8.508 -15.749 16.860 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -10.059 -14.909 16.765 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -9.739 -13.970 13.423 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -10.726 -13.940 14.888 1.00 0.00 H new ATOM 510 N LYS A 57 -3.899 -18.118 10.882 1.00 0.00 N ATOM 511 CA LYS A 57 -4.052 -19.156 9.818 1.00 0.00 C ATOM 512 C LYS A 57 -2.701 -19.632 9.183 1.00 0.00 C ATOM 513 O LYS A 57 -2.536 -20.840 8.988 1.00 0.00 O ATOM 514 CB LYS A 57 -5.046 -18.651 8.729 1.00 0.00 C ATOM 515 CG LYS A 57 -6.517 -18.402 9.148 1.00 0.00 C ATOM 516 CD LYS A 57 -7.583 -18.197 8.038 1.00 0.00 C ATOM 517 CE LYS A 57 -8.175 -19.455 7.357 1.00 0.00 C ATOM 518 NZ LYS A 57 -9.169 -20.171 8.184 1.00 0.00 N ATOM 0 H LYS A 57 -4.121 -17.176 10.560 1.00 0.00 H new ATOM 0 HA LYS A 57 -4.458 -20.043 10.304 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -4.652 -17.719 8.323 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -5.048 -19.377 7.916 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -6.834 -19.247 9.759 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -6.534 -17.521 9.789 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -8.409 -17.631 8.469 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -7.140 -17.574 7.261 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -8.642 -19.161 6.417 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -7.363 -20.138 7.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -9.521 -21.000 7.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -8.723 -20.482 9.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -9.963 -19.535 8.400 1.00 0.00 H new ATOM 532 N HIS A 58 -1.776 -18.693 8.878 1.00 0.00 N ATOM 533 CA HIS A 58 -0.389 -18.956 8.373 1.00 0.00 C ATOM 534 C HIS A 58 0.528 -19.965 9.144 1.00 0.00 C ATOM 535 O HIS A 58 1.378 -20.588 8.504 1.00 0.00 O ATOM 536 CB HIS A 58 0.299 -17.552 8.205 1.00 0.00 C ATOM 537 CG HIS A 58 0.258 -16.832 6.847 1.00 0.00 C ATOM 538 ND1 HIS A 58 1.279 -15.956 6.495 1.00 0.00 N ATOM 539 CD2 HIS A 58 -0.748 -16.820 5.850 1.00 0.00 C ATOM 540 CE1 HIS A 58 0.816 -15.542 5.276 1.00 0.00 C ATOM 541 NE2 HIS A 58 -0.358 -16.038 4.780 1.00 0.00 N ATOM 0 H HIS A 58 -1.971 -17.697 8.976 1.00 0.00 H new ATOM 0 HA HIS A 58 -0.516 -19.504 7.439 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -0.147 -16.882 8.940 1.00 0.00 H new ATOM 0 HB3 HIS A 58 1.348 -17.671 8.477 1.00 0.00 H new ATOM 0 HD1 HIS A 58 2.127 -15.697 6.999 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -1.688 -17.348 5.917 1.00 0.00 H new ATOM 0 HE1 HIS A 58 1.380 -14.821 4.703 1.00 0.00 H new ATOM 549 N SER A 59 0.355 -20.074 10.471 1.00 0.00 N ATOM 550 CA SER A 59 1.055 -21.057 11.340 1.00 0.00 C ATOM 551 C SER A 59 0.416 -22.479 11.347 1.00 0.00 C ATOM 552 O SER A 59 1.199 -23.425 11.230 1.00 0.00 O ATOM 553 CB SER A 59 1.195 -20.447 12.748 1.00 0.00 C ATOM 554 OG SER A 59 1.947 -21.314 13.586 1.00 0.00 O ATOM 0 H SER A 59 -0.287 -19.473 10.988 1.00 0.00 H new ATOM 0 HA SER A 59 2.045 -21.238 10.921 1.00 0.00 H new ATOM 0 HB2 SER A 59 1.685 -19.476 12.684 1.00 0.00 H new ATOM 0 HB3 SER A 59 0.208 -20.278 13.179 1.00 0.00 H new ATOM 0 HG SER A 59 2.031 -20.916 14.477 1.00 0.00 H new ATOM 560 N ALA A 60 -0.931 -22.641 11.461 1.00 0.00 N ATOM 561 CA ALA A 60 -1.623 -23.951 11.278 1.00 0.00 C ATOM 562 C ALA A 60 -1.605 -24.620 9.868 1.00 0.00 C ATOM 563 O ALA A 60 -1.820 -25.834 9.811 1.00 0.00 O ATOM 564 CB ALA A 60 -3.079 -23.773 11.721 1.00 0.00 C ATOM 0 H ALA A 60 -1.566 -21.873 11.681 1.00 0.00 H new ATOM 0 HA ALA A 60 -1.039 -24.645 11.882 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -3.614 -24.715 11.600 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -3.106 -23.473 12.768 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.554 -23.005 11.111 1.00 0.00 H new ATOM 570 N ILE A 61 -1.377 -23.855 8.779 1.00 0.00 N ATOM 571 CA ILE A 61 -1.336 -24.347 7.359 1.00 0.00 C ATOM 572 C ILE A 61 0.172 -24.507 7.004 1.00 0.00 C ATOM 573 O ILE A 61 0.474 -25.504 6.338 1.00 0.00 O ATOM 574 CB ILE A 61 -2.268 -23.394 6.483 1.00 0.00 C ATOM 575 CG1 ILE A 61 -3.785 -23.371 6.960 1.00 0.00 C ATOM 576 CG2 ILE A 61 -2.195 -23.734 4.953 1.00 0.00 C ATOM 577 CD1 ILE A 61 -4.681 -22.162 6.617 1.00 0.00 C ATOM 0 H ILE A 61 -1.211 -22.851 8.850 1.00 0.00 H new ATOM 0 HA ILE A 61 -1.762 -25.330 7.159 1.00 0.00 H new ATOM 0 HB ILE A 61 -1.864 -22.394 6.641 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -4.267 -24.259 6.551 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -3.786 -23.478 8.045 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -2.846 -23.058 4.399 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.169 -23.618 4.603 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -2.519 -24.763 4.793 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.680 -22.323 7.023 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -4.254 -21.258 7.051 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.743 -22.050 5.534 1.00 0.00 H new ATOM 734 N LYS A 72 -7.299 -23.040 2.397 1.00 0.00 N ATOM 735 CA LYS A 72 -7.070 -21.923 1.455 1.00 0.00 C ATOM 736 C LYS A 72 -8.402 -21.381 0.877 1.00 0.00 C ATOM 737 O LYS A 72 -8.383 -20.268 0.345 1.00 0.00 O ATOM 738 CB LYS A 72 -6.067 -22.388 0.354 1.00 0.00 C ATOM 739 CG LYS A 72 -4.583 -22.624 0.804 1.00 0.00 C ATOM 740 CD LYS A 72 -3.695 -23.398 -0.183 1.00 0.00 C ATOM 741 CE LYS A 72 -2.233 -23.552 0.269 1.00 0.00 C ATOM 742 NZ LYS A 72 -1.464 -24.311 -0.730 1.00 0.00 N ATOM 0 HA LYS A 72 -6.625 -21.080 1.984 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -6.443 -23.316 -0.078 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -6.066 -21.643 -0.442 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -4.123 -21.654 0.993 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -4.593 -23.162 1.752 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -4.122 -24.389 -0.338 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -3.714 -22.889 -1.147 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -1.785 -22.569 0.412 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -2.195 -24.063 1.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -0.479 -24.407 -0.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -1.883 -25.256 -0.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -1.485 -23.808 -1.640 1.00 0.00 H new ATOM 756 N GLU A 73 -9.541 -22.124 0.990 1.00 0.00 N ATOM 757 CA GLU A 73 -10.936 -21.649 0.697 1.00 0.00 C ATOM 758 C GLU A 73 -11.253 -20.156 1.116 1.00 0.00 C ATOM 759 O GLU A 73 -11.847 -19.437 0.307 1.00 0.00 O ATOM 760 CB GLU A 73 -11.959 -22.631 1.333 1.00 0.00 C ATOM 761 CG GLU A 73 -12.016 -24.143 0.999 1.00 0.00 C ATOM 762 CD GLU A 73 -12.573 -24.454 -0.386 1.00 0.00 C ATOM 763 OE1 GLU A 73 -11.875 -24.530 -1.396 1.00 0.00 O ATOM 764 OE2 GLU A 73 -13.930 -24.634 -0.363 1.00 0.00 O ATOM 0 H GLU A 73 -9.519 -23.097 1.295 1.00 0.00 H new ATOM 0 HA GLU A 73 -11.023 -21.643 -0.389 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -11.822 -22.560 2.412 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -12.948 -22.230 1.110 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -11.012 -24.559 1.077 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -12.629 -24.646 1.747 1.00 0.00 H new ATOM 771 N GLU A 74 -10.822 -19.724 2.333 1.00 0.00 N ATOM 772 CA GLU A 74 -10.837 -18.302 2.789 1.00 0.00 C ATOM 773 C GLU A 74 -9.533 -17.503 2.458 1.00 0.00 C ATOM 774 O GLU A 74 -9.664 -16.277 2.382 1.00 0.00 O ATOM 775 CB GLU A 74 -11.117 -18.217 4.323 1.00 0.00 C ATOM 776 CG GLU A 74 -12.550 -18.502 4.838 1.00 0.00 C ATOM 777 CD GLU A 74 -12.899 -19.987 4.910 1.00 0.00 C ATOM 778 OE1 GLU A 74 -12.260 -20.612 5.948 1.00 0.00 O ATOM 779 OE2 GLU A 74 -13.665 -20.543 4.125 1.00 0.00 O ATOM 0 H GLU A 74 -10.449 -20.362 3.036 1.00 0.00 H new ATOM 0 HA GLU A 74 -11.643 -17.832 2.224 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -10.443 -18.914 4.820 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -10.841 -17.216 4.654 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -12.663 -18.064 5.830 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -13.266 -18.002 4.186 1.00 0.00 H new ATOM 786 N LEU A 75 -8.322 -18.112 2.299 1.00 0.00 N ATOM 787 CA LEU A 75 -7.034 -17.389 2.092 1.00 0.00 C ATOM 788 C LEU A 75 -6.918 -16.558 0.779 1.00 0.00 C ATOM 789 O LEU A 75 -6.308 -15.486 0.845 1.00 0.00 O ATOM 790 CB LEU A 75 -5.833 -18.376 2.264 1.00 0.00 C ATOM 791 CG LEU A 75 -5.520 -19.098 3.639 1.00 0.00 C ATOM 792 CD1 LEU A 75 -4.359 -20.127 3.538 1.00 0.00 C ATOM 793 CD2 LEU A 75 -5.282 -18.158 4.839 1.00 0.00 C ATOM 0 H LEU A 75 -8.213 -19.126 2.311 1.00 0.00 H new ATOM 0 HA LEU A 75 -7.006 -16.626 2.870 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -5.966 -19.162 1.521 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -4.934 -17.825 1.988 1.00 0.00 H new ATOM 0 HG LEU A 75 -6.449 -19.630 3.844 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -4.194 -20.587 4.513 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -4.618 -20.898 2.812 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.449 -19.619 3.218 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -5.076 -18.751 5.730 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -4.431 -17.510 4.630 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -6.170 -17.549 5.006 1.00 0.00 H new ATOM 805 N GLU A 76 -7.501 -17.010 -0.359 1.00 0.00 N ATOM 806 CA GLU A 76 -7.649 -16.161 -1.593 1.00 0.00 C ATOM 807 C GLU A 76 -8.580 -14.904 -1.411 1.00 0.00 C ATOM 808 O GLU A 76 -8.407 -13.947 -2.172 1.00 0.00 O ATOM 809 CB GLU A 76 -8.139 -16.988 -2.821 1.00 0.00 C ATOM 810 CG GLU A 76 -7.173 -18.016 -3.463 1.00 0.00 C ATOM 811 CD GLU A 76 -6.070 -17.408 -4.331 1.00 0.00 C ATOM 812 OE1 GLU A 76 -4.981 -17.044 -3.888 1.00 0.00 O ATOM 813 OE2 GLU A 76 -6.443 -17.320 -5.646 1.00 0.00 O ATOM 0 H GLU A 76 -7.879 -17.952 -0.459 1.00 0.00 H new ATOM 0 HA GLU A 76 -6.641 -15.791 -1.778 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -9.039 -17.524 -2.520 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -8.434 -16.282 -3.598 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -6.709 -18.602 -2.669 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -7.755 -18.708 -4.072 1.00 0.00 H new ATOM 820 N GLU A 77 -9.505 -14.909 -0.414 1.00 0.00 N ATOM 821 CA GLU A 77 -10.302 -13.726 0.014 1.00 0.00 C ATOM 822 C GLU A 77 -9.455 -12.741 0.902 1.00 0.00 C ATOM 823 O GLU A 77 -9.385 -11.585 0.481 1.00 0.00 O ATOM 824 CB GLU A 77 -11.629 -14.254 0.653 1.00 0.00 C ATOM 825 CG GLU A 77 -12.754 -13.219 0.863 1.00 0.00 C ATOM 826 CD GLU A 77 -13.987 -13.836 1.511 1.00 0.00 C ATOM 827 OE1 GLU A 77 -13.871 -13.898 2.874 1.00 0.00 O ATOM 828 OE2 GLU A 77 -14.963 -14.228 0.873 1.00 0.00 O ATOM 0 H GLU A 77 -9.722 -15.748 0.124 1.00 0.00 H new ATOM 0 HA GLU A 77 -10.581 -13.100 -0.834 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -12.016 -15.055 0.022 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -11.389 -14.697 1.619 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -12.385 -12.405 1.488 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -13.029 -12.784 -0.098 1.00 0.00 H new ATOM 835 N LEU A 78 -8.841 -13.135 2.057 1.00 0.00 N ATOM 836 CA LEU A 78 -8.076 -12.219 2.948 1.00 0.00 C ATOM 837 C LEU A 78 -6.763 -11.595 2.403 1.00 0.00 C ATOM 838 O LEU A 78 -6.493 -10.454 2.793 1.00 0.00 O ATOM 839 CB LEU A 78 -7.821 -12.905 4.329 1.00 0.00 C ATOM 840 CG LEU A 78 -7.052 -14.260 4.598 1.00 0.00 C ATOM 841 CD1 LEU A 78 -5.610 -14.428 4.036 1.00 0.00 C ATOM 842 CD2 LEU A 78 -7.042 -14.602 6.117 1.00 0.00 C ATOM 0 H LEU A 78 -8.865 -14.098 2.393 1.00 0.00 H new ATOM 0 HA LEU A 78 -8.733 -11.354 3.035 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -7.305 -12.157 4.931 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -8.809 -13.042 4.769 1.00 0.00 H new ATOM 0 HG LEU A 78 -7.643 -14.961 4.009 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -5.226 -15.411 4.308 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -5.629 -14.334 2.950 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -4.964 -13.657 4.456 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -6.507 -15.538 6.276 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -6.545 -13.803 6.667 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -8.067 -14.705 6.474 1.00 0.00 H new ATOM 854 N MET A 79 -5.996 -12.276 1.518 1.00 0.00 N ATOM 855 CA MET A 79 -4.825 -11.664 0.800 1.00 0.00 C ATOM 856 C MET A 79 -5.276 -10.656 -0.317 1.00 0.00 C ATOM 857 O MET A 79 -4.726 -9.548 -0.325 1.00 0.00 O ATOM 858 CB MET A 79 -3.847 -12.747 0.234 1.00 0.00 C ATOM 859 CG MET A 79 -2.972 -13.582 1.197 1.00 0.00 C ATOM 860 SD MET A 79 -1.693 -14.395 0.203 1.00 0.00 S ATOM 861 CE MET A 79 -0.368 -14.726 1.391 1.00 0.00 C ATOM 0 H MET A 79 -6.159 -13.253 1.276 1.00 0.00 H new ATOM 0 HA MET A 79 -4.273 -11.092 1.545 1.00 0.00 H new ATOM 0 HB2 MET A 79 -4.443 -13.447 -0.351 1.00 0.00 H new ATOM 0 HB3 MET A 79 -3.174 -12.244 -0.461 1.00 0.00 H new ATOM 0 HG2 MET A 79 -2.520 -12.943 1.956 1.00 0.00 H new ATOM 0 HG3 MET A 79 -3.577 -14.321 1.722 1.00 0.00 H new ATOM 0 HE1 MET A 79 0.481 -15.172 0.874 1.00 0.00 H new ATOM 0 HE2 MET A 79 -0.058 -13.792 1.859 1.00 0.00 H new ATOM 0 HE3 MET A 79 -0.729 -15.413 2.156 1.00 0.00 H new ATOM 871 N SER A 80 -6.255 -11.002 -1.196 1.00 0.00 N ATOM 872 CA SER A 80 -6.906 -10.030 -2.121 1.00 0.00 C ATOM 873 C SER A 80 -7.767 -8.902 -1.450 1.00 0.00 C ATOM 874 O SER A 80 -8.033 -7.908 -2.132 1.00 0.00 O ATOM 875 CB SER A 80 -7.768 -10.825 -3.113 1.00 0.00 C ATOM 876 OG SER A 80 -8.293 -9.971 -4.122 1.00 0.00 O ATOM 0 H SER A 80 -6.613 -11.953 -1.284 1.00 0.00 H new ATOM 0 HA SER A 80 -6.095 -9.487 -2.605 1.00 0.00 H new ATOM 0 HB2 SER A 80 -7.170 -11.613 -3.572 1.00 0.00 H new ATOM 0 HB3 SER A 80 -8.585 -11.313 -2.582 1.00 0.00 H new ATOM 0 HG SER A 80 -8.378 -9.061 -3.769 1.00 0.00 H new ATOM 882 N ASP A 81 -8.164 -9.047 -0.157 1.00 0.00 N ATOM 883 CA ASP A 81 -8.810 -7.978 0.658 1.00 0.00 C ATOM 884 C ASP A 81 -7.800 -6.924 1.203 1.00 0.00 C ATOM 885 O ASP A 81 -8.111 -5.740 1.033 1.00 0.00 O ATOM 886 CB ASP A 81 -9.668 -8.619 1.788 1.00 0.00 C ATOM 887 CG ASP A 81 -10.755 -7.703 2.355 1.00 0.00 C ATOM 888 OD1 ASP A 81 -11.841 -7.520 1.807 1.00 0.00 O ATOM 889 OD2 ASP A 81 -10.370 -7.122 3.534 1.00 0.00 O ATOM 0 H ASP A 81 -8.043 -9.920 0.356 1.00 0.00 H new ATOM 0 HA ASP A 81 -9.471 -7.415 -0.001 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -10.138 -9.524 1.402 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -9.008 -8.924 2.600 1.00 0.00 H new ATOM 894 N ILE A 82 -6.614 -7.288 1.785 1.00 0.00 N ATOM 895 CA ILE A 82 -5.546 -6.305 2.162 1.00 0.00 C ATOM 896 C ILE A 82 -4.911 -5.681 0.866 1.00 0.00 C ATOM 897 O ILE A 82 -4.791 -4.465 0.871 1.00 0.00 O ATOM 898 CB ILE A 82 -4.532 -6.964 3.187 1.00 0.00 C ATOM 899 CG1 ILE A 82 -5.209 -7.485 4.530 1.00 0.00 C ATOM 900 CG2 ILE A 82 -3.357 -5.991 3.547 1.00 0.00 C ATOM 901 CD1 ILE A 82 -4.612 -8.745 5.203 1.00 0.00 C ATOM 0 H ILE A 82 -6.374 -8.255 2.003 1.00 0.00 H new ATOM 0 HA ILE A 82 -5.963 -5.455 2.703 1.00 0.00 H new ATOM 0 HB ILE A 82 -4.144 -7.837 2.662 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.179 -6.673 5.256 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -6.259 -7.685 4.319 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -2.684 -6.479 4.252 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -2.809 -5.732 2.641 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -3.760 -5.085 3.999 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -5.177 -8.978 6.106 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -4.668 -9.587 4.513 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -3.570 -8.559 5.465 1.00 0.00 H new ATOM 913 N LYS A 83 -4.559 -6.416 -0.209 1.00 0.00 N ATOM 914 CA LYS A 83 -4.166 -5.832 -1.530 1.00 0.00 C ATOM 915 C LYS A 83 -5.160 -4.712 -2.064 1.00 0.00 C ATOM 916 O LYS A 83 -4.695 -3.593 -2.320 1.00 0.00 O ATOM 917 CB LYS A 83 -4.003 -7.086 -2.444 1.00 0.00 C ATOM 918 CG LYS A 83 -3.445 -6.906 -3.880 1.00 0.00 C ATOM 919 CD LYS A 83 -3.839 -8.083 -4.796 1.00 0.00 C ATOM 920 CE LYS A 83 -3.252 -7.995 -6.210 1.00 0.00 C ATOM 921 NZ LYS A 83 -3.695 -9.147 -7.010 1.00 0.00 N ATOM 0 H LYS A 83 -4.536 -7.436 -0.196 1.00 0.00 H new ATOM 0 HA LYS A 83 -3.242 -5.255 -1.484 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -3.352 -7.789 -1.924 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -4.981 -7.560 -2.529 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -3.821 -5.974 -4.303 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -2.359 -6.823 -3.841 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -3.511 -9.015 -4.335 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -4.926 -8.127 -4.867 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -3.568 -7.067 -6.687 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -2.163 -7.973 -6.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -3.293 -9.080 -7.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -3.372 -10.027 -6.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -4.733 -9.149 -7.070 1.00 0.00 H new ATOM 935 N LYS A 84 -6.488 -5.009 -2.138 1.00 0.00 N ATOM 936 CA LYS A 84 -7.546 -4.055 -2.577 1.00 0.00 C ATOM 937 C LYS A 84 -7.815 -2.871 -1.584 1.00 0.00 C ATOM 938 O LYS A 84 -7.839 -1.730 -2.060 1.00 0.00 O ATOM 939 CB LYS A 84 -8.835 -4.874 -2.933 1.00 0.00 C ATOM 940 CG LYS A 84 -8.915 -5.609 -4.310 1.00 0.00 C ATOM 941 CD LYS A 84 -9.219 -4.780 -5.589 1.00 0.00 C ATOM 942 CE LYS A 84 -10.699 -4.437 -5.856 1.00 0.00 C ATOM 943 NZ LYS A 84 -10.837 -3.664 -7.100 1.00 0.00 N ATOM 0 H LYS A 84 -6.857 -5.927 -1.892 1.00 0.00 H new ATOM 0 HA LYS A 84 -7.186 -3.538 -3.466 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -8.974 -5.623 -2.153 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -9.683 -4.192 -2.875 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -7.965 -6.119 -4.467 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -9.681 -6.380 -4.228 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -8.658 -3.847 -5.531 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -8.836 -5.329 -6.449 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -11.283 -5.354 -5.925 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -11.102 -3.865 -5.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -11.840 -3.443 -7.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -10.296 -2.779 -7.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -10.472 -4.222 -7.898 1.00 0.00 H new ATOM 957 N THR A 85 -7.967 -3.114 -0.249 1.00 0.00 N ATOM 958 CA THR A 85 -8.137 -2.048 0.785 1.00 0.00 C ATOM 959 C THR A 85 -6.807 -1.222 0.984 1.00 0.00 C ATOM 960 O THR A 85 -6.892 -0.014 0.754 1.00 0.00 O ATOM 961 CB THR A 85 -8.746 -2.707 2.071 1.00 0.00 C ATOM 962 OG1 THR A 85 -9.885 -3.496 1.736 1.00 0.00 O ATOM 963 CG2 THR A 85 -9.234 -1.744 3.173 1.00 0.00 C ATOM 0 H THR A 85 -7.975 -4.057 0.141 1.00 0.00 H new ATOM 0 HA THR A 85 -8.847 -1.285 0.467 1.00 0.00 H new ATOM 0 HB THR A 85 -7.904 -3.276 2.466 1.00 0.00 H new ATOM 0 HG1 THR A 85 -9.593 -4.382 1.436 1.00 0.00 H new ATOM 0 HG21 THR A 85 -9.633 -2.319 4.008 1.00 0.00 H new ATOM 0 HG22 THR A 85 -8.400 -1.134 3.518 1.00 0.00 H new ATOM 0 HG23 THR A 85 -10.015 -1.098 2.772 1.00 0.00 H new ATOM 971 N ALA A 86 -5.629 -1.840 1.309 1.00 0.00 N ATOM 972 CA ALA A 86 -4.293 -1.162 1.410 1.00 0.00 C ATOM 973 C ALA A 86 -3.907 -0.250 0.213 1.00 0.00 C ATOM 974 O ALA A 86 -3.393 0.826 0.495 1.00 0.00 O ATOM 975 CB ALA A 86 -3.157 -2.160 1.672 1.00 0.00 C ATOM 0 H ALA A 86 -5.579 -2.838 1.511 1.00 0.00 H new ATOM 0 HA ALA A 86 -4.420 -0.501 2.267 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -2.210 -1.624 1.737 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -3.343 -2.685 2.609 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -3.110 -2.881 0.856 1.00 0.00 H new ATOM 981 N ASN A 87 -4.200 -0.620 -1.058 1.00 0.00 N ATOM 982 CA ASN A 87 -4.061 0.292 -2.236 1.00 0.00 C ATOM 983 C ASN A 87 -5.123 1.436 -2.330 1.00 0.00 C ATOM 984 O ASN A 87 -4.709 2.541 -2.698 1.00 0.00 O ATOM 985 CB ASN A 87 -3.989 -0.563 -3.532 1.00 0.00 C ATOM 986 CG ASN A 87 -3.397 0.158 -4.761 1.00 0.00 C ATOM 987 OD1 ASN A 87 -4.124 0.787 -5.528 1.00 0.00 O ATOM 988 ND2 ASN A 87 -2.090 0.087 -4.975 1.00 0.00 N ATOM 0 H ASN A 87 -4.538 -1.551 -1.302 1.00 0.00 H new ATOM 0 HA ASN A 87 -3.130 0.841 -2.099 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -3.392 -1.452 -3.329 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -4.994 -0.904 -3.780 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -1.679 0.557 -5.782 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -1.496 -0.437 -4.333 1.00 0.00 H new ATOM 995 N LYS A 88 -6.420 1.214 -1.987 1.00 0.00 N ATOM 996 CA LYS A 88 -7.436 2.310 -1.838 1.00 0.00 C ATOM 997 C LYS A 88 -7.117 3.349 -0.689 1.00 0.00 C ATOM 998 O LYS A 88 -7.300 4.546 -0.931 1.00 0.00 O ATOM 999 CB LYS A 88 -8.846 1.648 -1.714 1.00 0.00 C ATOM 1000 CG LYS A 88 -10.073 2.551 -2.016 1.00 0.00 C ATOM 1001 CD LYS A 88 -11.448 1.931 -1.832 1.00 0.00 C ATOM 1002 CE LYS A 88 -12.691 2.796 -2.143 1.00 0.00 C ATOM 1003 NZ LYS A 88 -12.984 2.915 -3.586 1.00 0.00 N ATOM 0 H LYS A 88 -6.795 0.283 -1.806 1.00 0.00 H new ATOM 0 HA LYS A 88 -7.406 2.936 -2.730 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -8.880 0.792 -2.388 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -8.951 1.260 -0.701 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -10.011 3.432 -1.377 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -9.993 2.898 -3.046 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -11.498 1.041 -2.459 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -11.526 1.597 -0.797 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -13.557 2.367 -1.639 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -12.543 3.793 -1.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -13.828 3.507 -3.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -12.174 3.352 -4.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -13.157 1.970 -3.984 1.00 0.00 H new ATOM 1017 N VAL A 89 -6.644 2.894 0.497 1.00 0.00 N ATOM 1018 CA VAL A 89 -6.191 3.762 1.638 1.00 0.00 C ATOM 1019 C VAL A 89 -4.762 4.389 1.410 1.00 0.00 C ATOM 1020 O VAL A 89 -4.671 5.612 1.567 1.00 0.00 O ATOM 1021 CB VAL A 89 -6.398 2.989 3.013 1.00 0.00 C ATOM 1022 CG1 VAL A 89 -5.586 1.699 3.243 1.00 0.00 C ATOM 1023 CG2 VAL A 89 -6.266 3.855 4.288 1.00 0.00 C ATOM 0 H VAL A 89 -6.561 1.898 0.702 1.00 0.00 H new ATOM 0 HA VAL A 89 -6.823 4.648 1.690 1.00 0.00 H new ATOM 0 HB VAL A 89 -7.437 2.697 2.860 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -5.831 1.284 4.221 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -5.831 0.972 2.468 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -4.521 1.927 3.203 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -6.425 3.233 5.169 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -5.269 4.293 4.328 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -7.011 4.650 4.267 1.00 0.00 H new ATOM 1033 N ARG A 90 -3.692 3.614 1.084 1.00 0.00 N ATOM 1034 CA ARG A 90 -2.292 4.159 0.924 1.00 0.00 C ATOM 1035 C ARG A 90 -2.158 5.270 -0.190 1.00 0.00 C ATOM 1036 O ARG A 90 -1.538 6.304 0.079 1.00 0.00 O ATOM 1037 CB ARG A 90 -1.292 2.948 0.850 1.00 0.00 C ATOM 1038 CG ARG A 90 -0.944 2.371 -0.520 1.00 0.00 C ATOM 1039 CD ARG A 90 -0.098 1.087 -0.609 1.00 0.00 C ATOM 1040 NE ARG A 90 1.355 1.332 -0.387 1.00 0.00 N ATOM 1041 CZ ARG A 90 2.335 0.395 -0.323 1.00 0.00 C ATOM 1042 NH1 ARG A 90 2.171 -0.930 -0.449 1.00 0.00 N ATOM 1043 NH2 ARG A 90 3.565 0.828 -0.117 1.00 0.00 N ATOM 0 H ARG A 90 -3.760 2.609 0.924 1.00 0.00 H new ATOM 0 HA ARG A 90 -2.012 4.740 1.803 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -0.361 3.258 1.325 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -1.705 2.140 1.454 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -1.882 2.181 -1.042 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -0.420 3.147 -1.078 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -0.457 0.370 0.129 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -0.239 0.633 -1.590 1.00 0.00 H new ATOM 0 HE ARG A 90 1.643 2.304 -0.271 1.00 0.00 H new ATOM 0 HH11 ARG A 90 1.240 -1.316 -0.609 1.00 0.00 H new ATOM 0 HH12 ARG A 90 2.977 -1.552 -0.385 1.00 0.00 H new ATOM 0 HH21 ARG A 90 3.743 1.827 -0.014 1.00 0.00 H new ATOM 0 HH22 ARG A 90 4.337 0.164 -0.061 1.00 0.00 H new ATOM 1057 N SER A 91 -2.776 5.036 -1.369 1.00 0.00 N ATOM 1058 CA SER A 91 -2.957 6.061 -2.437 1.00 0.00 C ATOM 1059 C SER A 91 -3.777 7.336 -2.043 1.00 0.00 C ATOM 1060 O SER A 91 -3.567 8.370 -2.686 1.00 0.00 O ATOM 1061 CB SER A 91 -3.617 5.388 -3.650 1.00 0.00 C ATOM 1062 OG SER A 91 -2.797 4.342 -4.157 1.00 0.00 O ATOM 0 H SER A 91 -3.168 4.127 -1.614 1.00 0.00 H new ATOM 0 HA SER A 91 -1.956 6.436 -2.651 1.00 0.00 H new ATOM 0 HB2 SER A 91 -4.590 4.987 -3.364 1.00 0.00 H new ATOM 0 HB3 SER A 91 -3.794 6.128 -4.430 1.00 0.00 H new ATOM 0 HG SER A 91 -3.145 3.477 -3.854 1.00 0.00 H new ATOM 1068 N LYS A 92 -4.668 7.260 -1.017 1.00 0.00 N ATOM 1069 CA LYS A 92 -5.440 8.413 -0.483 1.00 0.00 C ATOM 1070 C LYS A 92 -4.629 9.323 0.485 1.00 0.00 C ATOM 1071 O LYS A 92 -4.685 10.539 0.268 1.00 0.00 O ATOM 1072 CB LYS A 92 -6.781 7.875 0.139 1.00 0.00 C ATOM 1073 CG LYS A 92 -8.018 8.815 0.115 1.00 0.00 C ATOM 1074 CD LYS A 92 -8.791 8.843 -1.228 1.00 0.00 C ATOM 1075 CE LYS A 92 -10.015 9.767 -1.225 1.00 0.00 C ATOM 1076 NZ LYS A 92 -10.680 9.728 -2.536 1.00 0.00 N ATOM 0 H LYS A 92 -4.872 6.386 -0.533 1.00 0.00 H new ATOM 0 HA LYS A 92 -5.676 9.083 -1.310 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -7.048 6.956 -0.384 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -6.585 7.606 1.177 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -8.703 8.510 0.906 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -7.691 9.828 0.350 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -8.112 9.159 -2.020 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -9.114 7.831 -1.471 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -10.712 9.458 -0.446 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -9.710 10.787 -0.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -11.508 10.357 -2.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -10.016 10.044 -3.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -10.987 8.756 -2.741 1.00 0.00 H new ATOM 1090 N LEU A 93 -3.891 8.792 1.505 1.00 0.00 N ATOM 1091 CA LEU A 93 -2.921 9.613 2.306 1.00 0.00 C ATOM 1092 C LEU A 93 -1.631 10.047 1.516 1.00 0.00 C ATOM 1093 O LEU A 93 -1.032 11.071 1.874 1.00 0.00 O ATOM 1094 CB LEU A 93 -2.639 8.909 3.671 1.00 0.00 C ATOM 1095 CG LEU A 93 -2.011 7.479 3.834 1.00 0.00 C ATOM 1096 CD1 LEU A 93 -0.531 7.416 3.417 1.00 0.00 C ATOM 1097 CD2 LEU A 93 -2.169 6.947 5.284 1.00 0.00 C ATOM 0 H LEU A 93 -3.945 7.815 1.791 1.00 0.00 H new ATOM 0 HA LEU A 93 -3.392 10.572 2.520 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -1.992 9.586 4.229 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -3.594 8.878 4.195 1.00 0.00 H new ATOM 0 HG LEU A 93 -2.571 6.838 3.153 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -0.157 6.401 3.554 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -0.436 7.700 2.369 1.00 0.00 H new ATOM 0 HD13 LEU A 93 0.050 8.103 4.033 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -1.723 5.955 5.358 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -1.668 7.623 5.976 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -3.228 6.888 5.537 1.00 0.00 H new ATOM 1109 N LYS A 94 -1.259 9.360 0.398 1.00 0.00 N ATOM 1110 CA LYS A 94 -0.229 9.783 -0.579 1.00 0.00 C ATOM 1111 C LYS A 94 -0.594 11.163 -1.243 1.00 0.00 C ATOM 1112 O LYS A 94 0.245 12.059 -1.130 1.00 0.00 O ATOM 1113 CB LYS A 94 -0.073 8.509 -1.476 1.00 0.00 C ATOM 1114 CG LYS A 94 0.583 8.557 -2.859 1.00 0.00 C ATOM 1115 CD LYS A 94 2.122 8.708 -2.926 1.00 0.00 C ATOM 1116 CE LYS A 94 2.738 8.725 -4.340 1.00 0.00 C ATOM 1117 NZ LYS A 94 2.880 7.384 -4.946 1.00 0.00 N ATOM 0 H LYS A 94 -1.686 8.468 0.150 1.00 0.00 H new ATOM 0 HA LYS A 94 0.751 10.047 -0.182 1.00 0.00 H new ATOM 0 HB2 LYS A 94 0.486 7.780 -0.890 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -1.074 8.102 -1.619 1.00 0.00 H new ATOM 0 HG2 LYS A 94 0.313 7.643 -3.389 1.00 0.00 H new ATOM 0 HG3 LYS A 94 0.141 9.387 -3.410 1.00 0.00 H new ATOM 0 HD2 LYS A 94 2.399 9.632 -2.419 1.00 0.00 H new ATOM 0 HD3 LYS A 94 2.572 7.889 -2.365 1.00 0.00 H new ATOM 0 HE2 LYS A 94 2.117 9.343 -4.989 1.00 0.00 H new ATOM 0 HE3 LYS A 94 3.719 9.198 -4.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 3.300 7.474 -5.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 3.496 6.797 -4.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 1.944 6.937 -5.023 1.00 0.00 H new ATOM 1131 N SER A 95 -1.824 11.366 -1.806 1.00 0.00 N ATOM 1132 CA SER A 95 -2.320 12.715 -2.246 1.00 0.00 C ATOM 1133 C SER A 95 -2.246 13.903 -1.220 1.00 0.00 C ATOM 1134 O SER A 95 -2.188 15.056 -1.657 1.00 0.00 O ATOM 1135 CB SER A 95 -3.767 12.566 -2.741 1.00 0.00 C ATOM 1136 OG SER A 95 -3.838 11.652 -3.829 1.00 0.00 O ATOM 0 H SER A 95 -2.493 10.613 -1.967 1.00 0.00 H new ATOM 0 HA SER A 95 -1.616 13.012 -3.023 1.00 0.00 H new ATOM 0 HB2 SER A 95 -4.401 12.217 -1.926 1.00 0.00 H new ATOM 0 HB3 SER A 95 -4.152 13.538 -3.051 1.00 0.00 H new ATOM 0 HG SER A 95 -4.768 11.571 -4.128 1.00 0.00 H new ATOM 1142 N ILE A 96 -2.210 13.602 0.102 1.00 0.00 N ATOM 1143 CA ILE A 96 -1.919 14.569 1.215 1.00 0.00 C ATOM 1144 C ILE A 96 -0.380 14.921 1.213 1.00 0.00 C ATOM 1145 O ILE A 96 -0.102 16.125 1.170 1.00 0.00 O ATOM 1146 CB ILE A 96 -2.479 13.998 2.616 1.00 0.00 C ATOM 1147 CG1 ILE A 96 -3.979 13.495 2.703 1.00 0.00 C ATOM 1148 CG2 ILE A 96 -2.211 14.973 3.822 1.00 0.00 C ATOM 1149 CD1 ILE A 96 -5.181 14.381 2.326 1.00 0.00 C ATOM 0 H ILE A 96 -2.386 12.657 0.443 1.00 0.00 H new ATOM 0 HA ILE A 96 -2.447 15.510 1.061 1.00 0.00 H new ATOM 0 HB ILE A 96 -1.883 13.088 2.682 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -4.044 12.603 2.079 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -4.140 13.176 3.733 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -2.609 14.537 4.738 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -1.138 15.130 3.932 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -2.700 15.929 3.633 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -6.105 13.820 2.467 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.194 15.266 2.962 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.096 14.685 1.283 1.00 0.00 H new ATOM 1161 N GLU A 97 0.576 13.946 1.248 1.00 0.00 N ATOM 1162 CA GLU A 97 2.039 14.247 1.090 1.00 0.00 C ATOM 1163 C GLU A 97 2.452 14.874 -0.283 1.00 0.00 C ATOM 1164 O GLU A 97 3.340 15.730 -0.269 1.00 0.00 O ATOM 1165 CB GLU A 97 2.870 12.966 1.416 1.00 0.00 C ATOM 1166 CG GLU A 97 4.344 13.129 1.861 1.00 0.00 C ATOM 1167 CD GLU A 97 5.313 13.408 0.712 1.00 0.00 C ATOM 1168 OE1 GLU A 97 5.440 12.666 -0.261 1.00 0.00 O ATOM 1169 OE2 GLU A 97 6.010 14.573 0.897 1.00 0.00 O ATOM 0 H GLU A 97 0.367 12.957 1.382 1.00 0.00 H new ATOM 0 HA GLU A 97 2.265 15.036 1.807 1.00 0.00 H new ATOM 0 HB2 GLU A 97 2.346 12.423 2.202 1.00 0.00 H new ATOM 0 HB3 GLU A 97 2.861 12.332 0.530 1.00 0.00 H new ATOM 0 HG2 GLU A 97 4.407 13.944 2.582 1.00 0.00 H new ATOM 0 HG3 GLU A 97 4.660 12.222 2.377 1.00 0.00 H new ATOM 1176 N GLN A 98 1.791 14.507 -1.404 1.00 0.00 N ATOM 1177 CA GLN A 98 1.942 15.157 -2.731 1.00 0.00 C ATOM 1178 C GLN A 98 1.469 16.644 -2.813 1.00 0.00 C ATOM 1179 O GLN A 98 2.201 17.435 -3.416 1.00 0.00 O ATOM 1180 CB GLN A 98 1.222 14.269 -3.795 1.00 0.00 C ATOM 1181 CG GLN A 98 1.675 12.797 -4.023 1.00 0.00 C ATOM 1182 CD GLN A 98 3.129 12.547 -4.462 1.00 0.00 C ATOM 1183 OE1 GLN A 98 3.447 12.474 -5.648 1.00 0.00 O ATOM 1184 NE2 GLN A 98 4.023 12.415 -3.487 1.00 0.00 N ATOM 0 H GLN A 98 1.124 13.736 -1.415 1.00 0.00 H new ATOM 0 HA GLN A 98 3.012 15.224 -2.928 1.00 0.00 H new ATOM 0 HB2 GLN A 98 0.164 14.245 -3.533 1.00 0.00 H new ATOM 0 HB3 GLN A 98 1.302 14.784 -4.753 1.00 0.00 H new ATOM 0 HG2 GLN A 98 1.507 12.249 -3.096 1.00 0.00 H new ATOM 0 HG3 GLN A 98 1.019 12.359 -4.775 1.00 0.00 H new ATOM 0 HE21 GLN A 98 3.728 12.481 -2.513 1.00 0.00 H new ATOM 0 HE22 GLN A 98 5.004 12.248 -3.713 1.00 0.00 H new ATOM 1193 N SER A 99 0.296 16.997 -2.226 1.00 0.00 N ATOM 1194 CA SER A 99 -0.196 18.404 -2.173 1.00 0.00 C ATOM 1195 C SER A 99 0.483 19.363 -1.166 1.00 0.00 C ATOM 1196 O SER A 99 0.446 20.567 -1.438 1.00 0.00 O ATOM 1197 CB SER A 99 -1.712 18.390 -1.932 1.00 0.00 C ATOM 1198 OG SER A 99 -2.384 17.703 -2.980 1.00 0.00 O ATOM 0 H SER A 99 -0.330 16.326 -1.781 1.00 0.00 H new ATOM 0 HA SER A 99 0.079 18.821 -3.142 1.00 0.00 H new ATOM 0 HB2 SER A 99 -1.929 17.909 -0.978 1.00 0.00 H new ATOM 0 HB3 SER A 99 -2.083 19.413 -1.865 1.00 0.00 H new ATOM 0 HG SER A 99 -2.445 16.750 -2.760 1.00 0.00 H new ATOM 1371 N ALA A 111 1.583 27.767 10.325 1.00 0.00 N ATOM 1372 CA ALA A 111 1.270 26.584 11.168 1.00 0.00 C ATOM 1373 C ALA A 111 -0.252 26.284 10.970 1.00 0.00 C ATOM 1374 O ALA A 111 -1.172 26.837 11.583 1.00 0.00 O ATOM 1375 CB ALA A 111 1.618 26.846 12.618 1.00 0.00 C ATOM 0 HA ALA A 111 1.863 25.718 10.874 1.00 0.00 H new ATOM 0 HB1 ALA A 111 1.380 25.965 13.214 1.00 0.00 H new ATOM 0 HB2 ALA A 111 2.682 27.064 12.703 1.00 0.00 H new ATOM 0 HB3 ALA A 111 1.043 27.697 12.982 1.00 0.00 H new ATOM 1381 N ASP A 112 -0.424 25.432 9.962 1.00 0.00 N ATOM 1382 CA ASP A 112 -1.691 25.009 9.260 1.00 0.00 C ATOM 1383 C ASP A 112 -1.231 23.832 8.328 1.00 0.00 C ATOM 1384 O ASP A 112 -1.799 22.740 8.390 1.00 0.00 O ATOM 1385 CB ASP A 112 -2.415 26.157 8.485 1.00 0.00 C ATOM 1386 CG ASP A 112 -3.864 25.856 8.128 1.00 0.00 C ATOM 1387 OD1 ASP A 112 -4.194 25.090 7.225 1.00 0.00 O ATOM 1388 OD2 ASP A 112 -4.741 26.538 8.931 1.00 0.00 O ATOM 0 H ASP A 112 0.384 24.959 9.557 1.00 0.00 H new ATOM 0 HA ASP A 112 -2.457 24.706 9.974 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -2.383 27.064 9.089 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -1.863 26.365 7.568 1.00 0.00 H new ATOM 1393 N LEU A 113 -0.167 24.084 7.515 1.00 0.00 N ATOM 1394 CA LEU A 113 0.647 23.086 6.745 1.00 0.00 C ATOM 1395 C LEU A 113 1.358 22.026 7.686 1.00 0.00 C ATOM 1396 O LEU A 113 1.724 20.932 7.247 1.00 0.00 O ATOM 1397 CB LEU A 113 1.633 24.029 5.928 1.00 0.00 C ATOM 1398 CG LEU A 113 3.049 23.614 5.356 1.00 0.00 C ATOM 1399 CD1 LEU A 113 3.543 24.632 4.294 1.00 0.00 C ATOM 1400 CD2 LEU A 113 4.158 23.477 6.446 1.00 0.00 C ATOM 0 H LEU A 113 0.167 25.036 7.368 1.00 0.00 H new ATOM 0 HA LEU A 113 0.067 22.435 6.091 1.00 0.00 H new ATOM 0 HB2 LEU A 113 1.060 24.383 5.071 1.00 0.00 H new ATOM 0 HB3 LEU A 113 1.815 24.892 6.568 1.00 0.00 H new ATOM 0 HG LEU A 113 2.890 22.631 4.912 1.00 0.00 H new ATOM 0 HD11 LEU A 113 4.518 24.322 3.918 1.00 0.00 H new ATOM 0 HD12 LEU A 113 2.832 24.671 3.469 1.00 0.00 H new ATOM 0 HD13 LEU A 113 3.627 25.620 4.748 1.00 0.00 H new ATOM 0 HD21 LEU A 113 5.098 23.190 5.975 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.285 24.431 6.958 1.00 0.00 H new ATOM 0 HD23 LEU A 113 3.867 22.714 7.168 1.00 0.00 H new ATOM 1412 N ARG A 114 1.612 22.474 8.924 1.00 0.00 N ATOM 1413 CA ARG A 114 2.442 21.842 9.976 1.00 0.00 C ATOM 1414 C ARG A 114 1.526 20.909 10.834 1.00 0.00 C ATOM 1415 O ARG A 114 1.905 19.763 11.085 1.00 0.00 O ATOM 1416 CB ARG A 114 3.134 23.002 10.781 1.00 0.00 C ATOM 1417 CG ARG A 114 4.030 24.059 10.043 1.00 0.00 C ATOM 1418 CD ARG A 114 5.481 23.705 9.747 1.00 0.00 C ATOM 1419 NE ARG A 114 6.379 23.708 10.941 1.00 0.00 N ATOM 1420 CZ ARG A 114 7.142 24.740 11.391 1.00 0.00 C ATOM 1421 NH1 ARG A 114 7.225 25.957 10.836 1.00 0.00 N ATOM 1422 NH2 ARG A 114 7.865 24.523 12.474 1.00 0.00 N ATOM 0 H ARG A 114 1.214 23.356 9.247 1.00 0.00 H new ATOM 0 HA ARG A 114 3.234 21.205 9.583 1.00 0.00 H new ATOM 0 HB2 ARG A 114 2.346 23.551 11.295 1.00 0.00 H new ATOM 0 HB3 ARG A 114 3.752 22.537 11.549 1.00 0.00 H new ATOM 0 HG2 ARG A 114 3.548 24.298 9.095 1.00 0.00 H new ATOM 0 HG3 ARG A 114 4.027 24.971 10.641 1.00 0.00 H new ATOM 0 HD2 ARG A 114 5.514 22.717 9.287 1.00 0.00 H new ATOM 0 HD3 ARG A 114 5.871 24.411 9.014 1.00 0.00 H new ATOM 0 HE ARG A 114 6.425 22.842 11.477 1.00 0.00 H new ATOM 0 HH11 ARG A 114 6.684 26.174 9.999 1.00 0.00 H new ATOM 0 HH12 ARG A 114 7.829 26.667 11.251 1.00 0.00 H new ATOM 0 HH21 ARG A 114 7.835 23.613 12.934 1.00 0.00 H new ATOM 0 HH22 ARG A 114 8.454 25.265 12.851 1.00 0.00 H new ATOM 1436 N ILE A 115 0.311 21.391 11.220 1.00 0.00 N ATOM 1437 CA ILE A 115 -0.837 20.629 11.830 1.00 0.00 C ATOM 1438 C ILE A 115 -1.219 19.373 10.925 1.00 0.00 C ATOM 1439 O ILE A 115 -1.356 18.267 11.452 1.00 0.00 O ATOM 1440 CB ILE A 115 -1.996 21.721 12.092 1.00 0.00 C ATOM 1441 CG1 ILE A 115 -1.680 22.751 13.262 1.00 0.00 C ATOM 1442 CG2 ILE A 115 -3.400 21.088 12.335 1.00 0.00 C ATOM 1443 CD1 ILE A 115 -2.347 24.151 13.198 1.00 0.00 C ATOM 0 H ILE A 115 0.085 22.380 11.111 1.00 0.00 H new ATOM 0 HA ILE A 115 -0.605 20.162 12.788 1.00 0.00 H new ATOM 0 HB ILE A 115 -2.017 22.279 11.156 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -1.969 22.286 14.204 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -0.600 22.896 13.297 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -4.131 21.878 12.504 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -3.692 20.504 11.462 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -3.360 20.438 13.209 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -2.038 24.741 14.061 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -2.041 24.658 12.283 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -3.431 24.038 13.205 1.00 0.00 H new ATOM 1455 N ARG A 116 -1.408 19.596 9.605 1.00 0.00 N ATOM 1456 CA ARG A 116 -1.749 18.553 8.580 1.00 0.00 C ATOM 1457 C ARG A 116 -0.625 17.483 8.386 1.00 0.00 C ATOM 1458 O ARG A 116 -0.952 16.297 8.279 1.00 0.00 O ATOM 1459 CB ARG A 116 -2.179 19.257 7.252 1.00 0.00 C ATOM 1460 CG ARG A 116 -3.449 20.157 7.358 1.00 0.00 C ATOM 1461 CD ARG A 116 -3.926 20.993 6.164 1.00 0.00 C ATOM 1462 NE ARG A 116 -2.993 22.081 5.747 1.00 0.00 N ATOM 1463 CZ ARG A 116 -3.165 22.946 4.716 1.00 0.00 C ATOM 1464 NH1 ARG A 116 -4.215 22.982 3.881 1.00 0.00 N ATOM 1465 NH2 ARG A 116 -2.211 23.836 4.515 1.00 0.00 N ATOM 0 H ARG A 116 -1.328 20.529 9.200 1.00 0.00 H new ATOM 0 HA ARG A 116 -2.595 17.972 8.947 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -1.349 19.868 6.898 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -2.357 18.493 6.496 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -4.277 19.509 7.645 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -3.283 20.847 8.185 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -4.089 20.328 5.315 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -4.891 21.436 6.411 1.00 0.00 H new ATOM 0 HE ARG A 116 -2.138 22.185 6.293 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -4.979 22.316 3.994 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -4.249 23.675 3.134 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -1.392 23.851 5.122 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -2.293 24.508 3.753 1.00 0.00 H new ATOM 1479 N LYS A 117 0.658 17.914 8.404 1.00 0.00 N ATOM 1480 CA LYS A 117 1.856 17.030 8.497 1.00 0.00 C ATOM 1481 C LYS A 117 2.003 16.269 9.863 1.00 0.00 C ATOM 1482 O LYS A 117 2.486 15.133 9.828 1.00 0.00 O ATOM 1483 CB LYS A 117 3.138 17.885 8.198 1.00 0.00 C ATOM 1484 CG LYS A 117 3.571 18.065 6.720 1.00 0.00 C ATOM 1485 CD LYS A 117 4.395 16.907 6.096 1.00 0.00 C ATOM 1486 CE LYS A 117 4.797 17.073 4.617 1.00 0.00 C ATOM 1487 NZ LYS A 117 5.945 17.980 4.406 1.00 0.00 N ATOM 0 H LYS A 117 0.900 18.904 8.354 1.00 0.00 H new ATOM 0 HA LYS A 117 1.727 16.243 7.754 1.00 0.00 H new ATOM 0 HB2 LYS A 117 2.983 18.877 8.623 1.00 0.00 H new ATOM 0 HB3 LYS A 117 3.972 17.434 8.737 1.00 0.00 H new ATOM 0 HG2 LYS A 117 2.675 18.210 6.117 1.00 0.00 H new ATOM 0 HG3 LYS A 117 4.158 18.981 6.645 1.00 0.00 H new ATOM 0 HD2 LYS A 117 5.303 16.778 6.685 1.00 0.00 H new ATOM 0 HD3 LYS A 117 3.819 15.987 6.193 1.00 0.00 H new ATOM 0 HE2 LYS A 117 5.040 16.094 4.205 1.00 0.00 H new ATOM 0 HE3 LYS A 117 3.941 17.451 4.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 6.157 18.042 3.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 5.711 18.926 4.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 6.776 17.611 4.911 1.00 0.00 H new ATOM 1501 N THR A 118 1.578 16.860 11.014 1.00 0.00 N ATOM 1502 CA THR A 118 1.468 16.166 12.340 1.00 0.00 C ATOM 1503 C THR A 118 0.520 14.906 12.342 1.00 0.00 C ATOM 1504 O THR A 118 0.918 13.884 12.910 1.00 0.00 O ATOM 1505 CB THR A 118 1.130 17.270 13.402 1.00 0.00 C ATOM 1506 OG1 THR A 118 2.044 18.358 13.300 1.00 0.00 O ATOM 1507 CG2 THR A 118 1.166 16.879 14.885 1.00 0.00 C ATOM 0 H THR A 118 1.298 17.840 11.054 1.00 0.00 H new ATOM 0 HA THR A 118 2.417 15.697 12.602 1.00 0.00 H new ATOM 0 HB THR A 118 0.096 17.499 13.146 1.00 0.00 H new ATOM 0 HG1 THR A 118 1.774 18.944 12.562 1.00 0.00 H new ATOM 0 HG21 THR A 118 0.911 17.745 15.496 1.00 0.00 H new ATOM 0 HG22 THR A 118 0.447 16.081 15.068 1.00 0.00 H new ATOM 0 HG23 THR A 118 2.166 16.533 15.146 1.00 0.00 H new ATOM 1515 N GLN A 119 -0.657 14.985 11.686 1.00 0.00 N ATOM 1516 CA GLN A 119 -1.564 13.826 11.413 1.00 0.00 C ATOM 1517 C GLN A 119 -1.017 12.837 10.333 1.00 0.00 C ATOM 1518 O GLN A 119 -1.086 11.642 10.621 1.00 0.00 O ATOM 1519 CB GLN A 119 -2.993 14.324 11.033 1.00 0.00 C ATOM 1520 CG GLN A 119 -3.827 15.051 12.115 1.00 0.00 C ATOM 1521 CD GLN A 119 -4.678 14.137 13.005 1.00 0.00 C ATOM 1522 OE1 GLN A 119 -5.819 13.821 12.673 1.00 0.00 O ATOM 1523 NE2 GLN A 119 -4.158 13.703 14.145 1.00 0.00 N ATOM 0 H GLN A 119 -1.019 15.866 11.321 1.00 0.00 H new ATOM 0 HA GLN A 119 -1.613 13.257 12.341 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -2.895 14.996 10.181 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -3.567 13.461 10.694 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -3.150 15.622 12.750 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -4.485 15.768 11.624 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -3.210 13.973 14.409 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -4.706 13.100 14.758 1.00 0.00 H new ATOM 1532 N HIS A 120 -0.467 13.275 9.162 1.00 0.00 N ATOM 1533 CA HIS A 120 0.204 12.367 8.177 1.00 0.00 C ATOM 1534 C HIS A 120 1.462 11.594 8.704 1.00 0.00 C ATOM 1535 O HIS A 120 1.633 10.455 8.261 1.00 0.00 O ATOM 1536 CB HIS A 120 0.502 13.160 6.875 1.00 0.00 C ATOM 1537 CG HIS A 120 0.936 12.301 5.686 1.00 0.00 C ATOM 1538 ND1 HIS A 120 2.259 11.920 5.507 1.00 0.00 N ATOM 1539 CD2 HIS A 120 0.080 11.588 4.827 1.00 0.00 C ATOM 1540 CE1 HIS A 120 2.073 10.976 4.531 1.00 0.00 C ATOM 1541 NE2 HIS A 120 0.819 10.714 4.055 1.00 0.00 N ATOM 0 H HIS A 120 -0.475 14.254 8.875 1.00 0.00 H new ATOM 0 HA HIS A 120 -0.502 11.561 7.976 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -0.391 13.719 6.595 1.00 0.00 H new ATOM 0 HB3 HIS A 120 1.284 13.891 7.082 1.00 0.00 H new ATOM 0 HD1 HIS A 120 3.111 12.244 5.964 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -0.992 11.706 4.779 1.00 0.00 H new ATOM 0 HE1 HIS A 120 2.921 10.437 4.136 1.00 0.00 H new ATOM 1549 N SER A 121 2.293 12.177 9.601 1.00 0.00 N ATOM 1550 CA SER A 121 3.376 11.433 10.308 1.00 0.00 C ATOM 1551 C SER A 121 2.907 10.377 11.359 1.00 0.00 C ATOM 1552 O SER A 121 3.502 9.299 11.352 1.00 0.00 O ATOM 1553 CB SER A 121 4.368 12.441 10.915 1.00 0.00 C ATOM 1554 OG SER A 121 4.962 13.236 9.896 1.00 0.00 O ATOM 0 H SER A 121 2.238 13.163 9.856 1.00 0.00 H new ATOM 0 HA SER A 121 3.864 10.822 9.549 1.00 0.00 H new ATOM 0 HB2 SER A 121 3.852 13.082 11.629 1.00 0.00 H new ATOM 0 HB3 SER A 121 5.143 11.909 11.467 1.00 0.00 H new ATOM 0 HG SER A 121 4.369 13.986 9.679 1.00 0.00 H new ATOM 1560 N THR A 122 1.859 10.638 12.187 1.00 0.00 N ATOM 1561 CA THR A 122 1.198 9.621 13.069 1.00 0.00 C ATOM 1562 C THR A 122 0.380 8.535 12.259 1.00 0.00 C ATOM 1563 O THR A 122 0.511 7.353 12.588 1.00 0.00 O ATOM 1564 CB THR A 122 0.387 10.433 14.137 1.00 0.00 C ATOM 1565 OG1 THR A 122 1.224 11.397 14.772 1.00 0.00 O ATOM 1566 CG2 THR A 122 -0.222 9.627 15.298 1.00 0.00 C ATOM 0 H THR A 122 1.442 11.565 12.266 1.00 0.00 H new ATOM 0 HA THR A 122 1.927 8.995 13.583 1.00 0.00 H new ATOM 0 HB THR A 122 -0.425 10.852 13.543 1.00 0.00 H new ATOM 0 HG1 THR A 122 1.193 12.238 14.271 1.00 0.00 H new ATOM 0 HG21 THR A 122 -0.757 10.301 15.967 1.00 0.00 H new ATOM 0 HG22 THR A 122 -0.914 8.884 14.902 1.00 0.00 H new ATOM 0 HG23 THR A 122 0.573 9.124 15.849 1.00 0.00 H new ATOM 1574 N LEU A 123 -0.409 8.930 11.224 1.00 0.00 N ATOM 1575 CA LEU A 123 -1.070 8.019 10.225 1.00 0.00 C ATOM 1576 C LEU A 123 -0.040 7.113 9.452 1.00 0.00 C ATOM 1577 O LEU A 123 -0.260 5.896 9.428 1.00 0.00 O ATOM 1578 CB LEU A 123 -1.975 8.822 9.220 1.00 0.00 C ATOM 1579 CG LEU A 123 -3.221 9.648 9.725 1.00 0.00 C ATOM 1580 CD1 LEU A 123 -3.550 10.851 8.804 1.00 0.00 C ATOM 1581 CD2 LEU A 123 -4.500 8.813 9.973 1.00 0.00 C ATOM 0 H LEU A 123 -0.614 9.914 11.049 1.00 0.00 H new ATOM 0 HA LEU A 123 -1.710 7.351 10.801 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -1.324 9.519 8.692 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -2.343 8.108 8.483 1.00 0.00 H new ATOM 0 HG LEU A 123 -2.899 10.019 10.698 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -4.415 11.385 9.197 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -2.694 11.525 8.766 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -3.772 10.490 7.800 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -5.301 9.467 10.317 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -4.802 8.327 9.046 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -4.299 8.056 10.731 1.00 0.00 H new ATOM 1593 N SER A 124 1.085 7.679 8.917 1.00 0.00 N ATOM 1594 CA SER A 124 2.228 6.901 8.369 1.00 0.00 C ATOM 1595 C SER A 124 2.992 6.017 9.406 1.00 0.00 C ATOM 1596 O SER A 124 3.284 4.878 9.044 1.00 0.00 O ATOM 1597 CB SER A 124 3.170 7.862 7.622 1.00 0.00 C ATOM 1598 OG SER A 124 4.201 7.135 6.967 1.00 0.00 O ATOM 0 H SER A 124 1.219 8.688 8.856 1.00 0.00 H new ATOM 0 HA SER A 124 1.809 6.168 7.680 1.00 0.00 H new ATOM 0 HB2 SER A 124 2.605 8.442 6.892 1.00 0.00 H new ATOM 0 HB3 SER A 124 3.607 8.572 8.324 1.00 0.00 H new ATOM 0 HG SER A 124 4.792 7.758 6.495 1.00 0.00 H new ATOM 1604 N ARG A 125 3.239 6.474 10.667 1.00 0.00 N ATOM 1605 CA ARG A 125 3.832 5.648 11.771 1.00 0.00 C ATOM 1606 C ARG A 125 3.062 4.323 12.105 1.00 0.00 C ATOM 1607 O ARG A 125 3.738 3.299 12.253 1.00 0.00 O ATOM 1608 CB ARG A 125 4.045 6.566 13.013 1.00 0.00 C ATOM 1609 CG ARG A 125 5.166 6.124 13.982 1.00 0.00 C ATOM 1610 CD ARG A 125 5.310 6.915 15.279 1.00 0.00 C ATOM 1611 NE ARG A 125 5.989 8.234 15.132 1.00 0.00 N ATOM 1612 CZ ARG A 125 5.920 9.284 15.990 1.00 0.00 C ATOM 1613 NH1 ARG A 125 5.222 9.322 17.135 1.00 0.00 N ATOM 1614 NH2 ARG A 125 6.603 10.366 15.668 1.00 0.00 N ATOM 0 H ARG A 125 3.032 7.431 10.952 1.00 0.00 H new ATOM 0 HA ARG A 125 4.792 5.271 11.420 1.00 0.00 H new ATOM 0 HB2 ARG A 125 4.267 7.574 12.664 1.00 0.00 H new ATOM 0 HB3 ARG A 125 3.109 6.620 13.568 1.00 0.00 H new ATOM 0 HG2 ARG A 125 4.999 5.078 14.239 1.00 0.00 H new ATOM 0 HG3 ARG A 125 6.115 6.173 13.448 1.00 0.00 H new ATOM 0 HD2 ARG A 125 4.318 7.077 15.702 1.00 0.00 H new ATOM 0 HD3 ARG A 125 5.868 6.313 15.996 1.00 0.00 H new ATOM 0 HE ARG A 125 6.565 8.361 14.300 1.00 0.00 H new ATOM 0 HH11 ARG A 125 4.678 8.510 17.428 1.00 0.00 H new ATOM 0 HH12 ARG A 125 5.235 10.163 17.713 1.00 0.00 H new ATOM 0 HH21 ARG A 125 7.150 10.386 14.807 1.00 0.00 H new ATOM 0 HH22 ARG A 125 6.584 11.182 16.280 1.00 0.00 H new ATOM 1628 N LYS A 126 1.707 4.345 12.192 1.00 0.00 N ATOM 1629 CA LYS A 126 0.875 3.101 12.264 1.00 0.00 C ATOM 1630 C LYS A 126 0.798 2.321 10.900 1.00 0.00 C ATOM 1631 O LYS A 126 0.644 1.097 10.954 1.00 0.00 O ATOM 1632 CB LYS A 126 -0.524 3.470 12.839 1.00 0.00 C ATOM 1633 CG LYS A 126 -1.370 2.311 13.438 1.00 0.00 C ATOM 1634 CD LYS A 126 -2.788 2.667 13.964 1.00 0.00 C ATOM 1635 CE LYS A 126 -2.916 3.292 15.376 1.00 0.00 C ATOM 1636 NZ LYS A 126 -2.741 2.322 16.477 1.00 0.00 N ATOM 0 H LYS A 126 1.162 5.207 12.214 1.00 0.00 H new ATOM 0 HA LYS A 126 1.360 2.395 12.938 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -0.383 4.223 13.615 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -1.105 3.937 12.043 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -1.476 1.540 12.674 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -0.806 1.870 14.260 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -3.242 3.358 13.253 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -3.386 1.756 13.949 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -2.174 4.084 15.481 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -3.896 3.759 15.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -2.840 2.811 17.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -3.464 1.578 16.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -1.796 1.893 16.415 1.00 0.00 H new ATOM 1650 N PHE A 127 0.935 3.005 9.735 1.00 0.00 N ATOM 1651 CA PHE A 127 1.097 2.369 8.394 1.00 0.00 C ATOM 1652 C PHE A 127 2.403 1.553 8.159 1.00 0.00 C ATOM 1653 O PHE A 127 2.304 0.498 7.529 1.00 0.00 O ATOM 1654 CB PHE A 127 0.908 3.453 7.276 1.00 0.00 C ATOM 1655 CG PHE A 127 -0.028 3.023 6.130 1.00 0.00 C ATOM 1656 CD1 PHE A 127 -1.407 3.188 6.244 1.00 0.00 C ATOM 1657 CD2 PHE A 127 0.488 2.395 5.002 1.00 0.00 C ATOM 1658 CE1 PHE A 127 -2.249 2.680 5.279 1.00 0.00 C ATOM 1659 CE2 PHE A 127 -0.363 1.905 4.034 1.00 0.00 C ATOM 1660 CZ PHE A 127 -1.726 2.024 4.187 1.00 0.00 C ATOM 0 H PHE A 127 0.937 4.024 9.696 1.00 0.00 H new ATOM 0 HA PHE A 127 0.317 1.609 8.350 1.00 0.00 H new ATOM 0 HB2 PHE A 127 0.514 4.362 7.730 1.00 0.00 H new ATOM 0 HB3 PHE A 127 1.884 3.702 6.859 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -1.817 3.716 7.092 1.00 0.00 H new ATOM 0 HD2 PHE A 127 1.556 2.291 4.884 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -3.318 2.796 5.379 1.00 0.00 H new ATOM 0 HE2 PHE A 127 0.041 1.427 3.154 1.00 0.00 H new ATOM 0 HZ PHE A 127 -2.389 1.601 3.447 1.00 0.00 H new ATOM 1670 N VAL A 128 3.582 2.020 8.647 1.00 0.00 N ATOM 1671 CA VAL A 128 4.891 1.278 8.582 1.00 0.00 C ATOM 1672 C VAL A 128 4.925 0.165 9.687 1.00 0.00 C ATOM 1673 O VAL A 128 5.313 -0.956 9.345 1.00 0.00 O ATOM 1674 CB VAL A 128 6.158 2.225 8.659 1.00 0.00 C ATOM 1675 CG1 VAL A 128 7.494 1.492 8.354 1.00 0.00 C ATOM 1676 CG2 VAL A 128 6.093 3.477 7.755 1.00 0.00 C ATOM 0 H VAL A 128 3.662 2.929 9.103 1.00 0.00 H new ATOM 0 HA VAL A 128 4.949 0.808 7.600 1.00 0.00 H new ATOM 0 HB VAL A 128 6.136 2.550 9.699 1.00 0.00 H new ATOM 0 HG11 VAL A 128 8.321 2.199 8.424 1.00 0.00 H new ATOM 0 HG12 VAL A 128 7.641 0.689 9.076 1.00 0.00 H new ATOM 0 HG13 VAL A 128 7.458 1.074 7.348 1.00 0.00 H new ATOM 0 HG21 VAL A 128 7.005 4.062 7.877 1.00 0.00 H new ATOM 0 HG22 VAL A 128 5.996 3.169 6.714 1.00 0.00 H new ATOM 0 HG23 VAL A 128 5.232 4.084 8.036 1.00 0.00 H new ATOM 1686 N GLU A 129 4.502 0.457 10.944 1.00 0.00 N ATOM 1687 CA GLU A 129 4.273 -0.589 12.004 1.00 0.00 C ATOM 1688 C GLU A 129 3.230 -1.723 11.650 1.00 0.00 C ATOM 1689 O GLU A 129 3.172 -2.711 12.392 1.00 0.00 O ATOM 1690 CB GLU A 129 3.887 0.081 13.366 1.00 0.00 C ATOM 1691 CG GLU A 129 4.972 0.858 14.154 1.00 0.00 C ATOM 1692 CD GLU A 129 5.992 -0.019 14.880 1.00 0.00 C ATOM 1693 OE1 GLU A 129 5.784 -0.535 15.977 1.00 0.00 O ATOM 1694 OE2 GLU A 129 7.152 -0.155 14.163 1.00 0.00 O ATOM 0 H GLU A 129 4.309 1.408 11.260 1.00 0.00 H new ATOM 0 HA GLU A 129 5.231 -1.103 12.077 1.00 0.00 H new ATOM 0 HB2 GLU A 129 3.064 0.769 13.173 1.00 0.00 H new ATOM 0 HB3 GLU A 129 3.502 -0.701 14.020 1.00 0.00 H new ATOM 0 HG2 GLU A 129 5.504 1.512 13.463 1.00 0.00 H new ATOM 0 HG3 GLU A 129 4.480 1.499 14.885 1.00 0.00 H new ATOM 1701 N VAL A 130 2.468 -1.591 10.534 1.00 0.00 N ATOM 1702 CA VAL A 130 1.560 -2.657 9.997 1.00 0.00 C ATOM 1703 C VAL A 130 2.162 -3.172 8.630 1.00 0.00 C ATOM 1704 O VAL A 130 2.514 -4.353 8.603 1.00 0.00 O ATOM 1705 CB VAL A 130 0.051 -2.117 9.997 1.00 0.00 C ATOM 1706 CG1 VAL A 130 -0.904 -2.749 8.947 1.00 0.00 C ATOM 1707 CG2 VAL A 130 -0.647 -2.211 11.387 1.00 0.00 C ATOM 0 H VAL A 130 2.461 -0.739 9.973 1.00 0.00 H new ATOM 0 HA VAL A 130 1.505 -3.548 10.623 1.00 0.00 H new ATOM 0 HB VAL A 130 0.208 -1.075 9.717 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -1.895 -2.305 9.043 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -0.518 -2.562 7.945 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -0.970 -3.824 9.115 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -1.664 -1.828 11.310 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -0.675 -3.251 11.711 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -0.091 -1.620 12.114 1.00 0.00 H new ATOM 1717 N MET A 131 2.223 -2.376 7.524 1.00 0.00 N ATOM 1718 CA MET A 131 2.568 -2.867 6.146 1.00 0.00 C ATOM 1719 C MET A 131 4.018 -3.440 6.037 1.00 0.00 C ATOM 1720 O MET A 131 4.119 -4.546 5.499 1.00 0.00 O ATOM 1721 CB MET A 131 2.288 -1.807 5.027 1.00 0.00 C ATOM 1722 CG MET A 131 0.857 -1.221 4.808 1.00 0.00 C ATOM 1723 SD MET A 131 -0.532 -2.285 5.325 1.00 0.00 S ATOM 1724 CE MET A 131 -0.593 -3.655 4.148 1.00 0.00 C ATOM 0 H MET A 131 2.035 -1.374 7.557 1.00 0.00 H new ATOM 0 HA MET A 131 1.888 -3.701 5.972 1.00 0.00 H new ATOM 0 HB2 MET A 131 2.952 -0.963 5.214 1.00 0.00 H new ATOM 0 HB3 MET A 131 2.598 -2.253 4.082 1.00 0.00 H new ATOM 0 HG2 MET A 131 0.786 -0.277 5.348 1.00 0.00 H new ATOM 0 HG3 MET A 131 0.738 -0.992 3.749 1.00 0.00 H new ATOM 0 HE1 MET A 131 -1.174 -4.474 4.572 1.00 0.00 H new ATOM 0 HE2 MET A 131 -1.061 -3.319 3.223 1.00 0.00 H new ATOM 0 HE3 MET A 131 0.420 -4.000 3.938 1.00 0.00 H new ATOM 1734 N SER A 132 5.079 -2.769 6.571 1.00 0.00 N ATOM 1735 CA SER A 132 6.437 -3.387 6.716 1.00 0.00 C ATOM 1736 C SER A 132 6.526 -4.605 7.700 1.00 0.00 C ATOM 1737 O SER A 132 7.461 -5.397 7.548 1.00 0.00 O ATOM 1738 CB SER A 132 7.454 -2.317 7.129 1.00 0.00 C ATOM 1739 OG SER A 132 7.508 -1.275 6.162 1.00 0.00 O ATOM 0 H SER A 132 5.024 -1.807 6.907 1.00 0.00 H new ATOM 0 HA SER A 132 6.665 -3.797 5.732 1.00 0.00 H new ATOM 0 HB2 SER A 132 7.181 -1.905 8.100 1.00 0.00 H new ATOM 0 HB3 SER A 132 8.440 -2.769 7.240 1.00 0.00 H new ATOM 0 HG SER A 132 8.267 -0.686 6.357 1.00 0.00 H new ATOM 1745 N GLU A 133 5.571 -4.753 8.661 1.00 0.00 N ATOM 1746 CA GLU A 133 5.400 -5.980 9.502 1.00 0.00 C ATOM 1747 C GLU A 133 4.734 -7.146 8.686 1.00 0.00 C ATOM 1748 O GLU A 133 5.249 -8.266 8.760 1.00 0.00 O ATOM 1749 CB GLU A 133 4.639 -5.583 10.810 1.00 0.00 C ATOM 1750 CG GLU A 133 4.692 -6.552 12.011 1.00 0.00 C ATOM 1751 CD GLU A 133 6.001 -6.522 12.800 1.00 0.00 C ATOM 1752 OE1 GLU A 133 6.075 -5.432 13.626 1.00 0.00 O ATOM 1753 OE2 GLU A 133 6.876 -7.381 12.696 1.00 0.00 O ATOM 0 H GLU A 133 4.893 -4.022 8.877 1.00 0.00 H new ATOM 0 HA GLU A 133 6.368 -6.383 9.800 1.00 0.00 H new ATOM 0 HB2 GLU A 133 5.028 -4.621 11.142 1.00 0.00 H new ATOM 0 HB3 GLU A 133 3.591 -5.431 10.552 1.00 0.00 H new ATOM 0 HG2 GLU A 133 3.871 -6.316 12.687 1.00 0.00 H new ATOM 0 HG3 GLU A 133 4.525 -7.567 11.649 1.00 0.00 H new ATOM 1760 N TYR A 134 3.654 -6.870 7.907 1.00 0.00 N ATOM 1761 CA TYR A 134 3.066 -7.800 6.902 1.00 0.00 C ATOM 1762 C TYR A 134 4.050 -8.229 5.755 1.00 0.00 C ATOM 1763 O TYR A 134 3.978 -9.389 5.337 1.00 0.00 O ATOM 1764 CB TYR A 134 1.745 -7.174 6.369 1.00 0.00 C ATOM 1765 CG TYR A 134 0.861 -7.988 5.369 1.00 0.00 C ATOM 1766 CD1 TYR A 134 0.472 -9.306 5.615 1.00 0.00 C ATOM 1767 CD2 TYR A 134 0.330 -7.345 4.258 1.00 0.00 C ATOM 1768 CE1 TYR A 134 -0.458 -9.930 4.817 1.00 0.00 C ATOM 1769 CE2 TYR A 134 -0.571 -7.991 3.440 1.00 0.00 C ATOM 1770 CZ TYR A 134 -0.974 -9.279 3.719 1.00 0.00 C ATOM 1771 OH TYR A 134 -1.928 -9.885 2.944 1.00 0.00 O ATOM 0 H TYR A 134 3.158 -5.980 7.960 1.00 0.00 H new ATOM 0 HA TYR A 134 2.850 -8.745 7.401 1.00 0.00 H new ATOM 0 HB2 TYR A 134 1.125 -6.933 7.233 1.00 0.00 H new ATOM 0 HB3 TYR A 134 2.001 -6.231 5.887 1.00 0.00 H new ATOM 0 HD1 TYR A 134 0.908 -9.843 6.444 1.00 0.00 H new ATOM 0 HD2 TYR A 134 0.626 -6.331 4.034 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -0.784 -10.932 5.052 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -0.965 -7.483 2.572 1.00 0.00 H new ATOM 0 HH TYR A 134 -2.183 -9.286 2.211 1.00 0.00 H new ATOM 1781 N ASN A 135 4.953 -7.322 5.290 1.00 0.00 N ATOM 1782 CA ASN A 135 6.108 -7.644 4.387 1.00 0.00 C ATOM 1783 C ASN A 135 6.973 -8.865 4.857 1.00 0.00 C ATOM 1784 O ASN A 135 7.340 -9.671 3.995 1.00 0.00 O ATOM 1785 CB ASN A 135 6.963 -6.355 4.188 1.00 0.00 C ATOM 1786 CG ASN A 135 6.425 -5.323 3.175 1.00 0.00 C ATOM 1787 OD1 ASN A 135 5.797 -4.332 3.542 1.00 0.00 O ATOM 1788 ND2 ASN A 135 6.688 -5.500 1.886 1.00 0.00 N ATOM 0 H ASN A 135 4.904 -6.332 5.532 1.00 0.00 H new ATOM 0 HA ASN A 135 5.699 -7.969 3.430 1.00 0.00 H new ATOM 0 HB2 ASN A 135 7.068 -5.862 5.155 1.00 0.00 H new ATOM 0 HB3 ASN A 135 7.963 -6.654 3.873 1.00 0.00 H new ATOM 0 HD21 ASN A 135 6.369 -4.814 1.202 1.00 0.00 H new ATOM 0 HD22 ASN A 135 7.209 -6.322 1.580 1.00 0.00 H new ATOM 1795 N ALA A 136 7.244 -8.995 6.184 1.00 0.00 N ATOM 1796 CA ALA A 136 7.832 -10.226 6.771 1.00 0.00 C ATOM 1797 C ALA A 136 6.844 -11.417 6.956 1.00 0.00 C ATOM 1798 O ALA A 136 7.342 -12.543 6.970 1.00 0.00 O ATOM 1799 CB ALA A 136 8.448 -9.876 8.121 1.00 0.00 C ATOM 0 H ALA A 136 7.063 -8.259 6.867 1.00 0.00 H new ATOM 0 HA ALA A 136 8.572 -10.574 6.051 1.00 0.00 H new ATOM 0 HB1 ALA A 136 8.884 -10.771 8.565 1.00 0.00 H new ATOM 0 HB2 ALA A 136 9.225 -9.124 7.982 1.00 0.00 H new ATOM 0 HB3 ALA A 136 7.676 -9.483 8.782 1.00 0.00 H new ATOM 1805 N THR A 137 5.503 -11.206 7.072 1.00 0.00 N ATOM 1806 CA THR A 137 4.475 -12.295 7.153 1.00 0.00 C ATOM 1807 C THR A 137 4.361 -13.154 5.836 1.00 0.00 C ATOM 1808 O THR A 137 4.378 -14.382 5.967 1.00 0.00 O ATOM 1809 CB THR A 137 3.140 -11.634 7.649 1.00 0.00 C ATOM 1810 OG1 THR A 137 3.369 -10.909 8.854 1.00 0.00 O ATOM 1811 CG2 THR A 137 1.947 -12.563 7.953 1.00 0.00 C ATOM 0 H THR A 137 5.098 -10.271 7.113 1.00 0.00 H new ATOM 0 HA THR A 137 4.774 -13.054 7.876 1.00 0.00 H new ATOM 0 HB THR A 137 2.859 -11.026 6.789 1.00 0.00 H new ATOM 0 HG1 THR A 137 2.531 -10.499 9.154 1.00 0.00 H new ATOM 0 HG21 THR A 137 1.097 -11.967 8.285 1.00 0.00 H new ATOM 0 HG22 THR A 137 1.675 -13.113 7.052 1.00 0.00 H new ATOM 0 HG23 THR A 137 2.225 -13.267 8.737 1.00 0.00 H new ATOM 1819 N GLN A 138 4.249 -12.537 4.632 1.00 0.00 N ATOM 1820 CA GLN A 138 4.161 -13.260 3.326 1.00 0.00 C ATOM 1821 C GLN A 138 5.495 -13.960 2.889 1.00 0.00 C ATOM 1822 O GLN A 138 5.398 -15.127 2.492 1.00 0.00 O ATOM 1823 CB GLN A 138 3.569 -12.261 2.280 1.00 0.00 C ATOM 1824 CG GLN A 138 3.029 -12.872 0.968 1.00 0.00 C ATOM 1825 CD GLN A 138 2.426 -11.819 0.029 1.00 0.00 C ATOM 1826 OE1 GLN A 138 1.275 -11.418 0.192 1.00 0.00 O ATOM 1827 NE2 GLN A 138 3.172 -11.351 -0.961 1.00 0.00 N ATOM 0 H GLN A 138 4.217 -11.522 4.534 1.00 0.00 H new ATOM 0 HA GLN A 138 3.491 -14.114 3.420 1.00 0.00 H new ATOM 0 HB2 GLN A 138 2.759 -11.709 2.757 1.00 0.00 H new ATOM 0 HB3 GLN A 138 4.342 -11.536 2.025 1.00 0.00 H new ATOM 0 HG2 GLN A 138 3.838 -13.391 0.454 1.00 0.00 H new ATOM 0 HG3 GLN A 138 2.271 -13.619 1.205 1.00 0.00 H new ATOM 0 HE21 GLN A 138 4.125 -11.691 -1.086 1.00 0.00 H new ATOM 0 HE22 GLN A 138 2.793 -10.650 -1.598 1.00 0.00 H new ATOM 1836 N SER A 139 6.679 -13.298 2.959 1.00 0.00 N ATOM 1837 CA SER A 139 7.993 -13.959 2.697 1.00 0.00 C ATOM 1838 C SER A 139 8.504 -14.953 3.770 1.00 0.00 C ATOM 1839 O SER A 139 9.233 -15.861 3.363 1.00 0.00 O ATOM 1840 CB SER A 139 9.056 -12.892 2.401 1.00 0.00 C ATOM 1841 OG SER A 139 8.688 -12.118 1.266 1.00 0.00 O ATOM 0 H SER A 139 6.755 -12.308 3.194 1.00 0.00 H new ATOM 0 HA SER A 139 7.810 -14.595 1.831 1.00 0.00 H new ATOM 0 HB2 SER A 139 9.177 -12.242 3.267 1.00 0.00 H new ATOM 0 HB3 SER A 139 10.019 -13.370 2.225 1.00 0.00 H new ATOM 0 HG SER A 139 9.376 -11.442 1.094 1.00 0.00 H new ATOM 1847 N ASP A 140 8.179 -14.804 5.079 1.00 0.00 N ATOM 1848 CA ASP A 140 8.434 -15.873 6.097 1.00 0.00 C ATOM 1849 C ASP A 140 7.396 -17.051 6.029 1.00 0.00 C ATOM 1850 O ASP A 140 7.726 -18.112 6.565 1.00 0.00 O ATOM 1851 CB ASP A 140 8.497 -15.268 7.521 1.00 0.00 C ATOM 1852 CG ASP A 140 9.204 -16.132 8.569 1.00 0.00 C ATOM 1853 OD1 ASP A 140 10.557 -16.180 8.364 1.00 0.00 O ATOM 1854 OD2 ASP A 140 8.615 -16.709 9.482 1.00 0.00 O ATOM 0 H ASP A 140 7.743 -13.964 5.459 1.00 0.00 H new ATOM 0 HA ASP A 140 9.404 -16.308 5.855 1.00 0.00 H new ATOM 0 HB2 ASP A 140 9.004 -14.305 7.466 1.00 0.00 H new ATOM 0 HB3 ASP A 140 7.480 -15.074 7.861 1.00 0.00 H new ATOM 1859 N TYR A 141 6.205 -16.890 5.380 1.00 0.00 N ATOM 1860 CA TYR A 141 5.261 -18.003 5.070 1.00 0.00 C ATOM 1861 C TYR A 141 5.826 -18.976 3.990 1.00 0.00 C ATOM 1862 O TYR A 141 6.039 -20.144 4.317 1.00 0.00 O ATOM 1863 CB TYR A 141 3.861 -17.418 4.693 1.00 0.00 C ATOM 1864 CG TYR A 141 2.673 -18.414 4.500 1.00 0.00 C ATOM 1865 CD1 TYR A 141 2.186 -19.201 5.542 1.00 0.00 C ATOM 1866 CD2 TYR A 141 2.094 -18.556 3.240 1.00 0.00 C ATOM 1867 CE1 TYR A 141 1.175 -20.115 5.321 1.00 0.00 C ATOM 1868 CE2 TYR A 141 1.071 -19.460 3.031 1.00 0.00 C ATOM 1869 CZ TYR A 141 0.614 -20.242 4.069 1.00 0.00 C ATOM 1870 OH TYR A 141 -0.392 -21.146 3.856 1.00 0.00 O ATOM 0 H TYR A 141 5.874 -15.981 5.057 1.00 0.00 H new ATOM 0 HA TYR A 141 5.138 -18.614 5.964 1.00 0.00 H new ATOM 0 HB2 TYR A 141 3.577 -16.707 5.469 1.00 0.00 H new ATOM 0 HB3 TYR A 141 3.975 -16.852 3.768 1.00 0.00 H new ATOM 0 HD1 TYR A 141 2.604 -19.095 6.532 1.00 0.00 H new ATOM 0 HD2 TYR A 141 2.449 -17.952 2.418 1.00 0.00 H new ATOM 0 HE1 TYR A 141 0.822 -20.733 6.133 1.00 0.00 H new ATOM 0 HE2 TYR A 141 0.628 -19.554 2.051 1.00 0.00 H new ATOM 0 HH TYR A 141 -0.674 -21.106 2.918 1.00 0.00 H new