USER MOD reduce.3.24.130724 H: found=0, std=0, add=782, rem=0, adj=21 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 120 HIS : no HD1:sc= -0.221 X(o=0.65,f=0.18) USER MOD Set 1.2: A 124 SER OG : rot 87:sc= 0.873 USER MOD Set 2.1: A 58 HIS : no HE2:sc= -0.197 K(o=-0.66,f=-2.8) USER MOD Set 2.2: A 79 MET CE :methyl -177:sc= -0.512 (180deg=0) USER MOD Set 2.3: A 83 LYS NZ :NH3+ -153:sc= 0.0469 (180deg=-1.31!) USER MOD Set 2.4: A 134 TYR OH : rot 15:sc= 0.241 USER MOD Set 2.5: A 138 GLN : amide:sc= -0.241 K(o=-0.66,f=0.067) USER MOD Single : A 30 MET CE :methyl -176:sc= -0.128 (180deg=-0.181) 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= 0.09 X(o=0.09,f=0) 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 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 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 -23:sc= 0.339 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ -106:sc= 0.0144 (180deg=-0.908!) USER MOD Single : A 95 SER OG : rot 70:sc= 0.105 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 SER OG : rot 81:sc= 0.0239 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 GLN : amide:sc= -0.133 K(o=-0.13,f=-1.5) USER MOD Single : A 121 SER OG : rot 88:sc= 0.238 USER MOD Single : A 122 THR OG1 : rot 91:sc= 0.553 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 MET CE :methyl 143:sc=-0.00818 (180deg=-1.24) USER MOD Single : A 132 SER OG : rot -160:sc= -0.0445 USER MOD Single : A 135 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 THR OG1 : rot 67:sc= 0.797 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 -10.657 27.684 5.655 1.00 0.00 N ATOM 2 CA ASP A 27 -11.805 27.048 6.347 1.00 0.00 C ATOM 3 C ASP A 27 -12.315 25.765 5.608 1.00 0.00 C ATOM 4 O ASP A 27 -12.382 24.729 6.280 1.00 0.00 O ATOM 5 CB ASP A 27 -12.919 28.104 6.604 1.00 0.00 C ATOM 6 CG ASP A 27 -12.632 29.108 7.725 1.00 0.00 C ATOM 7 OD1 ASP A 27 -11.753 30.080 7.328 1.00 0.00 O ATOM 8 OD2 ASP A 27 -13.138 29.038 8.844 1.00 0.00 O ATOM 0 HA ASP A 27 -11.469 26.686 7.319 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -13.091 28.657 5.680 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -13.845 27.579 6.839 1.00 0.00 H new ATOM 15 N ARG A 28 -12.651 25.792 4.288 1.00 0.00 N ATOM 16 CA ARG A 28 -13.239 24.647 3.530 1.00 0.00 C ATOM 17 C ARG A 28 -12.319 23.406 3.349 1.00 0.00 C ATOM 18 O ARG A 28 -12.815 22.283 3.495 1.00 0.00 O ATOM 19 CB ARG A 28 -13.789 25.199 2.182 1.00 0.00 C ATOM 20 CG ARG A 28 -15.052 26.106 2.268 1.00 0.00 C ATOM 21 CD ARG A 28 -15.471 26.799 0.975 1.00 0.00 C ATOM 22 NE ARG A 28 -14.663 28.005 0.629 1.00 0.00 N ATOM 23 CZ ARG A 28 -14.634 28.646 -0.567 1.00 0.00 C ATOM 24 NH1 ARG A 28 -15.331 28.308 -1.661 1.00 0.00 N ATOM 25 NH2 ARG A 28 -13.846 29.701 -0.661 1.00 0.00 N ATOM 0 H ARG A 28 -12.519 26.622 3.710 1.00 0.00 H new ATOM 0 HA ARG A 28 -14.046 24.234 4.136 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -12.995 25.765 1.695 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -14.020 24.353 1.535 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -15.887 25.499 2.618 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -14.875 26.870 3.025 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -15.402 26.084 0.155 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -16.518 27.090 1.057 1.00 0.00 H new ATOM 0 HE ARG A 28 -14.072 28.387 1.367 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -15.954 27.501 -1.639 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -15.238 28.858 -2.515 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -13.295 29.999 0.144 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -13.788 30.218 -1.538 1.00 0.00 H new ATOM 39 N PHE A 29 -11.020 23.621 3.058 1.00 0.00 N ATOM 40 CA PHE A 29 -10.033 22.532 2.805 1.00 0.00 C ATOM 41 C PHE A 29 -9.503 21.836 4.091 1.00 0.00 C ATOM 42 O PHE A 29 -9.384 20.607 4.048 1.00 0.00 O ATOM 43 CB PHE A 29 -8.896 23.073 1.898 1.00 0.00 C ATOM 44 CG PHE A 29 -9.340 23.481 0.468 1.00 0.00 C ATOM 45 CD1 PHE A 29 -9.392 22.544 -0.558 1.00 0.00 C ATOM 46 CD2 PHE A 29 -9.775 24.780 0.219 1.00 0.00 C ATOM 47 CE1 PHE A 29 -9.811 22.914 -1.821 1.00 0.00 C ATOM 48 CE2 PHE A 29 -10.192 25.143 -1.047 1.00 0.00 C ATOM 49 CZ PHE A 29 -10.203 24.214 -2.067 1.00 0.00 C ATOM 0 H PHE A 29 -10.617 24.555 2.990 1.00 0.00 H new ATOM 0 HA PHE A 29 -10.555 21.731 2.282 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -8.444 23.938 2.383 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -8.121 22.311 1.819 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -9.103 21.521 -0.366 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -9.786 25.506 1.018 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -9.832 22.185 -2.617 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -10.510 26.157 -1.239 1.00 0.00 H new ATOM 0 HZ PHE A 29 -10.518 24.504 -3.058 1.00 0.00 H new ATOM 59 N MET A 30 -9.246 22.560 5.215 1.00 0.00 N ATOM 60 CA MET A 30 -8.949 21.957 6.550 1.00 0.00 C ATOM 61 C MET A 30 -10.163 21.218 7.200 1.00 0.00 C ATOM 62 O MET A 30 -9.925 20.135 7.744 1.00 0.00 O ATOM 63 CB MET A 30 -8.359 23.033 7.497 1.00 0.00 C ATOM 64 CG MET A 30 -6.985 23.625 7.103 1.00 0.00 C ATOM 65 SD MET A 30 -5.655 22.394 7.190 1.00 0.00 S ATOM 66 CE MET A 30 -5.222 22.319 8.942 1.00 0.00 C ATOM 0 H MET A 30 -9.238 23.580 5.223 1.00 0.00 H new ATOM 0 HA MET A 30 -8.206 21.177 6.383 1.00 0.00 H new ATOM 0 HB2 MET A 30 -9.075 23.852 7.570 1.00 0.00 H new ATOM 0 HB3 MET A 30 -8.270 22.598 8.493 1.00 0.00 H new ATOM 0 HG2 MET A 30 -7.041 24.025 6.091 1.00 0.00 H new ATOM 0 HG3 MET A 30 -6.749 24.460 7.763 1.00 0.00 H new ATOM 0 HE1 MET A 30 -4.374 21.648 9.079 1.00 0.00 H new ATOM 0 HE2 MET A 30 -4.957 23.316 9.294 1.00 0.00 H new ATOM 0 HE3 MET A 30 -6.074 21.947 9.512 1.00 0.00 H new ATOM 76 N ASP A 31 -11.424 21.733 7.096 1.00 0.00 N ATOM 77 CA ASP A 31 -12.667 20.980 7.483 1.00 0.00 C ATOM 78 C ASP A 31 -12.862 19.624 6.711 1.00 0.00 C ATOM 79 O ASP A 31 -13.187 18.637 7.383 1.00 0.00 O ATOM 80 CB ASP A 31 -13.923 21.889 7.374 1.00 0.00 C ATOM 81 CG ASP A 31 -14.062 22.943 8.477 1.00 0.00 C ATOM 82 OD1 ASP A 31 -14.270 22.373 9.706 1.00 0.00 O ATOM 83 OD2 ASP A 31 -14.002 24.154 8.272 1.00 0.00 O ATOM 0 H ASP A 31 -11.611 22.672 6.746 1.00 0.00 H new ATOM 0 HA ASP A 31 -12.532 20.695 8.527 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -13.902 22.396 6.409 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -14.811 21.257 7.383 1.00 0.00 H new ATOM 88 N GLU A 32 -12.603 19.556 5.373 1.00 0.00 N ATOM 89 CA GLU A 32 -12.526 18.268 4.604 1.00 0.00 C ATOM 90 C GLU A 32 -11.337 17.335 5.040 1.00 0.00 C ATOM 91 O GLU A 32 -11.538 16.117 5.017 1.00 0.00 O ATOM 92 CB GLU A 32 -12.469 18.489 3.061 1.00 0.00 C ATOM 93 CG GLU A 32 -13.699 19.142 2.389 1.00 0.00 C ATOM 94 CD GLU A 32 -13.621 19.140 0.868 1.00 0.00 C ATOM 95 OE1 GLU A 32 -12.879 19.883 0.226 1.00 0.00 O ATOM 96 OE2 GLU A 32 -14.469 18.218 0.313 1.00 0.00 O ATOM 0 H GLU A 32 -12.442 20.382 4.797 1.00 0.00 H new ATOM 0 HA GLU A 32 -13.456 17.758 4.855 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -11.598 19.106 2.841 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -12.301 17.521 2.588 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -14.599 18.613 2.701 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -13.795 20.169 2.740 1.00 0.00 H new ATOM 103 N PHE A 33 -10.167 17.892 5.462 1.00 0.00 N ATOM 104 CA PHE A 33 -9.048 17.135 6.100 1.00 0.00 C ATOM 105 C PHE A 33 -9.378 16.488 7.489 1.00 0.00 C ATOM 106 O PHE A 33 -9.022 15.316 7.643 1.00 0.00 O ATOM 107 CB PHE A 33 -7.792 18.064 6.133 1.00 0.00 C ATOM 108 CG PHE A 33 -6.437 17.459 6.593 1.00 0.00 C ATOM 109 CD1 PHE A 33 -5.724 16.601 5.762 1.00 0.00 C ATOM 110 CD2 PHE A 33 -5.887 17.800 7.826 1.00 0.00 C ATOM 111 CE1 PHE A 33 -4.495 16.110 6.151 1.00 0.00 C ATOM 112 CE2 PHE A 33 -4.648 17.313 8.203 1.00 0.00 C ATOM 113 CZ PHE A 33 -3.944 16.482 7.357 1.00 0.00 C ATOM 0 H PHE A 33 -9.971 18.889 5.368 1.00 0.00 H new ATOM 0 HA PHE A 33 -8.849 16.256 5.487 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -7.652 18.468 5.130 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -8.019 18.906 6.787 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -6.136 16.317 4.805 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -6.432 18.450 8.494 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -3.961 15.429 5.505 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -4.231 17.584 9.162 1.00 0.00 H new ATOM 0 HZ PHE A 33 -2.965 16.124 7.639 1.00 0.00 H new ATOM 123 N PHE A 34 -10.039 17.187 8.452 1.00 0.00 N ATOM 124 CA PHE A 34 -10.531 16.581 9.720 1.00 0.00 C ATOM 125 C PHE A 34 -11.661 15.502 9.568 1.00 0.00 C ATOM 126 O PHE A 34 -11.646 14.548 10.352 1.00 0.00 O ATOM 127 CB PHE A 34 -10.948 17.722 10.691 1.00 0.00 C ATOM 128 CG PHE A 34 -9.804 18.523 11.369 1.00 0.00 C ATOM 129 CD1 PHE A 34 -9.091 17.993 12.443 1.00 0.00 C ATOM 130 CD2 PHE A 34 -9.494 19.806 10.933 1.00 0.00 C ATOM 131 CE1 PHE A 34 -8.075 18.716 13.036 1.00 0.00 C ATOM 132 CE2 PHE A 34 -8.478 20.525 11.531 1.00 0.00 C ATOM 133 CZ PHE A 34 -7.765 19.980 12.578 1.00 0.00 C ATOM 0 H PHE A 34 -10.245 18.183 8.371 1.00 0.00 H new ATOM 0 HA PHE A 34 -9.699 16.008 10.130 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -11.573 18.425 10.140 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -11.570 17.290 11.475 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -9.335 17.009 12.814 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -10.053 20.244 10.119 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -7.522 18.291 13.860 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -8.241 21.518 11.177 1.00 0.00 H new ATOM 0 HZ PHE A 34 -6.966 20.541 13.039 1.00 0.00 H new ATOM 143 N GLU A 35 -12.586 15.634 8.586 1.00 0.00 N ATOM 144 CA GLU A 35 -13.630 14.665 8.236 1.00 0.00 C ATOM 145 C GLU A 35 -13.131 13.322 7.592 1.00 0.00 C ATOM 146 O GLU A 35 -13.622 12.278 8.032 1.00 0.00 O ATOM 147 CB GLU A 35 -14.565 15.553 7.334 1.00 0.00 C ATOM 148 CG GLU A 35 -15.757 16.293 7.981 1.00 0.00 C ATOM 149 CD GLU A 35 -16.931 15.406 8.392 1.00 0.00 C ATOM 150 OE1 GLU A 35 -17.824 15.061 7.620 1.00 0.00 O ATOM 151 OE2 GLU A 35 -16.864 15.048 9.713 1.00 0.00 O ATOM 0 H GLU A 35 -12.618 16.463 7.993 1.00 0.00 H new ATOM 0 HA GLU A 35 -14.136 14.235 9.101 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -13.938 16.302 6.850 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -14.964 14.914 6.547 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -15.398 16.824 8.863 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -16.119 17.046 7.281 1.00 0.00 H new ATOM 158 N GLN A 36 -12.197 13.340 6.602 1.00 0.00 N ATOM 159 CA GLN A 36 -11.598 12.106 5.988 1.00 0.00 C ATOM 160 C GLN A 36 -10.636 11.265 6.896 1.00 0.00 C ATOM 161 O GLN A 36 -10.692 10.035 6.809 1.00 0.00 O ATOM 162 CB GLN A 36 -10.945 12.457 4.611 1.00 0.00 C ATOM 163 CG GLN A 36 -9.688 13.367 4.503 1.00 0.00 C ATOM 164 CD GLN A 36 -9.215 13.528 3.054 1.00 0.00 C ATOM 165 OE1 GLN A 36 -8.522 12.664 2.520 1.00 0.00 O ATOM 166 NE2 GLN A 36 -9.570 14.619 2.391 1.00 0.00 N ATOM 0 H GLN A 36 -11.834 14.205 6.203 1.00 0.00 H new ATOM 0 HA GLN A 36 -12.440 11.429 5.845 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -10.690 11.511 4.134 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -11.722 12.921 4.004 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -9.914 14.348 4.921 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -8.882 12.943 5.102 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -10.145 15.328 2.846 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -9.268 14.750 1.426 1.00 0.00 H new ATOM 175 N VAL A 37 -9.788 11.904 7.740 1.00 0.00 N ATOM 176 CA VAL A 37 -8.864 11.222 8.730 1.00 0.00 C ATOM 177 C VAL A 37 -9.549 10.165 9.687 1.00 0.00 C ATOM 178 O VAL A 37 -8.982 9.079 9.842 1.00 0.00 O ATOM 179 CB VAL A 37 -8.001 12.267 9.577 1.00 0.00 C ATOM 180 CG1 VAL A 37 -6.876 12.978 8.769 1.00 0.00 C ATOM 181 CG2 VAL A 37 -8.764 13.319 10.436 1.00 0.00 C ATOM 0 H VAL A 37 -9.712 12.921 7.766 1.00 0.00 H new ATOM 0 HA VAL A 37 -8.197 10.644 8.090 1.00 0.00 H new ATOM 0 HB VAL A 37 -7.558 11.577 10.295 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -6.341 13.669 9.421 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -6.181 12.234 8.381 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -7.317 13.530 7.939 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -8.046 13.957 10.952 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -9.393 13.930 9.789 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -9.387 12.807 11.169 1.00 0.00 H new ATOM 191 N GLU A 38 -10.728 10.481 10.278 1.00 0.00 N ATOM 192 CA GLU A 38 -11.561 9.508 11.067 1.00 0.00 C ATOM 193 C GLU A 38 -12.125 8.279 10.276 1.00 0.00 C ATOM 194 O GLU A 38 -12.275 7.217 10.888 1.00 0.00 O ATOM 195 CB GLU A 38 -12.726 10.233 11.815 1.00 0.00 C ATOM 196 CG GLU A 38 -12.347 11.086 13.048 1.00 0.00 C ATOM 197 CD GLU A 38 -13.557 11.783 13.655 1.00 0.00 C ATOM 198 OE1 GLU A 38 -14.257 10.955 14.494 1.00 0.00 O ATOM 199 OE2 GLU A 38 -13.860 12.950 13.413 1.00 0.00 O ATOM 0 H GLU A 38 -11.137 11.414 10.228 1.00 0.00 H new ATOM 0 HA GLU A 38 -10.849 9.087 11.777 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -13.237 10.879 11.101 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -13.445 9.478 12.134 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -11.881 10.449 13.800 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -11.607 11.832 12.759 1.00 0.00 H new ATOM 206 N GLU A 39 -12.414 8.427 8.966 1.00 0.00 N ATOM 207 CA GLU A 39 -12.724 7.297 8.033 1.00 0.00 C ATOM 208 C GLU A 39 -11.483 6.348 7.756 1.00 0.00 C ATOM 209 O GLU A 39 -11.652 5.126 7.738 1.00 0.00 O ATOM 210 CB GLU A 39 -13.389 7.980 6.790 1.00 0.00 C ATOM 211 CG GLU A 39 -13.686 7.101 5.567 1.00 0.00 C ATOM 212 CD GLU A 39 -14.346 7.864 4.427 1.00 0.00 C ATOM 213 OE1 GLU A 39 -13.722 8.550 3.619 1.00 0.00 O ATOM 214 OE2 GLU A 39 -15.705 7.692 4.415 1.00 0.00 O ATOM 0 H GLU A 39 -12.442 9.340 8.511 1.00 0.00 H new ATOM 0 HA GLU A 39 -13.417 6.570 8.457 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -14.327 8.429 7.116 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -12.740 8.795 6.468 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -12.755 6.660 5.210 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -14.334 6.278 5.868 1.00 0.00 H new ATOM 221 N ILE A 40 -10.279 6.931 7.561 1.00 0.00 N ATOM 222 CA ILE A 40 -8.934 6.246 7.417 1.00 0.00 C ATOM 223 C ILE A 40 -8.676 5.297 8.646 1.00 0.00 C ATOM 224 O ILE A 40 -8.638 4.083 8.426 1.00 0.00 O ATOM 225 CB ILE A 40 -7.863 7.404 7.073 1.00 0.00 C ATOM 226 CG1 ILE A 40 -8.038 7.964 5.599 1.00 0.00 C ATOM 227 CG2 ILE A 40 -6.372 6.976 7.309 1.00 0.00 C ATOM 228 CD1 ILE A 40 -7.539 9.385 5.239 1.00 0.00 C ATOM 0 H ILE A 40 -10.193 7.945 7.493 1.00 0.00 H new ATOM 0 HA ILE A 40 -8.859 5.540 6.590 1.00 0.00 H new ATOM 0 HB ILE A 40 -8.084 8.202 7.782 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -7.538 7.266 4.927 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -9.102 7.926 5.364 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -5.711 7.805 7.057 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -6.232 6.706 8.356 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -6.135 6.119 6.679 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -7.746 9.588 4.188 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -8.053 10.119 5.859 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -6.465 9.449 5.416 1.00 0.00 H new ATOM 240 N ARG A 41 -8.619 5.822 9.890 1.00 0.00 N ATOM 241 CA ARG A 41 -8.543 4.970 11.143 1.00 0.00 C ATOM 242 C ARG A 41 -9.632 3.822 11.273 1.00 0.00 C ATOM 243 O ARG A 41 -9.314 2.798 11.887 1.00 0.00 O ATOM 244 CB ARG A 41 -8.430 5.894 12.384 1.00 0.00 C ATOM 245 CG ARG A 41 -9.690 6.625 12.851 1.00 0.00 C ATOM 246 CD ARG A 41 -9.557 7.742 13.895 1.00 0.00 C ATOM 247 NE ARG A 41 -9.319 7.257 15.285 1.00 0.00 N ATOM 248 CZ ARG A 41 -9.344 8.000 16.420 1.00 0.00 C ATOM 249 NH1 ARG A 41 -9.590 9.317 16.496 1.00 0.00 N ATOM 250 NH2 ARG A 41 -9.104 7.370 17.554 1.00 0.00 N ATOM 0 H ARG A 41 -8.623 6.825 10.075 1.00 0.00 H new ATOM 0 HA ARG A 41 -7.633 4.374 11.066 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -8.065 5.292 13.216 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -7.667 6.644 12.174 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -10.168 7.053 11.970 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -10.374 5.878 13.253 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -8.736 8.398 13.606 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -10.465 8.344 13.883 1.00 0.00 H new ATOM 0 HE ARG A 41 -9.116 6.263 15.394 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -9.781 9.850 15.648 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -9.586 9.785 17.402 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -8.911 6.368 17.550 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -9.111 7.884 18.435 1.00 0.00 H new ATOM 264 N GLY A 42 -10.842 4.000 10.682 1.00 0.00 N ATOM 265 CA GLY A 42 -11.855 2.919 10.517 1.00 0.00 C ATOM 266 C GLY A 42 -11.444 1.771 9.551 1.00 0.00 C ATOM 267 O GLY A 42 -11.482 0.610 9.975 1.00 0.00 O ATOM 0 H GLY A 42 -11.145 4.898 10.305 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -12.069 2.490 11.496 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -12.782 3.363 10.155 1.00 0.00 H new ATOM 271 N PHE A 43 -11.013 2.104 8.304 1.00 0.00 N ATOM 272 CA PHE A 43 -10.378 1.141 7.356 1.00 0.00 C ATOM 273 C PHE A 43 -9.048 0.472 7.865 1.00 0.00 C ATOM 274 O PHE A 43 -8.914 -0.736 7.653 1.00 0.00 O ATOM 275 CB PHE A 43 -10.111 1.793 5.969 1.00 0.00 C ATOM 276 CG PHE A 43 -11.239 2.445 5.132 1.00 0.00 C ATOM 277 CD1 PHE A 43 -12.222 1.663 4.537 1.00 0.00 C ATOM 278 CD2 PHE A 43 -11.175 3.799 4.812 1.00 0.00 C ATOM 279 CE1 PHE A 43 -13.120 2.225 3.652 1.00 0.00 C ATOM 280 CE2 PHE A 43 -12.064 4.349 3.913 1.00 0.00 C ATOM 281 CZ PHE A 43 -13.042 3.566 3.338 1.00 0.00 C ATOM 0 H PHE A 43 -11.095 3.048 7.926 1.00 0.00 H new ATOM 0 HA PHE A 43 -11.116 0.344 7.273 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -9.353 2.561 6.125 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -9.661 1.023 5.342 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -12.284 0.610 4.768 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -10.423 4.423 5.272 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -13.887 1.612 3.203 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -11.994 5.396 3.659 1.00 0.00 H new ATOM 0 HZ PHE A 43 -13.745 4.001 2.644 1.00 0.00 H new ATOM 291 N ILE A 44 -8.126 1.215 8.553 1.00 0.00 N ATOM 292 CA ILE A 44 -6.871 0.664 9.197 1.00 0.00 C ATOM 293 C ILE A 44 -7.268 -0.383 10.319 1.00 0.00 C ATOM 294 O ILE A 44 -6.659 -1.457 10.328 1.00 0.00 O ATOM 295 CB ILE A 44 -5.861 1.793 9.729 1.00 0.00 C ATOM 296 CG1 ILE A 44 -5.545 2.995 8.736 1.00 0.00 C ATOM 297 CG2 ILE A 44 -4.504 1.156 10.218 1.00 0.00 C ATOM 298 CD1 ILE A 44 -4.983 4.328 9.288 1.00 0.00 C ATOM 0 H ILE A 44 -8.226 2.222 8.682 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.303 0.151 8.422 1.00 0.00 H new ATOM 0 HB ILE A 44 -6.412 2.243 10.555 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -4.835 2.626 7.996 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -6.468 3.228 8.205 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -3.839 1.944 10.573 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -4.702 0.456 11.029 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -4.031 0.628 9.390 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -4.831 5.027 8.466 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -5.690 4.754 10.000 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -4.032 4.143 9.788 1.00 0.00 H new ATOM 310 N ASP A 45 -8.261 -0.096 11.203 1.00 0.00 N ATOM 311 CA ASP A 45 -8.878 -1.100 12.138 1.00 0.00 C ATOM 312 C ASP A 45 -9.324 -2.441 11.445 1.00 0.00 C ATOM 313 O ASP A 45 -8.993 -3.514 11.959 1.00 0.00 O ATOM 314 CB ASP A 45 -10.056 -0.435 12.909 1.00 0.00 C ATOM 315 CG ASP A 45 -10.315 -1.034 14.289 1.00 0.00 C ATOM 316 OD1 ASP A 45 -9.474 -0.515 15.238 1.00 0.00 O ATOM 317 OD2 ASP A 45 -11.179 -1.881 14.510 1.00 0.00 O ATOM 0 H ASP A 45 -8.663 0.837 11.294 1.00 0.00 H new ATOM 0 HA ASP A 45 -8.099 -1.400 12.839 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -9.849 0.629 13.020 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -10.963 -0.522 12.311 1.00 0.00 H new ATOM 322 N LYS A 46 -9.994 -2.335 10.264 1.00 0.00 N ATOM 323 CA LYS A 46 -10.281 -3.481 9.357 1.00 0.00 C ATOM 324 C LYS A 46 -9.019 -4.171 8.723 1.00 0.00 C ATOM 325 O LYS A 46 -9.134 -5.357 8.401 1.00 0.00 O ATOM 326 CB LYS A 46 -11.317 -2.984 8.300 1.00 0.00 C ATOM 327 CG LYS A 46 -12.111 -4.022 7.464 1.00 0.00 C ATOM 328 CD LYS A 46 -13.318 -4.703 8.154 1.00 0.00 C ATOM 329 CE LYS A 46 -14.058 -5.704 7.256 1.00 0.00 C ATOM 330 NZ LYS A 46 -15.186 -6.303 7.986 1.00 0.00 N ATOM 0 H LYS A 46 -10.352 -1.447 9.913 1.00 0.00 H new ATOM 0 HA LYS A 46 -10.698 -4.296 9.949 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -12.043 -2.360 8.822 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -10.786 -2.338 7.601 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -12.471 -3.527 6.562 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -11.419 -4.801 7.145 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -12.970 -5.219 9.049 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -14.019 -3.935 8.481 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -14.421 -5.201 6.360 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -13.372 -6.485 6.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -15.680 -6.979 7.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -14.830 -6.799 8.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -15.847 -5.555 8.278 1.00 0.00 H new ATOM 344 N ILE A 47 -7.847 -3.483 8.593 1.00 0.00 N ATOM 345 CA ILE A 47 -6.533 -4.093 8.222 1.00 0.00 C ATOM 346 C ILE A 47 -6.026 -4.887 9.496 1.00 0.00 C ATOM 347 O ILE A 47 -5.973 -6.110 9.366 1.00 0.00 O ATOM 348 CB ILE A 47 -5.518 -2.998 7.628 1.00 0.00 C ATOM 349 CG1 ILE A 47 -5.980 -2.086 6.409 1.00 0.00 C ATOM 350 CG2 ILE A 47 -4.129 -3.621 7.273 1.00 0.00 C ATOM 351 CD1 ILE A 47 -6.492 -2.657 5.060 1.00 0.00 C ATOM 0 H ILE A 47 -7.787 -2.476 8.745 1.00 0.00 H new ATOM 0 HA ILE A 47 -6.621 -4.802 7.399 1.00 0.00 H new ATOM 0 HB ILE A 47 -5.473 -2.311 8.473 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -6.772 -1.442 6.790 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -5.134 -1.442 6.169 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -3.474 -2.846 6.875 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -3.682 -4.048 8.170 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -4.261 -4.403 6.526 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -6.746 -1.835 4.390 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -5.713 -3.269 4.605 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -7.377 -3.268 5.236 1.00 0.00 H new ATOM 363 N ALA A 48 -5.715 -4.267 10.672 1.00 0.00 N ATOM 364 CA ALA A 48 -5.294 -5.012 11.901 1.00 0.00 C ATOM 365 C ALA A 48 -6.197 -6.168 12.431 1.00 0.00 C ATOM 366 O ALA A 48 -5.659 -7.071 13.081 1.00 0.00 O ATOM 367 CB ALA A 48 -5.051 -3.996 13.020 1.00 0.00 C ATOM 0 H ALA A 48 -5.747 -3.255 10.796 1.00 0.00 H new ATOM 0 HA ALA A 48 -4.400 -5.547 11.582 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -4.743 -4.519 13.926 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -4.267 -3.302 12.717 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -5.970 -3.443 13.215 1.00 0.00 H new ATOM 373 N GLU A 49 -7.514 -6.150 12.112 1.00 0.00 N ATOM 374 CA GLU A 49 -8.451 -7.290 12.357 1.00 0.00 C ATOM 375 C GLU A 49 -8.251 -8.456 11.327 1.00 0.00 C ATOM 376 O GLU A 49 -8.147 -9.600 11.790 1.00 0.00 O ATOM 377 CB GLU A 49 -9.939 -6.810 12.410 1.00 0.00 C ATOM 378 CG GLU A 49 -10.396 -5.906 13.583 1.00 0.00 C ATOM 379 CD GLU A 49 -10.592 -6.633 14.913 1.00 0.00 C ATOM 380 OE1 GLU A 49 -11.821 -7.234 14.990 1.00 0.00 O ATOM 381 OE2 GLU A 49 -9.740 -6.666 15.800 1.00 0.00 O ATOM 0 H GLU A 49 -7.964 -5.345 11.676 1.00 0.00 H new ATOM 0 HA GLU A 49 -8.205 -7.696 13.338 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -10.145 -6.275 11.483 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -10.571 -7.698 12.413 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -9.659 -5.115 13.722 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -11.333 -5.423 13.307 1.00 0.00 H new ATOM 388 N ASN A 50 -8.137 -8.191 9.989 1.00 0.00 N ATOM 389 CA ASN A 50 -7.776 -9.213 8.971 1.00 0.00 C ATOM 390 C ASN A 50 -6.301 -9.734 9.081 1.00 0.00 C ATOM 391 O ASN A 50 -6.148 -10.956 9.059 1.00 0.00 O ATOM 392 CB ASN A 50 -8.134 -8.651 7.568 1.00 0.00 C ATOM 393 CG ASN A 50 -9.636 -8.659 7.205 1.00 0.00 C ATOM 394 OD1 ASN A 50 -10.307 -9.686 7.307 1.00 0.00 O ATOM 395 ND2 ASN A 50 -10.189 -7.539 6.768 1.00 0.00 N ATOM 0 H ASN A 50 -8.294 -7.264 9.594 1.00 0.00 H new ATOM 0 HA ASN A 50 -8.362 -10.113 9.157 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -7.769 -7.626 7.504 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -7.595 -9.229 6.817 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -11.177 -7.523 6.513 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -9.628 -6.691 6.686 1.00 0.00 H new ATOM 402 N VAL A 51 -5.271 -8.860 9.279 1.00 0.00 N ATOM 403 CA VAL A 51 -3.819 -9.232 9.490 1.00 0.00 C ATOM 404 C VAL A 51 -3.650 -10.110 10.794 1.00 0.00 C ATOM 405 O VAL A 51 -2.990 -11.149 10.678 1.00 0.00 O ATOM 406 CB VAL A 51 -2.857 -7.961 9.450 1.00 0.00 C ATOM 407 CG1 VAL A 51 -1.334 -8.297 9.569 1.00 0.00 C ATOM 408 CG2 VAL A 51 -3.007 -7.025 8.208 1.00 0.00 C ATOM 0 H VAL A 51 -5.420 -7.851 9.299 1.00 0.00 H new ATOM 0 HA VAL A 51 -3.503 -9.852 8.651 1.00 0.00 H new ATOM 0 HB VAL A 51 -3.208 -7.433 10.337 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -0.754 -7.375 9.533 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -1.147 -8.807 10.514 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -1.039 -8.944 8.743 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -2.304 -6.196 8.290 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -2.798 -7.590 7.299 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -4.024 -6.635 8.167 1.00 0.00 H new ATOM 418 N GLU A 52 -4.238 -9.734 11.966 1.00 0.00 N ATOM 419 CA GLU A 52 -4.314 -10.628 13.176 1.00 0.00 C ATOM 420 C GLU A 52 -5.007 -12.012 12.908 1.00 0.00 C ATOM 421 O GLU A 52 -4.532 -12.997 13.483 1.00 0.00 O ATOM 422 CB GLU A 52 -4.986 -9.908 14.386 1.00 0.00 C ATOM 423 CG GLU A 52 -4.150 -8.830 15.112 1.00 0.00 C ATOM 424 CD GLU A 52 -4.928 -8.169 16.242 1.00 0.00 C ATOM 425 OE1 GLU A 52 -4.939 -8.592 17.397 1.00 0.00 O ATOM 426 OE2 GLU A 52 -5.606 -7.058 15.813 1.00 0.00 O ATOM 0 H GLU A 52 -4.668 -8.820 12.105 1.00 0.00 H new ATOM 0 HA GLU A 52 -3.276 -10.848 13.427 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -5.907 -9.443 14.035 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -5.270 -10.666 15.116 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -3.244 -9.283 15.513 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -3.837 -8.071 14.395 1.00 0.00 H new ATOM 433 N GLU A 53 -6.050 -12.085 12.032 1.00 0.00 N ATOM 434 CA GLU A 53 -6.609 -13.379 11.527 1.00 0.00 C ATOM 435 C GLU A 53 -5.629 -14.167 10.576 1.00 0.00 C ATOM 436 O GLU A 53 -5.569 -15.395 10.720 1.00 0.00 O ATOM 437 CB GLU A 53 -8.011 -13.114 10.905 1.00 0.00 C ATOM 438 CG GLU A 53 -8.895 -14.349 10.577 1.00 0.00 C ATOM 439 CD GLU A 53 -8.700 -14.852 9.152 1.00 0.00 C ATOM 440 OE1 GLU A 53 -7.650 -15.724 9.057 1.00 0.00 O ATOM 441 OE2 GLU A 53 -9.411 -14.507 8.210 1.00 0.00 O ATOM 0 H GLU A 53 -6.523 -11.262 11.659 1.00 0.00 H new ATOM 0 HA GLU A 53 -6.729 -14.058 12.372 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -8.567 -12.474 11.590 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -7.869 -12.548 9.984 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -8.663 -15.152 11.276 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -9.943 -14.090 10.726 1.00 0.00 H new ATOM 448 N VAL A 54 -4.846 -13.500 9.677 1.00 0.00 N ATOM 449 CA VAL A 54 -3.713 -14.129 8.878 1.00 0.00 C ATOM 450 C VAL A 54 -2.772 -14.935 9.835 1.00 0.00 C ATOM 451 O VAL A 54 -2.602 -16.120 9.572 1.00 0.00 O ATOM 452 CB VAL A 54 -2.889 -13.104 7.967 1.00 0.00 C ATOM 453 CG1 VAL A 54 -1.778 -13.725 7.054 1.00 0.00 C ATOM 454 CG2 VAL A 54 -3.760 -12.224 7.050 1.00 0.00 C ATOM 0 H VAL A 54 -4.971 -12.508 9.475 1.00 0.00 H new ATOM 0 HA VAL A 54 -4.181 -14.807 8.165 1.00 0.00 H new ATOM 0 HB VAL A 54 -2.414 -12.508 8.746 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -1.290 -12.933 6.485 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -1.040 -14.234 7.674 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -2.230 -14.440 6.366 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -3.121 -11.560 6.469 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -4.333 -12.859 6.374 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.443 -11.630 7.657 1.00 0.00 H new ATOM 464 N LYS A 55 -2.238 -14.344 10.922 1.00 0.00 N ATOM 465 CA LYS A 55 -1.282 -15.052 11.837 1.00 0.00 C ATOM 466 C LYS A 55 -1.838 -16.300 12.581 1.00 0.00 C ATOM 467 O LYS A 55 -1.012 -17.170 12.877 1.00 0.00 O ATOM 468 CB LYS A 55 -0.654 -14.098 12.894 1.00 0.00 C ATOM 469 CG LYS A 55 0.279 -12.958 12.388 1.00 0.00 C ATOM 470 CD LYS A 55 0.803 -11.952 13.444 1.00 0.00 C ATOM 471 CE LYS A 55 -0.165 -10.833 13.893 1.00 0.00 C ATOM 472 NZ LYS A 55 0.501 -9.905 14.821 1.00 0.00 N ATOM 0 H LYS A 55 -2.443 -13.384 11.198 1.00 0.00 H new ATOM 0 HA LYS A 55 -0.528 -15.413 11.138 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -1.468 -13.639 13.455 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -0.086 -14.707 13.597 1.00 0.00 H new ATOM 0 HG2 LYS A 55 1.140 -13.417 11.902 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -0.258 -12.396 11.623 1.00 0.00 H new ATOM 0 HD2 LYS A 55 1.102 -12.515 14.328 1.00 0.00 H new ATOM 0 HD3 LYS A 55 1.702 -11.482 13.046 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -0.525 -10.286 13.021 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -1.037 -11.273 14.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -0.168 -9.162 15.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 0.823 -10.426 15.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 1.319 -9.470 14.349 1.00 0.00 H new ATOM 486 N ARG A 56 -3.164 -16.404 12.863 1.00 0.00 N ATOM 487 CA ARG A 56 -3.772 -17.699 13.350 1.00 0.00 C ATOM 488 C ARG A 56 -3.941 -18.765 12.206 1.00 0.00 C ATOM 489 O ARG A 56 -3.849 -19.955 12.524 1.00 0.00 O ATOM 490 CB ARG A 56 -5.098 -17.535 14.148 1.00 0.00 C ATOM 491 CG ARG A 56 -6.275 -16.735 13.559 1.00 0.00 C ATOM 492 CD ARG A 56 -7.465 -16.558 14.515 1.00 0.00 C ATOM 493 NE ARG A 56 -8.518 -15.720 13.892 1.00 0.00 N ATOM 494 CZ ARG A 56 -9.731 -15.415 14.419 1.00 0.00 C ATOM 495 NH1 ARG A 56 -10.200 -15.819 15.609 1.00 0.00 N ATOM 496 NH2 ARG A 56 -10.524 -14.648 13.693 1.00 0.00 N ATOM 0 H ARG A 56 -3.828 -15.636 12.769 1.00 0.00 H new ATOM 0 HA ARG A 56 -3.035 -18.075 14.060 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -5.468 -18.537 14.365 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -4.843 -17.075 15.103 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -5.915 -15.750 13.260 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -6.622 -17.236 12.655 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -7.876 -17.533 14.776 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -7.127 -16.096 15.443 1.00 0.00 H new ATOM 0 HE ARG A 56 -8.309 -15.333 12.972 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -9.626 -16.412 16.208 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -11.130 -15.533 15.914 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -10.214 -14.313 12.781 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -11.446 -14.390 14.045 1.00 0.00 H new ATOM 510 N LYS A 57 -4.138 -18.348 10.929 1.00 0.00 N ATOM 511 CA LYS A 57 -4.115 -19.246 9.734 1.00 0.00 C ATOM 512 C LYS A 57 -2.646 -19.594 9.278 1.00 0.00 C ATOM 513 O LYS A 57 -2.200 -20.728 9.456 1.00 0.00 O ATOM 514 CB LYS A 57 -5.008 -18.595 8.612 1.00 0.00 C ATOM 515 CG LYS A 57 -6.547 -18.683 8.702 1.00 0.00 C ATOM 516 CD LYS A 57 -7.194 -19.998 8.208 1.00 0.00 C ATOM 517 CE LYS A 57 -8.730 -20.078 8.319 1.00 0.00 C ATOM 518 NZ LYS A 57 -9.215 -20.398 9.679 1.00 0.00 N ATOM 0 H LYS A 57 -4.319 -17.372 10.693 1.00 0.00 H new ATOM 0 HA LYS A 57 -4.542 -20.218 9.982 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -4.746 -17.538 8.562 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -4.713 -19.042 7.663 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -6.837 -18.530 9.741 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -6.970 -17.858 8.128 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -6.917 -20.147 7.164 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -6.765 -20.826 8.773 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -9.158 -19.126 8.006 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -9.096 -20.835 7.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -10.254 -20.435 9.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -8.836 -21.320 9.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -8.896 -19.664 10.343 1.00 0.00 H new ATOM 532 N HIS A 58 -1.925 -18.605 8.719 1.00 0.00 N ATOM 533 CA HIS A 58 -0.606 -18.706 8.019 1.00 0.00 C ATOM 534 C HIS A 58 0.578 -19.446 8.724 1.00 0.00 C ATOM 535 O HIS A 58 1.481 -19.940 8.049 1.00 0.00 O ATOM 536 CB HIS A 58 -0.265 -17.209 7.698 1.00 0.00 C ATOM 537 CG HIS A 58 0.339 -16.894 6.340 1.00 0.00 C ATOM 538 ND1 HIS A 58 1.479 -16.120 6.174 1.00 0.00 N ATOM 539 CD2 HIS A 58 -0.430 -16.901 5.162 1.00 0.00 C ATOM 540 CE1 HIS A 58 1.287 -15.742 4.868 1.00 0.00 C ATOM 541 NE2 HIS A 58 0.199 -16.185 4.170 1.00 0.00 N ATOM 0 H HIS A 58 -2.261 -17.642 8.739 1.00 0.00 H new ATOM 0 HA HIS A 58 -0.718 -19.367 7.159 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -1.182 -16.628 7.799 1.00 0.00 H new ATOM 0 HB3 HIS A 58 0.425 -16.852 8.462 1.00 0.00 H new ATOM 0 HD1 HIS A 58 2.232 -15.899 6.825 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -1.382 -17.399 5.052 1.00 0.00 H new ATOM 0 HE1 HIS A 58 2.002 -15.089 4.389 1.00 0.00 H new ATOM 549 N SER A 59 0.533 -19.472 10.061 1.00 0.00 N ATOM 550 CA SER A 59 1.410 -20.283 10.946 1.00 0.00 C ATOM 551 C SER A 59 0.872 -21.698 11.310 1.00 0.00 C ATOM 552 O SER A 59 1.724 -22.578 11.476 1.00 0.00 O ATOM 553 CB SER A 59 1.712 -19.471 12.217 1.00 0.00 C ATOM 554 OG SER A 59 2.400 -18.269 11.894 1.00 0.00 O ATOM 0 H SER A 59 -0.137 -18.911 10.587 1.00 0.00 H new ATOM 0 HA SER A 59 2.317 -20.485 10.376 1.00 0.00 H new ATOM 0 HB2 SER A 59 0.782 -19.236 12.734 1.00 0.00 H new ATOM 0 HB3 SER A 59 2.315 -20.068 12.901 1.00 0.00 H new ATOM 0 HG SER A 59 2.582 -17.765 12.715 1.00 0.00 H new ATOM 560 N ALA A 60 -0.466 -21.921 11.469 1.00 0.00 N ATOM 561 CA ALA A 60 -1.041 -23.272 11.696 1.00 0.00 C ATOM 562 C ALA A 60 -1.146 -24.161 10.429 1.00 0.00 C ATOM 563 O ALA A 60 -1.137 -25.379 10.595 1.00 0.00 O ATOM 564 CB ALA A 60 -2.423 -23.100 12.334 1.00 0.00 C ATOM 0 H ALA A 60 -1.163 -21.177 11.443 1.00 0.00 H new ATOM 0 HA ALA A 60 -0.351 -23.803 12.351 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -2.867 -24.080 12.511 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -2.323 -22.571 13.282 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.064 -22.527 11.664 1.00 0.00 H new ATOM 570 N ILE A 61 -1.233 -23.565 9.218 1.00 0.00 N ATOM 571 CA ILE A 61 -1.208 -24.249 7.897 1.00 0.00 C ATOM 572 C ILE A 61 0.274 -24.380 7.426 1.00 0.00 C ATOM 573 O ILE A 61 0.598 -25.471 6.951 1.00 0.00 O ATOM 574 CB ILE A 61 -2.131 -23.511 6.819 1.00 0.00 C ATOM 575 CG1 ILE A 61 -3.498 -22.859 7.289 1.00 0.00 C ATOM 576 CG2 ILE A 61 -2.392 -24.505 5.635 1.00 0.00 C ATOM 577 CD1 ILE A 61 -4.197 -21.807 6.391 1.00 0.00 C ATOM 0 H ILE A 61 -1.326 -22.553 9.126 1.00 0.00 H new ATOM 0 HA ILE A 61 -1.632 -25.247 8.002 1.00 0.00 H new ATOM 0 HB ILE A 61 -1.550 -22.631 6.542 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -4.207 -23.671 7.451 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -3.320 -22.393 8.258 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -3.020 -24.022 4.887 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.442 -24.789 5.182 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -2.895 -25.395 6.012 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.116 -21.472 6.871 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.533 -20.955 6.244 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.434 -22.253 5.425 1.00 0.00 H new ATOM 734 N LYS A 72 -6.146 -23.389 2.250 1.00 0.00 N ATOM 735 CA LYS A 72 -5.427 -22.365 1.428 1.00 0.00 C ATOM 736 C LYS A 72 -6.382 -21.592 0.481 1.00 0.00 C ATOM 737 O LYS A 72 -6.175 -20.394 0.283 1.00 0.00 O ATOM 738 CB LYS A 72 -4.313 -23.049 0.580 1.00 0.00 C ATOM 739 CG LYS A 72 -2.994 -23.430 1.311 1.00 0.00 C ATOM 740 CD LYS A 72 -1.957 -24.252 0.509 1.00 0.00 C ATOM 741 CE LYS A 72 -1.071 -23.467 -0.477 1.00 0.00 C ATOM 742 NZ LYS A 72 -0.095 -24.353 -1.132 1.00 0.00 N ATOM 0 HA LYS A 72 -4.990 -21.648 2.123 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -4.731 -23.956 0.143 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -4.061 -22.384 -0.246 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -2.513 -22.510 1.643 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -3.254 -23.995 2.206 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -1.307 -24.765 1.218 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -2.490 -25.021 -0.050 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -1.696 -22.989 -1.231 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -0.547 -22.672 0.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 0.489 -23.799 -1.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 0.515 -24.790 -0.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -0.599 -25.097 -1.657 1.00 0.00 H new ATOM 756 N GLU A 73 -7.381 -22.272 -0.120 1.00 0.00 N ATOM 757 CA GLU A 73 -8.514 -21.681 -0.877 1.00 0.00 C ATOM 758 C GLU A 73 -9.226 -20.420 -0.251 1.00 0.00 C ATOM 759 O GLU A 73 -9.640 -19.550 -1.023 1.00 0.00 O ATOM 760 CB GLU A 73 -9.431 -22.917 -1.153 1.00 0.00 C ATOM 761 CG GLU A 73 -9.265 -23.679 -2.495 1.00 0.00 C ATOM 762 CD GLU A 73 -9.952 -23.006 -3.682 1.00 0.00 C ATOM 763 OE1 GLU A 73 -9.439 -22.104 -4.341 1.00 0.00 O ATOM 764 OE2 GLU A 73 -11.197 -23.530 -3.915 1.00 0.00 O ATOM 0 H GLU A 73 -7.426 -23.291 -0.092 1.00 0.00 H new ATOM 0 HA GLU A 73 -8.170 -21.194 -1.790 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -9.276 -23.632 -0.345 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -10.466 -22.582 -1.088 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -8.202 -23.781 -2.714 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -9.665 -24.687 -2.381 1.00 0.00 H new ATOM 771 N GLU A 74 -9.331 -20.334 1.098 1.00 0.00 N ATOM 772 CA GLU A 74 -9.759 -19.096 1.833 1.00 0.00 C ATOM 773 C GLU A 74 -8.639 -17.997 1.949 1.00 0.00 C ATOM 774 O GLU A 74 -9.010 -16.821 2.073 1.00 0.00 O ATOM 775 CB GLU A 74 -10.296 -19.431 3.258 1.00 0.00 C ATOM 776 CG GLU A 74 -11.687 -20.101 3.347 1.00 0.00 C ATOM 777 CD GLU A 74 -12.076 -20.424 4.784 1.00 0.00 C ATOM 778 OE1 GLU A 74 -12.548 -19.596 5.561 1.00 0.00 O ATOM 779 OE2 GLU A 74 -11.837 -21.736 5.095 1.00 0.00 O ATOM 0 H GLU A 74 -9.123 -21.117 1.717 1.00 0.00 H new ATOM 0 HA GLU A 74 -10.559 -18.678 1.222 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -9.574 -20.085 3.747 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -10.329 -18.506 3.833 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -12.436 -19.441 2.909 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -11.686 -21.018 2.757 1.00 0.00 H new ATOM 786 N LEU A 75 -7.316 -18.333 1.910 1.00 0.00 N ATOM 787 CA LEU A 75 -6.183 -17.364 1.874 1.00 0.00 C ATOM 788 C LEU A 75 -6.191 -16.361 0.674 1.00 0.00 C ATOM 789 O LEU A 75 -5.841 -15.200 0.903 1.00 0.00 O ATOM 790 CB LEU A 75 -4.813 -18.116 1.980 1.00 0.00 C ATOM 791 CG LEU A 75 -4.421 -19.018 3.217 1.00 0.00 C ATOM 792 CD1 LEU A 75 -3.086 -19.775 2.987 1.00 0.00 C ATOM 793 CD2 LEU A 75 -4.365 -18.286 4.580 1.00 0.00 C ATOM 0 H LEU A 75 -7.004 -19.304 1.903 1.00 0.00 H new ATOM 0 HA LEU A 75 -6.325 -16.731 2.750 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.740 -18.752 1.098 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -4.036 -17.357 1.891 1.00 0.00 H new ATOM 0 HG LEU A 75 -5.247 -19.726 3.281 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -2.856 -20.382 3.863 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -3.179 -20.420 2.113 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -2.283 -19.056 2.824 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -4.087 -18.993 5.362 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -3.625 -17.487 4.534 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -5.343 -17.862 4.805 1.00 0.00 H new ATOM 805 N GLU A 76 -6.599 -16.776 -0.553 1.00 0.00 N ATOM 806 CA GLU A 76 -6.872 -15.821 -1.684 1.00 0.00 C ATOM 807 C GLU A 76 -8.055 -14.799 -1.455 1.00 0.00 C ATOM 808 O GLU A 76 -8.053 -13.762 -2.125 1.00 0.00 O ATOM 809 CB GLU A 76 -7.036 -16.580 -3.036 1.00 0.00 C ATOM 810 CG GLU A 76 -8.189 -17.590 -3.287 1.00 0.00 C ATOM 811 CD GLU A 76 -8.137 -18.176 -4.691 1.00 0.00 C ATOM 812 OE1 GLU A 76 -8.652 -17.315 -5.624 1.00 0.00 O ATOM 813 OE2 GLU A 76 -7.684 -19.291 -4.944 1.00 0.00 O ATOM 0 H GLU A 76 -6.748 -17.756 -0.794 1.00 0.00 H new ATOM 0 HA GLU A 76 -5.982 -15.193 -1.723 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -7.111 -15.820 -3.814 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -6.105 -17.120 -3.206 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -8.131 -18.396 -2.555 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -9.147 -17.092 -3.137 1.00 0.00 H new ATOM 820 N GLU A 77 -8.998 -15.080 -0.517 1.00 0.00 N ATOM 821 CA GLU A 77 -10.043 -14.117 -0.043 1.00 0.00 C ATOM 822 C GLU A 77 -9.459 -13.069 0.967 1.00 0.00 C ATOM 823 O GLU A 77 -9.559 -11.879 0.649 1.00 0.00 O ATOM 824 CB GLU A 77 -11.292 -14.870 0.535 1.00 0.00 C ATOM 825 CG GLU A 77 -12.244 -15.518 -0.481 1.00 0.00 C ATOM 826 CD GLU A 77 -13.435 -16.195 0.184 1.00 0.00 C ATOM 827 OE1 GLU A 77 -13.361 -17.275 0.768 1.00 0.00 O ATOM 828 OE2 GLU A 77 -14.582 -15.459 0.050 1.00 0.00 O ATOM 0 H GLU A 77 -9.059 -15.990 -0.060 1.00 0.00 H new ATOM 0 HA GLU A 77 -10.384 -13.551 -0.910 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -10.936 -15.648 1.211 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -11.866 -14.164 1.135 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -12.603 -14.757 -1.174 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -11.695 -16.253 -1.071 1.00 0.00 H new ATOM 835 N LEU A 78 -8.846 -13.472 2.116 1.00 0.00 N ATOM 836 CA LEU A 78 -8.170 -12.550 3.074 1.00 0.00 C ATOM 837 C LEU A 78 -6.922 -11.769 2.559 1.00 0.00 C ATOM 838 O LEU A 78 -6.733 -10.637 3.021 1.00 0.00 O ATOM 839 CB LEU A 78 -7.872 -13.319 4.399 1.00 0.00 C ATOM 840 CG LEU A 78 -6.950 -14.587 4.578 1.00 0.00 C ATOM 841 CD1 LEU A 78 -5.458 -14.430 4.162 1.00 0.00 C ATOM 842 CD2 LEU A 78 -7.020 -15.130 6.034 1.00 0.00 C ATOM 0 H LEU A 78 -8.807 -14.450 2.404 1.00 0.00 H new ATOM 0 HA LEU A 78 -8.883 -11.742 3.238 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -7.470 -12.571 5.083 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -8.847 -13.614 4.787 1.00 0.00 H new ATOM 0 HG LEU A 78 -7.371 -15.298 3.867 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -4.932 -15.369 4.333 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -5.400 -14.169 3.105 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -4.996 -13.642 4.756 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -6.375 -16.004 6.128 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -6.687 -14.357 6.727 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -8.047 -15.410 6.269 1.00 0.00 H new ATOM 854 N MET A 79 -6.141 -12.320 1.597 1.00 0.00 N ATOM 855 CA MET A 79 -5.042 -11.583 0.891 1.00 0.00 C ATOM 856 C MET A 79 -5.598 -10.505 -0.104 1.00 0.00 C ATOM 857 O MET A 79 -5.258 -9.337 0.108 1.00 0.00 O ATOM 858 CB MET A 79 -4.043 -12.578 0.209 1.00 0.00 C ATOM 859 CG MET A 79 -2.986 -13.258 1.096 1.00 0.00 C ATOM 860 SD MET A 79 -1.816 -14.115 0.026 1.00 0.00 S ATOM 861 CE MET A 79 -0.603 -14.635 1.250 1.00 0.00 C ATOM 0 H MET A 79 -6.248 -13.285 1.283 1.00 0.00 H new ATOM 0 HA MET A 79 -4.478 -11.031 1.643 1.00 0.00 H new ATOM 0 HB2 MET A 79 -4.628 -13.361 -0.274 1.00 0.00 H new ATOM 0 HB3 MET A 79 -3.520 -12.038 -0.580 1.00 0.00 H new ATOM 0 HG2 MET A 79 -2.470 -12.518 1.707 1.00 0.00 H new ATOM 0 HG3 MET A 79 -3.460 -13.961 1.780 1.00 0.00 H new ATOM 0 HE1 MET A 79 0.225 -15.138 0.751 1.00 0.00 H new ATOM 0 HE2 MET A 79 -0.228 -13.762 1.785 1.00 0.00 H new ATOM 0 HE3 MET A 79 -1.070 -15.320 1.957 1.00 0.00 H new ATOM 871 N SER A 80 -6.479 -10.836 -1.091 1.00 0.00 N ATOM 872 CA SER A 80 -7.203 -9.820 -1.919 1.00 0.00 C ATOM 873 C SER A 80 -8.055 -8.749 -1.167 1.00 0.00 C ATOM 874 O SER A 80 -8.217 -7.655 -1.714 1.00 0.00 O ATOM 875 CB SER A 80 -8.061 -10.559 -2.957 1.00 0.00 C ATOM 876 OG SER A 80 -8.618 -9.645 -3.893 1.00 0.00 O ATOM 0 H SER A 80 -6.707 -11.800 -1.335 1.00 0.00 H new ATOM 0 HA SER A 80 -6.416 -9.219 -2.374 1.00 0.00 H new ATOM 0 HB2 SER A 80 -7.452 -11.297 -3.480 1.00 0.00 H new ATOM 0 HB3 SER A 80 -8.860 -11.104 -2.454 1.00 0.00 H new ATOM 0 HG SER A 80 -9.160 -10.135 -4.546 1.00 0.00 H new ATOM 882 N ASP A 81 -8.538 -9.052 0.062 1.00 0.00 N ATOM 883 CA ASP A 81 -9.171 -8.070 0.991 1.00 0.00 C ATOM 884 C ASP A 81 -8.187 -7.019 1.594 1.00 0.00 C ATOM 885 O ASP A 81 -8.530 -5.833 1.560 1.00 0.00 O ATOM 886 CB ASP A 81 -9.918 -8.854 2.110 1.00 0.00 C ATOM 887 CG ASP A 81 -11.106 -8.109 2.714 1.00 0.00 C ATOM 888 OD1 ASP A 81 -11.001 -7.290 3.626 1.00 0.00 O ATOM 889 OD2 ASP A 81 -12.288 -8.464 2.119 1.00 0.00 O ATOM 0 H ASP A 81 -8.501 -9.996 0.446 1.00 0.00 H new ATOM 0 HA ASP A 81 -9.871 -7.476 0.403 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -10.268 -9.802 1.701 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -9.211 -9.092 2.905 1.00 0.00 H new ATOM 894 N ILE A 82 -6.991 -7.441 2.094 1.00 0.00 N ATOM 895 CA ILE A 82 -5.931 -6.515 2.618 1.00 0.00 C ATOM 896 C ILE A 82 -5.303 -5.676 1.425 1.00 0.00 C ATOM 897 O ILE A 82 -5.172 -4.472 1.648 1.00 0.00 O ATOM 898 CB ILE A 82 -4.913 -7.323 3.549 1.00 0.00 C ATOM 899 CG1 ILE A 82 -5.573 -7.970 4.851 1.00 0.00 C ATOM 900 CG2 ILE A 82 -3.693 -6.440 3.973 1.00 0.00 C ATOM 901 CD1 ILE A 82 -4.897 -9.207 5.504 1.00 0.00 C ATOM 0 H ILE A 82 -6.731 -8.426 2.147 1.00 0.00 H new ATOM 0 HA ILE A 82 -6.348 -5.756 3.280 1.00 0.00 H new ATOM 0 HB ILE A 82 -4.577 -8.149 2.922 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.635 -7.190 5.610 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -6.595 -8.250 4.597 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -3.024 -7.024 4.605 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -3.156 -6.110 3.084 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -4.048 -5.571 4.526 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -5.473 -9.519 6.375 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -4.859 -10.024 4.783 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -3.884 -8.948 5.812 1.00 0.00 H new ATOM 913 N LYS A 83 -4.966 -6.232 0.230 1.00 0.00 N ATOM 914 CA LYS A 83 -4.573 -5.414 -0.974 1.00 0.00 C ATOM 915 C LYS A 83 -5.695 -4.485 -1.529 1.00 0.00 C ATOM 916 O LYS A 83 -5.340 -3.375 -1.931 1.00 0.00 O ATOM 917 CB LYS A 83 -4.019 -6.276 -2.157 1.00 0.00 C ATOM 918 CG LYS A 83 -2.662 -7.012 -1.999 1.00 0.00 C ATOM 919 CD LYS A 83 -2.728 -8.333 -1.203 1.00 0.00 C ATOM 920 CE LYS A 83 -1.375 -9.050 -1.082 1.00 0.00 C ATOM 921 NZ LYS A 83 -1.506 -10.260 -0.260 1.00 0.00 N ATOM 0 H LYS A 83 -4.955 -7.238 0.065 1.00 0.00 H new ATOM 0 HA LYS A 83 -3.778 -4.783 -0.576 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -4.772 -7.028 -2.393 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -3.937 -5.623 -3.026 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -2.262 -7.222 -2.991 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -1.957 -6.342 -1.506 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -3.110 -8.126 -0.203 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -3.442 -9.002 -1.684 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -1.007 -9.315 -2.073 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -0.640 -8.379 -0.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -0.593 -10.475 0.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -2.226 -10.105 0.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -1.792 -11.059 -0.861 1.00 0.00 H new ATOM 935 N LYS A 84 -6.990 -4.900 -1.531 1.00 0.00 N ATOM 936 CA LYS A 84 -8.126 -4.020 -1.978 1.00 0.00 C ATOM 937 C LYS A 84 -8.415 -2.803 -1.028 1.00 0.00 C ATOM 938 O LYS A 84 -8.499 -1.685 -1.554 1.00 0.00 O ATOM 939 CB LYS A 84 -9.411 -4.870 -2.248 1.00 0.00 C ATOM 940 CG LYS A 84 -9.506 -5.609 -3.599 1.00 0.00 C ATOM 941 CD LYS A 84 -10.707 -6.569 -3.824 1.00 0.00 C ATOM 942 CE LYS A 84 -12.066 -5.957 -4.246 1.00 0.00 C ATOM 943 NZ LYS A 84 -12.122 -5.540 -5.662 1.00 0.00 N ATOM 0 H LYS A 84 -7.282 -5.831 -1.232 1.00 0.00 H new ATOM 0 HA LYS A 84 -7.804 -3.566 -2.915 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -9.498 -5.611 -1.453 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -10.274 -4.210 -2.164 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -9.526 -4.858 -4.389 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -8.590 -6.185 -3.730 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -10.417 -7.292 -4.586 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -10.865 -7.126 -2.900 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -12.855 -6.686 -4.061 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -12.276 -5.094 -3.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -13.060 -5.141 -5.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -11.392 -4.821 -5.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -11.953 -6.364 -6.274 1.00 0.00 H new ATOM 957 N THR A 85 -8.484 -2.983 0.323 1.00 0.00 N ATOM 958 CA THR A 85 -8.587 -1.870 1.312 1.00 0.00 C ATOM 959 C THR A 85 -7.209 -1.116 1.410 1.00 0.00 C ATOM 960 O THR A 85 -7.226 0.046 1.013 1.00 0.00 O ATOM 961 CB THR A 85 -9.180 -2.453 2.640 1.00 0.00 C ATOM 962 OG1 THR A 85 -10.367 -3.196 2.371 1.00 0.00 O ATOM 963 CG2 THR A 85 -9.579 -1.437 3.728 1.00 0.00 C ATOM 0 H THR A 85 -8.470 -3.906 0.757 1.00 0.00 H new ATOM 0 HA THR A 85 -9.281 -1.086 1.009 1.00 0.00 H new ATOM 0 HB THR A 85 -8.351 -3.047 3.024 1.00 0.00 H new ATOM 0 HG1 THR A 85 -10.725 -3.555 3.209 1.00 0.00 H new ATOM 0 HG21 THR A 85 -9.974 -1.968 4.594 1.00 0.00 H new ATOM 0 HG22 THR A 85 -8.704 -0.859 4.025 1.00 0.00 H new ATOM 0 HG23 THR A 85 -10.342 -0.764 3.336 1.00 0.00 H new ATOM 971 N ALA A 86 -6.046 -1.712 1.806 1.00 0.00 N ATOM 972 CA ALA A 86 -4.732 -0.986 1.880 1.00 0.00 C ATOM 973 C ALA A 86 -4.287 -0.165 0.629 1.00 0.00 C ATOM 974 O ALA A 86 -3.702 0.898 0.833 1.00 0.00 O ATOM 975 CB ALA A 86 -3.625 -1.956 2.298 1.00 0.00 C ATOM 0 H ALA A 86 -5.987 -2.693 2.080 1.00 0.00 H new ATOM 0 HA ALA A 86 -4.907 -0.216 2.632 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -2.675 -1.424 2.350 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -3.859 -2.376 3.276 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -3.551 -2.760 1.566 1.00 0.00 H new ATOM 981 N ASN A 87 -4.600 -0.619 -0.611 1.00 0.00 N ATOM 982 CA ASN A 87 -4.445 0.189 -1.866 1.00 0.00 C ATOM 983 C ASN A 87 -5.504 1.345 -1.965 1.00 0.00 C ATOM 984 O ASN A 87 -5.098 2.464 -2.296 1.00 0.00 O ATOM 985 CB ASN A 87 -4.434 -0.738 -3.113 1.00 0.00 C ATOM 986 CG ASN A 87 -3.882 -0.094 -4.400 1.00 0.00 C ATOM 987 OD1 ASN A 87 -4.627 0.513 -5.167 1.00 0.00 O ATOM 988 ND2 ASN A 87 -2.587 -0.208 -4.664 1.00 0.00 N ATOM 0 H ASN A 87 -4.968 -1.556 -0.778 1.00 0.00 H new ATOM 0 HA ASN A 87 -3.478 0.690 -1.829 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -3.840 -1.623 -2.884 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -5.452 -1.078 -3.303 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -2.200 0.210 -5.510 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -1.978 -0.714 -4.021 1.00 0.00 H new ATOM 995 N LYS A 88 -6.805 1.092 -1.651 1.00 0.00 N ATOM 996 CA LYS A 88 -7.864 2.141 -1.465 1.00 0.00 C ATOM 997 C LYS A 88 -7.528 3.238 -0.380 1.00 0.00 C ATOM 998 O LYS A 88 -7.831 4.403 -0.631 1.00 0.00 O ATOM 999 CB LYS A 88 -9.226 1.424 -1.153 1.00 0.00 C ATOM 1000 CG LYS A 88 -10.025 0.883 -2.370 1.00 0.00 C ATOM 1001 CD LYS A 88 -11.320 0.146 -2.076 1.00 0.00 C ATOM 1002 CE LYS A 88 -12.127 -0.424 -3.265 1.00 0.00 C ATOM 1003 NZ LYS A 88 -11.582 -1.689 -3.799 1.00 0.00 N ATOM 0 H LYS A 88 -7.158 0.145 -1.517 1.00 0.00 H new ATOM 0 HA LYS A 88 -7.926 2.704 -2.397 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -9.025 0.590 -0.480 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -9.863 2.124 -0.612 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -10.256 1.724 -3.024 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -9.374 0.212 -2.931 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -11.086 -0.681 -1.406 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -11.972 0.826 -1.528 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -13.157 -0.587 -2.949 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -12.152 0.317 -4.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -12.171 -2.013 -4.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -10.608 -1.535 -4.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -11.582 -2.411 -3.050 1.00 0.00 H new ATOM 1017 N VAL A 89 -6.897 2.857 0.757 1.00 0.00 N ATOM 1018 CA VAL A 89 -6.462 3.767 1.879 1.00 0.00 C ATOM 1019 C VAL A 89 -5.114 4.498 1.512 1.00 0.00 C ATOM 1020 O VAL A 89 -5.071 5.726 1.676 1.00 0.00 O ATOM 1021 CB VAL A 89 -6.358 3.024 3.296 1.00 0.00 C ATOM 1022 CG1 VAL A 89 -6.212 3.976 4.521 1.00 0.00 C ATOM 1023 CG2 VAL A 89 -7.454 1.988 3.661 1.00 0.00 C ATOM 0 H VAL A 89 -6.663 1.881 0.938 1.00 0.00 H new ATOM 0 HA VAL A 89 -7.246 4.516 1.994 1.00 0.00 H new ATOM 0 HB VAL A 89 -5.437 2.471 3.109 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -6.149 3.386 5.435 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -5.307 4.573 4.412 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -7.078 4.636 4.574 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -7.247 1.572 4.647 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -8.428 2.477 3.670 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -7.457 1.186 2.922 1.00 0.00 H new ATOM 1033 N ARG A 90 -4.042 3.771 1.087 1.00 0.00 N ATOM 1034 CA ARG A 90 -2.685 4.363 0.807 1.00 0.00 C ATOM 1035 C ARG A 90 -2.676 5.541 -0.241 1.00 0.00 C ATOM 1036 O ARG A 90 -1.962 6.525 -0.030 1.00 0.00 O ATOM 1037 CB ARG A 90 -1.681 3.189 0.539 1.00 0.00 C ATOM 1038 CG ARG A 90 -1.579 2.642 -0.886 1.00 0.00 C ATOM 1039 CD ARG A 90 -0.762 1.363 -1.148 1.00 0.00 C ATOM 1040 NE ARG A 90 0.711 1.603 -1.164 1.00 0.00 N ATOM 1041 CZ ARG A 90 1.494 1.832 -2.251 1.00 0.00 C ATOM 1042 NH1 ARG A 90 1.077 1.884 -3.524 1.00 0.00 N ATOM 1043 NH2 ARG A 90 2.782 2.021 -2.034 1.00 0.00 N ATOM 0 H ARG A 90 -4.085 2.764 0.927 1.00 0.00 H new ATOM 0 HA ARG A 90 -2.339 4.899 1.690 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -0.688 3.523 0.840 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -1.951 2.362 1.196 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -2.594 2.460 -1.240 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -1.160 3.431 -1.510 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -0.996 0.626 -0.380 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -1.065 0.935 -2.103 1.00 0.00 H new ATOM 0 HE ARG A 90 1.182 1.594 -0.259 1.00 0.00 H new ATOM 0 HH11 ARG A 90 0.091 1.745 -3.744 1.00 0.00 H new ATOM 0 HH12 ARG A 90 1.746 2.063 -4.273 1.00 0.00 H new ATOM 0 HH21 ARG A 90 3.149 1.991 -1.083 1.00 0.00 H new ATOM 0 HH22 ARG A 90 3.411 2.197 -2.818 1.00 0.00 H new ATOM 1057 N SER A 91 -3.487 5.389 -1.304 1.00 0.00 N ATOM 1058 CA SER A 91 -3.803 6.472 -2.273 1.00 0.00 C ATOM 1059 C SER A 91 -4.651 7.670 -1.734 1.00 0.00 C ATOM 1060 O SER A 91 -4.617 8.714 -2.396 1.00 0.00 O ATOM 1061 CB SER A 91 -4.521 5.838 -3.474 1.00 0.00 C ATOM 1062 OG SER A 91 -4.689 6.787 -4.520 1.00 0.00 O ATOM 0 H SER A 91 -3.949 4.506 -1.523 1.00 0.00 H new ATOM 0 HA SER A 91 -2.845 6.923 -2.531 1.00 0.00 H new ATOM 0 HB2 SER A 91 -3.947 4.986 -3.838 1.00 0.00 H new ATOM 0 HB3 SER A 91 -5.494 5.457 -3.163 1.00 0.00 H new ATOM 0 HG SER A 91 -4.653 7.693 -4.149 1.00 0.00 H new ATOM 1068 N LYS A 92 -5.375 7.545 -0.586 1.00 0.00 N ATOM 1069 CA LYS A 92 -6.057 8.688 0.090 1.00 0.00 C ATOM 1070 C LYS A 92 -5.086 9.483 1.003 1.00 0.00 C ATOM 1071 O LYS A 92 -5.088 10.710 0.851 1.00 0.00 O ATOM 1072 CB LYS A 92 -7.345 8.259 0.876 1.00 0.00 C ATOM 1073 CG LYS A 92 -8.569 7.621 0.159 1.00 0.00 C ATOM 1074 CD LYS A 92 -9.280 8.463 -0.926 1.00 0.00 C ATOM 1075 CE LYS A 92 -10.561 7.870 -1.545 1.00 0.00 C ATOM 1076 NZ LYS A 92 -11.757 8.047 -0.697 1.00 0.00 N ATOM 0 H LYS A 92 -5.502 6.654 -0.105 1.00 0.00 H new ATOM 0 HA LYS A 92 -6.386 9.351 -0.711 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -7.026 7.553 1.643 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -7.710 9.147 1.392 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -8.241 6.688 -0.300 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -9.306 7.360 0.919 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -9.530 9.432 -0.493 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -8.569 8.648 -1.731 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -10.738 8.338 -2.513 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -10.409 6.806 -1.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -12.583 7.627 -1.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -11.606 7.577 0.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -11.926 9.061 -0.542 1.00 0.00 H new ATOM 1090 N LEU A 93 -4.249 8.862 1.885 1.00 0.00 N ATOM 1091 CA LEU A 93 -3.172 9.535 2.607 1.00 0.00 C ATOM 1092 C LEU A 93 -1.963 10.017 1.728 1.00 0.00 C ATOM 1093 O LEU A 93 -1.354 11.031 2.090 1.00 0.00 O ATOM 1094 CB LEU A 93 -2.934 8.520 3.768 1.00 0.00 C ATOM 1095 CG LEU A 93 -2.105 7.185 3.675 1.00 0.00 C ATOM 1096 CD1 LEU A 93 -0.591 7.401 3.472 1.00 0.00 C ATOM 1097 CD2 LEU A 93 -2.338 6.263 4.901 1.00 0.00 C ATOM 0 H LEU A 93 -4.320 7.868 2.104 1.00 0.00 H new ATOM 0 HA LEU A 93 -3.401 10.529 2.990 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -2.476 9.095 4.573 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -3.926 8.227 4.111 1.00 0.00 H new ATOM 0 HG LEU A 93 -2.485 6.694 2.779 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -0.090 6.435 3.418 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -0.423 7.950 2.545 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -0.189 7.972 4.309 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -1.745 5.355 4.791 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -2.039 6.784 5.810 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -3.394 6.001 4.964 1.00 0.00 H new ATOM 1109 N LYS A 94 -1.660 9.338 0.584 1.00 0.00 N ATOM 1110 CA LYS A 94 -0.702 9.838 -0.453 1.00 0.00 C ATOM 1111 C LYS A 94 -1.172 11.106 -1.213 1.00 0.00 C ATOM 1112 O LYS A 94 -0.262 11.806 -1.649 1.00 0.00 O ATOM 1113 CB LYS A 94 -0.299 8.732 -1.481 1.00 0.00 C ATOM 1114 CG LYS A 94 0.842 7.767 -1.070 1.00 0.00 C ATOM 1115 CD LYS A 94 2.302 8.258 -1.276 1.00 0.00 C ATOM 1116 CE LYS A 94 3.416 7.253 -0.917 1.00 0.00 C ATOM 1117 NZ LYS A 94 3.683 7.148 0.533 1.00 0.00 N ATOM 0 H LYS A 94 -2.070 8.433 0.353 1.00 0.00 H new ATOM 0 HA LYS A 94 0.174 10.125 0.129 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -1.184 8.135 -1.700 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -0.008 9.223 -2.410 1.00 0.00 H new ATOM 0 HG2 LYS A 94 0.714 7.524 -0.015 1.00 0.00 H new ATOM 0 HG3 LYS A 94 0.716 6.839 -1.629 1.00 0.00 H new ATOM 0 HD2 LYS A 94 2.423 8.545 -2.321 1.00 0.00 H new ATOM 0 HD3 LYS A 94 2.448 9.159 -0.680 1.00 0.00 H new ATOM 0 HE2 LYS A 94 3.141 6.269 -1.298 1.00 0.00 H new ATOM 0 HE3 LYS A 94 4.334 7.547 -1.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 4.579 7.626 0.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 2.909 7.598 1.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 3.749 6.146 0.802 1.00 0.00 H new ATOM 1131 N SER A 95 -2.484 11.433 -1.378 1.00 0.00 N ATOM 1132 CA SER A 95 -2.912 12.784 -1.877 1.00 0.00 C ATOM 1133 C SER A 95 -2.489 13.994 -0.960 1.00 0.00 C ATOM 1134 O SER A 95 -2.331 15.110 -1.463 1.00 0.00 O ATOM 1135 CB SER A 95 -4.431 12.790 -2.096 1.00 0.00 C ATOM 1136 OG SER A 95 -4.799 11.814 -3.063 1.00 0.00 O ATOM 0 H SER A 95 -3.256 10.797 -1.179 1.00 0.00 H new ATOM 0 HA SER A 95 -2.381 12.939 -2.816 1.00 0.00 H new ATOM 0 HB2 SER A 95 -4.941 12.588 -1.154 1.00 0.00 H new ATOM 0 HB3 SER A 95 -4.753 13.778 -2.427 1.00 0.00 H new ATOM 0 HG SER A 95 -4.678 10.918 -2.686 1.00 0.00 H new ATOM 1142 N ILE A 96 -2.269 13.719 0.350 1.00 0.00 N ATOM 1143 CA ILE A 96 -1.650 14.631 1.362 1.00 0.00 C ATOM 1144 C ILE A 96 -0.081 14.632 1.172 1.00 0.00 C ATOM 1145 O ILE A 96 0.459 15.741 1.093 1.00 0.00 O ATOM 1146 CB ILE A 96 -2.166 14.234 2.833 1.00 0.00 C ATOM 1147 CG1 ILE A 96 -3.714 13.979 3.079 1.00 0.00 C ATOM 1148 CG2 ILE A 96 -1.644 15.229 3.931 1.00 0.00 C ATOM 1149 CD1 ILE A 96 -4.798 14.993 2.665 1.00 0.00 C ATOM 0 H ILE A 96 -2.527 12.819 0.754 1.00 0.00 H new ATOM 0 HA ILE A 96 -1.962 15.666 1.219 1.00 0.00 H new ATOM 0 HB ILE A 96 -1.722 13.242 2.917 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -3.958 13.041 2.580 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.836 13.812 4.149 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -2.017 14.922 4.908 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -0.554 15.221 3.940 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -1.998 16.236 3.708 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.781 14.605 2.932 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -4.628 15.938 3.181 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -4.753 15.155 1.588 1.00 0.00 H new ATOM 1161 N GLU A 97 0.624 13.464 1.088 1.00 0.00 N ATOM 1162 CA GLU A 97 2.080 13.400 0.717 1.00 0.00 C ATOM 1163 C GLU A 97 2.452 14.006 -0.681 1.00 0.00 C ATOM 1164 O GLU A 97 3.510 14.631 -0.752 1.00 0.00 O ATOM 1165 CB GLU A 97 2.591 11.927 0.857 1.00 0.00 C ATOM 1166 CG GLU A 97 4.099 11.737 1.141 1.00 0.00 C ATOM 1167 CD GLU A 97 4.492 10.268 1.209 1.00 0.00 C ATOM 1168 OE1 GLU A 97 4.395 9.586 2.229 1.00 0.00 O ATOM 1169 OE2 GLU A 97 4.961 9.808 0.007 1.00 0.00 O ATOM 0 H GLU A 97 0.210 12.550 1.272 1.00 0.00 H new ATOM 0 HA GLU A 97 2.595 14.051 1.423 1.00 0.00 H new ATOM 0 HB2 GLU A 97 2.031 11.448 1.660 1.00 0.00 H new ATOM 0 HB3 GLU A 97 2.349 11.394 -0.063 1.00 0.00 H new ATOM 0 HG2 GLU A 97 4.679 12.230 0.361 1.00 0.00 H new ATOM 0 HG3 GLU A 97 4.353 12.223 2.083 1.00 0.00 H new ATOM 1176 N GLN A 98 1.602 13.850 -1.722 1.00 0.00 N ATOM 1177 CA GLN A 98 1.722 14.552 -3.037 1.00 0.00 C ATOM 1178 C GLN A 98 1.708 16.117 -2.993 1.00 0.00 C ATOM 1179 O GLN A 98 2.473 16.714 -3.758 1.00 0.00 O ATOM 1180 CB GLN A 98 0.633 14.035 -4.035 1.00 0.00 C ATOM 1181 CG GLN A 98 0.691 12.604 -4.658 1.00 0.00 C ATOM 1182 CD GLN A 98 2.043 12.007 -5.102 1.00 0.00 C ATOM 1183 OE1 GLN A 98 2.400 12.028 -6.279 1.00 0.00 O ATOM 1184 NE2 GLN A 98 2.801 11.465 -4.157 1.00 0.00 N ATOM 0 H GLN A 98 0.798 13.224 -1.679 1.00 0.00 H new ATOM 0 HA GLN A 98 2.724 14.297 -3.381 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -0.326 14.116 -3.523 1.00 0.00 H new ATOM 0 HB3 GLN A 98 0.610 14.739 -4.867 1.00 0.00 H new ATOM 0 HG2 GLN A 98 0.257 11.917 -3.932 1.00 0.00 H new ATOM 0 HG3 GLN A 98 0.035 12.603 -5.529 1.00 0.00 H new ATOM 0 HE21 GLN A 98 2.482 11.460 -3.188 1.00 0.00 H new ATOM 0 HE22 GLN A 98 3.702 11.053 -4.400 1.00 0.00 H new ATOM 1193 N SER A 99 0.877 16.740 -2.121 1.00 0.00 N ATOM 1194 CA SER A 99 0.899 18.215 -1.871 1.00 0.00 C ATOM 1195 C SER A 99 2.193 18.778 -1.214 1.00 0.00 C ATOM 1196 O SER A 99 2.701 19.796 -1.682 1.00 0.00 O ATOM 1197 CB SER A 99 -0.364 18.600 -1.071 1.00 0.00 C ATOM 1198 OG SER A 99 -1.544 18.295 -1.802 1.00 0.00 O ATOM 0 H SER A 99 0.175 16.244 -1.572 1.00 0.00 H new ATOM 0 HA SER A 99 0.901 18.690 -2.852 1.00 0.00 H new ATOM 0 HB2 SER A 99 -0.373 18.067 -0.120 1.00 0.00 H new ATOM 0 HB3 SER A 99 -0.341 19.665 -0.839 1.00 0.00 H new ATOM 0 HG SER A 99 -1.752 17.342 -1.704 1.00 0.00 H new ATOM 1371 N ALA A 111 0.225 28.062 10.878 1.00 0.00 N ATOM 1372 CA ALA A 111 0.129 26.790 11.649 1.00 0.00 C ATOM 1373 C ALA A 111 -0.778 25.673 11.048 1.00 0.00 C ATOM 1374 O ALA A 111 -0.427 24.504 11.234 1.00 0.00 O ATOM 1375 CB ALA A 111 -0.304 27.126 13.080 1.00 0.00 C ATOM 0 HA ALA A 111 1.124 26.347 11.610 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -0.380 26.208 13.662 1.00 0.00 H new ATOM 0 HB2 ALA A 111 0.433 27.786 13.538 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -1.273 27.624 13.059 1.00 0.00 H new ATOM 1381 N ASP A 112 -1.890 26.001 10.334 1.00 0.00 N ATOM 1382 CA ASP A 112 -2.714 25.043 9.526 1.00 0.00 C ATOM 1383 C ASP A 112 -1.941 24.152 8.489 1.00 0.00 C ATOM 1384 O ASP A 112 -2.273 22.969 8.387 1.00 0.00 O ATOM 1385 CB ASP A 112 -3.853 25.868 8.855 1.00 0.00 C ATOM 1386 CG ASP A 112 -5.050 26.187 9.755 1.00 0.00 C ATOM 1387 OD1 ASP A 112 -4.859 27.340 10.470 1.00 0.00 O ATOM 1388 OD2 ASP A 112 -6.057 25.484 9.820 1.00 0.00 O ATOM 0 H ASP A 112 -2.250 26.955 10.300 1.00 0.00 H new ATOM 0 HA ASP A 112 -3.102 24.293 10.215 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -3.433 26.806 8.491 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -4.211 25.320 7.984 1.00 0.00 H new ATOM 1393 N LEU A 113 -0.940 24.716 7.775 1.00 0.00 N ATOM 1394 CA LEU A 113 0.028 23.945 6.930 1.00 0.00 C ATOM 1395 C LEU A 113 1.008 23.003 7.698 1.00 0.00 C ATOM 1396 O LEU A 113 1.578 22.096 7.084 1.00 0.00 O ATOM 1397 CB LEU A 113 0.746 24.985 5.987 1.00 0.00 C ATOM 1398 CG LEU A 113 1.917 24.676 4.979 1.00 0.00 C ATOM 1399 CD1 LEU A 113 3.298 24.531 5.665 1.00 0.00 C ATOM 1400 CD2 LEU A 113 1.677 23.521 3.976 1.00 0.00 C ATOM 0 H LEU A 113 -0.772 25.722 7.762 1.00 0.00 H new ATOM 0 HA LEU A 113 -0.531 23.215 6.345 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -0.047 25.432 5.387 1.00 0.00 H new ATOM 0 HB3 LEU A 113 1.126 25.765 6.647 1.00 0.00 H new ATOM 0 HG LEU A 113 1.926 25.579 4.369 1.00 0.00 H new ATOM 0 HD11 LEU A 113 4.058 24.319 4.913 1.00 0.00 H new ATOM 0 HD12 LEU A 113 3.547 25.458 6.181 1.00 0.00 H new ATOM 0 HD13 LEU A 113 3.263 23.713 6.385 1.00 0.00 H new ATOM 0 HD21 LEU A 113 2.553 23.406 3.337 1.00 0.00 H new ATOM 0 HD22 LEU A 113 1.503 22.594 4.523 1.00 0.00 H new ATOM 0 HD23 LEU A 113 0.807 23.748 3.361 1.00 0.00 H new ATOM 1412 N ARG A 114 1.219 23.299 8.980 1.00 0.00 N ATOM 1413 CA ARG A 114 2.199 22.627 9.878 1.00 0.00 C ATOM 1414 C ARG A 114 1.511 21.427 10.601 1.00 0.00 C ATOM 1415 O ARG A 114 2.088 20.338 10.671 1.00 0.00 O ATOM 1416 CB ARG A 114 2.824 23.728 10.788 1.00 0.00 C ATOM 1417 CG ARG A 114 3.696 24.796 10.063 1.00 0.00 C ATOM 1418 CD ARG A 114 4.268 25.870 10.996 1.00 0.00 C ATOM 1419 NE ARG A 114 5.061 26.850 10.211 1.00 0.00 N ATOM 1420 CZ ARG A 114 5.716 27.937 10.693 1.00 0.00 C ATOM 1421 NH1 ARG A 114 5.765 28.325 11.976 1.00 0.00 N ATOM 1422 NH2 ARG A 114 6.365 28.682 9.817 1.00 0.00 N ATOM 0 H ARG A 114 0.700 24.039 9.454 1.00 0.00 H new ATOM 0 HA ARG A 114 3.031 22.164 9.348 1.00 0.00 H new ATOM 0 HB2 ARG A 114 2.017 24.241 11.312 1.00 0.00 H new ATOM 0 HB3 ARG A 114 3.437 23.241 11.546 1.00 0.00 H new ATOM 0 HG2 ARG A 114 4.520 24.294 9.555 1.00 0.00 H new ATOM 0 HG3 ARG A 114 3.095 25.280 9.294 1.00 0.00 H new ATOM 0 HD2 ARG A 114 3.458 26.379 11.518 1.00 0.00 H new ATOM 0 HD3 ARG A 114 4.896 25.406 11.757 1.00 0.00 H new ATOM 0 HE ARG A 114 5.120 26.690 9.205 1.00 0.00 H new ATOM 0 HH11 ARG A 114 5.280 27.784 12.691 1.00 0.00 H new ATOM 0 HH12 ARG A 114 6.287 29.161 12.236 1.00 0.00 H new ATOM 0 HH21 ARG A 114 6.358 28.430 8.829 1.00 0.00 H new ATOM 0 HH22 ARG A 114 6.873 29.510 10.129 1.00 0.00 H new ATOM 1436 N ILE A 115 0.251 21.627 11.065 1.00 0.00 N ATOM 1437 CA ILE A 115 -0.721 20.610 11.578 1.00 0.00 C ATOM 1438 C ILE A 115 -0.873 19.387 10.573 1.00 0.00 C ATOM 1439 O ILE A 115 -0.932 18.248 11.045 1.00 0.00 O ATOM 1440 CB ILE A 115 -2.053 21.435 11.943 1.00 0.00 C ATOM 1441 CG1 ILE A 115 -1.877 22.461 13.148 1.00 0.00 C ATOM 1442 CG2 ILE A 115 -3.280 20.518 12.226 1.00 0.00 C ATOM 1443 CD1 ILE A 115 -2.827 23.676 13.294 1.00 0.00 C ATOM 0 H ILE A 115 -0.146 22.566 11.095 1.00 0.00 H new ATOM 0 HA ILE A 115 -0.389 20.099 12.482 1.00 0.00 H new ATOM 0 HB ILE A 115 -2.244 22.015 11.040 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -1.946 21.887 14.072 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -0.861 22.852 13.091 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -4.147 21.134 12.466 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -3.496 19.916 11.343 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -3.057 19.861 13.067 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -2.546 24.254 14.174 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -2.752 24.305 12.407 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -3.853 23.325 13.403 1.00 0.00 H new ATOM 1455 N ARG A 116 -0.928 19.652 9.242 1.00 0.00 N ATOM 1456 CA ARG A 116 -0.997 18.617 8.155 1.00 0.00 C ATOM 1457 C ARG A 116 0.213 17.626 8.139 1.00 0.00 C ATOM 1458 O ARG A 116 -0.037 16.422 8.025 1.00 0.00 O ATOM 1459 CB ARG A 116 -1.230 19.295 6.763 1.00 0.00 C ATOM 1460 CG ARG A 116 -2.587 20.034 6.587 1.00 0.00 C ATOM 1461 CD ARG A 116 -2.966 20.551 5.196 1.00 0.00 C ATOM 1462 NE ARG A 116 -2.286 21.825 4.826 1.00 0.00 N ATOM 1463 CZ ARG A 116 -2.750 22.776 3.973 1.00 0.00 C ATOM 1464 NH1 ARG A 116 -3.907 22.731 3.296 1.00 0.00 N ATOM 1465 NH2 ARG A 116 -1.996 23.844 3.795 1.00 0.00 N ATOM 0 H ARG A 116 -0.926 20.605 8.879 1.00 0.00 H new ATOM 0 HA ARG A 116 -1.859 17.989 8.381 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -0.424 20.008 6.588 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -1.152 18.530 5.990 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -3.377 19.358 6.915 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -2.591 20.885 7.269 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -2.720 19.790 4.456 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -4.045 20.700 5.155 1.00 0.00 H new ATOM 0 HE ARG A 116 -1.379 22.001 5.258 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -4.528 21.928 3.400 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -4.166 23.499 2.677 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -1.107 23.929 4.288 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -2.302 24.585 3.164 1.00 0.00 H new ATOM 1479 N LYS A 117 1.471 18.118 8.305 1.00 0.00 N ATOM 1480 CA LYS A 117 2.673 17.256 8.565 1.00 0.00 C ATOM 1481 C LYS A 117 2.615 16.452 9.915 1.00 0.00 C ATOM 1482 O LYS A 117 3.024 15.287 9.916 1.00 0.00 O ATOM 1483 CB LYS A 117 4.006 18.095 8.514 1.00 0.00 C ATOM 1484 CG LYS A 117 4.913 17.839 7.294 1.00 0.00 C ATOM 1485 CD LYS A 117 6.344 18.406 7.427 1.00 0.00 C ATOM 1486 CE LYS A 117 7.206 18.207 6.172 1.00 0.00 C ATOM 1487 NZ LYS A 117 8.553 18.762 6.383 1.00 0.00 N ATOM 0 H LYS A 117 1.687 19.114 8.264 1.00 0.00 H new ATOM 0 HA LYS A 117 2.662 16.522 7.759 1.00 0.00 H new ATOM 0 HB2 LYS A 117 3.748 19.154 8.535 1.00 0.00 H new ATOM 0 HB3 LYS A 117 4.578 17.888 9.418 1.00 0.00 H new ATOM 0 HG2 LYS A 117 4.976 16.764 7.124 1.00 0.00 H new ATOM 0 HG3 LYS A 117 4.444 18.274 6.411 1.00 0.00 H new ATOM 0 HD2 LYS A 117 6.284 19.471 7.651 1.00 0.00 H new ATOM 0 HD3 LYS A 117 6.837 17.930 8.275 1.00 0.00 H new ATOM 0 HE2 LYS A 117 7.276 17.145 5.935 1.00 0.00 H new ATOM 0 HE3 LYS A 117 6.735 18.694 5.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 9.125 18.620 5.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 8.481 19.779 6.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 9.006 18.279 7.185 1.00 0.00 H new ATOM 1501 N THR A 118 2.102 17.070 11.010 1.00 0.00 N ATOM 1502 CA THR A 118 1.858 16.410 12.331 1.00 0.00 C ATOM 1503 C THR A 118 0.847 15.202 12.267 1.00 0.00 C ATOM 1504 O THR A 118 1.157 14.160 12.853 1.00 0.00 O ATOM 1505 CB THR A 118 1.488 17.545 13.348 1.00 0.00 C ATOM 1506 OG1 THR A 118 2.408 18.632 13.261 1.00 0.00 O ATOM 1507 CG2 THR A 118 1.477 17.161 14.836 1.00 0.00 C ATOM 0 H THR A 118 1.840 18.056 11.006 1.00 0.00 H new ATOM 0 HA THR A 118 2.760 15.907 12.678 1.00 0.00 H new ATOM 0 HB THR A 118 0.470 17.792 13.046 1.00 0.00 H new ATOM 0 HG1 THR A 118 2.155 19.327 13.904 1.00 0.00 H new ATOM 0 HG21 THR A 118 1.207 18.031 15.434 1.00 0.00 H new ATOM 0 HG22 THR A 118 0.749 16.367 15.001 1.00 0.00 H new ATOM 0 HG23 THR A 118 2.467 16.812 15.129 1.00 0.00 H new ATOM 1515 N GLN A 119 -0.292 15.353 11.555 1.00 0.00 N ATOM 1516 CA GLN A 119 -1.284 14.262 11.305 1.00 0.00 C ATOM 1517 C GLN A 119 -0.833 13.250 10.204 1.00 0.00 C ATOM 1518 O GLN A 119 -1.013 12.062 10.476 1.00 0.00 O ATOM 1519 CB GLN A 119 -2.716 14.799 10.973 1.00 0.00 C ATOM 1520 CG GLN A 119 -3.442 15.659 12.042 1.00 0.00 C ATOM 1521 CD GLN A 119 -4.948 15.839 11.803 1.00 0.00 C ATOM 1522 OE1 GLN A 119 -5.373 16.760 11.108 1.00 0.00 O ATOM 1523 NE2 GLN A 119 -5.783 14.984 12.376 1.00 0.00 N ATOM 0 H GLN A 119 -0.559 16.241 11.130 1.00 0.00 H new ATOM 0 HA GLN A 119 -1.331 13.725 12.253 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -2.646 15.391 10.060 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -3.350 13.941 10.749 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -3.295 15.200 13.020 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -2.973 16.642 12.078 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -5.420 14.224 12.951 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -6.789 15.086 12.242 1.00 0.00 H new ATOM 1532 N HIS A 120 -0.251 13.643 9.031 1.00 0.00 N ATOM 1533 CA HIS A 120 0.339 12.677 8.050 1.00 0.00 C ATOM 1534 C HIS A 120 1.554 11.835 8.570 1.00 0.00 C ATOM 1535 O HIS A 120 1.620 10.668 8.171 1.00 0.00 O ATOM 1536 CB HIS A 120 0.663 13.426 6.727 1.00 0.00 C ATOM 1537 CG HIS A 120 1.056 12.533 5.546 1.00 0.00 C ATOM 1538 ND1 HIS A 120 2.375 12.174 5.305 1.00 0.00 N ATOM 1539 CD2 HIS A 120 0.175 11.764 4.766 1.00 0.00 C ATOM 1540 CE1 HIS A 120 2.155 11.186 4.379 1.00 0.00 C ATOM 1541 NE2 HIS A 120 0.881 10.869 3.994 1.00 0.00 N ATOM 0 H HIS A 120 -0.178 14.619 8.742 1.00 0.00 H new ATOM 0 HA HIS A 120 -0.422 11.917 7.875 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -0.208 14.016 6.441 1.00 0.00 H new ATOM 0 HB3 HIS A 120 1.475 14.128 6.916 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -0.901 11.861 4.772 1.00 0.00 H new ATOM 0 HE1 HIS A 120 2.993 10.655 3.951 1.00 0.00 H new ATOM 0 HE2 HIS A 120 0.550 10.171 3.328 1.00 0.00 H new ATOM 1549 N SER A 121 2.463 12.384 9.411 1.00 0.00 N ATOM 1550 CA SER A 121 3.522 11.588 10.097 1.00 0.00 C ATOM 1551 C SER A 121 3.034 10.604 11.206 1.00 0.00 C ATOM 1552 O SER A 121 3.558 9.488 11.215 1.00 0.00 O ATOM 1553 CB SER A 121 4.609 12.542 10.622 1.00 0.00 C ATOM 1554 OG SER A 121 5.208 13.259 9.550 1.00 0.00 O ATOM 0 H SER A 121 2.488 13.379 9.635 1.00 0.00 H new ATOM 0 HA SER A 121 3.927 10.918 9.339 1.00 0.00 H new ATOM 0 HB2 SER A 121 4.173 13.241 11.335 1.00 0.00 H new ATOM 0 HB3 SER A 121 5.370 11.975 11.157 1.00 0.00 H new ATOM 0 HG SER A 121 4.694 14.075 9.375 1.00 0.00 H new ATOM 1560 N THR A 122 2.044 10.961 12.068 1.00 0.00 N ATOM 1561 CA THR A 122 1.366 10.018 13.016 1.00 0.00 C ATOM 1562 C THR A 122 0.437 8.965 12.287 1.00 0.00 C ATOM 1563 O THR A 122 0.526 7.785 12.640 1.00 0.00 O ATOM 1564 CB THR A 122 0.666 10.910 14.099 1.00 0.00 C ATOM 1565 OG1 THR A 122 1.587 11.852 14.645 1.00 0.00 O ATOM 1566 CG2 THR A 122 0.091 10.177 15.323 1.00 0.00 C ATOM 0 H THR A 122 1.688 11.915 12.129 1.00 0.00 H new ATOM 0 HA THR A 122 2.082 9.362 13.512 1.00 0.00 H new ATOM 0 HB THR A 122 -0.158 11.352 13.539 1.00 0.00 H new ATOM 0 HG1 THR A 122 1.547 12.685 14.130 1.00 0.00 H new ATOM 0 HG21 THR A 122 -0.366 10.900 15.998 1.00 0.00 H new ATOM 0 HG22 THR A 122 -0.661 9.459 14.997 1.00 0.00 H new ATOM 0 HG23 THR A 122 0.893 9.652 15.842 1.00 0.00 H new ATOM 1574 N LEU A 123 -0.394 9.379 11.295 1.00 0.00 N ATOM 1575 CA LEU A 123 -1.166 8.476 10.373 1.00 0.00 C ATOM 1576 C LEU A 123 -0.265 7.503 9.534 1.00 0.00 C ATOM 1577 O LEU A 123 -0.621 6.322 9.482 1.00 0.00 O ATOM 1578 CB LEU A 123 -2.123 9.295 9.433 1.00 0.00 C ATOM 1579 CG LEU A 123 -3.320 10.123 10.039 1.00 0.00 C ATOM 1580 CD1 LEU A 123 -3.721 11.321 9.145 1.00 0.00 C ATOM 1581 CD2 LEU A 123 -4.576 9.289 10.398 1.00 0.00 C ATOM 0 H LEU A 123 -0.556 10.368 11.102 1.00 0.00 H new ATOM 0 HA LEU A 123 -1.768 7.845 11.027 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -1.502 9.991 8.869 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -2.548 8.593 8.715 1.00 0.00 H new ATOM 0 HG LEU A 123 -2.920 10.496 10.982 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -4.549 11.858 9.607 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -2.870 11.993 9.034 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -4.027 10.957 8.164 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -5.344 9.945 10.807 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -4.957 8.800 9.501 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -4.312 8.534 11.138 1.00 0.00 H new ATOM 1593 N SER A 124 0.869 7.971 8.939 1.00 0.00 N ATOM 1594 CA SER A 124 1.898 7.088 8.324 1.00 0.00 C ATOM 1595 C SER A 124 2.745 6.231 9.314 1.00 0.00 C ATOM 1596 O SER A 124 3.207 5.177 8.874 1.00 0.00 O ATOM 1597 CB SER A 124 2.836 7.938 7.454 1.00 0.00 C ATOM 1598 OG SER A 124 2.110 8.591 6.419 1.00 0.00 O ATOM 0 H SER A 124 1.093 8.964 8.873 1.00 0.00 H new ATOM 0 HA SER A 124 1.335 6.362 7.738 1.00 0.00 H new ATOM 0 HB2 SER A 124 3.342 8.679 8.073 1.00 0.00 H new ATOM 0 HB3 SER A 124 3.609 7.305 7.019 1.00 0.00 H new ATOM 0 HG SER A 124 1.765 9.446 6.751 1.00 0.00 H new ATOM 1604 N ARG A 125 2.929 6.640 10.598 1.00 0.00 N ATOM 1605 CA ARG A 125 3.554 5.802 11.670 1.00 0.00 C ATOM 1606 C ARG A 125 2.691 4.566 12.125 1.00 0.00 C ATOM 1607 O ARG A 125 3.291 3.507 12.337 1.00 0.00 O ATOM 1608 CB ARG A 125 3.949 6.731 12.859 1.00 0.00 C ATOM 1609 CG ARG A 125 5.023 6.191 13.834 1.00 0.00 C ATOM 1610 CD ARG A 125 5.290 7.093 15.040 1.00 0.00 C ATOM 1611 NE ARG A 125 6.335 6.497 15.911 1.00 0.00 N ATOM 1612 CZ ARG A 125 7.124 7.153 16.799 1.00 0.00 C ATOM 1613 NH1 ARG A 125 7.102 8.470 17.054 1.00 0.00 N ATOM 1614 NH2 ARG A 125 7.994 6.427 17.476 1.00 0.00 N ATOM 0 H ARG A 125 2.648 7.564 10.925 1.00 0.00 H new ATOM 0 HA ARG A 125 4.446 5.338 11.250 1.00 0.00 H new ATOM 0 HB2 ARG A 125 4.306 7.676 12.449 1.00 0.00 H new ATOM 0 HB3 ARG A 125 3.049 6.952 13.432 1.00 0.00 H new ATOM 0 HG2 ARG A 125 4.712 5.209 14.191 1.00 0.00 H new ATOM 0 HG3 ARG A 125 5.955 6.050 13.287 1.00 0.00 H new ATOM 0 HD2 ARG A 125 5.609 8.079 14.701 1.00 0.00 H new ATOM 0 HD3 ARG A 125 4.370 7.233 15.608 1.00 0.00 H new ATOM 0 HE ARG A 125 6.474 5.489 15.834 1.00 0.00 H new ATOM 0 HH11 ARG A 125 6.447 9.075 16.558 1.00 0.00 H new ATOM 0 HH12 ARG A 125 7.740 8.867 17.744 1.00 0.00 H new ATOM 0 HH21 ARG A 125 8.050 5.421 17.319 1.00 0.00 H new ATOM 0 HH22 ARG A 125 8.610 6.872 18.156 1.00 0.00 H new ATOM 1628 N LYS A 126 1.348 4.687 12.296 1.00 0.00 N ATOM 1629 CA LYS A 126 0.434 3.514 12.504 1.00 0.00 C ATOM 1630 C LYS A 126 0.200 2.669 11.199 1.00 0.00 C ATOM 1631 O LYS A 126 0.133 1.442 11.320 1.00 0.00 O ATOM 1632 CB LYS A 126 -0.884 4.022 13.166 1.00 0.00 C ATOM 1633 CG LYS A 126 -1.756 2.959 13.884 1.00 0.00 C ATOM 1634 CD LYS A 126 -3.079 3.504 14.474 1.00 0.00 C ATOM 1635 CE LYS A 126 -3.967 2.472 15.200 1.00 0.00 C ATOM 1636 NZ LYS A 126 -4.764 1.621 14.291 1.00 0.00 N ATOM 0 H LYS A 126 0.865 5.586 12.295 1.00 0.00 H new ATOM 0 HA LYS A 126 0.913 2.806 13.181 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -0.626 4.795 13.889 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -1.491 4.496 12.395 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -1.989 2.162 13.178 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -1.172 2.512 14.688 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -2.840 4.305 15.173 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -3.659 3.949 13.666 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -3.335 1.834 15.817 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -4.643 2.999 15.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -5.334 0.954 14.850 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -5.393 2.219 13.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -4.126 1.090 13.664 1.00 0.00 H new ATOM 1650 N PHE A 127 0.114 3.307 10.006 1.00 0.00 N ATOM 1651 CA PHE A 127 0.115 2.623 8.679 1.00 0.00 C ATOM 1652 C PHE A 127 1.429 1.853 8.312 1.00 0.00 C ATOM 1653 O PHE A 127 1.291 0.780 7.717 1.00 0.00 O ATOM 1654 CB PHE A 127 -0.265 3.673 7.591 1.00 0.00 C ATOM 1655 CG PHE A 127 -0.911 3.089 6.319 1.00 0.00 C ATOM 1656 CD1 PHE A 127 -2.294 2.953 6.236 1.00 0.00 C ATOM 1657 CD2 PHE A 127 -0.133 2.719 5.228 1.00 0.00 C ATOM 1658 CE1 PHE A 127 -2.880 2.423 5.106 1.00 0.00 C ATOM 1659 CE2 PHE A 127 -0.727 2.190 4.098 1.00 0.00 C ATOM 1660 CZ PHE A 127 -2.097 2.037 4.041 1.00 0.00 C ATOM 0 H PHE A 127 0.041 4.322 9.932 1.00 0.00 H new ATOM 0 HA PHE A 127 -0.626 1.825 8.733 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -0.952 4.396 8.030 1.00 0.00 H new ATOM 0 HB3 PHE A 127 0.634 4.220 7.306 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -2.913 3.265 7.064 1.00 0.00 H new ATOM 0 HD2 PHE A 127 0.939 2.845 5.264 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -3.953 2.311 5.056 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -0.117 1.895 3.257 1.00 0.00 H new ATOM 0 HZ PHE A 127 -2.556 1.614 3.160 1.00 0.00 H new ATOM 1670 N VAL A 128 2.651 2.344 8.677 1.00 0.00 N ATOM 1671 CA VAL A 128 3.940 1.596 8.500 1.00 0.00 C ATOM 1672 C VAL A 128 4.090 0.349 9.451 1.00 0.00 C ATOM 1673 O VAL A 128 4.497 -0.700 8.947 1.00 0.00 O ATOM 1674 CB VAL A 128 5.159 2.631 8.559 1.00 0.00 C ATOM 1675 CG1 VAL A 128 5.701 3.098 9.938 1.00 0.00 C ATOM 1676 CG2 VAL A 128 6.349 2.189 7.666 1.00 0.00 C ATOM 0 H VAL A 128 2.773 3.264 9.100 1.00 0.00 H new ATOM 0 HA VAL A 128 3.942 1.135 7.512 1.00 0.00 H new ATOM 0 HB VAL A 128 4.661 3.520 8.171 1.00 0.00 H new ATOM 0 HG11 VAL A 128 6.524 3.796 9.788 1.00 0.00 H new ATOM 0 HG12 VAL A 128 4.904 3.591 10.494 1.00 0.00 H new ATOM 0 HG13 VAL A 128 6.056 2.235 10.501 1.00 0.00 H new ATOM 0 HG21 VAL A 128 7.151 2.923 7.739 1.00 0.00 H new ATOM 0 HG22 VAL A 128 6.714 1.218 8.001 1.00 0.00 H new ATOM 0 HG23 VAL A 128 6.019 2.115 6.630 1.00 0.00 H new ATOM 1686 N GLU A 129 3.756 0.463 10.767 1.00 0.00 N ATOM 1687 CA GLU A 129 3.744 -0.688 11.736 1.00 0.00 C ATOM 1688 C GLU A 129 2.880 -1.931 11.319 1.00 0.00 C ATOM 1689 O GLU A 129 3.235 -3.040 11.727 1.00 0.00 O ATOM 1690 CB GLU A 129 3.318 -0.226 13.166 1.00 0.00 C ATOM 1691 CG GLU A 129 4.287 0.691 13.950 1.00 0.00 C ATOM 1692 CD GLU A 129 3.726 1.088 15.309 1.00 0.00 C ATOM 1693 OE1 GLU A 129 3.841 0.395 16.319 1.00 0.00 O ATOM 1694 OE2 GLU A 129 3.085 2.298 15.264 1.00 0.00 O ATOM 0 H GLU A 129 3.487 1.350 11.192 1.00 0.00 H new ATOM 0 HA GLU A 129 4.779 -1.030 11.728 1.00 0.00 H new ATOM 0 HB2 GLU A 129 2.363 0.293 13.079 1.00 0.00 H new ATOM 0 HB3 GLU A 129 3.142 -1.118 13.767 1.00 0.00 H new ATOM 0 HG2 GLU A 129 5.239 0.179 14.087 1.00 0.00 H new ATOM 0 HG3 GLU A 129 4.489 1.588 13.365 1.00 0.00 H new ATOM 1701 N VAL A 130 1.794 -1.734 10.534 1.00 0.00 N ATOM 1702 CA VAL A 130 0.935 -2.830 9.977 1.00 0.00 C ATOM 1703 C VAL A 130 1.412 -3.136 8.499 1.00 0.00 C ATOM 1704 O VAL A 130 1.656 -4.317 8.254 1.00 0.00 O ATOM 1705 CB VAL A 130 -0.625 -2.523 10.091 1.00 0.00 C ATOM 1706 CG1 VAL A 130 -1.510 -3.734 9.679 1.00 0.00 C ATOM 1707 CG2 VAL A 130 -1.181 -2.006 11.455 1.00 0.00 C ATOM 0 H VAL A 130 1.478 -0.803 10.261 1.00 0.00 H new ATOM 0 HA VAL A 130 1.064 -3.728 10.581 1.00 0.00 H new ATOM 0 HB VAL A 130 -0.695 -1.690 9.391 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -2.562 -3.466 9.777 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -1.299 -4.003 8.644 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -1.290 -4.583 10.327 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -2.256 -1.844 11.372 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -0.984 -2.745 12.232 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -0.692 -1.067 11.715 1.00 0.00 H new ATOM 1717 N MET A 131 1.488 -2.167 7.541 1.00 0.00 N ATOM 1718 CA MET A 131 1.849 -2.396 6.102 1.00 0.00 C ATOM 1719 C MET A 131 3.298 -2.949 5.880 1.00 0.00 C ATOM 1720 O MET A 131 3.427 -3.882 5.080 1.00 0.00 O ATOM 1721 CB MET A 131 1.559 -1.091 5.288 1.00 0.00 C ATOM 1722 CG MET A 131 1.156 -1.238 3.808 1.00 0.00 C ATOM 1723 SD MET A 131 -0.471 -2.027 3.737 1.00 0.00 S ATOM 1724 CE MET A 131 -0.100 -3.726 3.263 1.00 0.00 C ATOM 0 H MET A 131 1.297 -1.186 7.747 1.00 0.00 H new ATOM 0 HA MET A 131 1.216 -3.199 5.725 1.00 0.00 H new ATOM 0 HB2 MET A 131 0.763 -0.548 5.799 1.00 0.00 H new ATOM 0 HB3 MET A 131 2.450 -0.465 5.331 1.00 0.00 H new ATOM 0 HG2 MET A 131 1.126 -0.262 3.324 1.00 0.00 H new ATOM 0 HG3 MET A 131 1.892 -1.837 3.272 1.00 0.00 H new ATOM 0 HE1 MET A 131 -0.776 -4.405 3.783 1.00 0.00 H new ATOM 0 HE2 MET A 131 -0.229 -3.840 2.187 1.00 0.00 H new ATOM 0 HE3 MET A 131 0.929 -3.962 3.532 1.00 0.00 H new ATOM 1734 N SER A 132 4.335 -2.417 6.587 1.00 0.00 N ATOM 1735 CA SER A 132 5.700 -3.031 6.629 1.00 0.00 C ATOM 1736 C SER A 132 5.786 -4.423 7.342 1.00 0.00 C ATOM 1737 O SER A 132 6.631 -5.223 6.929 1.00 0.00 O ATOM 1738 CB SER A 132 6.720 -2.063 7.247 1.00 0.00 C ATOM 1739 OG SER A 132 6.733 -0.823 6.551 1.00 0.00 O ATOM 0 H SER A 132 4.254 -1.562 7.138 1.00 0.00 H new ATOM 0 HA SER A 132 5.943 -3.222 5.584 1.00 0.00 H new ATOM 0 HB2 SER A 132 6.476 -1.893 8.296 1.00 0.00 H new ATOM 0 HB3 SER A 132 7.714 -2.510 7.219 1.00 0.00 H new ATOM 0 HG SER A 132 7.573 -0.353 6.736 1.00 0.00 H new ATOM 1745 N GLU A 133 4.926 -4.704 8.360 1.00 0.00 N ATOM 1746 CA GLU A 133 4.746 -6.063 8.962 1.00 0.00 C ATOM 1747 C GLU A 133 4.001 -7.067 8.005 1.00 0.00 C ATOM 1748 O GLU A 133 4.414 -8.230 7.955 1.00 0.00 O ATOM 1749 CB GLU A 133 4.048 -5.888 10.350 1.00 0.00 C ATOM 1750 CG GLU A 133 4.097 -7.058 11.360 1.00 0.00 C ATOM 1751 CD GLU A 133 5.436 -7.235 12.075 1.00 0.00 C ATOM 1752 OE1 GLU A 133 5.694 -6.204 12.939 1.00 0.00 O ATOM 1753 OE2 GLU A 133 6.185 -8.193 11.887 1.00 0.00 O ATOM 0 H GLU A 133 4.334 -3.994 8.790 1.00 0.00 H new ATOM 0 HA GLU A 133 5.720 -6.528 9.111 1.00 0.00 H new ATOM 0 HB2 GLU A 133 4.488 -5.016 10.833 1.00 0.00 H new ATOM 0 HB3 GLU A 133 2.999 -5.655 10.165 1.00 0.00 H new ATOM 0 HG2 GLU A 133 3.319 -6.906 12.108 1.00 0.00 H new ATOM 0 HG3 GLU A 133 3.857 -7.983 10.835 1.00 0.00 H new ATOM 1760 N TYR A 134 2.966 -6.608 7.255 1.00 0.00 N ATOM 1761 CA TYR A 134 2.305 -7.360 6.155 1.00 0.00 C ATOM 1762 C TYR A 134 3.230 -7.729 4.945 1.00 0.00 C ATOM 1763 O TYR A 134 3.103 -8.860 4.465 1.00 0.00 O ATOM 1764 CB TYR A 134 1.022 -6.584 5.713 1.00 0.00 C ATOM 1765 CG TYR A 134 0.013 -7.444 4.893 1.00 0.00 C ATOM 1766 CD1 TYR A 134 -0.790 -8.410 5.497 1.00 0.00 C ATOM 1767 CD2 TYR A 134 -0.007 -7.342 3.506 1.00 0.00 C ATOM 1768 CE1 TYR A 134 -1.533 -9.282 4.730 1.00 0.00 C ATOM 1769 CE2 TYR A 134 -0.787 -8.191 2.748 1.00 0.00 C ATOM 1770 CZ TYR A 134 -1.544 -9.167 3.357 1.00 0.00 C ATOM 1771 OH TYR A 134 -2.301 -10.023 2.601 1.00 0.00 O ATOM 0 H TYR A 134 2.558 -5.684 7.401 1.00 0.00 H new ATOM 0 HA TYR A 134 2.033 -8.336 6.557 1.00 0.00 H new ATOM 0 HB2 TYR A 134 0.519 -6.199 6.600 1.00 0.00 H new ATOM 0 HB3 TYR A 134 1.319 -5.722 5.115 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -0.830 -8.476 6.574 1.00 0.00 H new ATOM 0 HD2 TYR A 134 0.595 -6.590 3.017 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -2.110 -10.060 5.208 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -0.804 -8.090 1.673 1.00 0.00 H new ATOM 0 HH TYR A 134 -2.944 -10.487 3.177 1.00 0.00 H new ATOM 1781 N ASN A 135 4.146 -6.828 4.495 1.00 0.00 N ATOM 1782 CA ASN A 135 5.226 -7.157 3.509 1.00 0.00 C ATOM 1783 C ASN A 135 6.180 -8.333 3.947 1.00 0.00 C ATOM 1784 O ASN A 135 6.501 -9.158 3.085 1.00 0.00 O ATOM 1785 CB ASN A 135 5.996 -5.851 3.185 1.00 0.00 C ATOM 1786 CG ASN A 135 6.851 -5.892 1.906 1.00 0.00 C ATOM 1787 OD1 ASN A 135 6.364 -5.615 0.811 1.00 0.00 O ATOM 1788 ND2 ASN A 135 8.126 -6.233 2.016 1.00 0.00 N ATOM 0 H ASN A 135 4.161 -5.855 4.801 1.00 0.00 H new ATOM 0 HA ASN A 135 4.753 -7.549 2.608 1.00 0.00 H new ATOM 0 HB2 ASN A 135 5.276 -5.037 3.095 1.00 0.00 H new ATOM 0 HB3 ASN A 135 6.644 -5.612 4.028 1.00 0.00 H new ATOM 0 HD21 ASN A 135 8.718 -6.268 1.186 1.00 0.00 H new ATOM 0 HD22 ASN A 135 8.516 -6.460 2.931 1.00 0.00 H new ATOM 1795 N ALA A 136 6.578 -8.401 5.244 1.00 0.00 N ATOM 1796 CA ALA A 136 7.282 -9.575 5.825 1.00 0.00 C ATOM 1797 C ALA A 136 6.442 -10.865 6.062 1.00 0.00 C ATOM 1798 O ALA A 136 7.067 -11.926 6.139 1.00 0.00 O ATOM 1799 CB ALA A 136 7.897 -9.142 7.156 1.00 0.00 C ATOM 0 H ALA A 136 6.421 -7.648 5.914 1.00 0.00 H new ATOM 0 HA ALA A 136 8.012 -9.867 5.070 1.00 0.00 H new ATOM 0 HB1 ALA A 136 8.421 -9.985 7.606 1.00 0.00 H new ATOM 0 HB2 ALA A 136 8.601 -8.327 6.984 1.00 0.00 H new ATOM 0 HB3 ALA A 136 7.108 -8.804 7.828 1.00 0.00 H new ATOM 1805 N THR A 137 5.088 -10.800 6.164 1.00 0.00 N ATOM 1806 CA THR A 137 4.189 -11.988 6.344 1.00 0.00 C ATOM 1807 C THR A 137 4.186 -12.973 5.111 1.00 0.00 C ATOM 1808 O THR A 137 4.309 -14.178 5.355 1.00 0.00 O ATOM 1809 CB THR A 137 2.779 -11.446 6.771 1.00 0.00 C ATOM 1810 OG1 THR A 137 2.903 -10.533 7.858 1.00 0.00 O ATOM 1811 CG2 THR A 137 1.722 -12.471 7.232 1.00 0.00 C ATOM 0 H THR A 137 4.579 -9.917 6.124 1.00 0.00 H new ATOM 0 HA THR A 137 4.568 -12.634 7.136 1.00 0.00 H new ATOM 0 HB THR A 137 2.424 -11.010 5.837 1.00 0.00 H new ATOM 0 HG1 THR A 137 3.377 -9.729 7.558 1.00 0.00 H new ATOM 0 HG21 THR A 137 0.801 -11.951 7.495 1.00 0.00 H new ATOM 0 HG22 THR A 137 1.523 -13.176 6.425 1.00 0.00 H new ATOM 0 HG23 THR A 137 2.094 -13.011 8.102 1.00 0.00 H new ATOM 1819 N GLN A 138 4.059 -12.478 3.852 1.00 0.00 N ATOM 1820 CA GLN A 138 4.122 -13.310 2.611 1.00 0.00 C ATOM 1821 C GLN A 138 5.569 -13.804 2.246 1.00 0.00 C ATOM 1822 O GLN A 138 5.686 -15.000 1.956 1.00 0.00 O ATOM 1823 CB GLN A 138 3.392 -12.514 1.482 1.00 0.00 C ATOM 1824 CG GLN A 138 2.980 -13.306 0.223 1.00 0.00 C ATOM 1825 CD GLN A 138 2.300 -12.419 -0.826 1.00 0.00 C ATOM 1826 OE1 GLN A 138 2.967 -11.713 -1.581 1.00 0.00 O ATOM 1827 NE2 GLN A 138 0.978 -12.429 -0.900 1.00 0.00 N ATOM 0 H GLN A 138 3.909 -11.487 3.664 1.00 0.00 H new ATOM 0 HA GLN A 138 3.604 -14.256 2.768 1.00 0.00 H new ATOM 0 HB2 GLN A 138 2.495 -12.065 1.909 1.00 0.00 H new ATOM 0 HB3 GLN A 138 4.041 -11.695 1.170 1.00 0.00 H new ATOM 0 HG2 GLN A 138 3.863 -13.772 -0.215 1.00 0.00 H new ATOM 0 HG3 GLN A 138 2.303 -14.111 0.508 1.00 0.00 H new ATOM 0 HE21 GLN A 138 0.436 -13.019 -0.268 1.00 0.00 H new ATOM 0 HE22 GLN A 138 0.501 -11.847 -1.589 1.00 0.00 H new ATOM 1836 N SER A 139 6.622 -12.944 2.270 1.00 0.00 N ATOM 1837 CA SER A 139 8.041 -13.373 2.076 1.00 0.00 C ATOM 1838 C SER A 139 8.647 -14.318 3.163 1.00 0.00 C ATOM 1839 O SER A 139 9.416 -15.199 2.765 1.00 0.00 O ATOM 1840 CB SER A 139 8.921 -12.128 1.871 1.00 0.00 C ATOM 1841 OG SER A 139 8.498 -11.395 0.728 1.00 0.00 O ATOM 0 H SER A 139 6.517 -11.941 2.423 1.00 0.00 H new ATOM 0 HA SER A 139 8.027 -14.004 1.187 1.00 0.00 H new ATOM 0 HB2 SER A 139 8.872 -11.492 2.755 1.00 0.00 H new ATOM 0 HB3 SER A 139 9.962 -12.428 1.752 1.00 0.00 H new ATOM 0 HG SER A 139 9.069 -10.606 0.616 1.00 0.00 H new ATOM 1847 N ASP A 140 8.309 -14.165 4.472 1.00 0.00 N ATOM 1848 CA ASP A 140 8.653 -15.155 5.543 1.00 0.00 C ATOM 1849 C ASP A 140 7.846 -16.499 5.472 1.00 0.00 C ATOM 1850 O ASP A 140 8.430 -17.523 5.841 1.00 0.00 O ATOM 1851 CB ASP A 140 8.517 -14.483 6.934 1.00 0.00 C ATOM 1852 CG ASP A 140 9.273 -15.175 8.072 1.00 0.00 C ATOM 1853 OD1 ASP A 140 10.574 -14.752 8.152 1.00 0.00 O ATOM 1854 OD2 ASP A 140 8.762 -16.008 8.818 1.00 0.00 O ATOM 0 H ASP A 140 7.792 -13.357 4.819 1.00 0.00 H new ATOM 0 HA ASP A 140 9.688 -15.451 5.372 1.00 0.00 H new ATOM 0 HB2 ASP A 140 8.870 -13.454 6.858 1.00 0.00 H new ATOM 0 HB3 ASP A 140 7.460 -14.439 7.196 1.00 0.00 H new ATOM 1859 N TYR A 141 6.563 -16.498 5.016 1.00 0.00 N ATOM 1860 CA TYR A 141 5.792 -17.743 4.695 1.00 0.00 C ATOM 1861 C TYR A 141 6.345 -18.527 3.453 1.00 0.00 C ATOM 1862 O TYR A 141 6.314 -19.757 3.486 1.00 0.00 O ATOM 1863 CB TYR A 141 4.296 -17.337 4.570 1.00 0.00 C ATOM 1864 CG TYR A 141 3.266 -18.448 4.243 1.00 0.00 C ATOM 1865 CD1 TYR A 141 3.007 -18.783 2.917 1.00 0.00 C ATOM 1866 CD2 TYR A 141 2.578 -19.111 5.249 1.00 0.00 C ATOM 1867 CE1 TYR A 141 2.068 -19.747 2.610 1.00 0.00 C ATOM 1868 CE2 TYR A 141 1.631 -20.067 4.934 1.00 0.00 C ATOM 1869 CZ TYR A 141 1.378 -20.388 3.617 1.00 0.00 C ATOM 1870 OH TYR A 141 0.441 -21.339 3.310 1.00 0.00 O ATOM 0 H TYR A 141 6.032 -15.641 4.860 1.00 0.00 H new ATOM 0 HA TYR A 141 5.909 -18.468 5.500 1.00 0.00 H new ATOM 0 HB2 TYR A 141 3.997 -16.870 5.508 1.00 0.00 H new ATOM 0 HB3 TYR A 141 4.221 -16.573 3.796 1.00 0.00 H new ATOM 0 HD1 TYR A 141 3.544 -18.285 2.123 1.00 0.00 H new ATOM 0 HD2 TYR A 141 2.784 -18.879 6.284 1.00 0.00 H new ATOM 0 HE1 TYR A 141 1.873 -20.000 1.578 1.00 0.00 H new ATOM 0 HE2 TYR A 141 1.087 -20.565 5.723 1.00 0.00 H new ATOM 0 HH TYR A 141 0.050 -21.692 4.136 1.00 0.00 H new