USER MOD reduce.3.24.130724 H: found=0, std=0, add=782, rem=0, adj=23 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= -0.255 X(o=-0.36,f=-0.76) USER MOD Set 1.2: A 79 MET CE :methyl -157:sc= -0.1 (180deg=-0.755) USER MOD Single : A 30 MET CE :methyl 153:sc= -0.157 (180deg=-0.483) USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc= -0.0807 K(o=-0.081,f=-5.3!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 155:sc= 0.0231 (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 101:sc= 0.457 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 80:sc= 0.313 USER MOD Single : A 87 ASN : amide:sc= -0.179 K(o=-0.18,f=-1.7) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot -20:sc= 0.216 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ -168:sc= 0.129 (180deg=0.0853) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -0.762 K(o=-0.76,f=0) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ -149:sc= -0.143 (180deg=-1.43!) USER MOD Single : A 118 THR OG1 : rot 82:sc= 1.25 USER MOD Single : A 119 GLN : amide:sc= -0.41 K(o=-0.41,f=-2.6!) USER MOD Single : A 120 HIS : no HE2:sc= -0.0082 K(o=-0.0082,f=-0.52) USER MOD Single : A 121 SER OG : rot 91:sc= 0.146 USER MOD Single : A 122 THR OG1 : rot 91:sc= 0.126 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 155:sc= 0 (180deg=-0.209) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 134 TYR OH : rot 150:sc= 0 USER MOD Single : A 135 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 GLN : amide:sc= 0 X(o=0,f=-0.075) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 141 TYR OH : rot -140:sc= -0.332 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 27 -11.524 27.425 5.900 1.00 0.00 N ATOM 2 CA ASP A 27 -12.753 26.767 6.407 1.00 0.00 C ATOM 3 C ASP A 27 -13.108 25.490 5.569 1.00 0.00 C ATOM 4 O ASP A 27 -13.143 24.420 6.185 1.00 0.00 O ATOM 5 CB ASP A 27 -13.870 27.844 6.525 1.00 0.00 C ATOM 6 CG ASP A 27 -15.093 27.395 7.325 1.00 0.00 C ATOM 7 OD1 ASP A 27 -15.138 27.401 8.554 1.00 0.00 O ATOM 8 OD2 ASP A 27 -16.117 26.990 6.510 1.00 0.00 O ATOM 0 HA ASP A 27 -12.608 26.364 7.410 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -13.452 28.735 6.992 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -14.190 28.130 5.523 1.00 0.00 H new ATOM 15 N ARG A 28 -13.343 25.569 4.228 1.00 0.00 N ATOM 16 CA ARG A 28 -13.728 24.396 3.372 1.00 0.00 C ATOM 17 C ARG A 28 -12.655 23.264 3.239 1.00 0.00 C ATOM 18 O ARG A 28 -13.036 22.090 3.330 1.00 0.00 O ATOM 19 CB ARG A 28 -14.262 24.892 2.006 1.00 0.00 C ATOM 20 CG ARG A 28 -13.357 25.619 0.967 1.00 0.00 C ATOM 21 CD ARG A 28 -14.138 26.027 -0.283 1.00 0.00 C ATOM 22 NE ARG A 28 -13.247 26.709 -1.255 1.00 0.00 N ATOM 23 CZ ARG A 28 -13.610 27.265 -2.439 1.00 0.00 C ATOM 24 NH1 ARG A 28 -14.850 27.298 -2.948 1.00 0.00 N ATOM 25 NH2 ARG A 28 -12.654 27.825 -3.155 1.00 0.00 N ATOM 0 H ARG A 28 -13.272 26.443 3.706 1.00 0.00 H new ATOM 0 HA ARG A 28 -14.531 23.888 3.906 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -14.680 24.022 1.500 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -15.092 25.565 2.221 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -12.917 26.505 1.425 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -12.533 24.965 0.683 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -14.582 25.145 -0.745 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -14.958 26.689 -0.006 1.00 0.00 H new ATOM 0 HE ARG A 28 -12.259 26.766 -1.007 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -15.624 26.879 -2.433 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -15.019 27.742 -3.850 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -11.694 27.826 -2.811 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -12.875 28.257 -4.052 1.00 0.00 H new ATOM 39 N PHE A 29 -11.368 23.618 3.041 1.00 0.00 N ATOM 40 CA PHE A 29 -10.262 22.648 2.770 1.00 0.00 C ATOM 41 C PHE A 29 -9.776 21.849 4.014 1.00 0.00 C ATOM 42 O PHE A 29 -9.601 20.632 3.890 1.00 0.00 O ATOM 43 CB PHE A 29 -9.059 23.344 2.066 1.00 0.00 C ATOM 44 CG PHE A 29 -9.374 24.176 0.804 1.00 0.00 C ATOM 45 CD1 PHE A 29 -9.431 23.571 -0.443 1.00 0.00 C ATOM 46 CD2 PHE A 29 -9.707 25.521 0.930 1.00 0.00 C ATOM 47 CE1 PHE A 29 -9.754 24.316 -1.560 1.00 0.00 C ATOM 48 CE2 PHE A 29 -10.029 26.259 -0.193 1.00 0.00 C ATOM 49 CZ PHE A 29 -10.045 25.659 -1.436 1.00 0.00 C ATOM 0 H PHE A 29 -11.055 24.589 3.063 1.00 0.00 H new ATOM 0 HA PHE A 29 -10.700 21.909 2.099 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -8.574 23.998 2.791 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -8.335 22.576 1.794 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -9.222 22.516 -0.540 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -9.714 25.988 1.904 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -9.779 23.847 -2.532 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -10.269 27.308 -0.098 1.00 0.00 H new ATOM 0 HZ PHE A 29 -10.286 26.242 -2.313 1.00 0.00 H new ATOM 59 N MET A 30 -9.601 22.512 5.184 1.00 0.00 N ATOM 60 CA MET A 30 -9.298 21.856 6.492 1.00 0.00 C ATOM 61 C MET A 30 -10.527 21.091 7.079 1.00 0.00 C ATOM 62 O MET A 30 -10.304 19.978 7.566 1.00 0.00 O ATOM 63 CB MET A 30 -8.697 22.888 7.489 1.00 0.00 C ATOM 64 CG MET A 30 -7.293 23.446 7.140 1.00 0.00 C ATOM 65 SD MET A 30 -6.035 22.156 7.285 1.00 0.00 S ATOM 66 CE MET A 30 -5.491 22.336 8.995 1.00 0.00 C ATOM 0 H MET A 30 -9.666 23.528 5.253 1.00 0.00 H new ATOM 0 HA MET A 30 -8.543 21.090 6.315 1.00 0.00 H new ATOM 0 HB2 MET A 30 -9.388 23.727 7.570 1.00 0.00 H new ATOM 0 HB3 MET A 30 -8.645 22.422 8.473 1.00 0.00 H new ATOM 0 HG2 MET A 30 -7.297 23.844 6.125 1.00 0.00 H new ATOM 0 HG3 MET A 30 -7.050 24.274 7.806 1.00 0.00 H new ATOM 0 HE1 MET A 30 -5.117 21.380 9.360 1.00 0.00 H new ATOM 0 HE2 MET A 30 -4.697 23.081 9.048 1.00 0.00 H new ATOM 0 HE3 MET A 30 -6.330 22.657 9.612 1.00 0.00 H new ATOM 76 N ASP A 31 -11.788 21.608 6.970 1.00 0.00 N ATOM 77 CA ASP A 31 -13.033 20.837 7.292 1.00 0.00 C ATOM 78 C ASP A 31 -13.221 19.508 6.482 1.00 0.00 C ATOM 79 O ASP A 31 -13.645 18.540 7.125 1.00 0.00 O ATOM 80 CB ASP A 31 -14.292 21.739 7.176 1.00 0.00 C ATOM 81 CG ASP A 31 -14.482 22.793 8.279 1.00 0.00 C ATOM 82 OD1 ASP A 31 -14.108 22.657 9.445 1.00 0.00 O ATOM 83 OD2 ASP A 31 -15.144 23.896 7.809 1.00 0.00 O ATOM 0 H ASP A 31 -11.971 22.562 6.659 1.00 0.00 H new ATOM 0 HA ASP A 31 -12.904 20.520 8.327 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -14.257 22.253 6.215 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -15.172 21.097 7.162 1.00 0.00 H new ATOM 88 N GLU A 32 -12.890 19.423 5.155 1.00 0.00 N ATOM 89 CA GLU A 32 -12.834 18.104 4.428 1.00 0.00 C ATOM 90 C GLU A 32 -11.670 17.154 4.896 1.00 0.00 C ATOM 91 O GLU A 32 -11.933 15.959 5.061 1.00 0.00 O ATOM 92 CB GLU A 32 -12.854 18.306 2.882 1.00 0.00 C ATOM 93 CG GLU A 32 -11.689 18.998 2.134 1.00 0.00 C ATOM 94 CD GLU A 32 -11.947 19.105 0.638 1.00 0.00 C ATOM 95 OE1 GLU A 32 -12.592 20.018 0.125 1.00 0.00 O ATOM 96 OE2 GLU A 32 -11.377 18.070 -0.055 1.00 0.00 O ATOM 0 H GLU A 32 -12.662 20.231 4.575 1.00 0.00 H new ATOM 0 HA GLU A 32 -13.745 17.574 4.708 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -12.972 17.318 2.437 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -13.757 18.870 2.650 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -11.537 19.995 2.547 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -10.769 18.439 2.303 1.00 0.00 H new ATOM 103 N PHE A 33 -10.450 17.697 5.155 1.00 0.00 N ATOM 104 CA PHE A 33 -9.313 16.975 5.806 1.00 0.00 C ATOM 105 C PHE A 33 -9.607 16.370 7.229 1.00 0.00 C ATOM 106 O PHE A 33 -9.280 15.191 7.401 1.00 0.00 O ATOM 107 CB PHE A 33 -8.070 17.920 5.773 1.00 0.00 C ATOM 108 CG PHE A 33 -6.715 17.335 6.257 1.00 0.00 C ATOM 109 CD1 PHE A 33 -5.996 16.449 5.463 1.00 0.00 C ATOM 110 CD2 PHE A 33 -6.206 17.681 7.504 1.00 0.00 C ATOM 111 CE1 PHE A 33 -4.801 15.920 5.910 1.00 0.00 C ATOM 112 CE2 PHE A 33 -5.005 17.157 7.939 1.00 0.00 C ATOM 113 CZ PHE A 33 -4.298 16.282 7.140 1.00 0.00 C ATOM 0 H PHE A 33 -10.222 18.662 4.916 1.00 0.00 H new ATOM 0 HA PHE A 33 -9.119 16.070 5.230 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -7.940 18.269 4.749 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -8.296 18.795 6.382 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -6.374 16.172 4.490 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -6.754 18.364 8.136 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -4.259 15.219 5.292 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -4.617 17.433 8.909 1.00 0.00 H new ATOM 0 HZ PHE A 33 -3.353 15.882 7.478 1.00 0.00 H new ATOM 123 N PHE A 34 -10.211 17.115 8.195 1.00 0.00 N ATOM 124 CA PHE A 34 -10.708 16.547 9.480 1.00 0.00 C ATOM 125 C PHE A 34 -11.906 15.538 9.375 1.00 0.00 C ATOM 126 O PHE A 34 -11.929 14.611 10.191 1.00 0.00 O ATOM 127 CB PHE A 34 -11.026 17.720 10.453 1.00 0.00 C ATOM 128 CG PHE A 34 -9.809 18.375 11.160 1.00 0.00 C ATOM 129 CD1 PHE A 34 -9.223 17.778 12.276 1.00 0.00 C ATOM 130 CD2 PHE A 34 -9.305 19.591 10.716 1.00 0.00 C ATOM 131 CE1 PHE A 34 -8.149 18.373 12.907 1.00 0.00 C ATOM 132 CE2 PHE A 34 -8.231 20.182 11.352 1.00 0.00 C ATOM 133 CZ PHE A 34 -7.650 19.572 12.444 1.00 0.00 C ATOM 0 H PHE A 34 -10.366 18.119 8.106 1.00 0.00 H new ATOM 0 HA PHE A 34 -9.903 15.922 9.866 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -11.555 18.493 9.896 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -11.710 17.354 11.218 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -9.613 16.843 12.650 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -9.757 20.079 9.865 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -7.698 17.898 13.766 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -7.845 21.125 10.993 1.00 0.00 H new ATOM 0 HZ PHE A 34 -6.806 20.033 12.935 1.00 0.00 H new ATOM 143 N GLU A 35 -12.850 15.700 8.412 1.00 0.00 N ATOM 144 CA GLU A 35 -13.953 14.718 8.143 1.00 0.00 C ATOM 145 C GLU A 35 -13.489 13.370 7.485 1.00 0.00 C ATOM 146 O GLU A 35 -13.989 12.336 7.941 1.00 0.00 O ATOM 147 CB GLU A 35 -15.104 15.378 7.309 1.00 0.00 C ATOM 148 CG GLU A 35 -16.007 16.443 7.983 1.00 0.00 C ATOM 149 CD GLU A 35 -17.041 15.882 8.960 1.00 0.00 C ATOM 150 OE1 GLU A 35 -18.152 15.483 8.615 1.00 0.00 O ATOM 151 OE2 GLU A 35 -16.578 15.879 10.249 1.00 0.00 O ATOM 0 H GLU A 35 -12.875 16.512 7.796 1.00 0.00 H new ATOM 0 HA GLU A 35 -14.330 14.442 9.128 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -14.651 15.839 6.431 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -15.751 14.577 6.951 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -15.373 17.152 8.515 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -16.528 17.002 7.206 1.00 0.00 H new ATOM 158 N GLN A 36 -12.581 13.361 6.468 1.00 0.00 N ATOM 159 CA GLN A 36 -12.052 12.106 5.830 1.00 0.00 C ATOM 160 C GLN A 36 -11.115 11.218 6.724 1.00 0.00 C ATOM 161 O GLN A 36 -11.278 9.993 6.693 1.00 0.00 O ATOM 162 CB GLN A 36 -11.414 12.433 4.440 1.00 0.00 C ATOM 163 CG GLN A 36 -10.108 13.265 4.308 1.00 0.00 C ATOM 164 CD GLN A 36 -9.685 13.447 2.846 1.00 0.00 C ATOM 165 OE1 GLN A 36 -9.075 12.559 2.253 1.00 0.00 O ATOM 166 NE2 GLN A 36 -9.991 14.583 2.236 1.00 0.00 N ATOM 0 H GLN A 36 -12.193 14.214 6.065 1.00 0.00 H new ATOM 0 HA GLN A 36 -12.924 11.467 5.690 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -11.230 11.479 3.946 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -12.177 12.951 3.858 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -10.254 14.243 4.767 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -9.307 12.771 4.858 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -10.497 15.312 2.739 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -9.720 14.729 1.263 1.00 0.00 H new ATOM 175 N VAL A 37 -10.185 11.812 7.516 1.00 0.00 N ATOM 176 CA VAL A 37 -9.340 11.092 8.551 1.00 0.00 C ATOM 177 C VAL A 37 -10.103 10.073 9.496 1.00 0.00 C ATOM 178 O VAL A 37 -9.565 8.988 9.739 1.00 0.00 O ATOM 179 CB VAL A 37 -8.459 12.090 9.432 1.00 0.00 C ATOM 180 CG1 VAL A 37 -7.224 12.683 8.691 1.00 0.00 C ATOM 181 CG2 VAL A 37 -9.191 13.214 10.219 1.00 0.00 C ATOM 0 H VAL A 37 -9.986 12.811 7.467 1.00 0.00 H new ATOM 0 HA VAL A 37 -8.689 10.480 7.927 1.00 0.00 H new ATOM 0 HB VAL A 37 -8.123 11.389 10.196 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -6.682 13.349 9.362 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -6.566 11.873 8.375 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -7.558 13.242 7.817 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -8.461 13.808 10.768 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -9.730 13.855 9.521 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -9.896 12.767 10.920 1.00 0.00 H new ATOM 191 N GLU A 38 -11.315 10.433 9.978 1.00 0.00 N ATOM 192 CA GLU A 38 -12.216 9.542 10.786 1.00 0.00 C ATOM 193 C GLU A 38 -12.725 8.254 10.055 1.00 0.00 C ATOM 194 O GLU A 38 -12.827 7.225 10.731 1.00 0.00 O ATOM 195 CB GLU A 38 -13.420 10.344 11.385 1.00 0.00 C ATOM 196 CG GLU A 38 -13.152 11.342 12.542 1.00 0.00 C ATOM 197 CD GLU A 38 -12.913 10.694 13.906 1.00 0.00 C ATOM 198 OE1 GLU A 38 -14.060 10.151 14.423 1.00 0.00 O ATOM 199 OE2 GLU A 38 -11.816 10.670 14.463 1.00 0.00 O ATOM 0 H GLU A 38 -11.711 11.360 9.821 1.00 0.00 H new ATOM 0 HA GLU A 38 -11.577 9.177 11.590 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -13.884 10.900 10.570 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -14.156 9.621 11.737 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -12.283 11.948 12.286 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -14.001 12.021 12.622 1.00 0.00 H new ATOM 206 N GLU A 39 -13.047 8.306 8.737 1.00 0.00 N ATOM 207 CA GLU A 39 -13.301 7.073 7.909 1.00 0.00 C ATOM 208 C GLU A 39 -12.002 6.266 7.527 1.00 0.00 C ATOM 209 O GLU A 39 -12.089 5.045 7.369 1.00 0.00 O ATOM 210 CB GLU A 39 -14.175 7.392 6.658 1.00 0.00 C ATOM 211 CG GLU A 39 -13.691 8.336 5.525 1.00 0.00 C ATOM 212 CD GLU A 39 -14.715 8.454 4.403 1.00 0.00 C ATOM 213 OE1 GLU A 39 -15.623 9.284 4.399 1.00 0.00 O ATOM 214 OE2 GLU A 39 -14.497 7.532 3.414 1.00 0.00 O ATOM 0 H GLU A 39 -13.139 9.178 8.217 1.00 0.00 H new ATOM 0 HA GLU A 39 -13.867 6.404 8.557 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -14.410 6.436 6.189 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -15.113 7.805 7.029 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -13.490 9.325 5.938 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -12.750 7.963 5.120 1.00 0.00 H new ATOM 221 N ILE A 40 -10.828 6.943 7.444 1.00 0.00 N ATOM 222 CA ILE A 40 -9.447 6.344 7.285 1.00 0.00 C ATOM 223 C ILE A 40 -9.114 5.462 8.552 1.00 0.00 C ATOM 224 O ILE A 40 -8.970 4.253 8.346 1.00 0.00 O ATOM 225 CB ILE A 40 -8.469 7.554 6.870 1.00 0.00 C ATOM 226 CG1 ILE A 40 -8.668 8.017 5.354 1.00 0.00 C ATOM 227 CG2 ILE A 40 -6.952 7.283 7.143 1.00 0.00 C ATOM 228 CD1 ILE A 40 -8.298 9.462 4.940 1.00 0.00 C ATOM 0 H ILE A 40 -10.800 7.962 7.486 1.00 0.00 H new ATOM 0 HA ILE A 40 -9.331 5.616 6.482 1.00 0.00 H new ATOM 0 HB ILE A 40 -8.773 8.366 7.531 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -8.088 7.340 4.728 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -9.717 7.864 5.102 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -6.366 8.149 6.834 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -6.800 7.103 8.207 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -6.631 6.408 6.578 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -8.498 9.599 3.877 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -8.895 10.170 5.515 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -7.240 9.637 5.135 1.00 0.00 H new ATOM 240 N ARG A 41 -9.098 5.982 9.810 1.00 0.00 N ATOM 241 CA ARG A 41 -8.982 5.130 11.062 1.00 0.00 C ATOM 242 C ARG A 41 -9.915 3.852 11.146 1.00 0.00 C ATOM 243 O ARG A 41 -9.482 2.858 11.736 1.00 0.00 O ATOM 244 CB ARG A 41 -9.071 6.026 12.326 1.00 0.00 C ATOM 245 CG ARG A 41 -10.408 6.703 12.636 1.00 0.00 C ATOM 246 CD ARG A 41 -10.486 7.696 13.803 1.00 0.00 C ATOM 247 NE ARG A 41 -10.524 7.042 15.143 1.00 0.00 N ATOM 248 CZ ARG A 41 -10.524 7.664 16.349 1.00 0.00 C ATOM 249 NH1 ARG A 41 -10.489 8.989 16.555 1.00 0.00 N ATOM 250 NH2 ARG A 41 -10.561 6.893 17.420 1.00 0.00 N ATOM 0 H ARG A 41 -9.163 6.982 10.000 1.00 0.00 H new ATOM 0 HA ARG A 41 -7.993 4.676 11.003 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -8.798 5.416 13.187 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -8.315 6.806 12.236 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -10.728 7.228 11.736 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -11.139 5.917 12.823 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -9.626 8.364 13.758 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -11.376 8.314 13.684 1.00 0.00 H new ATOM 0 HE ARG A 41 -10.553 6.022 15.154 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -10.459 9.628 15.761 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -10.493 9.358 17.506 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -10.588 5.879 17.317 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -10.563 7.312 18.350 1.00 0.00 H new ATOM 264 N GLY A 42 -11.128 3.897 10.538 1.00 0.00 N ATOM 265 CA GLY A 42 -12.006 2.711 10.326 1.00 0.00 C ATOM 266 C GLY A 42 -11.436 1.623 9.377 1.00 0.00 C ATOM 267 O GLY A 42 -11.344 0.470 9.809 1.00 0.00 O ATOM 0 H GLY A 42 -11.530 4.763 10.177 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -12.211 2.254 11.294 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -12.961 3.053 9.927 1.00 0.00 H new ATOM 271 N PHE A 43 -11.026 2.001 8.136 1.00 0.00 N ATOM 272 CA PHE A 43 -10.250 1.123 7.208 1.00 0.00 C ATOM 273 C PHE A 43 -8.852 0.655 7.741 1.00 0.00 C ATOM 274 O PHE A 43 -8.501 -0.485 7.432 1.00 0.00 O ATOM 275 CB PHE A 43 -10.051 1.780 5.806 1.00 0.00 C ATOM 276 CG PHE A 43 -11.289 2.228 4.986 1.00 0.00 C ATOM 277 CD1 PHE A 43 -12.086 1.294 4.334 1.00 0.00 C ATOM 278 CD2 PHE A 43 -11.591 3.580 4.845 1.00 0.00 C ATOM 279 CE1 PHE A 43 -13.171 1.699 3.582 1.00 0.00 C ATOM 280 CE2 PHE A 43 -12.677 3.979 4.091 1.00 0.00 C ATOM 281 CZ PHE A 43 -13.468 3.040 3.462 1.00 0.00 C ATOM 0 H PHE A 43 -11.223 2.923 7.748 1.00 0.00 H new ATOM 0 HA PHE A 43 -10.876 0.234 7.129 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -9.417 2.656 5.944 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -9.491 1.074 5.192 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -11.855 0.242 4.416 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -10.972 4.321 5.328 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -13.788 0.964 3.087 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -12.908 5.030 3.993 1.00 0.00 H new ATOM 0 HZ PHE A 43 -14.319 3.355 2.876 1.00 0.00 H new ATOM 291 N ILE A 44 -8.111 1.479 8.543 1.00 0.00 N ATOM 292 CA ILE A 44 -6.809 1.093 9.209 1.00 0.00 C ATOM 293 C ILE A 44 -7.112 0.034 10.353 1.00 0.00 C ATOM 294 O ILE A 44 -6.479 -1.026 10.300 1.00 0.00 O ATOM 295 CB ILE A 44 -5.919 2.325 9.732 1.00 0.00 C ATOM 296 CG1 ILE A 44 -5.750 3.561 8.750 1.00 0.00 C ATOM 297 CG2 ILE A 44 -4.495 1.828 10.197 1.00 0.00 C ATOM 298 CD1 ILE A 44 -5.326 4.939 9.316 1.00 0.00 C ATOM 0 H ILE A 44 -8.395 2.436 8.752 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.178 0.643 8.442 1.00 0.00 H new ATOM 0 HB ILE A 44 -6.503 2.714 10.566 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -5.016 3.279 7.995 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -6.700 3.699 8.234 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -3.909 2.678 10.547 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -4.608 1.107 11.007 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -3.983 1.355 9.359 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -5.261 5.662 8.503 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -6.064 5.276 10.043 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -4.354 4.850 9.801 1.00 0.00 H new ATOM 310 N ASP A 45 -8.042 0.279 11.320 1.00 0.00 N ATOM 311 CA ASP A 45 -8.544 -0.740 12.298 1.00 0.00 C ATOM 312 C ASP A 45 -8.968 -2.132 11.700 1.00 0.00 C ATOM 313 O ASP A 45 -8.597 -3.150 12.299 1.00 0.00 O ATOM 314 CB ASP A 45 -9.675 -0.079 13.137 1.00 0.00 C ATOM 315 CG ASP A 45 -9.212 0.874 14.246 1.00 0.00 C ATOM 316 OD1 ASP A 45 -8.498 0.222 15.217 1.00 0.00 O ATOM 317 OD2 ASP A 45 -9.465 2.077 14.256 1.00 0.00 O ATOM 0 H ASP A 45 -8.470 1.196 11.446 1.00 0.00 H new ATOM 0 HA ASP A 45 -7.700 -1.021 12.928 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -10.329 0.471 12.461 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -10.275 -0.869 13.589 1.00 0.00 H new ATOM 322 N LYS A 46 -9.663 -2.166 10.530 1.00 0.00 N ATOM 323 CA LYS A 46 -9.919 -3.413 9.751 1.00 0.00 C ATOM 324 C LYS A 46 -8.648 -4.121 9.162 1.00 0.00 C ATOM 325 O LYS A 46 -8.732 -5.337 8.960 1.00 0.00 O ATOM 326 CB LYS A 46 -10.994 -3.079 8.667 1.00 0.00 C ATOM 327 CG LYS A 46 -11.773 -4.235 7.985 1.00 0.00 C ATOM 328 CD LYS A 46 -12.939 -4.861 8.788 1.00 0.00 C ATOM 329 CE LYS A 46 -13.671 -5.985 8.044 1.00 0.00 C ATOM 330 NZ LYS A 46 -14.759 -6.522 8.877 1.00 0.00 N ATOM 0 H LYS A 46 -10.062 -1.332 10.100 1.00 0.00 H new ATOM 0 HA LYS A 46 -10.290 -4.169 10.443 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -11.728 -2.417 9.127 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -10.499 -2.509 7.880 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -12.171 -3.865 7.040 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -11.064 -5.026 7.744 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -12.551 -5.253 9.728 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -13.655 -4.079 9.040 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -14.075 -5.606 7.105 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -12.970 -6.781 7.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -15.247 -7.282 8.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -14.364 -6.901 9.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -15.435 -5.763 9.096 1.00 0.00 H new ATOM 344 N ILE A 47 -7.504 -3.415 8.937 1.00 0.00 N ATOM 345 CA ILE A 47 -6.179 -4.022 8.603 1.00 0.00 C ATOM 346 C ILE A 47 -5.635 -4.793 9.865 1.00 0.00 C ATOM 347 O ILE A 47 -5.281 -5.956 9.661 1.00 0.00 O ATOM 348 CB ILE A 47 -5.132 -2.943 8.037 1.00 0.00 C ATOM 349 CG1 ILE A 47 -5.558 -1.944 6.877 1.00 0.00 C ATOM 350 CG2 ILE A 47 -3.780 -3.615 7.630 1.00 0.00 C ATOM 351 CD1 ILE A 47 -6.218 -2.370 5.544 1.00 0.00 C ATOM 0 H ILE A 47 -7.474 -2.396 8.983 1.00 0.00 H new ATOM 0 HA ILE A 47 -6.313 -4.735 7.789 1.00 0.00 H new ATOM 0 HB ILE A 47 -5.056 -2.296 8.911 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -6.239 -1.226 7.334 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -4.655 -1.398 6.604 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -3.096 -2.856 7.252 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -3.338 -4.100 8.500 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -3.962 -4.358 6.854 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -6.404 -1.488 4.932 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -5.553 -3.049 5.009 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -7.162 -2.874 5.750 1.00 0.00 H new ATOM 363 N ALA A 48 -5.521 -4.194 11.084 1.00 0.00 N ATOM 364 CA ALA A 48 -4.979 -4.905 12.272 1.00 0.00 C ATOM 365 C ALA A 48 -5.788 -6.147 12.758 1.00 0.00 C ATOM 366 O ALA A 48 -5.144 -7.147 13.102 1.00 0.00 O ATOM 367 CB ALA A 48 -4.745 -3.889 13.395 1.00 0.00 C ATOM 0 H ALA A 48 -5.795 -3.229 11.266 1.00 0.00 H new ATOM 0 HA ALA A 48 -4.036 -5.350 11.955 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -4.347 -4.401 14.271 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -4.033 -3.135 13.061 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -5.688 -3.408 13.653 1.00 0.00 H new ATOM 373 N GLU A 49 -7.149 -6.115 12.681 1.00 0.00 N ATOM 374 CA GLU A 49 -8.022 -7.314 12.897 1.00 0.00 C ATOM 375 C GLU A 49 -7.851 -8.409 11.782 1.00 0.00 C ATOM 376 O GLU A 49 -7.701 -9.577 12.167 1.00 0.00 O ATOM 377 CB GLU A 49 -9.523 -6.915 13.067 1.00 0.00 C ATOM 378 CG GLU A 49 -9.913 -6.133 14.342 1.00 0.00 C ATOM 379 CD GLU A 49 -11.394 -5.785 14.366 1.00 0.00 C ATOM 380 OE1 GLU A 49 -11.657 -4.621 13.692 1.00 0.00 O ATOM 381 OE2 GLU A 49 -12.244 -6.475 14.927 1.00 0.00 O ATOM 0 H GLU A 49 -7.672 -5.265 12.469 1.00 0.00 H new ATOM 0 HA GLU A 49 -7.684 -7.764 13.831 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -9.812 -6.316 12.203 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -10.119 -7.827 13.036 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -9.666 -6.727 15.222 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -9.324 -5.217 14.400 1.00 0.00 H new ATOM 388 N ASN A 50 -7.803 -8.059 10.457 1.00 0.00 N ATOM 389 CA ASN A 50 -7.538 -9.043 9.365 1.00 0.00 C ATOM 390 C ASN A 50 -6.078 -9.612 9.352 1.00 0.00 C ATOM 391 O ASN A 50 -5.965 -10.829 9.192 1.00 0.00 O ATOM 392 CB ASN A 50 -7.964 -8.421 8.004 1.00 0.00 C ATOM 393 CG ASN A 50 -8.185 -9.437 6.864 1.00 0.00 C ATOM 394 OD1 ASN A 50 -7.254 -9.777 6.136 1.00 0.00 O ATOM 395 ND2 ASN A 50 -9.399 -9.939 6.685 1.00 0.00 N ATOM 0 H ASN A 50 -7.944 -7.105 10.125 1.00 0.00 H new ATOM 0 HA ASN A 50 -8.148 -9.926 9.558 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -8.885 -7.857 8.152 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -7.200 -7.708 7.692 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -9.567 -10.613 5.938 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -10.165 -9.651 7.294 1.00 0.00 H new ATOM 402 N VAL A 51 -5.018 -8.785 9.564 1.00 0.00 N ATOM 403 CA VAL A 51 -3.583 -9.219 9.595 1.00 0.00 C ATOM 404 C VAL A 51 -3.240 -10.213 10.769 1.00 0.00 C ATOM 405 O VAL A 51 -2.653 -11.267 10.510 1.00 0.00 O ATOM 406 CB VAL A 51 -2.706 -7.893 9.481 1.00 0.00 C ATOM 407 CG1 VAL A 51 -2.334 -7.115 10.753 1.00 0.00 C ATOM 408 CG2 VAL A 51 -1.415 -8.130 8.689 1.00 0.00 C ATOM 0 H VAL A 51 -5.132 -7.784 9.721 1.00 0.00 H new ATOM 0 HA VAL A 51 -3.337 -9.857 8.746 1.00 0.00 H new ATOM 0 HB VAL A 51 -3.421 -7.250 8.969 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -1.737 -6.243 10.485 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -3.243 -6.790 11.260 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -1.758 -7.759 11.418 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -0.846 -7.202 8.634 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -0.817 -8.893 9.187 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -1.662 -8.464 7.681 1.00 0.00 H new ATOM 418 N GLU A 52 -3.663 -9.869 12.010 1.00 0.00 N ATOM 419 CA GLU A 52 -3.652 -10.782 13.204 1.00 0.00 C ATOM 420 C GLU A 52 -4.491 -12.091 12.968 1.00 0.00 C ATOM 421 O GLU A 52 -4.064 -13.138 13.466 1.00 0.00 O ATOM 422 CB GLU A 52 -4.126 -10.059 14.502 1.00 0.00 C ATOM 423 CG GLU A 52 -3.146 -9.049 15.140 1.00 0.00 C ATOM 424 CD GLU A 52 -3.740 -8.379 16.372 1.00 0.00 C ATOM 425 OE1 GLU A 52 -4.476 -7.395 16.319 1.00 0.00 O ATOM 426 OE2 GLU A 52 -3.358 -9.004 17.529 1.00 0.00 O ATOM 0 H GLU A 52 -4.028 -8.941 12.224 1.00 0.00 H new ATOM 0 HA GLU A 52 -2.612 -11.076 13.342 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -5.055 -9.534 14.278 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -4.361 -10.819 15.247 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -2.224 -9.562 15.415 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -2.880 -8.288 14.406 1.00 0.00 H new ATOM 433 N GLU A 53 -5.614 -12.031 12.189 1.00 0.00 N ATOM 434 CA GLU A 53 -6.348 -13.244 11.691 1.00 0.00 C ATOM 435 C GLU A 53 -5.500 -14.119 10.693 1.00 0.00 C ATOM 436 O GLU A 53 -5.447 -15.341 10.871 1.00 0.00 O ATOM 437 CB GLU A 53 -7.730 -12.853 11.067 1.00 0.00 C ATOM 438 CG GLU A 53 -8.855 -13.916 11.147 1.00 0.00 C ATOM 439 CD GLU A 53 -9.604 -13.924 12.478 1.00 0.00 C ATOM 440 OE1 GLU A 53 -10.378 -12.804 12.637 1.00 0.00 O ATOM 441 OE2 GLU A 53 -9.518 -14.835 13.300 1.00 0.00 O ATOM 0 H GLU A 53 -6.034 -11.151 11.890 1.00 0.00 H new ATOM 0 HA GLU A 53 -6.528 -13.870 12.565 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -8.082 -11.947 11.560 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -7.571 -12.604 10.018 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -9.567 -13.738 10.341 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -8.422 -14.902 10.979 1.00 0.00 H new ATOM 448 N VAL A 54 -4.811 -13.493 9.694 1.00 0.00 N ATOM 449 CA VAL A 54 -3.770 -14.169 8.820 1.00 0.00 C ATOM 450 C VAL A 54 -2.710 -14.921 9.715 1.00 0.00 C ATOM 451 O VAL A 54 -2.399 -16.062 9.389 1.00 0.00 O ATOM 452 CB VAL A 54 -3.043 -13.191 7.788 1.00 0.00 C ATOM 453 CG1 VAL A 54 -2.035 -13.895 6.828 1.00 0.00 C ATOM 454 CG2 VAL A 54 -3.932 -12.308 6.889 1.00 0.00 C ATOM 0 H VAL A 54 -4.952 -12.510 9.462 1.00 0.00 H new ATOM 0 HA VAL A 54 -4.315 -14.887 8.207 1.00 0.00 H new ATOM 0 HB VAL A 54 -2.539 -12.549 8.510 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -1.589 -13.156 6.163 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -1.251 -14.377 7.413 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -2.559 -14.645 6.236 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -3.302 -11.698 6.241 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -4.575 -12.942 6.278 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.548 -11.659 7.511 1.00 0.00 H new ATOM 464 N LYS A 55 -2.219 -14.279 10.790 1.00 0.00 N ATOM 465 CA LYS A 55 -1.253 -14.867 11.762 1.00 0.00 C ATOM 466 C LYS A 55 -1.709 -16.147 12.528 1.00 0.00 C ATOM 467 O LYS A 55 -0.826 -16.969 12.800 1.00 0.00 O ATOM 468 CB LYS A 55 -0.836 -13.724 12.738 1.00 0.00 C ATOM 469 CG LYS A 55 0.563 -13.815 13.409 1.00 0.00 C ATOM 470 CD LYS A 55 0.868 -12.793 14.544 1.00 0.00 C ATOM 471 CE LYS A 55 1.066 -11.290 14.216 1.00 0.00 C ATOM 472 NZ LYS A 55 2.337 -10.996 13.524 1.00 0.00 N ATOM 0 H LYS A 55 -2.481 -13.320 11.020 1.00 0.00 H new ATOM 0 HA LYS A 55 -0.413 -15.250 11.182 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -0.884 -12.783 12.190 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -1.584 -13.671 13.529 1.00 0.00 H new ATOM 0 HG2 LYS A 55 0.679 -14.819 13.817 1.00 0.00 H new ATOM 0 HG3 LYS A 55 1.320 -13.696 12.633 1.00 0.00 H new ATOM 0 HD2 LYS A 55 0.054 -12.861 15.265 1.00 0.00 H new ATOM 0 HD3 LYS A 55 1.771 -13.134 15.050 1.00 0.00 H new ATOM 0 HE2 LYS A 55 0.237 -10.951 13.595 1.00 0.00 H new ATOM 0 HE3 LYS A 55 1.026 -10.717 15.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 2.402 -9.975 13.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 3.135 -11.290 14.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 2.371 -11.516 12.624 1.00 0.00 H new ATOM 486 N ARG A 56 -3.017 -16.317 12.851 1.00 0.00 N ATOM 487 CA ARG A 56 -3.540 -17.628 13.370 1.00 0.00 C ATOM 488 C ARG A 56 -3.675 -18.732 12.252 1.00 0.00 C ATOM 489 O ARG A 56 -3.423 -19.900 12.566 1.00 0.00 O ATOM 490 CB ARG A 56 -4.824 -17.398 14.221 1.00 0.00 C ATOM 491 CG ARG A 56 -6.184 -17.098 13.550 1.00 0.00 C ATOM 492 CD ARG A 56 -7.439 -17.118 14.445 1.00 0.00 C ATOM 493 NE ARG A 56 -7.603 -15.876 15.252 1.00 0.00 N ATOM 494 CZ ARG A 56 -8.402 -15.713 16.337 1.00 0.00 C ATOM 495 NH1 ARG A 56 -9.194 -16.647 16.883 1.00 0.00 N ATOM 496 NH2 ARG A 56 -8.399 -14.523 16.909 1.00 0.00 N ATOM 0 H ARG A 56 -3.723 -15.586 12.767 1.00 0.00 H new ATOM 0 HA ARG A 56 -2.795 -18.051 14.043 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -4.962 -18.287 14.837 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -4.613 -16.570 14.898 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -6.119 -16.115 13.083 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -6.331 -17.822 12.749 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -8.321 -17.257 13.820 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -7.386 -17.975 15.116 1.00 0.00 H new ATOM 0 HE ARG A 56 -7.059 -15.065 14.959 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -9.232 -17.583 16.479 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -9.758 -16.422 17.702 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -7.813 -13.778 16.532 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -8.982 -14.349 17.728 1.00 0.00 H new ATOM 510 N LYS A 57 -4.046 -18.356 11.007 1.00 0.00 N ATOM 511 CA LYS A 57 -4.208 -19.281 9.851 1.00 0.00 C ATOM 512 C LYS A 57 -2.874 -19.713 9.157 1.00 0.00 C ATOM 513 O LYS A 57 -2.768 -20.883 8.778 1.00 0.00 O ATOM 514 CB LYS A 57 -5.190 -18.621 8.833 1.00 0.00 C ATOM 515 CG LYS A 57 -6.639 -18.354 9.316 1.00 0.00 C ATOM 516 CD LYS A 57 -7.706 -17.909 8.284 1.00 0.00 C ATOM 517 CE LYS A 57 -8.365 -18.996 7.400 1.00 0.00 C ATOM 518 NZ LYS A 57 -9.382 -19.804 8.104 1.00 0.00 N ATOM 0 H LYS A 57 -4.246 -17.385 10.768 1.00 0.00 H new ATOM 0 HA LYS A 57 -4.612 -20.215 10.240 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -4.759 -17.671 8.516 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -5.240 -19.259 7.950 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -7.001 -19.266 9.791 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -6.592 -17.589 10.091 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -8.499 -17.394 8.826 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -7.244 -17.176 7.622 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -8.829 -18.517 6.538 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -7.589 -19.659 7.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -10.057 -20.191 7.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -8.916 -20.585 8.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -9.890 -19.205 8.786 1.00 0.00 H new ATOM 532 N HIS A 58 -1.906 -18.784 8.987 1.00 0.00 N ATOM 533 CA HIS A 58 -0.627 -18.993 8.236 1.00 0.00 C ATOM 534 C HIS A 58 0.379 -20.050 8.798 1.00 0.00 C ATOM 535 O HIS A 58 1.055 -20.664 7.975 1.00 0.00 O ATOM 536 CB HIS A 58 0.057 -17.594 8.038 1.00 0.00 C ATOM 537 CG HIS A 58 0.035 -16.855 6.693 1.00 0.00 C ATOM 538 ND1 HIS A 58 0.984 -15.856 6.478 1.00 0.00 N ATOM 539 CD2 HIS A 58 -0.869 -16.905 5.602 1.00 0.00 C ATOM 540 CE1 HIS A 58 0.574 -15.403 5.261 1.00 0.00 C ATOM 541 NE2 HIS A 58 -0.505 -15.978 4.643 1.00 0.00 N ATOM 0 H HIS A 58 -1.985 -17.843 9.373 1.00 0.00 H new ATOM 0 HA HIS A 58 -0.917 -19.450 7.290 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -0.387 -16.922 8.772 1.00 0.00 H new ATOM 0 HB3 HIS A 58 1.105 -17.716 8.311 1.00 0.00 H new ATOM 0 HD1 HIS A 58 1.762 -15.552 7.064 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -1.717 -17.570 5.531 1.00 0.00 H new ATOM 0 HE1 HIS A 58 1.100 -14.590 4.783 1.00 0.00 H new ATOM 549 N SER A 59 0.508 -20.203 10.130 1.00 0.00 N ATOM 550 CA SER A 59 1.444 -21.159 10.791 1.00 0.00 C ATOM 551 C SER A 59 0.993 -22.652 10.768 1.00 0.00 C ATOM 552 O SER A 59 1.832 -23.475 10.383 1.00 0.00 O ATOM 553 CB SER A 59 1.751 -20.644 12.210 1.00 0.00 C ATOM 554 OG SER A 59 0.574 -20.673 13.005 1.00 0.00 O ATOM 0 H SER A 59 -0.041 -19.660 10.797 1.00 0.00 H new ATOM 0 HA SER A 59 2.359 -21.182 10.199 1.00 0.00 H new ATOM 0 HB2 SER A 59 2.525 -21.259 12.669 1.00 0.00 H new ATOM 0 HB3 SER A 59 2.140 -19.627 12.160 1.00 0.00 H new ATOM 0 HG SER A 59 0.779 -20.346 13.906 1.00 0.00 H new ATOM 560 N ALA A 60 -0.271 -23.005 11.132 1.00 0.00 N ATOM 561 CA ALA A 60 -0.833 -24.372 10.919 1.00 0.00 C ATOM 562 C ALA A 60 -1.057 -24.821 9.440 1.00 0.00 C ATOM 563 O ALA A 60 -0.956 -26.024 9.178 1.00 0.00 O ATOM 564 CB ALA A 60 -2.138 -24.486 11.713 1.00 0.00 C ATOM 0 H ALA A 60 -0.924 -22.359 11.576 1.00 0.00 H new ATOM 0 HA ALA A 60 -0.065 -25.059 11.274 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -2.565 -25.479 11.571 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -1.935 -24.327 12.772 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -2.844 -23.733 11.362 1.00 0.00 H new ATOM 570 N ILE A 61 -1.315 -23.877 8.501 1.00 0.00 N ATOM 571 CA ILE A 61 -1.356 -24.111 7.021 1.00 0.00 C ATOM 572 C ILE A 61 0.123 -24.104 6.462 1.00 0.00 C ATOM 573 O ILE A 61 0.332 -24.811 5.476 1.00 0.00 O ATOM 574 CB ILE A 61 -2.399 -23.099 6.364 1.00 0.00 C ATOM 575 CG1 ILE A 61 -3.874 -23.113 6.972 1.00 0.00 C ATOM 576 CG2 ILE A 61 -2.481 -23.334 4.820 1.00 0.00 C ATOM 577 CD1 ILE A 61 -4.828 -21.920 6.720 1.00 0.00 C ATOM 0 H ILE A 61 -1.506 -22.906 8.749 1.00 0.00 H new ATOM 0 HA ILE A 61 -1.738 -25.094 6.747 1.00 0.00 H new ATOM 0 HB ILE A 61 -1.998 -22.114 6.605 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -4.370 -24.009 6.598 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -3.778 -23.229 8.052 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -3.196 -22.637 4.383 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.499 -23.173 4.375 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -2.805 -24.356 4.624 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.783 -22.108 7.210 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -4.386 -21.009 7.124 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.987 -21.801 5.648 1.00 0.00 H new ATOM 734 N LYS A 72 -6.943 -23.347 2.083 1.00 0.00 N ATOM 735 CA LYS A 72 -6.166 -22.707 0.973 1.00 0.00 C ATOM 736 C LYS A 72 -7.016 -21.846 0.006 1.00 0.00 C ATOM 737 O LYS A 72 -6.516 -20.784 -0.384 1.00 0.00 O ATOM 738 CB LYS A 72 -5.311 -23.785 0.225 1.00 0.00 C ATOM 739 CG LYS A 72 -4.046 -24.352 0.961 1.00 0.00 C ATOM 740 CD LYS A 72 -2.839 -23.409 1.231 1.00 0.00 C ATOM 741 CE LYS A 72 -1.929 -23.031 0.045 1.00 0.00 C ATOM 742 NZ LYS A 72 -0.957 -24.083 -0.311 1.00 0.00 N ATOM 0 HA LYS A 72 -5.494 -21.986 1.438 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -5.964 -24.624 -0.014 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -4.984 -23.356 -0.722 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -4.375 -24.747 1.922 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -3.678 -25.197 0.378 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -3.228 -22.485 1.660 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -2.215 -23.876 1.993 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -2.550 -22.812 -0.824 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -1.389 -22.116 0.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -0.379 -23.764 -1.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -0.341 -24.277 0.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -1.466 -24.951 -0.574 1.00 0.00 H new ATOM 756 N GLU A 73 -8.257 -22.251 -0.358 1.00 0.00 N ATOM 757 CA GLU A 73 -9.233 -21.373 -1.096 1.00 0.00 C ATOM 758 C GLU A 73 -9.563 -19.988 -0.412 1.00 0.00 C ATOM 759 O GLU A 73 -9.799 -19.014 -1.133 1.00 0.00 O ATOM 760 CB GLU A 73 -10.503 -22.209 -1.461 1.00 0.00 C ATOM 761 CG GLU A 73 -11.558 -22.628 -0.398 1.00 0.00 C ATOM 762 CD GLU A 73 -12.615 -21.563 -0.093 1.00 0.00 C ATOM 763 OE1 GLU A 73 -13.171 -20.875 -0.950 1.00 0.00 O ATOM 764 OE2 GLU A 73 -12.887 -21.490 1.247 1.00 0.00 O ATOM 0 H GLU A 73 -8.619 -23.183 -0.157 1.00 0.00 H new ATOM 0 HA GLU A 73 -8.737 -21.053 -2.012 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -11.037 -21.647 -2.227 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -10.149 -23.128 -1.929 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -12.061 -23.532 -0.741 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -11.041 -22.883 0.527 1.00 0.00 H new ATOM 771 N GLU A 74 -9.532 -19.938 0.942 1.00 0.00 N ATOM 772 CA GLU A 74 -9.592 -18.680 1.748 1.00 0.00 C ATOM 773 C GLU A 74 -8.293 -17.809 1.722 1.00 0.00 C ATOM 774 O GLU A 74 -8.464 -16.596 1.898 1.00 0.00 O ATOM 775 CB GLU A 74 -9.959 -18.966 3.239 1.00 0.00 C ATOM 776 CG GLU A 74 -11.419 -19.370 3.546 1.00 0.00 C ATOM 777 CD GLU A 74 -11.637 -19.657 5.026 1.00 0.00 C ATOM 778 OE1 GLU A 74 -11.343 -20.726 5.560 1.00 0.00 O ATOM 779 OE2 GLU A 74 -12.194 -18.589 5.678 1.00 0.00 O ATOM 0 H GLU A 74 -9.464 -20.777 1.518 1.00 0.00 H new ATOM 0 HA GLU A 74 -10.376 -18.104 1.256 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -9.306 -19.761 3.600 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -9.727 -18.074 3.820 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -12.090 -18.571 3.230 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -11.680 -20.254 2.964 1.00 0.00 H new ATOM 786 N LEU A 75 -7.045 -18.344 1.545 1.00 0.00 N ATOM 787 CA LEU A 75 -5.796 -17.533 1.581 1.00 0.00 C ATOM 788 C LEU A 75 -5.671 -16.446 0.463 1.00 0.00 C ATOM 789 O LEU A 75 -5.230 -15.343 0.806 1.00 0.00 O ATOM 790 CB LEU A 75 -4.541 -18.455 1.637 1.00 0.00 C ATOM 791 CG LEU A 75 -4.190 -19.396 2.862 1.00 0.00 C ATOM 792 CD1 LEU A 75 -2.733 -19.913 2.732 1.00 0.00 C ATOM 793 CD2 LEU A 75 -4.388 -18.858 4.311 1.00 0.00 C ATOM 0 H LEU A 75 -6.883 -19.337 1.376 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.857 -16.954 2.503 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.599 -19.102 0.762 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -3.678 -17.804 1.495 1.00 0.00 H new ATOM 0 HG LEU A 75 -4.948 -20.174 2.769 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -2.499 -20.559 3.578 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.628 -20.477 1.805 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -2.046 -19.067 2.721 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -4.101 -19.628 5.027 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -3.767 -17.975 4.459 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -5.435 -18.594 4.461 1.00 0.00 H new ATOM 805 N GLU A 76 -6.081 -16.719 -0.805 1.00 0.00 N ATOM 806 CA GLU A 76 -6.214 -15.649 -1.861 1.00 0.00 C ATOM 807 C GLU A 76 -7.267 -14.539 -1.514 1.00 0.00 C ATOM 808 O GLU A 76 -7.082 -13.423 -2.002 1.00 0.00 O ATOM 809 CB GLU A 76 -6.566 -16.162 -3.287 1.00 0.00 C ATOM 810 CG GLU A 76 -5.533 -17.066 -3.991 1.00 0.00 C ATOM 811 CD GLU A 76 -6.022 -17.527 -5.357 1.00 0.00 C ATOM 812 OE1 GLU A 76 -5.862 -16.557 -6.311 1.00 0.00 O ATOM 813 OE2 GLU A 76 -6.502 -18.640 -5.566 1.00 0.00 O ATOM 0 H GLU A 76 -6.325 -17.655 -1.129 1.00 0.00 H new ATOM 0 HA GLU A 76 -5.205 -15.236 -1.866 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -7.506 -16.710 -3.225 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -6.743 -15.295 -3.923 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -4.594 -16.524 -4.105 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -5.326 -17.935 -3.367 1.00 0.00 H new ATOM 820 N GLU A 77 -8.303 -14.831 -0.681 1.00 0.00 N ATOM 821 CA GLU A 77 -9.251 -13.825 -0.125 1.00 0.00 C ATOM 822 C GLU A 77 -8.584 -12.897 0.954 1.00 0.00 C ATOM 823 O GLU A 77 -8.715 -11.689 0.755 1.00 0.00 O ATOM 824 CB GLU A 77 -10.535 -14.575 0.358 1.00 0.00 C ATOM 825 CG GLU A 77 -11.802 -13.718 0.571 1.00 0.00 C ATOM 826 CD GLU A 77 -12.972 -14.546 1.088 1.00 0.00 C ATOM 827 OE1 GLU A 77 -12.974 -14.629 2.455 1.00 0.00 O ATOM 828 OE2 GLU A 77 -13.808 -15.071 0.354 1.00 0.00 O ATOM 0 H GLU A 77 -8.506 -15.782 -0.373 1.00 0.00 H new ATOM 0 HA GLU A 77 -9.550 -13.121 -0.901 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -10.769 -15.352 -0.370 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -10.302 -15.077 1.297 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -11.584 -12.918 1.278 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -12.081 -13.244 -0.370 1.00 0.00 H new ATOM 835 N LEU A 78 -7.890 -13.394 2.019 1.00 0.00 N ATOM 836 CA LEU A 78 -7.230 -12.546 3.055 1.00 0.00 C ATOM 837 C LEU A 78 -6.033 -11.660 2.597 1.00 0.00 C ATOM 838 O LEU A 78 -5.966 -10.520 3.075 1.00 0.00 O ATOM 839 CB LEU A 78 -6.867 -13.426 4.296 1.00 0.00 C ATOM 840 CG LEU A 78 -5.995 -14.742 4.297 1.00 0.00 C ATOM 841 CD1 LEU A 78 -4.503 -14.639 3.865 1.00 0.00 C ATOM 842 CD2 LEU A 78 -6.064 -15.479 5.663 1.00 0.00 C ATOM 0 H LEU A 78 -7.773 -14.394 2.182 1.00 0.00 H new ATOM 0 HA LEU A 78 -7.976 -11.795 3.315 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -6.376 -12.751 4.997 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -7.821 -13.709 4.741 1.00 0.00 H new ATOM 0 HG LEU A 78 -6.476 -15.307 3.498 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -4.040 -15.624 3.918 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -4.445 -14.266 2.843 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -3.978 -13.955 4.531 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -5.451 -16.379 5.622 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -5.693 -14.822 6.450 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -7.097 -15.753 5.877 1.00 0.00 H new ATOM 854 N MET A 79 -5.158 -12.120 1.671 1.00 0.00 N ATOM 855 CA MET A 79 -4.109 -11.279 1.021 1.00 0.00 C ATOM 856 C MET A 79 -4.690 -10.250 -0.012 1.00 0.00 C ATOM 857 O MET A 79 -4.247 -9.097 0.036 1.00 0.00 O ATOM 858 CB MET A 79 -3.012 -12.214 0.415 1.00 0.00 C ATOM 859 CG MET A 79 -1.948 -12.806 1.366 1.00 0.00 C ATOM 860 SD MET A 79 -0.699 -13.679 0.394 1.00 0.00 S ATOM 861 CE MET A 79 0.270 -14.496 1.683 1.00 0.00 C ATOM 0 H MET A 79 -5.155 -13.088 1.349 1.00 0.00 H new ATOM 0 HA MET A 79 -3.647 -10.649 1.781 1.00 0.00 H new ATOM 0 HB2 MET A 79 -3.518 -13.045 -0.077 1.00 0.00 H new ATOM 0 HB3 MET A 79 -2.490 -11.655 -0.361 1.00 0.00 H new ATOM 0 HG2 MET A 79 -1.482 -12.011 1.949 1.00 0.00 H new ATOM 0 HG3 MET A 79 -2.417 -13.489 2.075 1.00 0.00 H new ATOM 0 HE1 MET A 79 1.268 -14.717 1.303 1.00 0.00 H new ATOM 0 HE2 MET A 79 0.349 -13.840 2.550 1.00 0.00 H new ATOM 0 HE3 MET A 79 -0.221 -15.424 1.974 1.00 0.00 H new ATOM 871 N SER A 80 -5.656 -10.635 -0.889 1.00 0.00 N ATOM 872 CA SER A 80 -6.427 -9.675 -1.734 1.00 0.00 C ATOM 873 C SER A 80 -7.381 -8.686 -0.980 1.00 0.00 C ATOM 874 O SER A 80 -7.698 -7.645 -1.563 1.00 0.00 O ATOM 875 CB SER A 80 -7.211 -10.479 -2.784 1.00 0.00 C ATOM 876 OG SER A 80 -6.320 -11.196 -3.629 1.00 0.00 O ATOM 0 H SER A 80 -5.922 -11.609 -1.031 1.00 0.00 H new ATOM 0 HA SER A 80 -5.684 -9.015 -2.183 1.00 0.00 H new ATOM 0 HB2 SER A 80 -7.889 -11.173 -2.287 1.00 0.00 H new ATOM 0 HB3 SER A 80 -7.826 -9.806 -3.381 1.00 0.00 H new ATOM 0 HG SER A 80 -6.284 -12.133 -3.346 1.00 0.00 H new ATOM 882 N ASP A 81 -7.793 -8.986 0.281 1.00 0.00 N ATOM 883 CA ASP A 81 -8.519 -8.052 1.191 1.00 0.00 C ATOM 884 C ASP A 81 -7.621 -6.938 1.803 1.00 0.00 C ATOM 885 O ASP A 81 -8.022 -5.773 1.709 1.00 0.00 O ATOM 886 CB ASP A 81 -9.238 -8.862 2.312 1.00 0.00 C ATOM 887 CG ASP A 81 -10.482 -8.186 2.887 1.00 0.00 C ATOM 888 OD1 ASP A 81 -11.599 -8.449 2.139 1.00 0.00 O ATOM 889 OD2 ASP A 81 -10.468 -7.491 3.902 1.00 0.00 O ATOM 0 H ASP A 81 -7.628 -9.900 0.703 1.00 0.00 H new ATOM 0 HA ASP A 81 -9.253 -7.528 0.578 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -9.521 -9.836 1.913 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -8.531 -9.042 3.122 1.00 0.00 H new ATOM 894 N ILE A 82 -6.435 -7.274 2.390 1.00 0.00 N ATOM 895 CA ILE A 82 -5.448 -6.263 2.904 1.00 0.00 C ATOM 896 C ILE A 82 -4.835 -5.437 1.696 1.00 0.00 C ATOM 897 O ILE A 82 -4.691 -4.227 1.876 1.00 0.00 O ATOM 898 CB ILE A 82 -4.409 -6.965 3.889 1.00 0.00 C ATOM 899 CG1 ILE A 82 -5.054 -7.600 5.204 1.00 0.00 C ATOM 900 CG2 ILE A 82 -3.256 -5.989 4.293 1.00 0.00 C ATOM 901 CD1 ILE A 82 -4.347 -8.817 5.861 1.00 0.00 C ATOM 0 H ILE A 82 -6.134 -8.240 2.521 1.00 0.00 H new ATOM 0 HA ILE A 82 -5.934 -5.509 3.523 1.00 0.00 H new ATOM 0 HB ILE A 82 -4.011 -7.798 3.309 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.123 -6.812 5.954 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -6.074 -7.900 4.962 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -2.566 -6.499 4.965 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -2.721 -5.668 3.399 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -3.676 -5.119 4.797 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -4.907 -9.131 6.742 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -4.302 -9.640 5.148 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -3.336 -8.535 6.155 1.00 0.00 H new ATOM 913 N LYS A 83 -4.517 -6.042 0.526 1.00 0.00 N ATOM 914 CA LYS A 83 -4.149 -5.327 -0.728 1.00 0.00 C ATOM 915 C LYS A 83 -5.257 -4.317 -1.236 1.00 0.00 C ATOM 916 O LYS A 83 -4.908 -3.147 -1.432 1.00 0.00 O ATOM 917 CB LYS A 83 -3.793 -6.482 -1.714 1.00 0.00 C ATOM 918 CG LYS A 83 -3.194 -6.133 -3.101 1.00 0.00 C ATOM 919 CD LYS A 83 -3.420 -7.263 -4.133 1.00 0.00 C ATOM 920 CE LYS A 83 -2.777 -7.064 -5.521 1.00 0.00 C ATOM 921 NZ LYS A 83 -3.532 -6.150 -6.404 1.00 0.00 N ATOM 0 H LYS A 83 -4.508 -7.057 0.422 1.00 0.00 H new ATOM 0 HA LYS A 83 -3.308 -4.646 -0.598 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -3.087 -7.140 -1.208 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -4.701 -7.060 -1.885 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -3.645 -5.211 -3.469 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -2.125 -5.946 -2.997 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -3.039 -8.193 -3.710 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -4.494 -7.391 -4.269 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -1.767 -6.676 -5.391 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -2.685 -8.033 -6.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -3.041 -6.065 -7.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -4.488 -6.528 -6.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -3.598 -5.213 -5.958 1.00 0.00 H new ATOM 935 N LYS A 84 -6.540 -4.753 -1.400 1.00 0.00 N ATOM 936 CA LYS A 84 -7.666 -3.877 -1.856 1.00 0.00 C ATOM 937 C LYS A 84 -8.118 -2.803 -0.815 1.00 0.00 C ATOM 938 O LYS A 84 -8.289 -1.654 -1.242 1.00 0.00 O ATOM 939 CB LYS A 84 -8.877 -4.743 -2.353 1.00 0.00 C ATOM 940 CG LYS A 84 -8.803 -5.460 -3.720 1.00 0.00 C ATOM 941 CD LYS A 84 -9.026 -4.615 -5.000 1.00 0.00 C ATOM 942 CE LYS A 84 -8.881 -5.416 -6.301 1.00 0.00 C ATOM 943 NZ LYS A 84 -9.108 -4.544 -7.464 1.00 0.00 N ATOM 0 H LYS A 84 -6.824 -5.716 -1.221 1.00 0.00 H new ATOM 0 HA LYS A 84 -7.270 -3.302 -2.693 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -9.063 -5.505 -1.596 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -9.753 -4.094 -2.374 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -7.823 -5.930 -3.797 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -9.542 -6.262 -3.717 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -10.022 -4.174 -4.964 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -8.313 -3.791 -5.010 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -7.885 -5.856 -6.356 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -9.595 -6.240 -6.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -9.007 -5.098 -8.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -10.067 -4.144 -7.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -8.411 -3.772 -7.461 1.00 0.00 H new ATOM 957 N THR A 85 -8.255 -3.124 0.508 1.00 0.00 N ATOM 958 CA THR A 85 -8.547 -2.126 1.577 1.00 0.00 C ATOM 959 C THR A 85 -7.296 -1.206 1.821 1.00 0.00 C ATOM 960 O THR A 85 -7.478 -0.018 1.539 1.00 0.00 O ATOM 961 CB THR A 85 -9.111 -2.848 2.850 1.00 0.00 C ATOM 962 OG1 THR A 85 -10.121 -3.786 2.490 1.00 0.00 O ATOM 963 CG2 THR A 85 -9.757 -1.916 3.897 1.00 0.00 C ATOM 0 H THR A 85 -8.166 -4.078 0.858 1.00 0.00 H new ATOM 0 HA THR A 85 -9.338 -1.445 1.264 1.00 0.00 H new ATOM 0 HB THR A 85 -8.230 -3.313 3.293 1.00 0.00 H new ATOM 0 HG1 THR A 85 -9.701 -4.610 2.166 1.00 0.00 H new ATOM 0 HG21 THR A 85 -10.116 -2.508 4.739 1.00 0.00 H new ATOM 0 HG22 THR A 85 -9.018 -1.196 4.249 1.00 0.00 H new ATOM 0 HG23 THR A 85 -10.594 -1.384 3.444 1.00 0.00 H new ATOM 971 N ALA A 86 -6.076 -1.691 2.226 1.00 0.00 N ATOM 972 CA ALA A 86 -4.872 -0.810 2.417 1.00 0.00 C ATOM 973 C ALA A 86 -4.521 0.115 1.224 1.00 0.00 C ATOM 974 O ALA A 86 -4.151 1.242 1.514 1.00 0.00 O ATOM 975 CB ALA A 86 -3.585 -1.558 2.802 1.00 0.00 C ATOM 0 H ALA A 86 -5.902 -2.676 2.424 1.00 0.00 H new ATOM 0 HA ALA A 86 -5.212 -0.196 3.251 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -2.770 -0.844 2.919 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -3.740 -2.089 3.742 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -3.332 -2.273 2.019 1.00 0.00 H new ATOM 981 N ASN A 87 -4.693 -0.318 -0.045 1.00 0.00 N ATOM 982 CA ASN A 87 -4.575 0.554 -1.252 1.00 0.00 C ATOM 983 C ASN A 87 -5.699 1.620 -1.418 1.00 0.00 C ATOM 984 O ASN A 87 -5.339 2.740 -1.788 1.00 0.00 O ATOM 985 CB ASN A 87 -4.430 -0.317 -2.535 1.00 0.00 C ATOM 986 CG ASN A 87 -3.131 -1.137 -2.719 1.00 0.00 C ATOM 987 OD1 ASN A 87 -2.191 -1.114 -1.923 1.00 0.00 O ATOM 988 ND2 ASN A 87 -3.069 -1.895 -3.801 1.00 0.00 N ATOM 0 H ASN A 87 -4.919 -1.287 -0.270 1.00 0.00 H new ATOM 0 HA ASN A 87 -3.670 1.141 -1.096 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -5.269 -1.012 -2.562 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -4.533 0.341 -3.398 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -2.241 -2.463 -3.979 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -3.849 -1.911 -4.458 1.00 0.00 H new ATOM 995 N LYS A 88 -6.998 1.333 -1.130 1.00 0.00 N ATOM 996 CA LYS A 88 -8.076 2.378 -1.043 1.00 0.00 C ATOM 997 C LYS A 88 -7.778 3.562 -0.027 1.00 0.00 C ATOM 998 O LYS A 88 -8.091 4.716 -0.332 1.00 0.00 O ATOM 999 CB LYS A 88 -9.401 1.614 -0.740 1.00 0.00 C ATOM 1000 CG LYS A 88 -10.738 2.325 -0.992 1.00 0.00 C ATOM 1001 CD LYS A 88 -11.961 1.535 -0.578 1.00 0.00 C ATOM 1002 CE LYS A 88 -13.320 2.204 -0.806 1.00 0.00 C ATOM 1003 NZ LYS A 88 -14.395 1.321 -0.329 1.00 0.00 N ATOM 0 H LYS A 88 -7.332 0.386 -0.952 1.00 0.00 H new ATOM 0 HA LYS A 88 -8.143 2.914 -1.990 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -9.397 0.699 -1.332 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -9.378 1.316 0.308 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -10.736 3.274 -0.456 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -10.815 2.559 -2.054 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -11.953 0.588 -1.117 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -11.871 1.299 0.482 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -13.359 3.158 -0.279 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -13.457 2.419 -1.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -15.316 1.779 -0.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -14.362 0.422 -0.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -14.268 1.137 0.687 1.00 0.00 H new ATOM 1017 N VAL A 89 -7.187 3.226 1.140 1.00 0.00 N ATOM 1018 CA VAL A 89 -6.847 4.148 2.272 1.00 0.00 C ATOM 1019 C VAL A 89 -5.394 4.773 2.164 1.00 0.00 C ATOM 1020 O VAL A 89 -5.291 6.005 2.231 1.00 0.00 O ATOM 1021 CB VAL A 89 -7.221 3.402 3.626 1.00 0.00 C ATOM 1022 CG1 VAL A 89 -6.480 2.084 3.946 1.00 0.00 C ATOM 1023 CG2 VAL A 89 -7.247 4.317 4.868 1.00 0.00 C ATOM 0 H VAL A 89 -6.917 2.263 1.339 1.00 0.00 H new ATOM 0 HA VAL A 89 -7.446 5.058 2.235 1.00 0.00 H new ATOM 0 HB VAL A 89 -8.241 3.096 3.391 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -6.836 1.688 4.897 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -6.672 1.358 3.156 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -5.409 2.275 4.011 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -7.510 3.729 5.747 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -6.263 4.764 5.011 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -7.986 5.105 4.724 1.00 0.00 H new ATOM 1033 N ARG A 90 -4.306 3.973 2.003 1.00 0.00 N ATOM 1034 CA ARG A 90 -2.884 4.470 1.837 1.00 0.00 C ATOM 1035 C ARG A 90 -2.717 5.435 0.584 1.00 0.00 C ATOM 1036 O ARG A 90 -2.163 6.534 0.721 1.00 0.00 O ATOM 1037 CB ARG A 90 -1.922 3.230 1.952 1.00 0.00 C ATOM 1038 CG ARG A 90 -1.519 2.473 0.700 1.00 0.00 C ATOM 1039 CD ARG A 90 -0.738 1.164 0.880 1.00 0.00 C ATOM 1040 NE ARG A 90 -0.358 0.612 -0.444 1.00 0.00 N ATOM 1041 CZ ARG A 90 0.563 -0.356 -0.686 1.00 0.00 C ATOM 1042 NH1 ARG A 90 1.300 -0.994 0.235 1.00 0.00 N ATOM 1043 NH2 ARG A 90 0.750 -0.702 -1.947 1.00 0.00 N ATOM 0 H ARG A 90 -4.376 2.956 1.983 1.00 0.00 H new ATOM 0 HA ARG A 90 -2.589 5.146 2.640 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -1.006 3.572 2.435 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -2.391 2.515 2.628 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -2.425 2.249 0.137 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -0.918 3.141 0.083 1.00 0.00 H new ATOM 0 HD2 ARG A 90 0.155 1.344 1.478 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -1.345 0.441 1.424 1.00 0.00 H new ATOM 0 HE ARG A 90 -0.838 1.000 -1.256 1.00 0.00 H new ATOM 0 HH11 ARG A 90 1.193 -0.764 1.223 1.00 0.00 H new ATOM 0 HH12 ARG A 90 1.968 -1.710 -0.052 1.00 0.00 H new ATOM 0 HH21 ARG A 90 0.214 -0.247 -2.686 1.00 0.00 H new ATOM 0 HH22 ARG A 90 1.431 -1.424 -2.182 1.00 0.00 H new ATOM 1057 N SER A 91 -3.277 5.040 -0.591 1.00 0.00 N ATOM 1058 CA SER A 91 -3.430 5.947 -1.774 1.00 0.00 C ATOM 1059 C SER A 91 -4.305 7.226 -1.532 1.00 0.00 C ATOM 1060 O SER A 91 -4.172 8.171 -2.317 1.00 0.00 O ATOM 1061 CB SER A 91 -3.969 5.180 -2.984 1.00 0.00 C ATOM 1062 OG SER A 91 -3.855 5.972 -4.159 1.00 0.00 O ATOM 0 H SER A 91 -3.633 4.097 -0.750 1.00 0.00 H new ATOM 0 HA SER A 91 -2.420 6.311 -1.965 1.00 0.00 H new ATOM 0 HB2 SER A 91 -3.416 4.249 -3.109 1.00 0.00 H new ATOM 0 HB3 SER A 91 -5.012 4.911 -2.818 1.00 0.00 H new ATOM 0 HG SER A 91 -3.764 6.915 -3.910 1.00 0.00 H new ATOM 1068 N LYS A 92 -5.163 7.248 -0.468 1.00 0.00 N ATOM 1069 CA LYS A 92 -5.855 8.477 0.023 1.00 0.00 C ATOM 1070 C LYS A 92 -4.850 9.417 0.756 1.00 0.00 C ATOM 1071 O LYS A 92 -4.972 10.636 0.599 1.00 0.00 O ATOM 1072 CB LYS A 92 -7.096 8.089 0.904 1.00 0.00 C ATOM 1073 CG LYS A 92 -8.370 8.970 0.789 1.00 0.00 C ATOM 1074 CD LYS A 92 -9.271 8.659 -0.434 1.00 0.00 C ATOM 1075 CE LYS A 92 -10.530 9.530 -0.519 1.00 0.00 C ATOM 1076 NZ LYS A 92 -11.315 9.166 -1.708 1.00 0.00 N ATOM 0 H LYS A 92 -5.393 6.414 0.072 1.00 0.00 H new ATOM 0 HA LYS A 92 -6.239 9.042 -0.826 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -7.374 7.064 0.658 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -6.780 8.092 1.947 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -8.961 8.849 1.697 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -8.068 10.016 0.742 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -8.688 8.792 -1.345 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -9.569 7.611 -0.396 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -11.134 9.399 0.379 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -10.251 10.583 -0.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -12.166 9.761 -1.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -10.740 9.313 -2.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -11.595 8.166 -1.647 1.00 0.00 H new ATOM 1090 N LEU A 93 -3.852 8.841 1.488 1.00 0.00 N ATOM 1091 CA LEU A 93 -2.672 9.584 2.018 1.00 0.00 C ATOM 1092 C LEU A 93 -1.804 10.237 0.879 1.00 0.00 C ATOM 1093 O LEU A 93 -1.321 11.338 1.121 1.00 0.00 O ATOM 1094 CB LEU A 93 -1.700 8.742 2.873 1.00 0.00 C ATOM 1095 CG LEU A 93 -2.142 7.796 4.035 1.00 0.00 C ATOM 1096 CD1 LEU A 93 -0.924 6.954 4.431 1.00 0.00 C ATOM 1097 CD2 LEU A 93 -2.733 8.460 5.297 1.00 0.00 C ATOM 0 H LEU A 93 -3.844 7.849 1.726 1.00 0.00 H new ATOM 0 HA LEU A 93 -3.141 10.339 2.649 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -1.141 8.121 2.173 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -0.992 9.447 3.309 1.00 0.00 H new ATOM 0 HG LEU A 93 -2.973 7.214 3.638 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -1.196 6.279 5.243 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -0.589 6.372 3.572 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -0.119 7.611 4.760 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -2.997 7.691 6.023 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -1.995 9.133 5.734 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -3.625 9.026 5.027 1.00 0.00 H new ATOM 1109 N LYS A 94 -1.605 9.573 -0.304 1.00 0.00 N ATOM 1110 CA LYS A 94 -0.892 10.174 -1.479 1.00 0.00 C ATOM 1111 C LYS A 94 -1.452 11.514 -2.008 1.00 0.00 C ATOM 1112 O LYS A 94 -0.631 12.263 -2.534 1.00 0.00 O ATOM 1113 CB LYS A 94 -0.755 9.149 -2.655 1.00 0.00 C ATOM 1114 CG LYS A 94 0.454 8.174 -2.596 1.00 0.00 C ATOM 1115 CD LYS A 94 1.802 8.702 -3.150 1.00 0.00 C ATOM 1116 CE LYS A 94 2.943 7.676 -3.090 1.00 0.00 C ATOM 1117 NZ LYS A 94 4.181 8.257 -3.634 1.00 0.00 N ATOM 0 H LYS A 94 -1.929 8.620 -0.468 1.00 0.00 H new ATOM 0 HA LYS A 94 0.089 10.420 -1.074 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -1.668 8.556 -2.697 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -0.695 9.709 -3.588 1.00 0.00 H new ATOM 0 HG2 LYS A 94 0.605 7.881 -1.557 1.00 0.00 H new ATOM 0 HG3 LYS A 94 0.190 7.271 -3.147 1.00 0.00 H new ATOM 0 HD2 LYS A 94 1.661 9.014 -4.185 1.00 0.00 H new ATOM 0 HD3 LYS A 94 2.093 9.588 -2.586 1.00 0.00 H new ATOM 0 HE2 LYS A 94 3.104 7.360 -2.059 1.00 0.00 H new ATOM 0 HE3 LYS A 94 2.671 6.786 -3.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 4.884 7.504 -3.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 3.978 8.718 -4.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 4.557 8.960 -2.966 1.00 0.00 H new ATOM 1131 N SER A 95 -2.764 11.813 -1.884 1.00 0.00 N ATOM 1132 CA SER A 95 -3.277 13.202 -2.140 1.00 0.00 C ATOM 1133 C SER A 95 -2.840 14.270 -1.072 1.00 0.00 C ATOM 1134 O SER A 95 -2.776 15.459 -1.398 1.00 0.00 O ATOM 1135 CB SER A 95 -4.803 13.157 -2.277 1.00 0.00 C ATOM 1136 OG SER A 95 -5.306 14.429 -2.664 1.00 0.00 O ATOM 0 H SER A 95 -3.481 11.139 -1.616 1.00 0.00 H new ATOM 0 HA SER A 95 -2.817 13.538 -3.069 1.00 0.00 H new ATOM 0 HB2 SER A 95 -5.086 12.407 -3.016 1.00 0.00 H new ATOM 0 HB3 SER A 95 -5.250 12.855 -1.330 1.00 0.00 H new ATOM 0 HG SER A 95 -6.281 14.383 -2.749 1.00 0.00 H new ATOM 1142 N ILE A 96 -2.509 13.809 0.153 1.00 0.00 N ATOM 1143 CA ILE A 96 -1.864 14.589 1.261 1.00 0.00 C ATOM 1144 C ILE A 96 -0.305 14.671 1.017 1.00 0.00 C ATOM 1145 O ILE A 96 0.228 15.783 1.079 1.00 0.00 O ATOM 1146 CB ILE A 96 -2.309 13.959 2.678 1.00 0.00 C ATOM 1147 CG1 ILE A 96 -3.821 13.543 2.918 1.00 0.00 C ATOM 1148 CG2 ILE A 96 -1.843 14.832 3.889 1.00 0.00 C ATOM 1149 CD1 ILE A 96 -4.996 14.495 2.643 1.00 0.00 C ATOM 0 H ILE A 96 -2.687 12.841 0.421 1.00 0.00 H new ATOM 0 HA ILE A 96 -2.203 15.625 1.278 1.00 0.00 H new ATOM 0 HB ILE A 96 -1.783 13.007 2.612 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -3.997 12.650 2.318 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.900 13.245 3.964 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -2.167 14.366 4.820 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -0.756 14.913 3.882 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -2.281 15.827 3.810 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.934 13.993 2.880 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -4.895 15.386 3.262 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -4.994 14.782 1.591 1.00 0.00 H new ATOM 1161 N GLU A 97 0.384 13.534 0.742 1.00 0.00 N ATOM 1162 CA GLU A 97 1.812 13.465 0.301 1.00 0.00 C ATOM 1163 C GLU A 97 2.157 14.264 -0.995 1.00 0.00 C ATOM 1164 O GLU A 97 3.222 14.873 -1.024 1.00 0.00 O ATOM 1165 CB GLU A 97 2.222 11.959 0.156 1.00 0.00 C ATOM 1166 CG GLU A 97 3.679 11.614 0.526 1.00 0.00 C ATOM 1167 CD GLU A 97 3.978 10.132 0.348 1.00 0.00 C ATOM 1168 OE1 GLU A 97 4.135 9.796 -0.971 1.00 0.00 O ATOM 1169 OE2 GLU A 97 4.064 9.340 1.285 1.00 0.00 O ATOM 0 H GLU A 97 -0.045 12.612 0.821 1.00 0.00 H new ATOM 0 HA GLU A 97 2.395 13.962 1.076 1.00 0.00 H new ATOM 0 HB2 GLU A 97 1.559 11.361 0.781 1.00 0.00 H new ATOM 0 HB3 GLU A 97 2.049 11.654 -0.876 1.00 0.00 H new ATOM 0 HG2 GLU A 97 4.358 12.198 -0.095 1.00 0.00 H new ATOM 0 HG3 GLU A 97 3.868 11.900 1.561 1.00 0.00 H new ATOM 1176 N GLN A 98 1.256 14.268 -2.002 1.00 0.00 N ATOM 1177 CA GLN A 98 1.321 15.147 -3.215 1.00 0.00 C ATOM 1178 C GLN A 98 1.379 16.689 -2.947 1.00 0.00 C ATOM 1179 O GLN A 98 2.108 17.359 -3.688 1.00 0.00 O ATOM 1180 CB GLN A 98 0.137 14.801 -4.180 1.00 0.00 C ATOM 1181 CG GLN A 98 0.321 13.571 -5.110 1.00 0.00 C ATOM 1182 CD GLN A 98 -0.971 13.131 -5.817 1.00 0.00 C ATOM 1183 OE1 GLN A 98 -1.260 13.567 -6.930 1.00 0.00 O ATOM 1184 NE2 GLN A 98 -1.760 12.254 -5.203 1.00 0.00 N ATOM 0 H GLN A 98 0.443 13.652 -2.005 1.00 0.00 H new ATOM 0 HA GLN A 98 2.284 14.923 -3.675 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -0.756 14.638 -3.576 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -0.056 15.673 -4.805 1.00 0.00 H new ATOM 0 HG2 GLN A 98 1.074 13.805 -5.862 1.00 0.00 H new ATOM 0 HG3 GLN A 98 0.705 12.737 -4.523 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -1.508 11.900 -4.280 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -2.617 11.935 -5.655 1.00 0.00 H new ATOM 1193 N SER A 99 0.646 17.219 -1.935 1.00 0.00 N ATOM 1194 CA SER A 99 0.755 18.663 -1.528 1.00 0.00 C ATOM 1195 C SER A 99 2.044 19.102 -0.785 1.00 0.00 C ATOM 1196 O SER A 99 2.444 20.260 -0.933 1.00 0.00 O ATOM 1197 CB SER A 99 -0.479 19.076 -0.692 1.00 0.00 C ATOM 1198 OG SER A 99 -0.639 20.484 -0.753 1.00 0.00 O ATOM 0 H SER A 99 -0.024 16.682 -1.384 1.00 0.00 H new ATOM 0 HA SER A 99 0.805 19.186 -2.483 1.00 0.00 H new ATOM 0 HB2 SER A 99 -1.372 18.581 -1.072 1.00 0.00 H new ATOM 0 HB3 SER A 99 -0.354 18.758 0.343 1.00 0.00 H new ATOM 0 HG SER A 99 -1.421 20.747 -0.225 1.00 0.00 H new ATOM 1371 N ALA A 111 1.429 28.624 9.114 1.00 0.00 N ATOM 1372 CA ALA A 111 0.891 27.585 10.000 1.00 0.00 C ATOM 1373 C ALA A 111 -0.216 26.939 9.068 1.00 0.00 C ATOM 1374 O ALA A 111 -0.228 27.144 7.845 1.00 0.00 O ATOM 1375 CB ALA A 111 0.487 28.311 11.307 1.00 0.00 C ATOM 0 HA ALA A 111 1.517 26.772 10.368 1.00 0.00 H new ATOM 0 HB1 ALA A 111 0.077 27.589 12.013 1.00 0.00 H new ATOM 0 HB2 ALA A 111 1.364 28.788 11.745 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -0.265 29.069 11.085 1.00 0.00 H new ATOM 1381 N ASP A 112 -1.165 26.156 9.632 1.00 0.00 N ATOM 1382 CA ASP A 112 -2.287 25.365 8.953 1.00 0.00 C ATOM 1383 C ASP A 112 -1.800 24.173 8.056 1.00 0.00 C ATOM 1384 O ASP A 112 -2.400 23.099 8.012 1.00 0.00 O ATOM 1385 CB ASP A 112 -3.272 26.304 8.177 1.00 0.00 C ATOM 1386 CG ASP A 112 -4.697 25.790 8.022 1.00 0.00 C ATOM 1387 OD1 ASP A 112 -5.497 25.733 8.955 1.00 0.00 O ATOM 1388 OD2 ASP A 112 -4.971 25.415 6.733 1.00 0.00 O ATOM 0 H ASP A 112 -1.193 26.033 10.644 1.00 0.00 H new ATOM 0 HA ASP A 112 -2.832 24.897 9.773 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -3.307 27.265 8.690 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -2.862 26.487 7.184 1.00 0.00 H new ATOM 1393 N LEU A 113 -0.686 24.459 7.397 1.00 0.00 N ATOM 1394 CA LEU A 113 0.218 23.546 6.638 1.00 0.00 C ATOM 1395 C LEU A 113 0.965 22.512 7.550 1.00 0.00 C ATOM 1396 O LEU A 113 1.271 21.406 7.095 1.00 0.00 O ATOM 1397 CB LEU A 113 1.173 24.533 5.854 1.00 0.00 C ATOM 1398 CG LEU A 113 2.288 23.998 4.880 1.00 0.00 C ATOM 1399 CD1 LEU A 113 2.712 25.060 3.834 1.00 0.00 C ATOM 1400 CD2 LEU A 113 3.568 23.443 5.576 1.00 0.00 C ATOM 0 H LEU A 113 -0.343 25.419 7.365 1.00 0.00 H new ATOM 0 HA LEU A 113 -0.324 22.888 5.959 1.00 0.00 H new ATOM 0 HB2 LEU A 113 0.534 25.196 5.270 1.00 0.00 H new ATOM 0 HB3 LEU A 113 1.674 25.149 6.601 1.00 0.00 H new ATOM 0 HG LEU A 113 1.802 23.155 4.389 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.483 24.644 3.185 1.00 0.00 H new ATOM 0 HD12 LEU A 113 1.848 25.345 3.234 1.00 0.00 H new ATOM 0 HD13 LEU A 113 3.104 25.939 4.346 1.00 0.00 H new ATOM 0 HD21 LEU A 113 4.274 23.100 4.820 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.029 24.231 6.171 1.00 0.00 H new ATOM 0 HD23 LEU A 113 3.297 22.610 6.224 1.00 0.00 H new ATOM 1412 N ARG A 114 1.312 22.955 8.767 1.00 0.00 N ATOM 1413 CA ARG A 114 2.205 22.261 9.733 1.00 0.00 C ATOM 1414 C ARG A 114 1.377 21.285 10.619 1.00 0.00 C ATOM 1415 O ARG A 114 1.865 20.211 10.980 1.00 0.00 O ATOM 1416 CB ARG A 114 3.013 23.360 10.486 1.00 0.00 C ATOM 1417 CG ARG A 114 3.958 24.292 9.626 1.00 0.00 C ATOM 1418 CD ARG A 114 5.451 24.352 9.987 1.00 0.00 C ATOM 1419 NE ARG A 114 6.209 23.169 9.495 1.00 0.00 N ATOM 1420 CZ ARG A 114 7.558 23.051 9.402 1.00 0.00 C ATOM 1421 NH1 ARG A 114 8.458 23.986 9.739 1.00 0.00 N ATOM 1422 NH2 ARG A 114 8.028 21.908 8.936 1.00 0.00 N ATOM 0 H ARG A 114 0.968 23.844 9.130 1.00 0.00 H new ATOM 0 HA ARG A 114 2.937 21.611 9.253 1.00 0.00 H new ATOM 0 HB2 ARG A 114 2.303 23.997 11.014 1.00 0.00 H new ATOM 0 HB3 ARG A 114 3.624 22.868 11.243 1.00 0.00 H new ATOM 0 HG2 ARG A 114 3.880 23.974 8.586 1.00 0.00 H new ATOM 0 HG3 ARG A 114 3.562 25.306 9.680 1.00 0.00 H new ATOM 0 HD2 ARG A 114 5.886 25.258 9.566 1.00 0.00 H new ATOM 0 HD3 ARG A 114 5.556 24.421 11.070 1.00 0.00 H new ATOM 0 HE ARG A 114 5.658 22.364 9.197 1.00 0.00 H new ATOM 0 HH11 ARG A 114 8.146 24.886 10.104 1.00 0.00 H new ATOM 0 HH12 ARG A 114 9.454 23.797 9.630 1.00 0.00 H new ATOM 0 HH21 ARG A 114 7.384 21.164 8.666 1.00 0.00 H new ATOM 0 HH22 ARG A 114 9.035 21.769 8.847 1.00 0.00 H new ATOM 1436 N ILE A 115 0.107 21.665 10.889 1.00 0.00 N ATOM 1437 CA ILE A 115 -0.997 20.840 11.489 1.00 0.00 C ATOM 1438 C ILE A 115 -1.258 19.547 10.589 1.00 0.00 C ATOM 1439 O ILE A 115 -1.324 18.449 11.149 1.00 0.00 O ATOM 1440 CB ILE A 115 -2.222 21.864 11.719 1.00 0.00 C ATOM 1441 CG1 ILE A 115 -2.012 22.865 12.940 1.00 0.00 C ATOM 1442 CG2 ILE A 115 -3.604 21.159 11.870 1.00 0.00 C ATOM 1443 CD1 ILE A 115 -2.728 24.240 12.908 1.00 0.00 C ATOM 0 H ILE A 115 -0.207 22.614 10.685 1.00 0.00 H new ATOM 0 HA ILE A 115 -0.774 20.397 12.460 1.00 0.00 H new ATOM 0 HB ILE A 115 -2.228 22.449 10.799 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -2.327 22.350 13.848 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -0.942 23.052 13.034 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -4.380 21.909 12.022 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -3.822 20.588 10.967 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -3.577 20.486 12.727 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -2.482 24.800 13.810 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -2.400 24.801 12.032 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -3.806 24.088 12.859 1.00 0.00 H new ATOM 1455 N ARG A 116 -1.403 19.705 9.245 1.00 0.00 N ATOM 1456 CA ARG A 116 -1.551 18.590 8.241 1.00 0.00 C ATOM 1457 C ARG A 116 -0.362 17.564 8.247 1.00 0.00 C ATOM 1458 O ARG A 116 -0.626 16.358 8.260 1.00 0.00 O ATOM 1459 CB ARG A 116 -1.810 19.150 6.802 1.00 0.00 C ATOM 1460 CG ARG A 116 -3.078 20.021 6.600 1.00 0.00 C ATOM 1461 CD ARG A 116 -3.399 20.513 5.182 1.00 0.00 C ATOM 1462 NE ARG A 116 -2.535 21.639 4.725 1.00 0.00 N ATOM 1463 CZ ARG A 116 -2.337 22.042 3.444 1.00 0.00 C ATOM 1464 NH1 ARG A 116 -2.888 21.494 2.351 1.00 0.00 N ATOM 1465 NH2 ARG A 116 -1.528 23.068 3.257 1.00 0.00 N ATOM 0 H ARG A 116 -1.422 20.627 8.810 1.00 0.00 H new ATOM 0 HA ARG A 116 -2.428 18.026 8.558 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -0.943 19.742 6.508 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -1.867 18.305 6.115 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -3.935 19.450 6.957 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -2.988 20.896 7.244 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -3.293 19.681 4.486 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -4.441 20.829 5.145 1.00 0.00 H new ATOM 0 HE ARG A 116 -2.042 22.160 5.450 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -3.521 20.699 2.443 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -2.675 21.872 1.428 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -1.084 23.520 4.057 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -1.347 23.409 2.313 1.00 0.00 H new ATOM 1479 N LYS A 117 0.902 18.056 8.294 1.00 0.00 N ATOM 1480 CA LYS A 117 2.137 17.256 8.546 1.00 0.00 C ATOM 1481 C LYS A 117 2.196 16.546 9.947 1.00 0.00 C ATOM 1482 O LYS A 117 2.741 15.438 10.001 1.00 0.00 O ATOM 1483 CB LYS A 117 3.372 18.204 8.372 1.00 0.00 C ATOM 1484 CG LYS A 117 3.907 18.431 6.935 1.00 0.00 C ATOM 1485 CD LYS A 117 5.095 19.419 6.778 1.00 0.00 C ATOM 1486 CE LYS A 117 6.530 18.901 7.036 1.00 0.00 C ATOM 1487 NZ LYS A 117 6.852 18.808 8.473 1.00 0.00 N ATOM 0 H LYS A 117 1.100 19.047 8.154 1.00 0.00 H new ATOM 0 HA LYS A 117 2.139 16.441 7.823 1.00 0.00 H new ATOM 0 HB2 LYS A 117 3.111 19.176 8.790 1.00 0.00 H new ATOM 0 HB3 LYS A 117 4.188 17.806 8.975 1.00 0.00 H new ATOM 0 HG2 LYS A 117 4.212 17.466 6.530 1.00 0.00 H new ATOM 0 HG3 LYS A 117 3.083 18.790 6.318 1.00 0.00 H new ATOM 0 HD2 LYS A 117 5.064 19.815 5.763 1.00 0.00 H new ATOM 0 HD3 LYS A 117 4.920 20.257 7.453 1.00 0.00 H new ATOM 0 HE2 LYS A 117 6.645 17.919 6.578 1.00 0.00 H new ATOM 0 HE3 LYS A 117 7.245 19.565 6.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 7.868 18.978 8.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 6.306 19.521 8.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 6.608 17.859 8.823 1.00 0.00 H new ATOM 1501 N THR A 118 1.641 17.157 11.027 1.00 0.00 N ATOM 1502 CA THR A 118 1.525 16.547 12.390 1.00 0.00 C ATOM 1503 C THR A 118 0.636 15.243 12.432 1.00 0.00 C ATOM 1504 O THR A 118 1.089 14.259 13.026 1.00 0.00 O ATOM 1505 CB THR A 118 1.102 17.706 13.359 1.00 0.00 C ATOM 1506 OG1 THR A 118 1.975 18.824 13.214 1.00 0.00 O ATOM 1507 CG2 THR A 118 1.103 17.413 14.866 1.00 0.00 C ATOM 0 H THR A 118 1.255 18.100 10.981 1.00 0.00 H new ATOM 0 HA THR A 118 2.480 16.142 12.726 1.00 0.00 H new ATOM 0 HB THR A 118 0.070 17.876 13.052 1.00 0.00 H new ATOM 0 HG1 THR A 118 1.693 19.362 12.445 1.00 0.00 H new ATOM 0 HG21 THR A 118 0.790 18.304 15.410 1.00 0.00 H new ATOM 0 HG22 THR A 118 0.412 16.597 15.078 1.00 0.00 H new ATOM 0 HG23 THR A 118 2.107 17.130 15.181 1.00 0.00 H new ATOM 1515 N GLN A 119 -0.564 15.257 11.812 1.00 0.00 N ATOM 1516 CA GLN A 119 -1.448 14.059 11.657 1.00 0.00 C ATOM 1517 C GLN A 119 -1.114 13.123 10.453 1.00 0.00 C ATOM 1518 O GLN A 119 -1.255 11.916 10.666 1.00 0.00 O ATOM 1519 CB GLN A 119 -2.942 14.493 11.687 1.00 0.00 C ATOM 1520 CG GLN A 119 -3.575 15.422 10.616 1.00 0.00 C ATOM 1521 CD GLN A 119 -5.018 15.786 10.994 1.00 0.00 C ATOM 1522 OE1 GLN A 119 -5.933 14.977 10.863 1.00 0.00 O ATOM 1523 NE2 GLN A 119 -5.252 16.992 11.487 1.00 0.00 N ATOM 0 H GLN A 119 -0.958 16.102 11.398 1.00 0.00 H new ATOM 0 HA GLN A 119 -1.241 13.422 12.517 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -3.531 13.576 11.687 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -3.104 14.976 12.650 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -2.980 16.330 10.518 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -3.563 14.927 9.645 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -4.486 17.657 11.592 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -6.198 17.256 11.762 1.00 0.00 H new ATOM 1532 N HIS A 120 -0.676 13.595 9.252 1.00 0.00 N ATOM 1533 CA HIS A 120 -0.141 12.724 8.156 1.00 0.00 C ATOM 1534 C HIS A 120 1.110 11.855 8.511 1.00 0.00 C ATOM 1535 O HIS A 120 1.154 10.723 8.024 1.00 0.00 O ATOM 1536 CB HIS A 120 0.092 13.618 6.903 1.00 0.00 C ATOM 1537 CG HIS A 120 0.513 12.962 5.571 1.00 0.00 C ATOM 1538 ND1 HIS A 120 1.626 13.392 4.855 1.00 0.00 N ATOM 1539 CD2 HIS A 120 -0.149 11.922 4.876 1.00 0.00 C ATOM 1540 CE1 HIS A 120 1.529 12.552 3.776 1.00 0.00 C ATOM 1541 NE2 HIS A 120 0.510 11.645 3.696 1.00 0.00 N ATOM 0 H HIS A 120 -0.682 14.587 9.013 1.00 0.00 H new ATOM 0 HA HIS A 120 -0.895 11.961 7.961 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -0.830 14.169 6.719 1.00 0.00 H new ATOM 0 HB3 HIS A 120 0.856 14.351 7.162 1.00 0.00 H new ATOM 0 HD1 HIS A 120 2.311 14.117 5.069 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -1.041 11.418 5.219 1.00 0.00 H new ATOM 0 HE1 HIS A 120 2.262 12.607 2.985 1.00 0.00 H new ATOM 1549 N SER A 121 2.072 12.359 9.324 1.00 0.00 N ATOM 1550 CA SER A 121 3.196 11.542 9.863 1.00 0.00 C ATOM 1551 C SER A 121 2.814 10.488 10.946 1.00 0.00 C ATOM 1552 O SER A 121 3.349 9.384 10.838 1.00 0.00 O ATOM 1553 CB SER A 121 4.315 12.479 10.350 1.00 0.00 C ATOM 1554 OG SER A 121 4.809 13.270 9.276 1.00 0.00 O ATOM 0 H SER A 121 2.094 13.334 9.624 1.00 0.00 H new ATOM 0 HA SER A 121 3.544 10.927 9.033 1.00 0.00 H new ATOM 0 HB2 SER A 121 3.936 13.126 11.141 1.00 0.00 H new ATOM 0 HB3 SER A 121 5.127 11.892 10.780 1.00 0.00 H new ATOM 0 HG SER A 121 4.308 14.111 9.232 1.00 0.00 H new ATOM 1560 N THR A 122 1.903 10.771 11.916 1.00 0.00 N ATOM 1561 CA THR A 122 1.321 9.756 12.853 1.00 0.00 C ATOM 1562 C THR A 122 0.357 8.731 12.133 1.00 0.00 C ATOM 1563 O THR A 122 0.483 7.538 12.424 1.00 0.00 O ATOM 1564 CB THR A 122 0.684 10.540 14.049 1.00 0.00 C ATOM 1565 OG1 THR A 122 1.594 11.513 14.559 1.00 0.00 O ATOM 1566 CG2 THR A 122 0.276 9.708 15.276 1.00 0.00 C ATOM 0 H THR A 122 1.546 11.713 12.075 1.00 0.00 H new ATOM 0 HA THR A 122 2.099 9.101 13.245 1.00 0.00 H new ATOM 0 HB THR A 122 -0.216 10.956 13.597 1.00 0.00 H new ATOM 0 HG1 THR A 122 1.454 12.366 14.097 1.00 0.00 H new ATOM 0 HG21 THR A 122 -0.152 10.364 16.034 1.00 0.00 H new ATOM 0 HG22 THR A 122 -0.463 8.963 14.981 1.00 0.00 H new ATOM 0 HG23 THR A 122 1.154 9.206 15.683 1.00 0.00 H new ATOM 1574 N LEU A 123 -0.544 9.171 11.211 1.00 0.00 N ATOM 1575 CA LEU A 123 -1.354 8.302 10.300 1.00 0.00 C ATOM 1576 C LEU A 123 -0.458 7.378 9.382 1.00 0.00 C ATOM 1577 O LEU A 123 -0.619 6.147 9.444 1.00 0.00 O ATOM 1578 CB LEU A 123 -2.338 9.210 9.468 1.00 0.00 C ATOM 1579 CG LEU A 123 -3.552 9.953 10.145 1.00 0.00 C ATOM 1580 CD1 LEU A 123 -4.010 11.189 9.327 1.00 0.00 C ATOM 1581 CD2 LEU A 123 -4.779 9.053 10.444 1.00 0.00 C ATOM 0 H LEU A 123 -0.734 10.164 11.075 1.00 0.00 H new ATOM 0 HA LEU A 123 -1.939 7.610 10.905 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -1.730 9.975 8.985 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -2.752 8.585 8.677 1.00 0.00 H new ATOM 0 HG LEU A 123 -3.154 10.274 11.107 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -4.848 11.669 9.832 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -3.184 11.896 9.243 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -4.319 10.872 8.331 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -5.564 9.650 10.909 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -5.152 8.625 9.513 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -4.485 8.250 11.120 1.00 0.00 H new ATOM 1593 N SER A 124 0.541 7.948 8.636 1.00 0.00 N ATOM 1594 CA SER A 124 1.541 7.160 7.869 1.00 0.00 C ATOM 1595 C SER A 124 2.437 6.211 8.756 1.00 0.00 C ATOM 1596 O SER A 124 2.621 5.066 8.340 1.00 0.00 O ATOM 1597 CB SER A 124 2.401 8.108 7.016 1.00 0.00 C ATOM 1598 OG SER A 124 3.261 7.360 6.166 1.00 0.00 O ATOM 0 H SER A 124 0.668 8.957 8.555 1.00 0.00 H new ATOM 0 HA SER A 124 0.980 6.486 7.222 1.00 0.00 H new ATOM 0 HB2 SER A 124 1.759 8.754 6.418 1.00 0.00 H new ATOM 0 HB3 SER A 124 2.992 8.756 7.663 1.00 0.00 H new ATOM 0 HG SER A 124 3.802 7.974 5.627 1.00 0.00 H new ATOM 1604 N ARG A 125 2.908 6.645 9.970 1.00 0.00 N ATOM 1605 CA ARG A 125 3.575 5.785 11.011 1.00 0.00 C ATOM 1606 C ARG A 125 2.739 4.517 11.424 1.00 0.00 C ATOM 1607 O ARG A 125 3.346 3.445 11.510 1.00 0.00 O ATOM 1608 CB ARG A 125 3.978 6.703 12.199 1.00 0.00 C ATOM 1609 CG ARG A 125 4.946 6.086 13.241 1.00 0.00 C ATOM 1610 CD ARG A 125 5.356 6.976 14.408 1.00 0.00 C ATOM 1611 NE ARG A 125 6.407 7.982 14.077 1.00 0.00 N ATOM 1612 CZ ARG A 125 6.756 9.064 14.818 1.00 0.00 C ATOM 1613 NH1 ARG A 125 6.214 9.427 15.990 1.00 0.00 N ATOM 1614 NH2 ARG A 125 7.719 9.831 14.340 1.00 0.00 N ATOM 0 H ARG A 125 2.834 7.620 10.259 1.00 0.00 H new ATOM 0 HA ARG A 125 4.475 5.337 10.589 1.00 0.00 H new ATOM 0 HB2 ARG A 125 4.438 7.605 11.795 1.00 0.00 H new ATOM 0 HB3 ARG A 125 3.070 7.013 12.716 1.00 0.00 H new ATOM 0 HG2 ARG A 125 4.481 5.187 13.646 1.00 0.00 H new ATOM 0 HG3 ARG A 125 5.850 5.771 12.720 1.00 0.00 H new ATOM 0 HD2 ARG A 125 4.474 7.499 14.778 1.00 0.00 H new ATOM 0 HD3 ARG A 125 5.717 6.345 15.221 1.00 0.00 H new ATOM 0 HE ARG A 125 6.915 7.842 13.204 1.00 0.00 H new ATOM 0 HH11 ARG A 125 5.467 8.868 16.401 1.00 0.00 H new ATOM 0 HH12 ARG A 125 6.549 10.262 16.470 1.00 0.00 H new ATOM 0 HH21 ARG A 125 8.163 9.598 13.452 1.00 0.00 H new ATOM 0 HH22 ARG A 125 8.018 10.657 14.859 1.00 0.00 H new ATOM 1628 N LYS A 126 1.401 4.640 11.635 1.00 0.00 N ATOM 1629 CA LYS A 126 0.478 3.471 11.799 1.00 0.00 C ATOM 1630 C LYS A 126 0.445 2.518 10.552 1.00 0.00 C ATOM 1631 O LYS A 126 0.340 1.307 10.777 1.00 0.00 O ATOM 1632 CB LYS A 126 -0.924 4.005 12.221 1.00 0.00 C ATOM 1633 CG LYS A 126 -1.877 2.988 12.902 1.00 0.00 C ATOM 1634 CD LYS A 126 -3.244 3.577 13.315 1.00 0.00 C ATOM 1635 CE LYS A 126 -4.181 2.552 13.973 1.00 0.00 C ATOM 1636 NZ LYS A 126 -5.456 3.186 14.342 1.00 0.00 N ATOM 0 H LYS A 126 0.929 5.542 11.697 1.00 0.00 H new ATOM 0 HA LYS A 126 0.859 2.826 12.591 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -0.779 4.844 12.901 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -1.421 4.396 11.333 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -2.045 2.153 12.222 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -1.386 2.584 13.787 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -3.080 4.404 14.006 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -3.733 3.991 12.433 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -4.364 1.724 13.288 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -3.706 2.132 14.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -6.079 2.481 14.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -5.277 3.961 15.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -5.915 3.565 13.489 1.00 0.00 H new ATOM 1650 N PHE A 127 0.573 3.039 9.301 1.00 0.00 N ATOM 1651 CA PHE A 127 0.797 2.203 8.090 1.00 0.00 C ATOM 1652 C PHE A 127 2.189 1.509 7.992 1.00 0.00 C ATOM 1653 O PHE A 127 2.196 0.377 7.515 1.00 0.00 O ATOM 1654 CB PHE A 127 0.510 3.046 6.819 1.00 0.00 C ATOM 1655 CG PHE A 127 -0.975 3.118 6.435 1.00 0.00 C ATOM 1656 CD1 PHE A 127 -1.555 2.133 5.636 1.00 0.00 C ATOM 1657 CD2 PHE A 127 -1.740 4.198 6.850 1.00 0.00 C ATOM 1658 CE1 PHE A 127 -2.867 2.252 5.237 1.00 0.00 C ATOM 1659 CE2 PHE A 127 -3.035 4.329 6.411 1.00 0.00 C ATOM 1660 CZ PHE A 127 -3.583 3.369 5.601 1.00 0.00 C ATOM 0 H PHE A 127 0.524 4.039 9.105 1.00 0.00 H new ATOM 0 HA PHE A 127 0.095 1.373 8.176 1.00 0.00 H new ATOM 0 HB2 PHE A 127 0.883 4.058 6.976 1.00 0.00 H new ATOM 0 HB3 PHE A 127 1.070 2.626 5.984 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -0.974 1.276 5.330 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -1.318 4.935 7.517 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -3.330 1.477 4.644 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -3.621 5.188 6.704 1.00 0.00 H new ATOM 0 HZ PHE A 127 -4.594 3.491 5.242 1.00 0.00 H new ATOM 1670 N VAL A 128 3.323 2.125 8.409 1.00 0.00 N ATOM 1671 CA VAL A 128 4.683 1.473 8.454 1.00 0.00 C ATOM 1672 C VAL A 128 4.782 0.429 9.622 1.00 0.00 C ATOM 1673 O VAL A 128 5.405 -0.613 9.397 1.00 0.00 O ATOM 1674 CB VAL A 128 5.908 2.488 8.539 1.00 0.00 C ATOM 1675 CG1 VAL A 128 7.237 1.869 8.020 1.00 0.00 C ATOM 1676 CG2 VAL A 128 5.714 3.851 7.839 1.00 0.00 C ATOM 0 H VAL A 128 3.334 3.094 8.728 1.00 0.00 H new ATOM 0 HA VAL A 128 4.770 0.967 7.493 1.00 0.00 H new ATOM 0 HB VAL A 128 5.959 2.683 9.610 1.00 0.00 H new ATOM 0 HG11 VAL A 128 8.037 2.605 8.101 1.00 0.00 H new ATOM 0 HG12 VAL A 128 7.488 0.992 8.617 1.00 0.00 H new ATOM 0 HG13 VAL A 128 7.119 1.575 6.977 1.00 0.00 H new ATOM 0 HG21 VAL A 128 6.612 4.456 7.964 1.00 0.00 H new ATOM 0 HG22 VAL A 128 5.529 3.691 6.777 1.00 0.00 H new ATOM 0 HG23 VAL A 128 4.863 4.369 8.281 1.00 0.00 H new ATOM 1686 N GLU A 129 4.165 0.691 10.802 1.00 0.00 N ATOM 1687 CA GLU A 129 3.999 -0.324 11.894 1.00 0.00 C ATOM 1688 C GLU A 129 3.128 -1.592 11.516 1.00 0.00 C ATOM 1689 O GLU A 129 3.081 -2.520 12.333 1.00 0.00 O ATOM 1690 CB GLU A 129 3.437 0.349 13.188 1.00 0.00 C ATOM 1691 CG GLU A 129 4.326 1.378 13.929 1.00 0.00 C ATOM 1692 CD GLU A 129 3.647 1.925 15.178 1.00 0.00 C ATOM 1693 OE1 GLU A 129 3.725 1.388 16.282 1.00 0.00 O ATOM 1694 OE2 GLU A 129 2.949 3.075 14.918 1.00 0.00 O ATOM 0 H GLU A 129 3.768 1.603 11.030 1.00 0.00 H new ATOM 0 HA GLU A 129 5.003 -0.710 12.068 1.00 0.00 H new ATOM 0 HB2 GLU A 129 2.503 0.846 12.925 1.00 0.00 H new ATOM 0 HB3 GLU A 129 3.189 -0.444 13.893 1.00 0.00 H new ATOM 0 HG2 GLU A 129 5.270 0.909 14.206 1.00 0.00 H new ATOM 0 HG3 GLU A 129 4.565 2.202 13.256 1.00 0.00 H new ATOM 1701 N VAL A 130 2.490 -1.647 10.311 1.00 0.00 N ATOM 1702 CA VAL A 130 1.637 -2.814 9.869 1.00 0.00 C ATOM 1703 C VAL A 130 2.015 -3.278 8.404 1.00 0.00 C ATOM 1704 O VAL A 130 2.015 -4.494 8.230 1.00 0.00 O ATOM 1705 CB VAL A 130 0.086 -2.531 10.062 1.00 0.00 C ATOM 1706 CG1 VAL A 130 -0.822 -3.713 9.607 1.00 0.00 C ATOM 1707 CG2 VAL A 130 -0.362 -2.192 11.523 1.00 0.00 C ATOM 0 H VAL A 130 2.545 -0.899 9.620 1.00 0.00 H new ATOM 0 HA VAL A 130 1.859 -3.656 10.525 1.00 0.00 H new ATOM 0 HB VAL A 130 -0.045 -1.654 9.429 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -1.868 -3.451 9.767 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -0.656 -3.913 8.548 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -0.578 -4.603 10.187 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -1.438 -2.017 11.542 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -0.118 -3.026 12.181 1.00 0.00 H new ATOM 0 HG23 VAL A 130 0.158 -1.297 11.864 1.00 0.00 H new ATOM 1717 N MET A 131 2.234 -2.420 7.378 1.00 0.00 N ATOM 1718 CA MET A 131 2.723 -2.825 6.014 1.00 0.00 C ATOM 1719 C MET A 131 4.194 -3.377 5.999 1.00 0.00 C ATOM 1720 O MET A 131 4.384 -4.431 5.381 1.00 0.00 O ATOM 1721 CB MET A 131 2.499 -1.644 5.003 1.00 0.00 C ATOM 1722 CG MET A 131 1.098 -1.419 4.373 1.00 0.00 C ATOM 1723 SD MET A 131 -0.290 -1.674 5.522 1.00 0.00 S ATOM 1724 CE MET A 131 -0.861 -3.332 5.076 1.00 0.00 C ATOM 0 H MET A 131 2.078 -1.416 7.463 1.00 0.00 H new ATOM 0 HA MET A 131 2.126 -3.678 5.691 1.00 0.00 H new ATOM 0 HB2 MET A 131 2.777 -0.722 5.514 1.00 0.00 H new ATOM 0 HB3 MET A 131 3.205 -1.780 4.184 1.00 0.00 H new ATOM 0 HG2 MET A 131 1.048 -0.403 3.981 1.00 0.00 H new ATOM 0 HG3 MET A 131 0.981 -2.094 3.525 1.00 0.00 H new ATOM 0 HE1 MET A 131 -1.366 -3.785 5.929 1.00 0.00 H new ATOM 0 HE2 MET A 131 -1.554 -3.265 4.238 1.00 0.00 H new ATOM 0 HE3 MET A 131 -0.007 -3.947 4.792 1.00 0.00 H new ATOM 1734 N SER A 132 5.186 -2.724 6.664 1.00 0.00 N ATOM 1735 CA SER A 132 6.547 -3.312 6.886 1.00 0.00 C ATOM 1736 C SER A 132 6.636 -4.511 7.894 1.00 0.00 C ATOM 1737 O SER A 132 7.554 -5.326 7.752 1.00 0.00 O ATOM 1738 CB SER A 132 7.507 -2.191 7.311 1.00 0.00 C ATOM 1739 OG SER A 132 8.847 -2.666 7.337 1.00 0.00 O ATOM 0 H SER A 132 5.073 -1.790 7.058 1.00 0.00 H new ATOM 0 HA SER A 132 6.827 -3.755 5.931 1.00 0.00 H new ATOM 0 HB2 SER A 132 7.425 -1.353 6.619 1.00 0.00 H new ATOM 0 HB3 SER A 132 7.228 -1.819 8.297 1.00 0.00 H new ATOM 0 HG SER A 132 9.446 -1.940 7.608 1.00 0.00 H new ATOM 1745 N GLU A 133 5.701 -4.605 8.869 1.00 0.00 N ATOM 1746 CA GLU A 133 5.497 -5.776 9.774 1.00 0.00 C ATOM 1747 C GLU A 133 4.773 -6.962 9.045 1.00 0.00 C ATOM 1748 O GLU A 133 5.273 -8.085 9.169 1.00 0.00 O ATOM 1749 CB GLU A 133 4.808 -5.200 11.055 1.00 0.00 C ATOM 1750 CG GLU A 133 4.579 -6.150 12.245 1.00 0.00 C ATOM 1751 CD GLU A 133 3.936 -5.447 13.434 1.00 0.00 C ATOM 1752 OE1 GLU A 133 4.858 -4.772 14.189 1.00 0.00 O ATOM 1753 OE2 GLU A 133 2.730 -5.488 13.674 1.00 0.00 O ATOM 0 H GLU A 133 5.044 -3.848 9.059 1.00 0.00 H new ATOM 0 HA GLU A 133 6.426 -6.257 10.079 1.00 0.00 H new ATOM 0 HB2 GLU A 133 5.409 -4.362 11.408 1.00 0.00 H new ATOM 0 HB3 GLU A 133 3.840 -4.796 10.760 1.00 0.00 H new ATOM 0 HG2 GLU A 133 3.944 -6.978 11.929 1.00 0.00 H new ATOM 0 HG3 GLU A 133 5.533 -6.579 12.552 1.00 0.00 H new ATOM 1760 N TYR A 134 3.660 -6.725 8.298 1.00 0.00 N ATOM 1761 CA TYR A 134 3.037 -7.730 7.387 1.00 0.00 C ATOM 1762 C TYR A 134 3.986 -8.301 6.280 1.00 0.00 C ATOM 1763 O TYR A 134 3.801 -9.463 5.916 1.00 0.00 O ATOM 1764 CB TYR A 134 1.735 -7.167 6.749 1.00 0.00 C ATOM 1765 CG TYR A 134 0.800 -8.114 5.917 1.00 0.00 C ATOM 1766 CD1 TYR A 134 0.537 -9.435 6.288 1.00 0.00 C ATOM 1767 CD2 TYR A 134 0.116 -7.600 4.823 1.00 0.00 C ATOM 1768 CE1 TYR A 134 -0.416 -10.184 5.641 1.00 0.00 C ATOM 1769 CE2 TYR A 134 -0.808 -8.372 4.149 1.00 0.00 C ATOM 1770 CZ TYR A 134 -1.084 -9.659 4.559 1.00 0.00 C ATOM 1771 OH TYR A 134 -2.057 -10.389 3.928 1.00 0.00 O ATOM 0 H TYR A 134 3.168 -5.832 8.309 1.00 0.00 H new ATOM 0 HA TYR A 134 2.801 -8.579 8.029 1.00 0.00 H new ATOM 0 HB2 TYR A 134 1.135 -6.744 7.555 1.00 0.00 H new ATOM 0 HB3 TYR A 134 2.023 -6.341 6.098 1.00 0.00 H new ATOM 0 HD1 TYR A 134 1.095 -9.877 7.101 1.00 0.00 H new ATOM 0 HD2 TYR A 134 0.309 -6.588 4.497 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -0.640 -11.184 5.982 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -1.321 -7.963 3.291 1.00 0.00 H new ATOM 0 HH TYR A 134 -2.726 -9.782 3.548 1.00 0.00 H new ATOM 1781 N ASN A 135 4.974 -7.511 5.786 1.00 0.00 N ATOM 1782 CA ASN A 135 6.091 -7.993 4.915 1.00 0.00 C ATOM 1783 C ASN A 135 6.865 -9.239 5.490 1.00 0.00 C ATOM 1784 O ASN A 135 7.201 -10.120 4.692 1.00 0.00 O ATOM 1785 CB ASN A 135 7.028 -6.782 4.680 1.00 0.00 C ATOM 1786 CG ASN A 135 8.042 -6.937 3.533 1.00 0.00 C ATOM 1787 OD1 ASN A 135 7.740 -6.641 2.378 1.00 0.00 O ATOM 1788 ND2 ASN A 135 9.248 -7.400 3.824 1.00 0.00 N ATOM 0 H ASN A 135 5.023 -6.511 5.980 1.00 0.00 H new ATOM 0 HA ASN A 135 5.678 -8.362 3.976 1.00 0.00 H new ATOM 0 HB2 ASN A 135 6.414 -5.904 4.481 1.00 0.00 H new ATOM 0 HB3 ASN A 135 7.576 -6.586 5.601 1.00 0.00 H new ATOM 0 HD21 ASN A 135 9.942 -7.516 3.085 1.00 0.00 H new ATOM 0 HD22 ASN A 135 9.483 -7.641 4.787 1.00 0.00 H new ATOM 1795 N ALA A 136 7.091 -9.302 6.834 1.00 0.00 N ATOM 1796 CA ALA A 136 7.597 -10.527 7.511 1.00 0.00 C ATOM 1797 C ALA A 136 6.612 -11.738 7.570 1.00 0.00 C ATOM 1798 O ALA A 136 7.105 -12.859 7.430 1.00 0.00 O ATOM 1799 CB ALA A 136 8.076 -10.143 8.911 1.00 0.00 C ATOM 0 H ALA A 136 6.930 -8.518 7.467 1.00 0.00 H new ATOM 0 HA ALA A 136 8.413 -10.898 6.892 1.00 0.00 H new ATOM 0 HB1 ALA A 136 8.451 -11.029 9.423 1.00 0.00 H new ATOM 0 HB2 ALA A 136 8.874 -9.404 8.833 1.00 0.00 H new ATOM 0 HB3 ALA A 136 7.245 -9.721 9.477 1.00 0.00 H new ATOM 1805 N THR A 137 5.276 -11.531 7.722 1.00 0.00 N ATOM 1806 CA THR A 137 4.242 -12.615 7.671 1.00 0.00 C ATOM 1807 C THR A 137 3.998 -13.131 6.200 1.00 0.00 C ATOM 1808 O THR A 137 4.150 -14.339 5.987 1.00 0.00 O ATOM 1809 CB THR A 137 2.990 -12.087 8.457 1.00 0.00 C ATOM 1810 OG1 THR A 137 3.358 -11.790 9.800 1.00 0.00 O ATOM 1811 CG2 THR A 137 1.777 -13.029 8.535 1.00 0.00 C ATOM 0 H THR A 137 4.879 -10.606 7.884 1.00 0.00 H new ATOM 0 HA THR A 137 4.569 -13.529 8.167 1.00 0.00 H new ATOM 0 HB THR A 137 2.676 -11.218 7.878 1.00 0.00 H new ATOM 0 HG1 THR A 137 2.575 -11.459 10.288 1.00 0.00 H new ATOM 0 HG21 THR A 137 0.980 -12.549 9.103 1.00 0.00 H new ATOM 0 HG22 THR A 137 1.423 -13.250 7.528 1.00 0.00 H new ATOM 0 HG23 THR A 137 2.067 -13.956 9.029 1.00 0.00 H new ATOM 1819 N GLN A 138 3.630 -12.247 5.242 1.00 0.00 N ATOM 1820 CA GLN A 138 3.406 -12.585 3.805 1.00 0.00 C ATOM 1821 C GLN A 138 4.628 -13.179 3.050 1.00 0.00 C ATOM 1822 O GLN A 138 4.385 -14.043 2.204 1.00 0.00 O ATOM 1823 CB GLN A 138 2.830 -11.271 3.172 1.00 0.00 C ATOM 1824 CG GLN A 138 2.306 -11.291 1.720 1.00 0.00 C ATOM 1825 CD GLN A 138 1.816 -9.916 1.247 1.00 0.00 C ATOM 1826 OE1 GLN A 138 0.688 -9.518 1.535 1.00 0.00 O ATOM 1827 NE2 GLN A 138 2.634 -9.168 0.521 1.00 0.00 N ATOM 0 H GLN A 138 3.476 -11.259 5.444 1.00 0.00 H new ATOM 0 HA GLN A 138 2.710 -13.419 3.716 1.00 0.00 H new ATOM 0 HB2 GLN A 138 2.013 -10.933 3.809 1.00 0.00 H new ATOM 0 HB3 GLN A 138 3.611 -10.513 3.227 1.00 0.00 H new ATOM 0 HG2 GLN A 138 3.099 -11.637 1.057 1.00 0.00 H new ATOM 0 HG3 GLN A 138 1.490 -12.009 1.643 1.00 0.00 H new ATOM 0 HE21 GLN A 138 3.567 -9.510 0.289 1.00 0.00 H new ATOM 0 HE22 GLN A 138 2.331 -8.251 0.194 1.00 0.00 H new ATOM 1836 N SER A 139 5.873 -12.745 3.343 1.00 0.00 N ATOM 1837 CA SER A 139 7.094 -13.428 2.846 1.00 0.00 C ATOM 1838 C SER A 139 7.381 -14.756 3.605 1.00 0.00 C ATOM 1839 O SER A 139 7.504 -15.746 2.883 1.00 0.00 O ATOM 1840 CB SER A 139 8.273 -12.443 2.858 1.00 0.00 C ATOM 1841 OG SER A 139 9.428 -13.058 2.305 1.00 0.00 O ATOM 0 H SER A 139 6.062 -11.926 3.920 1.00 0.00 H new ATOM 0 HA SER A 139 6.933 -13.736 1.813 1.00 0.00 H new ATOM 0 HB2 SER A 139 8.017 -11.551 2.286 1.00 0.00 H new ATOM 0 HB3 SER A 139 8.477 -12.120 3.879 1.00 0.00 H new ATOM 0 HG SER A 139 10.174 -12.422 2.315 1.00 0.00 H new ATOM 1847 N ASP A 140 7.348 -14.846 4.971 1.00 0.00 N ATOM 1848 CA ASP A 140 7.492 -16.144 5.709 1.00 0.00 C ATOM 1849 C ASP A 140 6.480 -17.279 5.356 1.00 0.00 C ATOM 1850 O ASP A 140 6.823 -18.420 5.689 1.00 0.00 O ATOM 1851 CB ASP A 140 7.535 -15.869 7.234 1.00 0.00 C ATOM 1852 CG ASP A 140 8.111 -16.995 8.103 1.00 0.00 C ATOM 1853 OD1 ASP A 140 9.180 -17.555 7.865 1.00 0.00 O ATOM 1854 OD2 ASP A 140 7.296 -17.293 9.163 1.00 0.00 O ATOM 0 H ASP A 140 7.223 -14.038 5.581 1.00 0.00 H new ATOM 0 HA ASP A 140 8.437 -16.560 5.359 1.00 0.00 H new ATOM 0 HB2 ASP A 140 8.124 -14.968 7.404 1.00 0.00 H new ATOM 0 HB3 ASP A 140 6.521 -15.657 7.574 1.00 0.00 H new ATOM 1859 N TYR A 141 5.318 -17.017 4.698 1.00 0.00 N ATOM 1860 CA TYR A 141 4.479 -18.123 4.140 1.00 0.00 C ATOM 1861 C TYR A 141 5.107 -18.850 2.887 1.00 0.00 C ATOM 1862 O TYR A 141 4.949 -20.062 2.718 1.00 0.00 O ATOM 1863 CB TYR A 141 3.067 -17.566 3.774 1.00 0.00 C ATOM 1864 CG TYR A 141 1.997 -18.654 3.488 1.00 0.00 C ATOM 1865 CD1 TYR A 141 1.320 -19.296 4.519 1.00 0.00 C ATOM 1866 CD2 TYR A 141 1.855 -19.133 2.187 1.00 0.00 C ATOM 1867 CE1 TYR A 141 0.580 -20.434 4.258 1.00 0.00 C ATOM 1868 CE2 TYR A 141 1.116 -20.267 1.936 1.00 0.00 C ATOM 1869 CZ TYR A 141 0.505 -20.933 2.973 1.00 0.00 C ATOM 1870 OH TYR A 141 -0.209 -22.070 2.710 1.00 0.00 O ATOM 0 H TYR A 141 4.946 -16.080 4.542 1.00 0.00 H new ATOM 0 HA TYR A 141 4.414 -18.881 4.921 1.00 0.00 H new ATOM 0 HB2 TYR A 141 2.716 -16.936 4.592 1.00 0.00 H new ATOM 0 HB3 TYR A 141 3.160 -16.926 2.896 1.00 0.00 H new ATOM 0 HD1 TYR A 141 1.372 -18.905 5.524 1.00 0.00 H new ATOM 0 HD2 TYR A 141 2.329 -18.610 1.369 1.00 0.00 H new ATOM 0 HE1 TYR A 141 0.059 -20.934 5.061 1.00 0.00 H new ATOM 0 HE2 TYR A 141 1.016 -20.634 0.925 1.00 0.00 H new ATOM 0 HH TYR A 141 0.278 -22.619 2.061 1.00 0.00 H new