USER MOD reduce.3.24.130724 H: found=0, std=0, add=866, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 864 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 23:sc= 0.406 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 14 ASN : amide:sc= -0.814 X(o=-0.81,f=-0.57) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 LYS NZ :NH3+ -159:sc= -0.119 (180deg=-0.577) USER MOD Single : A 29 SER OG : rot 61:sc= 0.296 USER MOD Single : A 30 ASN : amide:sc= -0.878 K(o=-0.88,f=-2.7!) USER MOD Single : A 31 TYR OH : rot 180:sc= -0.937 USER MOD Single : A 34 SER OG : rot 67:sc= 0.617 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 31:sc= 0.413 USER MOD Single : A 48 SER OG : rot 46:sc= 1.06 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 HIS : no HD1:sc= -2.71! C(o=-2.7!,f=-5.4!) USER MOD Single : A 66 TYR OH : rot 180:sc= -0.374 USER MOD Single : A 67 ASN :FLIP amide:sc= 0.398 F(o=-1.9,f=0.4) USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 75 GLN :FLIP amide:sc= -0.96 F(o=-1.8!,f=-0.96) USER MOD Single : A 77 SER OG : rot 180:sc= 0.0209 USER MOD Single : A 79 GLN : amide:sc= 0 K(o=0,f=-0.92) USER MOD Single : A 87 GLN : amide:sc= 1.13 K(o=1.1,f=-0.07) USER MOD Single : A 89 THR OG1 : rot -103:sc= 0.474 USER MOD Single : A 90 CYS SG : rot -127:sc= 1.26 USER MOD Single : A 94 TYR OH : rot 165:sc= -1.55! USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ -136:sc=-0.00848 (180deg=-0.778) USER MOD Single : A 101 HIS : no HD1:sc=-0.00293 X(o=-0.0029,f=-0.086) USER MOD Single : A 102 LYS NZ :NH3+ 162:sc= -0.0246 (180deg=-0.258) USER MOD Single : A 103 MET CE :methyl -159:sc= -0.688 (180deg=-2.15) USER MOD Single : A 105 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 SER OG : rot 180:sc= -0.147 USER MOD Single : A 114 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 11.706 -9.329 20.487 1.00 0.00 N ATOM 2 CA GLY A 1 11.213 -10.271 19.500 1.00 0.00 C ATOM 3 C GLY A 1 9.973 -11.006 19.968 1.00 0.00 C ATOM 4 O GLY A 1 10.053 -12.150 20.416 1.00 0.00 O ATOM 0 H1 GLY A 1 12.554 -8.853 20.119 1.00 0.00 H new ATOM 0 H2 GLY A 1 10.971 -8.621 20.689 1.00 0.00 H new ATOM 0 H3 GLY A 1 11.946 -9.837 21.362 1.00 0.00 H new ATOM 0 HA2 GLY A 1 10.989 -9.739 18.575 1.00 0.00 H new ATOM 0 HA3 GLY A 1 11.995 -10.994 19.270 1.00 0.00 H new ATOM 8 N SER A 2 8.823 -10.348 19.867 1.00 0.00 N ATOM 9 CA SER A 2 7.561 -10.944 20.290 1.00 0.00 C ATOM 10 C SER A 2 6.879 -11.655 19.125 1.00 0.00 C ATOM 11 O SER A 2 6.487 -12.816 19.235 1.00 0.00 O ATOM 12 CB SER A 2 6.632 -9.872 20.862 1.00 0.00 C ATOM 13 OG SER A 2 7.288 -9.109 21.861 1.00 0.00 O ATOM 0 H SER A 2 8.739 -9.402 19.496 1.00 0.00 H new ATOM 0 HA SER A 2 7.777 -11.679 21.066 1.00 0.00 H new ATOM 0 HB2 SER A 2 6.294 -9.214 20.061 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.744 -10.343 21.284 1.00 0.00 H new ATOM 0 HG SER A 2 6.674 -8.430 22.210 1.00 0.00 H new ATOM 19 N SER A 3 6.740 -10.948 18.008 1.00 0.00 N ATOM 20 CA SER A 3 6.102 -11.508 16.822 1.00 0.00 C ATOM 21 C SER A 3 6.615 -10.828 15.557 1.00 0.00 C ATOM 22 O SER A 3 6.886 -9.628 15.549 1.00 0.00 O ATOM 23 CB SER A 3 4.583 -11.357 16.916 1.00 0.00 C ATOM 24 OG SER A 3 4.010 -12.416 17.663 1.00 0.00 O ATOM 0 H SER A 3 7.061 -9.986 17.899 1.00 0.00 H new ATOM 0 HA SER A 3 6.352 -12.568 16.770 1.00 0.00 H new ATOM 0 HB2 SER A 3 4.338 -10.404 17.384 1.00 0.00 H new ATOM 0 HB3 SER A 3 4.153 -11.340 15.914 1.00 0.00 H new ATOM 0 HG SER A 3 4.687 -12.799 18.259 1.00 0.00 H new ATOM 30 N GLY A 4 6.747 -11.606 14.486 1.00 0.00 N ATOM 31 CA GLY A 4 7.227 -11.063 13.229 1.00 0.00 C ATOM 32 C GLY A 4 8.736 -11.135 13.105 1.00 0.00 C ATOM 33 O GLY A 4 9.420 -11.583 14.025 1.00 0.00 O ATOM 0 H GLY A 4 6.530 -12.602 14.467 1.00 0.00 H new ATOM 0 HA2 GLY A 4 6.771 -11.609 12.403 1.00 0.00 H new ATOM 0 HA3 GLY A 4 6.907 -10.025 13.140 1.00 0.00 H new ATOM 37 N SER A 5 9.256 -10.693 11.965 1.00 0.00 N ATOM 38 CA SER A 5 10.694 -10.714 11.721 1.00 0.00 C ATOM 39 C SER A 5 11.305 -9.337 11.958 1.00 0.00 C ATOM 40 O SER A 5 10.724 -8.316 11.591 1.00 0.00 O ATOM 41 CB SER A 5 10.984 -11.175 10.292 1.00 0.00 C ATOM 42 OG SER A 5 10.690 -10.152 9.357 1.00 0.00 O ATOM 0 H SER A 5 8.703 -10.316 11.195 1.00 0.00 H new ATOM 0 HA SER A 5 11.146 -11.418 12.420 1.00 0.00 H new ATOM 0 HB2 SER A 5 12.032 -11.462 10.205 1.00 0.00 H new ATOM 0 HB3 SER A 5 10.391 -12.061 10.065 1.00 0.00 H new ATOM 0 HG SER A 5 10.885 -10.471 8.451 1.00 0.00 H new ATOM 48 N SER A 6 12.483 -9.317 12.574 1.00 0.00 N ATOM 49 CA SER A 6 13.173 -8.065 12.863 1.00 0.00 C ATOM 50 C SER A 6 14.151 -7.713 11.746 1.00 0.00 C ATOM 51 O SER A 6 14.646 -8.589 11.040 1.00 0.00 O ATOM 52 CB SER A 6 13.918 -8.166 14.196 1.00 0.00 C ATOM 53 OG SER A 6 13.023 -8.065 15.290 1.00 0.00 O ATOM 0 H SER A 6 12.979 -10.153 12.882 1.00 0.00 H new ATOM 0 HA SER A 6 12.426 -7.274 12.931 1.00 0.00 H new ATOM 0 HB2 SER A 6 14.453 -9.114 14.246 1.00 0.00 H new ATOM 0 HB3 SER A 6 14.665 -7.375 14.259 1.00 0.00 H new ATOM 0 HG SER A 6 13.524 -8.134 16.130 1.00 0.00 H new ATOM 59 N GLY A 7 14.424 -6.420 11.594 1.00 0.00 N ATOM 60 CA GLY A 7 15.341 -5.973 10.561 1.00 0.00 C ATOM 61 C GLY A 7 16.680 -5.539 11.123 1.00 0.00 C ATOM 62 O GLY A 7 16.738 -4.782 12.093 1.00 0.00 O ATOM 0 H GLY A 7 14.027 -5.675 12.167 1.00 0.00 H new ATOM 0 HA2 GLY A 7 15.496 -6.779 9.843 1.00 0.00 H new ATOM 0 HA3 GLY A 7 14.893 -5.142 10.016 1.00 0.00 H new ATOM 66 N ARG A 8 17.759 -6.020 10.515 1.00 0.00 N ATOM 67 CA ARG A 8 19.104 -5.679 10.963 1.00 0.00 C ATOM 68 C ARG A 8 19.565 -4.362 10.346 1.00 0.00 C ATOM 69 O ARG A 8 19.017 -3.909 9.341 1.00 0.00 O ATOM 70 CB ARG A 8 20.084 -6.796 10.599 1.00 0.00 C ATOM 71 CG ARG A 8 20.072 -7.960 11.577 1.00 0.00 C ATOM 72 CD ARG A 8 21.040 -9.054 11.152 1.00 0.00 C ATOM 73 NE ARG A 8 20.834 -10.288 11.905 1.00 0.00 N ATOM 74 CZ ARG A 8 21.310 -10.490 13.129 1.00 0.00 C ATOM 75 NH1 ARG A 8 22.015 -9.545 13.734 1.00 0.00 N ATOM 76 NH2 ARG A 8 21.081 -11.641 13.750 1.00 0.00 N ATOM 0 H ARG A 8 17.728 -6.647 9.711 1.00 0.00 H new ATOM 0 HA ARG A 8 19.081 -5.564 12.047 1.00 0.00 H new ATOM 0 HB2 ARG A 8 19.845 -7.167 9.603 1.00 0.00 H new ATOM 0 HB3 ARG A 8 21.091 -6.383 10.552 1.00 0.00 H new ATOM 0 HG2 ARG A 8 20.338 -7.603 12.572 1.00 0.00 H new ATOM 0 HG3 ARG A 8 19.064 -8.370 11.644 1.00 0.00 H new ATOM 0 HD2 ARG A 8 20.917 -9.254 10.088 1.00 0.00 H new ATOM 0 HD3 ARG A 8 22.064 -8.708 11.295 1.00 0.00 H new ATOM 0 HE ARG A 8 20.295 -11.036 11.468 1.00 0.00 H new ATOM 0 HH11 ARG A 8 22.194 -8.660 13.260 1.00 0.00 H new ATOM 0 HH12 ARG A 8 22.379 -9.703 14.674 1.00 0.00 H new ATOM 0 HH21 ARG A 8 20.539 -12.371 13.287 1.00 0.00 H new ATOM 0 HH22 ARG A 8 21.447 -11.795 14.690 1.00 0.00 H new ATOM 90 N LEU A 9 20.576 -3.752 10.955 1.00 0.00 N ATOM 91 CA LEU A 9 21.111 -2.486 10.466 1.00 0.00 C ATOM 92 C LEU A 9 21.204 -2.485 8.944 1.00 0.00 C ATOM 93 O LEU A 9 20.906 -1.483 8.293 1.00 0.00 O ATOM 94 CB LEU A 9 22.491 -2.225 11.073 1.00 0.00 C ATOM 95 CG LEU A 9 23.511 -3.356 10.933 1.00 0.00 C ATOM 96 CD1 LEU A 9 24.304 -3.203 9.645 1.00 0.00 C ATOM 97 CD2 LEU A 9 24.443 -3.385 12.135 1.00 0.00 C ATOM 0 H LEU A 9 21.041 -4.113 11.788 1.00 0.00 H new ATOM 0 HA LEU A 9 20.430 -1.691 10.770 1.00 0.00 H new ATOM 0 HB2 LEU A 9 22.906 -1.329 10.610 1.00 0.00 H new ATOM 0 HB3 LEU A 9 22.364 -2.006 12.133 1.00 0.00 H new ATOM 0 HG LEU A 9 22.972 -4.303 10.893 1.00 0.00 H new ATOM 0 HD11 LEU A 9 25.025 -4.017 9.563 1.00 0.00 H new ATOM 0 HD12 LEU A 9 23.624 -3.233 8.793 1.00 0.00 H new ATOM 0 HD13 LEU A 9 24.832 -2.250 9.654 1.00 0.00 H new ATOM 0 HD21 LEU A 9 25.162 -4.196 12.018 1.00 0.00 H new ATOM 0 HD22 LEU A 9 24.975 -2.436 12.206 1.00 0.00 H new ATOM 0 HD23 LEU A 9 23.861 -3.544 13.043 1.00 0.00 H new ATOM 109 N LEU A 10 21.617 -3.616 8.381 1.00 0.00 N ATOM 110 CA LEU A 10 21.747 -3.747 6.934 1.00 0.00 C ATOM 111 C LEU A 10 20.471 -3.297 6.230 1.00 0.00 C ATOM 112 O LEU A 10 19.414 -3.185 6.850 1.00 0.00 O ATOM 113 CB LEU A 10 22.065 -5.196 6.561 1.00 0.00 C ATOM 114 CG LEU A 10 22.893 -5.395 5.291 1.00 0.00 C ATOM 115 CD1 LEU A 10 24.379 -5.398 5.617 1.00 0.00 C ATOM 116 CD2 LEU A 10 22.496 -6.688 4.592 1.00 0.00 C ATOM 0 H LEU A 10 21.867 -4.455 8.905 1.00 0.00 H new ATOM 0 HA LEU A 10 22.566 -3.106 6.607 1.00 0.00 H new ATOM 0 HB2 LEU A 10 22.597 -5.656 7.394 1.00 0.00 H new ATOM 0 HB3 LEU A 10 21.125 -5.735 6.446 1.00 0.00 H new ATOM 0 HG LEU A 10 22.692 -4.564 4.616 1.00 0.00 H new ATOM 0 HD11 LEU A 10 24.952 -5.541 4.701 1.00 0.00 H new ATOM 0 HD12 LEU A 10 24.654 -4.446 6.072 1.00 0.00 H new ATOM 0 HD13 LEU A 10 24.597 -6.209 6.312 1.00 0.00 H new ATOM 0 HD21 LEU A 10 23.096 -6.813 3.690 1.00 0.00 H new ATOM 0 HD22 LEU A 10 22.667 -7.531 5.261 1.00 0.00 H new ATOM 0 HD23 LEU A 10 21.440 -6.647 4.323 1.00 0.00 H new ATOM 128 N ASP A 11 20.578 -3.042 4.930 1.00 0.00 N ATOM 129 CA ASP A 11 19.432 -2.607 4.140 1.00 0.00 C ATOM 130 C ASP A 11 19.799 -2.502 2.663 1.00 0.00 C ATOM 131 O ASP A 11 20.594 -1.646 2.269 1.00 0.00 O ATOM 132 CB ASP A 11 18.917 -1.260 4.648 1.00 0.00 C ATOM 133 CG ASP A 11 20.010 -0.426 5.287 1.00 0.00 C ATOM 134 OD1 ASP A 11 21.127 -0.384 4.731 1.00 0.00 O ATOM 135 OD2 ASP A 11 19.748 0.185 6.344 1.00 0.00 O ATOM 0 H ASP A 11 21.446 -3.129 4.402 1.00 0.00 H new ATOM 0 HA ASP A 11 18.644 -3.352 4.248 1.00 0.00 H new ATOM 0 HB2 ASP A 11 18.479 -0.705 3.818 1.00 0.00 H new ATOM 0 HB3 ASP A 11 18.121 -1.429 5.374 1.00 0.00 H new ATOM 140 N LEU A 12 19.217 -3.376 1.850 1.00 0.00 N ATOM 141 CA LEU A 12 19.484 -3.383 0.416 1.00 0.00 C ATOM 142 C LEU A 12 18.595 -2.376 -0.308 1.00 0.00 C ATOM 143 O LEU A 12 19.056 -1.643 -1.181 1.00 0.00 O ATOM 144 CB LEU A 12 19.261 -4.783 -0.158 1.00 0.00 C ATOM 145 CG LEU A 12 20.473 -5.714 -0.147 1.00 0.00 C ATOM 146 CD1 LEU A 12 20.880 -6.044 1.281 1.00 0.00 C ATOM 147 CD2 LEU A 12 20.176 -6.987 -0.926 1.00 0.00 C ATOM 0 H LEU A 12 18.557 -4.089 2.159 1.00 0.00 H new ATOM 0 HA LEU A 12 20.525 -3.097 0.264 1.00 0.00 H new ATOM 0 HB2 LEU A 12 18.457 -5.260 0.403 1.00 0.00 H new ATOM 0 HB3 LEU A 12 18.916 -4.681 -1.187 1.00 0.00 H new ATOM 0 HG LEU A 12 21.304 -5.201 -0.631 1.00 0.00 H new ATOM 0 HD11 LEU A 12 21.744 -6.708 1.269 1.00 0.00 H new ATOM 0 HD12 LEU A 12 21.136 -5.125 1.808 1.00 0.00 H new ATOM 0 HD13 LEU A 12 20.052 -6.536 1.791 1.00 0.00 H new ATOM 0 HD21 LEU A 12 21.050 -7.637 -0.907 1.00 0.00 H new ATOM 0 HD22 LEU A 12 19.330 -7.503 -0.471 1.00 0.00 H new ATOM 0 HD23 LEU A 12 19.934 -6.734 -1.958 1.00 0.00 H new ATOM 159 N GLU A 13 17.319 -2.347 0.064 1.00 0.00 N ATOM 160 CA GLU A 13 16.366 -1.429 -0.549 1.00 0.00 C ATOM 161 C GLU A 13 16.631 0.007 -0.106 1.00 0.00 C ATOM 162 O GLU A 13 16.327 0.385 1.024 1.00 0.00 O ATOM 163 CB GLU A 13 14.934 -1.829 -0.188 1.00 0.00 C ATOM 164 CG GLU A 13 14.318 -2.826 -1.156 1.00 0.00 C ATOM 165 CD GLU A 13 12.834 -3.029 -0.918 1.00 0.00 C ATOM 166 OE1 GLU A 13 12.481 -3.829 -0.027 1.00 0.00 O ATOM 167 OE2 GLU A 13 12.027 -2.389 -1.624 1.00 0.00 O ATOM 0 H GLU A 13 16.922 -2.948 0.786 1.00 0.00 H new ATOM 0 HA GLU A 13 16.490 -1.486 -1.630 1.00 0.00 H new ATOM 0 HB2 GLU A 13 14.927 -2.257 0.814 1.00 0.00 H new ATOM 0 HB3 GLU A 13 14.313 -0.934 -0.157 1.00 0.00 H new ATOM 0 HG2 GLU A 13 14.474 -2.479 -2.177 1.00 0.00 H new ATOM 0 HG3 GLU A 13 14.832 -3.783 -1.062 1.00 0.00 H new ATOM 174 N ASN A 14 17.202 0.801 -1.006 1.00 0.00 N ATOM 175 CA ASN A 14 17.510 2.196 -0.708 1.00 0.00 C ATOM 176 C ASN A 14 16.495 3.128 -1.362 1.00 0.00 C ATOM 177 O ASN A 14 16.852 4.190 -1.873 1.00 0.00 O ATOM 178 CB ASN A 14 18.921 2.542 -1.188 1.00 0.00 C ATOM 179 CG ASN A 14 19.993 1.789 -0.424 1.00 0.00 C ATOM 180 OD1 ASN A 14 20.014 0.558 -0.412 1.00 0.00 O ATOM 181 ND2 ASN A 14 20.889 2.527 0.220 1.00 0.00 N ATOM 0 H ASN A 14 17.461 0.503 -1.947 1.00 0.00 H new ATOM 0 HA ASN A 14 17.458 2.332 0.372 1.00 0.00 H new ATOM 0 HB2 ASN A 14 19.007 2.313 -2.250 1.00 0.00 H new ATOM 0 HB3 ASN A 14 19.086 3.614 -1.079 1.00 0.00 H new ATOM 0 HD21 ASN A 14 21.633 2.076 0.752 1.00 0.00 H new ATOM 0 HD22 ASN A 14 20.833 3.545 0.183 1.00 0.00 H new ATOM 188 N ILE A 15 15.229 2.725 -1.341 1.00 0.00 N ATOM 189 CA ILE A 15 14.163 3.525 -1.929 1.00 0.00 C ATOM 190 C ILE A 15 14.192 4.955 -1.400 1.00 0.00 C ATOM 191 O ILE A 15 14.472 5.185 -0.224 1.00 0.00 O ATOM 192 CB ILE A 15 12.778 2.913 -1.647 1.00 0.00 C ATOM 193 CG1 ILE A 15 12.699 1.493 -2.210 1.00 0.00 C ATOM 194 CG2 ILE A 15 11.682 3.786 -2.240 1.00 0.00 C ATOM 195 CD1 ILE A 15 13.334 1.349 -3.575 1.00 0.00 C ATOM 0 H ILE A 15 14.917 1.849 -0.923 1.00 0.00 H new ATOM 0 HA ILE A 15 14.334 3.535 -3.005 1.00 0.00 H new ATOM 0 HB ILE A 15 12.632 2.864 -0.568 1.00 0.00 H new ATOM 0 HG12 ILE A 15 13.187 0.808 -1.517 1.00 0.00 H new ATOM 0 HG13 ILE A 15 11.653 1.193 -2.271 1.00 0.00 H new ATOM 0 HG21 ILE A 15 10.709 3.340 -2.032 1.00 0.00 H new ATOM 0 HG22 ILE A 15 11.728 4.780 -1.795 1.00 0.00 H new ATOM 0 HG23 ILE A 15 11.822 3.864 -3.318 1.00 0.00 H new ATOM 0 HD11 ILE A 15 13.241 0.317 -3.912 1.00 0.00 H new ATOM 0 HD12 ILE A 15 12.830 2.008 -4.282 1.00 0.00 H new ATOM 0 HD13 ILE A 15 14.389 1.618 -3.516 1.00 0.00 H new ATOM 207 N GLN A 16 13.900 5.911 -2.276 1.00 0.00 N ATOM 208 CA GLN A 16 13.892 7.318 -1.896 1.00 0.00 C ATOM 209 C GLN A 16 12.517 7.737 -1.387 1.00 0.00 C ATOM 210 O GLN A 16 12.002 8.792 -1.758 1.00 0.00 O ATOM 211 CB GLN A 16 14.296 8.192 -3.085 1.00 0.00 C ATOM 212 CG GLN A 16 15.798 8.243 -3.320 1.00 0.00 C ATOM 213 CD GLN A 16 16.210 9.401 -4.207 1.00 0.00 C ATOM 214 OE1 GLN A 16 15.664 9.591 -5.294 1.00 0.00 O ATOM 215 NE2 GLN A 16 17.180 10.183 -3.747 1.00 0.00 N ATOM 0 H GLN A 16 13.666 5.737 -3.253 1.00 0.00 H new ATOM 0 HA GLN A 16 14.614 7.454 -1.091 1.00 0.00 H new ATOM 0 HB2 GLN A 16 13.808 7.816 -3.984 1.00 0.00 H new ATOM 0 HB3 GLN A 16 13.927 9.205 -2.923 1.00 0.00 H new ATOM 0 HG2 GLN A 16 16.310 8.325 -2.361 1.00 0.00 H new ATOM 0 HG3 GLN A 16 16.123 7.308 -3.776 1.00 0.00 H new ATOM 0 HE21 GLN A 16 17.605 9.989 -2.840 1.00 0.00 H new ATOM 0 HE22 GLN A 16 17.500 10.978 -4.300 1.00 0.00 H new ATOM 224 N ILE A 17 11.928 6.903 -0.536 1.00 0.00 N ATOM 225 CA ILE A 17 10.613 7.188 0.024 1.00 0.00 C ATOM 226 C ILE A 17 10.558 8.594 0.611 1.00 0.00 C ATOM 227 O ILE A 17 11.489 9.055 1.271 1.00 0.00 O ATOM 228 CB ILE A 17 10.235 6.172 1.118 1.00 0.00 C ATOM 229 CG1 ILE A 17 10.222 4.753 0.545 1.00 0.00 C ATOM 230 CG2 ILE A 17 8.881 6.519 1.718 1.00 0.00 C ATOM 231 CD1 ILE A 17 10.192 3.674 1.604 1.00 0.00 C ATOM 0 H ILE A 17 12.341 6.025 -0.220 1.00 0.00 H new ATOM 0 HA ILE A 17 9.898 7.111 -0.795 1.00 0.00 H new ATOM 0 HB ILE A 17 10.984 6.217 1.909 1.00 0.00 H new ATOM 0 HG12 ILE A 17 9.353 4.639 -0.103 1.00 0.00 H new ATOM 0 HG13 ILE A 17 11.105 4.614 -0.079 1.00 0.00 H new ATOM 0 HG21 ILE A 17 8.628 5.792 2.490 1.00 0.00 H new ATOM 0 HG22 ILE A 17 8.923 7.515 2.158 1.00 0.00 H new ATOM 0 HG23 ILE A 17 8.121 6.499 0.937 1.00 0.00 H new ATOM 0 HD11 ILE A 17 10.184 2.695 1.125 1.00 0.00 H new ATOM 0 HD12 ILE A 17 11.075 3.761 2.237 1.00 0.00 H new ATOM 0 HD13 ILE A 17 9.295 3.787 2.213 1.00 0.00 H new ATOM 243 N PRO A 18 9.439 9.293 0.369 1.00 0.00 N ATOM 244 CA PRO A 18 9.234 10.657 0.866 1.00 0.00 C ATOM 245 C PRO A 18 9.050 10.700 2.379 1.00 0.00 C ATOM 246 O PRO A 18 9.212 9.689 3.063 1.00 0.00 O ATOM 247 CB PRO A 18 7.953 11.104 0.159 1.00 0.00 C ATOM 248 CG PRO A 18 7.227 9.839 -0.146 1.00 0.00 C ATOM 249 CD PRO A 18 8.288 8.807 -0.410 1.00 0.00 C ATOM 0 HA PRO A 18 10.093 11.297 0.665 1.00 0.00 H new ATOM 0 HB2 PRO A 18 7.357 11.759 0.795 1.00 0.00 H new ATOM 0 HB3 PRO A 18 8.177 11.661 -0.751 1.00 0.00 H new ATOM 0 HG2 PRO A 18 6.593 9.542 0.689 1.00 0.00 H new ATOM 0 HG3 PRO A 18 6.577 9.961 -1.012 1.00 0.00 H new ATOM 0 HD2 PRO A 18 7.973 7.815 -0.085 1.00 0.00 H new ATOM 0 HD3 PRO A 18 8.523 8.735 -1.472 1.00 0.00 H new ATOM 257 N ASP A 19 8.709 11.876 2.896 1.00 0.00 N ATOM 258 CA ASP A 19 8.501 12.050 4.329 1.00 0.00 C ATOM 259 C ASP A 19 7.188 11.410 4.769 1.00 0.00 C ATOM 260 O ASP A 19 7.122 10.759 5.810 1.00 0.00 O ATOM 261 CB ASP A 19 8.505 13.536 4.689 1.00 0.00 C ATOM 262 CG ASP A 19 7.245 14.246 4.235 1.00 0.00 C ATOM 263 OD1 ASP A 19 6.844 14.053 3.068 1.00 0.00 O ATOM 264 OD2 ASP A 19 6.660 14.993 5.046 1.00 0.00 O ATOM 0 H ASP A 19 8.571 12.723 2.344 1.00 0.00 H new ATOM 0 HA ASP A 19 9.319 11.555 4.853 1.00 0.00 H new ATOM 0 HB2 ASP A 19 8.611 13.645 5.768 1.00 0.00 H new ATOM 0 HB3 ASP A 19 9.372 14.015 4.234 1.00 0.00 H new ATOM 269 N ALA A 20 6.145 11.603 3.968 1.00 0.00 N ATOM 270 CA ALA A 20 4.833 11.045 4.275 1.00 0.00 C ATOM 271 C ALA A 20 4.183 10.455 3.028 1.00 0.00 C ATOM 272 O ALA A 20 4.429 10.893 1.904 1.00 0.00 O ATOM 273 CB ALA A 20 3.936 12.110 4.887 1.00 0.00 C ATOM 0 H ALA A 20 6.183 12.141 3.102 1.00 0.00 H new ATOM 0 HA ALA A 20 4.967 10.241 4.998 1.00 0.00 H new ATOM 0 HB1 ALA A 20 2.960 11.679 5.111 1.00 0.00 H new ATOM 0 HB2 ALA A 20 4.388 12.482 5.806 1.00 0.00 H new ATOM 0 HB3 ALA A 20 3.816 12.933 4.183 1.00 0.00 H new ATOM 279 N PRO A 21 3.332 9.438 3.228 1.00 0.00 N ATOM 280 CA PRO A 21 2.629 8.766 2.131 1.00 0.00 C ATOM 281 C PRO A 21 1.568 9.656 1.492 1.00 0.00 C ATOM 282 O PRO A 21 1.000 10.542 2.130 1.00 0.00 O ATOM 283 CB PRO A 21 1.977 7.561 2.813 1.00 0.00 C ATOM 284 CG PRO A 21 1.822 7.970 4.237 1.00 0.00 C ATOM 285 CD PRO A 21 2.991 8.864 4.541 1.00 0.00 C ATOM 0 HA PRO A 21 3.303 8.499 1.317 1.00 0.00 H new ATOM 0 HB2 PRO A 21 1.013 7.324 2.362 1.00 0.00 H new ATOM 0 HB3 PRO A 21 2.599 6.670 2.722 1.00 0.00 H new ATOM 0 HG2 PRO A 21 0.879 8.495 4.392 1.00 0.00 H new ATOM 0 HG3 PRO A 21 1.815 7.100 4.894 1.00 0.00 H new ATOM 0 HD2 PRO A 21 2.728 9.638 5.262 1.00 0.00 H new ATOM 0 HD3 PRO A 21 3.825 8.305 4.964 1.00 0.00 H new ATOM 293 N PRO A 22 1.293 9.416 0.201 1.00 0.00 N ATOM 294 CA PRO A 22 0.297 10.185 -0.552 1.00 0.00 C ATOM 295 C PRO A 22 -1.128 9.895 -0.092 1.00 0.00 C ATOM 296 O PRO A 22 -1.403 8.886 0.557 1.00 0.00 O ATOM 297 CB PRO A 22 0.500 9.712 -1.993 1.00 0.00 C ATOM 298 CG PRO A 22 1.087 8.348 -1.866 1.00 0.00 C ATOM 299 CD PRO A 22 1.931 8.375 -0.622 1.00 0.00 C ATOM 0 HA PRO A 22 0.425 11.259 -0.419 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -0.444 9.688 -2.538 1.00 0.00 H new ATOM 0 HB3 PRO A 22 1.166 10.380 -2.539 1.00 0.00 H new ATOM 0 HG2 PRO A 22 0.305 7.592 -1.791 1.00 0.00 H new ATOM 0 HG3 PRO A 22 1.688 8.099 -2.740 1.00 0.00 H new ATOM 0 HD2 PRO A 22 1.933 7.409 -0.117 1.00 0.00 H new ATOM 0 HD3 PRO A 22 2.969 8.620 -0.846 1.00 0.00 H new ATOM 307 N PRO A 23 -2.056 10.800 -0.435 1.00 0.00 N ATOM 308 CA PRO A 23 -3.469 10.663 -0.069 1.00 0.00 C ATOM 309 C PRO A 23 -4.156 9.528 -0.821 1.00 0.00 C ATOM 310 O PRO A 23 -4.204 9.528 -2.052 1.00 0.00 O ATOM 311 CB PRO A 23 -4.072 12.012 -0.468 1.00 0.00 C ATOM 312 CG PRO A 23 -3.178 12.522 -1.545 1.00 0.00 C ATOM 313 CD PRO A 23 -1.799 12.027 -1.208 1.00 0.00 C ATOM 0 HA PRO A 23 -3.595 10.421 0.986 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -5.096 11.898 -0.824 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -4.103 12.698 0.379 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -3.496 12.157 -2.522 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -3.202 13.611 -1.589 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -1.215 11.822 -2.105 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -1.240 12.759 -0.625 1.00 0.00 H new ATOM 321 N ILE A 24 -4.685 8.565 -0.075 1.00 0.00 N ATOM 322 CA ILE A 24 -5.370 7.425 -0.674 1.00 0.00 C ATOM 323 C ILE A 24 -6.510 7.882 -1.577 1.00 0.00 C ATOM 324 O ILE A 24 -7.328 8.725 -1.208 1.00 0.00 O ATOM 325 CB ILE A 24 -5.931 6.478 0.403 1.00 0.00 C ATOM 326 CG1 ILE A 24 -4.797 5.926 1.269 1.00 0.00 C ATOM 327 CG2 ILE A 24 -6.710 5.343 -0.245 1.00 0.00 C ATOM 328 CD1 ILE A 24 -5.280 5.136 2.465 1.00 0.00 C ATOM 0 H ILE A 24 -4.653 8.550 0.944 1.00 0.00 H new ATOM 0 HA ILE A 24 -4.631 6.889 -1.269 1.00 0.00 H new ATOM 0 HB ILE A 24 -6.610 7.041 1.043 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -4.160 5.289 0.656 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -4.180 6.754 1.616 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -7.101 4.682 0.528 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -7.538 5.754 -0.823 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -6.051 4.779 -0.905 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -4.423 4.775 3.033 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -5.893 5.776 3.100 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -5.873 4.287 2.125 1.00 0.00 H new ATOM 340 N PRO A 25 -6.568 7.313 -2.790 1.00 0.00 N ATOM 341 CA PRO A 25 -7.605 7.644 -3.772 1.00 0.00 C ATOM 342 C PRO A 25 -8.980 7.131 -3.357 1.00 0.00 C ATOM 343 O PRO A 25 -9.125 6.478 -2.324 1.00 0.00 O ATOM 344 CB PRO A 25 -7.131 6.935 -5.042 1.00 0.00 C ATOM 345 CG PRO A 25 -6.286 5.809 -4.555 1.00 0.00 C ATOM 346 CD PRO A 25 -5.625 6.301 -3.297 1.00 0.00 C ATOM 0 HA PRO A 25 -7.726 8.721 -3.889 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -7.974 6.572 -5.630 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -6.562 7.609 -5.682 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -6.891 4.924 -4.357 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -5.543 5.527 -5.301 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -5.477 5.494 -2.579 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -4.644 6.731 -3.500 1.00 0.00 H new ATOM 354 N LYS A 26 -9.988 7.431 -4.170 1.00 0.00 N ATOM 355 CA LYS A 26 -11.352 6.999 -3.890 1.00 0.00 C ATOM 356 C LYS A 26 -11.540 5.527 -4.244 1.00 0.00 C ATOM 357 O LYS A 26 -11.303 5.118 -5.380 1.00 0.00 O ATOM 358 CB LYS A 26 -12.350 7.855 -4.672 1.00 0.00 C ATOM 359 CG LYS A 26 -12.798 9.101 -3.927 1.00 0.00 C ATOM 360 CD LYS A 26 -11.684 10.131 -3.844 1.00 0.00 C ATOM 361 CE LYS A 26 -12.218 11.500 -3.452 1.00 0.00 C ATOM 362 NZ LYS A 26 -13.171 12.034 -4.463 1.00 0.00 N ATOM 0 H LYS A 26 -9.885 7.972 -5.029 1.00 0.00 H new ATOM 0 HA LYS A 26 -11.535 7.123 -2.823 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -11.898 8.151 -5.619 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -13.225 7.251 -4.911 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -13.661 9.537 -4.431 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -13.119 8.829 -2.922 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -10.941 9.807 -3.115 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -11.178 10.199 -4.807 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -12.715 11.432 -2.484 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -11.386 12.194 -3.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -13.238 13.067 -4.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -12.833 11.797 -5.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -14.109 11.611 -4.313 1.00 0.00 H new ATOM 376 N GLU A 27 -11.970 4.738 -3.265 1.00 0.00 N ATOM 377 CA GLU A 27 -12.191 3.312 -3.476 1.00 0.00 C ATOM 378 C GLU A 27 -13.036 3.070 -4.723 1.00 0.00 C ATOM 379 O GLU A 27 -13.944 3.837 -5.047 1.00 0.00 O ATOM 380 CB GLU A 27 -12.875 2.693 -2.255 1.00 0.00 C ATOM 381 CG GLU A 27 -11.938 2.468 -1.081 1.00 0.00 C ATOM 382 CD GLU A 27 -12.352 1.288 -0.222 1.00 0.00 C ATOM 383 OE1 GLU A 27 -13.136 1.493 0.728 1.00 0.00 O ATOM 384 OE2 GLU A 27 -11.891 0.161 -0.500 1.00 0.00 O ATOM 0 H GLU A 27 -12.172 5.061 -2.319 1.00 0.00 H new ATOM 0 HA GLU A 27 -11.220 2.838 -3.619 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -13.691 3.342 -1.938 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -13.319 1.740 -2.542 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -10.927 2.304 -1.454 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -11.909 3.368 -0.466 1.00 0.00 H new ATOM 391 N PRO A 28 -12.731 1.980 -5.442 1.00 0.00 N ATOM 392 CA PRO A 28 -13.450 1.612 -6.666 1.00 0.00 C ATOM 393 C PRO A 28 -14.874 1.147 -6.383 1.00 0.00 C ATOM 394 O PRO A 28 -15.093 0.019 -5.942 1.00 0.00 O ATOM 395 CB PRO A 28 -12.615 0.462 -7.235 1.00 0.00 C ATOM 396 CG PRO A 28 -11.922 -0.124 -6.054 1.00 0.00 C ATOM 397 CD PRO A 28 -11.661 1.022 -5.116 1.00 0.00 C ATOM 0 HA PRO A 28 -13.557 2.457 -7.346 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -13.245 -0.277 -7.731 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -11.900 0.821 -7.976 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -12.539 -0.885 -5.577 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -10.990 -0.607 -6.348 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -11.708 0.707 -4.074 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -10.673 1.454 -5.274 1.00 0.00 H new ATOM 405 N SER A 29 -15.840 2.024 -6.641 1.00 0.00 N ATOM 406 CA SER A 29 -17.244 1.704 -6.410 1.00 0.00 C ATOM 407 C SER A 29 -17.823 0.924 -7.587 1.00 0.00 C ATOM 408 O SER A 29 -18.896 1.249 -8.093 1.00 0.00 O ATOM 409 CB SER A 29 -18.050 2.985 -6.187 1.00 0.00 C ATOM 410 OG SER A 29 -18.123 3.756 -7.374 1.00 0.00 O ATOM 0 H SER A 29 -15.676 2.961 -7.010 1.00 0.00 H new ATOM 0 HA SER A 29 -17.308 1.082 -5.517 1.00 0.00 H new ATOM 0 HB2 SER A 29 -19.056 2.732 -5.852 1.00 0.00 H new ATOM 0 HB3 SER A 29 -17.589 3.575 -5.395 1.00 0.00 H new ATOM 0 HG SER A 29 -18.572 3.237 -8.074 1.00 0.00 H new ATOM 416 N ASN A 30 -17.104 -0.108 -8.016 1.00 0.00 N ATOM 417 CA ASN A 30 -17.545 -0.936 -9.133 1.00 0.00 C ATOM 418 C ASN A 30 -16.603 -2.118 -9.339 1.00 0.00 C ATOM 419 O ASN A 30 -15.468 -1.951 -9.788 1.00 0.00 O ATOM 420 CB ASN A 30 -17.622 -0.102 -10.413 1.00 0.00 C ATOM 421 CG ASN A 30 -16.268 0.435 -10.836 1.00 0.00 C ATOM 422 OD1 ASN A 30 -15.544 1.025 -10.034 1.00 0.00 O ATOM 423 ND2 ASN A 30 -15.921 0.233 -12.102 1.00 0.00 N ATOM 0 H ASN A 30 -16.213 -0.391 -7.607 1.00 0.00 H new ATOM 0 HA ASN A 30 -18.537 -1.322 -8.898 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -18.035 -0.712 -11.216 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -18.308 0.731 -10.260 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -15.022 0.572 -12.445 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -16.553 -0.261 -12.731 1.00 0.00 H new ATOM 430 N TYR A 31 -17.081 -3.313 -9.009 1.00 0.00 N ATOM 431 CA TYR A 31 -16.281 -4.523 -9.156 1.00 0.00 C ATOM 432 C TYR A 31 -16.575 -5.211 -10.486 1.00 0.00 C ATOM 433 O TYR A 31 -17.726 -5.294 -10.914 1.00 0.00 O ATOM 434 CB TYR A 31 -16.557 -5.485 -7.999 1.00 0.00 C ATOM 435 CG TYR A 31 -16.583 -4.812 -6.646 1.00 0.00 C ATOM 436 CD1 TYR A 31 -15.610 -3.886 -6.290 1.00 0.00 C ATOM 437 CD2 TYR A 31 -17.579 -5.104 -5.722 1.00 0.00 C ATOM 438 CE1 TYR A 31 -15.629 -3.269 -5.054 1.00 0.00 C ATOM 439 CE2 TYR A 31 -17.607 -4.491 -4.484 1.00 0.00 C ATOM 440 CZ TYR A 31 -16.630 -3.575 -4.155 1.00 0.00 C ATOM 441 OH TYR A 31 -16.653 -2.963 -2.922 1.00 0.00 O ATOM 0 H TYR A 31 -18.018 -3.469 -8.638 1.00 0.00 H new ATOM 0 HA TYR A 31 -15.229 -4.238 -9.140 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -17.514 -5.979 -8.168 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -15.793 -6.263 -7.994 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -14.825 -3.644 -6.992 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -18.344 -5.822 -5.976 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -14.865 -2.552 -4.793 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -18.389 -4.728 -3.778 1.00 0.00 H new ATOM 0 HH TYR A 31 -17.423 -3.288 -2.410 1.00 0.00 H new ATOM 451 N ASP A 32 -15.525 -5.704 -11.134 1.00 0.00 N ATOM 452 CA ASP A 32 -15.668 -6.387 -12.414 1.00 0.00 C ATOM 453 C ASP A 32 -15.567 -7.899 -12.237 1.00 0.00 C ATOM 454 O ASP A 32 -16.096 -8.666 -13.043 1.00 0.00 O ATOM 455 CB ASP A 32 -14.600 -5.904 -13.396 1.00 0.00 C ATOM 456 CG ASP A 32 -13.294 -5.558 -12.708 1.00 0.00 C ATOM 457 OD1 ASP A 32 -12.598 -6.490 -12.253 1.00 0.00 O ATOM 458 OD2 ASP A 32 -12.967 -4.356 -12.626 1.00 0.00 O ATOM 0 H ASP A 32 -14.565 -5.643 -10.793 1.00 0.00 H new ATOM 0 HA ASP A 32 -16.653 -6.151 -12.816 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -14.420 -6.678 -14.142 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -14.970 -5.028 -13.928 1.00 0.00 H new ATOM 463 N PHE A 33 -14.883 -8.322 -11.179 1.00 0.00 N ATOM 464 CA PHE A 33 -14.711 -9.742 -10.897 1.00 0.00 C ATOM 465 C PHE A 33 -15.785 -10.240 -9.934 1.00 0.00 C ATOM 466 O PHE A 33 -16.216 -11.391 -10.009 1.00 0.00 O ATOM 467 CB PHE A 33 -13.323 -10.003 -10.310 1.00 0.00 C ATOM 468 CG PHE A 33 -13.085 -9.306 -9.001 1.00 0.00 C ATOM 469 CD1 PHE A 33 -12.788 -7.953 -8.965 1.00 0.00 C ATOM 470 CD2 PHE A 33 -13.159 -10.003 -7.806 1.00 0.00 C ATOM 471 CE1 PHE A 33 -12.570 -7.308 -7.762 1.00 0.00 C ATOM 472 CE2 PHE A 33 -12.942 -9.364 -6.600 1.00 0.00 C ATOM 473 CZ PHE A 33 -12.646 -8.015 -6.578 1.00 0.00 C ATOM 0 H PHE A 33 -14.439 -7.701 -10.503 1.00 0.00 H new ATOM 0 HA PHE A 33 -14.809 -10.287 -11.836 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -13.192 -11.076 -10.170 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -12.568 -9.681 -11.027 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -12.726 -7.396 -9.888 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -13.389 -11.058 -7.817 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -12.341 -6.253 -7.748 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -13.004 -9.919 -5.676 1.00 0.00 H new ATOM 0 HZ PHE A 33 -12.474 -7.514 -5.637 1.00 0.00 H new ATOM 483 N SER A 34 -16.212 -9.365 -9.030 1.00 0.00 N ATOM 484 CA SER A 34 -17.232 -9.715 -8.048 1.00 0.00 C ATOM 485 C SER A 34 -17.090 -11.171 -7.614 1.00 0.00 C ATOM 486 O SER A 34 -18.046 -11.943 -7.670 1.00 0.00 O ATOM 487 CB SER A 34 -18.629 -9.477 -8.626 1.00 0.00 C ATOM 488 OG SER A 34 -18.929 -10.421 -9.640 1.00 0.00 O ATOM 0 H SER A 34 -15.867 -8.408 -8.957 1.00 0.00 H new ATOM 0 HA SER A 34 -17.095 -9.078 -7.174 1.00 0.00 H new ATOM 0 HB2 SER A 34 -19.371 -9.545 -7.831 1.00 0.00 H new ATOM 0 HB3 SER A 34 -18.690 -8.468 -9.034 1.00 0.00 H new ATOM 0 HG SER A 34 -19.004 -11.314 -9.244 1.00 0.00 H new ATOM 494 N GLY A 35 -15.888 -11.538 -7.180 1.00 0.00 N ATOM 495 CA GLY A 35 -15.641 -12.900 -6.743 1.00 0.00 C ATOM 496 C GLY A 35 -15.576 -13.878 -7.899 1.00 0.00 C ATOM 497 O GLY A 35 -16.229 -13.700 -8.928 1.00 0.00 O ATOM 0 H GLY A 35 -15.081 -10.917 -7.123 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -14.704 -12.936 -6.188 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -16.430 -13.206 -6.056 1.00 0.00 H new ATOM 501 N PRO A 36 -14.770 -14.938 -7.738 1.00 0.00 N ATOM 502 CA PRO A 36 -14.601 -15.968 -8.767 1.00 0.00 C ATOM 503 C PRO A 36 -15.852 -16.822 -8.943 1.00 0.00 C ATOM 504 O PRO A 36 -16.856 -16.617 -8.260 1.00 0.00 O ATOM 505 CB PRO A 36 -13.445 -16.817 -8.233 1.00 0.00 C ATOM 506 CG PRO A 36 -13.481 -16.620 -6.757 1.00 0.00 C ATOM 507 CD PRO A 36 -13.962 -15.213 -6.538 1.00 0.00 C ATOM 0 HA PRO A 36 -14.412 -15.535 -9.749 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -13.571 -17.867 -8.495 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -12.491 -16.496 -8.652 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -14.150 -17.339 -6.284 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -12.494 -16.767 -6.320 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -14.554 -15.128 -5.627 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -13.131 -14.514 -6.444 1.00 0.00 H new ATOM 515 N SER A 37 -15.785 -17.780 -9.861 1.00 0.00 N ATOM 516 CA SER A 37 -16.914 -18.664 -10.128 1.00 0.00 C ATOM 517 C SER A 37 -17.034 -19.734 -9.048 1.00 0.00 C ATOM 518 O SER A 37 -16.351 -20.757 -9.093 1.00 0.00 O ATOM 519 CB SER A 37 -16.759 -19.323 -11.500 1.00 0.00 C ATOM 520 OG SER A 37 -17.930 -20.035 -11.859 1.00 0.00 O ATOM 0 H SER A 37 -14.961 -17.964 -10.433 1.00 0.00 H new ATOM 0 HA SER A 37 -17.823 -18.063 -10.122 1.00 0.00 H new ATOM 0 HB2 SER A 37 -16.548 -18.562 -12.251 1.00 0.00 H new ATOM 0 HB3 SER A 37 -15.907 -20.002 -11.486 1.00 0.00 H new ATOM 0 HG SER A 37 -17.806 -20.445 -12.740 1.00 0.00 H new ATOM 526 N SER A 38 -17.907 -19.489 -8.076 1.00 0.00 N ATOM 527 CA SER A 38 -18.115 -20.429 -6.981 1.00 0.00 C ATOM 528 C SER A 38 -18.736 -21.727 -7.489 1.00 0.00 C ATOM 529 O SER A 38 -19.226 -21.794 -8.616 1.00 0.00 O ATOM 530 CB SER A 38 -19.012 -19.806 -5.909 1.00 0.00 C ATOM 531 OG SER A 38 -20.371 -19.817 -6.313 1.00 0.00 O ATOM 0 H SER A 38 -18.481 -18.648 -8.025 1.00 0.00 H new ATOM 0 HA SER A 38 -17.144 -20.659 -6.543 1.00 0.00 H new ATOM 0 HB2 SER A 38 -18.903 -20.356 -4.974 1.00 0.00 H new ATOM 0 HB3 SER A 38 -18.695 -18.781 -5.715 1.00 0.00 H new ATOM 0 HG SER A 38 -20.924 -19.415 -5.611 1.00 0.00 H new ATOM 537 N GLY A 39 -18.713 -22.757 -6.648 1.00 0.00 N ATOM 538 CA GLY A 39 -19.276 -24.039 -7.029 1.00 0.00 C ATOM 539 C GLY A 39 -20.612 -24.305 -6.364 1.00 0.00 C ATOM 540 O GLY A 39 -21.613 -24.542 -7.041 1.00 0.00 O ATOM 0 H GLY A 39 -18.314 -22.726 -5.710 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -19.399 -24.071 -8.112 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -18.577 -24.833 -6.764 1.00 0.00 H new ATOM 544 N ILE A 40 -20.628 -24.269 -5.036 1.00 0.00 N ATOM 545 CA ILE A 40 -21.851 -24.509 -4.281 1.00 0.00 C ATOM 546 C ILE A 40 -21.898 -23.650 -3.022 1.00 0.00 C ATOM 547 O ILE A 40 -20.860 -23.265 -2.483 1.00 0.00 O ATOM 548 CB ILE A 40 -21.985 -25.991 -3.883 1.00 0.00 C ATOM 549 CG1 ILE A 40 -20.788 -26.424 -3.035 1.00 0.00 C ATOM 550 CG2 ILE A 40 -22.106 -26.863 -5.123 1.00 0.00 C ATOM 551 CD1 ILE A 40 -20.995 -26.225 -1.550 1.00 0.00 C ATOM 0 H ILE A 40 -19.808 -24.076 -4.461 1.00 0.00 H new ATOM 0 HA ILE A 40 -22.682 -24.239 -4.933 1.00 0.00 H new ATOM 0 HB ILE A 40 -22.890 -26.112 -3.288 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -20.579 -27.477 -3.227 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -19.908 -25.862 -3.349 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -22.200 -27.907 -4.826 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -22.988 -26.567 -5.691 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -21.217 -26.741 -5.742 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -20.106 -26.554 -1.011 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -21.174 -25.169 -1.346 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -21.855 -26.809 -1.221 1.00 0.00 H new ATOM 563 N GLU A 41 -23.108 -23.356 -2.557 1.00 0.00 N ATOM 564 CA GLU A 41 -23.288 -22.543 -1.360 1.00 0.00 C ATOM 565 C GLU A 41 -23.620 -23.417 -0.154 1.00 0.00 C ATOM 566 O GLU A 41 -24.162 -24.512 -0.297 1.00 0.00 O ATOM 567 CB GLU A 41 -24.399 -21.513 -1.578 1.00 0.00 C ATOM 568 CG GLU A 41 -25.798 -22.104 -1.513 1.00 0.00 C ATOM 569 CD GLU A 41 -26.067 -23.091 -2.633 1.00 0.00 C ATOM 570 OE1 GLU A 41 -25.735 -24.283 -2.466 1.00 0.00 O ATOM 571 OE2 GLU A 41 -26.610 -22.670 -3.676 1.00 0.00 O ATOM 0 H GLU A 41 -23.977 -23.668 -2.990 1.00 0.00 H new ATOM 0 HA GLU A 41 -22.352 -22.021 -1.162 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -24.309 -20.729 -0.826 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -24.258 -21.039 -2.550 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -25.933 -22.603 -0.554 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -26.531 -21.299 -1.559 1.00 0.00 H new ATOM 578 N GLY A 42 -23.290 -22.924 1.036 1.00 0.00 N ATOM 579 CA GLY A 42 -23.560 -23.672 2.250 1.00 0.00 C ATOM 580 C GLY A 42 -23.020 -22.983 3.488 1.00 0.00 C ATOM 581 O GLY A 42 -22.222 -22.050 3.389 1.00 0.00 O ATOM 0 H GLY A 42 -22.840 -22.020 1.181 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -24.636 -23.811 2.356 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -23.117 -24.664 2.168 1.00 0.00 H new ATOM 585 N ARG A 43 -23.457 -23.441 4.656 1.00 0.00 N ATOM 586 CA ARG A 43 -23.015 -22.860 5.918 1.00 0.00 C ATOM 587 C ARG A 43 -21.492 -22.797 5.984 1.00 0.00 C ATOM 588 O ARG A 43 -20.817 -23.825 5.984 1.00 0.00 O ATOM 589 CB ARG A 43 -23.553 -23.676 7.096 1.00 0.00 C ATOM 590 CG ARG A 43 -23.307 -23.028 8.448 1.00 0.00 C ATOM 591 CD ARG A 43 -24.184 -21.801 8.646 1.00 0.00 C ATOM 592 NE ARG A 43 -25.603 -22.144 8.692 1.00 0.00 N ATOM 593 CZ ARG A 43 -26.579 -21.263 8.502 1.00 0.00 C ATOM 594 NH1 ARG A 43 -26.291 -19.993 8.253 1.00 0.00 N ATOM 595 NH2 ARG A 43 -27.846 -21.653 8.559 1.00 0.00 N ATOM 0 H ARG A 43 -24.117 -24.213 4.755 1.00 0.00 H new ATOM 0 HA ARG A 43 -23.407 -21.845 5.978 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -24.625 -23.826 6.964 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -23.089 -24.662 7.086 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -23.505 -23.750 9.240 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -22.258 -22.744 8.531 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -23.902 -21.300 9.572 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -24.008 -21.095 7.835 1.00 0.00 H new ATOM 0 HE ARG A 43 -25.859 -23.113 8.880 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -25.318 -19.690 8.207 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -27.042 -19.319 8.107 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -28.071 -22.630 8.749 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -28.595 -20.976 8.413 1.00 0.00 H new ATOM 609 N GLY A 44 -20.958 -21.580 6.039 1.00 0.00 N ATOM 610 CA GLY A 44 -19.518 -21.405 6.103 1.00 0.00 C ATOM 611 C GLY A 44 -18.831 -21.774 4.803 1.00 0.00 C ATOM 612 O GLY A 44 -18.230 -22.842 4.692 1.00 0.00 O ATOM 0 H GLY A 44 -21.496 -20.713 6.040 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -19.292 -20.367 6.348 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -19.116 -22.018 6.910 1.00 0.00 H new ATOM 616 N SER A 45 -18.921 -20.888 3.816 1.00 0.00 N ATOM 617 CA SER A 45 -18.307 -21.129 2.515 1.00 0.00 C ATOM 618 C SER A 45 -17.038 -20.299 2.351 1.00 0.00 C ATOM 619 O SER A 45 -17.092 -19.132 1.961 1.00 0.00 O ATOM 620 CB SER A 45 -19.294 -20.799 1.393 1.00 0.00 C ATOM 621 OG SER A 45 -18.813 -21.256 0.141 1.00 0.00 O ATOM 0 H SER A 45 -19.413 -19.998 3.892 1.00 0.00 H new ATOM 0 HA SER A 45 -18.040 -22.184 2.457 1.00 0.00 H new ATOM 0 HB2 SER A 45 -20.259 -21.260 1.606 1.00 0.00 H new ATOM 0 HB3 SER A 45 -19.457 -19.722 1.353 1.00 0.00 H new ATOM 0 HG SER A 45 -19.462 -21.035 -0.559 1.00 0.00 H new ATOM 627 N SER A 46 -15.896 -20.909 2.653 1.00 0.00 N ATOM 628 CA SER A 46 -14.612 -20.226 2.543 1.00 0.00 C ATOM 629 C SER A 46 -13.508 -21.205 2.157 1.00 0.00 C ATOM 630 O SER A 46 -13.271 -22.196 2.846 1.00 0.00 O ATOM 631 CB SER A 46 -14.262 -19.540 3.865 1.00 0.00 C ATOM 632 OG SER A 46 -14.119 -20.487 4.909 1.00 0.00 O ATOM 0 H SER A 46 -15.834 -21.875 2.976 1.00 0.00 H new ATOM 0 HA SER A 46 -14.694 -19.472 1.761 1.00 0.00 H new ATOM 0 HB2 SER A 46 -13.336 -18.976 3.752 1.00 0.00 H new ATOM 0 HB3 SER A 46 -15.042 -18.824 4.124 1.00 0.00 H new ATOM 0 HG SER A 46 -13.782 -21.331 4.541 1.00 0.00 H new ATOM 638 N GLY A 47 -12.834 -20.919 1.047 1.00 0.00 N ATOM 639 CA GLY A 47 -11.762 -21.783 0.586 1.00 0.00 C ATOM 640 C GLY A 47 -11.663 -21.827 -0.926 1.00 0.00 C ATOM 641 O GLY A 47 -12.678 -21.846 -1.621 1.00 0.00 O ATOM 0 H GLY A 47 -13.011 -20.105 0.459 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -10.815 -21.434 0.999 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -11.924 -22.792 0.966 1.00 0.00 H new ATOM 645 N SER A 48 -10.435 -21.842 -1.436 1.00 0.00 N ATOM 646 CA SER A 48 -10.207 -21.878 -2.876 1.00 0.00 C ATOM 647 C SER A 48 -10.485 -23.270 -3.435 1.00 0.00 C ATOM 648 O SER A 48 -9.644 -24.165 -3.350 1.00 0.00 O ATOM 649 CB SER A 48 -8.769 -21.466 -3.196 1.00 0.00 C ATOM 650 OG SER A 48 -7.840 -22.380 -2.639 1.00 0.00 O ATOM 0 H SER A 48 -9.584 -21.830 -0.874 1.00 0.00 H new ATOM 0 HA SER A 48 -10.893 -21.173 -3.346 1.00 0.00 H new ATOM 0 HB2 SER A 48 -8.633 -21.418 -4.276 1.00 0.00 H new ATOM 0 HB3 SER A 48 -8.579 -20.466 -2.806 1.00 0.00 H new ATOM 0 HG SER A 48 -8.129 -23.297 -2.829 1.00 0.00 H new ATOM 656 N SER A 49 -11.672 -23.445 -4.006 1.00 0.00 N ATOM 657 CA SER A 49 -12.065 -24.728 -4.576 1.00 0.00 C ATOM 658 C SER A 49 -11.810 -24.755 -6.080 1.00 0.00 C ATOM 659 O SER A 49 -12.429 -24.011 -6.840 1.00 0.00 O ATOM 660 CB SER A 49 -13.543 -25.006 -4.293 1.00 0.00 C ATOM 661 OG SER A 49 -13.833 -26.388 -4.406 1.00 0.00 O ATOM 0 H SER A 49 -12.379 -22.714 -4.086 1.00 0.00 H new ATOM 0 HA SER A 49 -11.461 -25.505 -4.108 1.00 0.00 H new ATOM 0 HB2 SER A 49 -13.796 -24.659 -3.291 1.00 0.00 H new ATOM 0 HB3 SER A 49 -14.162 -24.443 -4.991 1.00 0.00 H new ATOM 0 HG SER A 49 -14.783 -26.539 -4.219 1.00 0.00 H new ATOM 667 N GLY A 50 -10.893 -25.620 -6.504 1.00 0.00 N ATOM 668 CA GLY A 50 -10.571 -25.729 -7.915 1.00 0.00 C ATOM 669 C GLY A 50 -10.392 -24.376 -8.575 1.00 0.00 C ATOM 670 O GLY A 50 -11.317 -23.855 -9.197 1.00 0.00 O ATOM 0 H GLY A 50 -10.367 -26.247 -5.895 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -9.657 -26.311 -8.032 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -11.364 -26.276 -8.424 1.00 0.00 H new ATOM 674 N SER A 51 -9.200 -23.806 -8.438 1.00 0.00 N ATOM 675 CA SER A 51 -8.904 -22.503 -9.021 1.00 0.00 C ATOM 676 C SER A 51 -8.590 -22.632 -10.509 1.00 0.00 C ATOM 677 O SER A 51 -8.139 -23.680 -10.970 1.00 0.00 O ATOM 678 CB SER A 51 -7.727 -21.850 -8.294 1.00 0.00 C ATOM 679 OG SER A 51 -8.103 -21.421 -6.997 1.00 0.00 O ATOM 0 H SER A 51 -8.423 -24.226 -7.928 1.00 0.00 H new ATOM 0 HA SER A 51 -9.786 -21.873 -8.907 1.00 0.00 H new ATOM 0 HB2 SER A 51 -6.902 -22.559 -8.221 1.00 0.00 H new ATOM 0 HB3 SER A 51 -7.366 -20.999 -8.871 1.00 0.00 H new ATOM 0 HG SER A 51 -7.333 -21.009 -6.553 1.00 0.00 H new ATOM 685 N SER A 52 -8.832 -21.558 -11.254 1.00 0.00 N ATOM 686 CA SER A 52 -8.579 -21.551 -12.690 1.00 0.00 C ATOM 687 C SER A 52 -7.085 -21.668 -12.979 1.00 0.00 C ATOM 688 O SER A 52 -6.262 -21.655 -12.065 1.00 0.00 O ATOM 689 CB SER A 52 -9.133 -20.272 -13.320 1.00 0.00 C ATOM 690 OG SER A 52 -8.332 -19.152 -12.989 1.00 0.00 O ATOM 0 H SER A 52 -9.203 -20.682 -10.887 1.00 0.00 H new ATOM 0 HA SER A 52 -9.085 -22.412 -13.128 1.00 0.00 H new ATOM 0 HB2 SER A 52 -9.175 -20.385 -14.403 1.00 0.00 H new ATOM 0 HB3 SER A 52 -10.154 -20.107 -12.977 1.00 0.00 H new ATOM 0 HG SER A 52 -8.706 -18.348 -13.405 1.00 0.00 H new ATOM 696 N GLY A 53 -6.743 -21.783 -14.258 1.00 0.00 N ATOM 697 CA GLY A 53 -5.350 -21.901 -14.646 1.00 0.00 C ATOM 698 C GLY A 53 -5.083 -21.335 -16.027 1.00 0.00 C ATOM 699 O GLY A 53 -4.131 -20.580 -16.222 1.00 0.00 O ATOM 0 H GLY A 53 -7.406 -21.797 -15.033 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -4.728 -21.382 -13.917 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -5.058 -22.951 -14.624 1.00 0.00 H new ATOM 703 N SER A 54 -5.924 -21.702 -16.988 1.00 0.00 N ATOM 704 CA SER A 54 -5.771 -21.230 -18.360 1.00 0.00 C ATOM 705 C SER A 54 -5.330 -19.770 -18.386 1.00 0.00 C ATOM 706 O SER A 54 -4.381 -19.409 -19.081 1.00 0.00 O ATOM 707 CB SER A 54 -7.085 -21.392 -19.127 1.00 0.00 C ATOM 708 OG SER A 54 -7.303 -22.746 -19.485 1.00 0.00 O ATOM 0 H SER A 54 -6.719 -22.325 -16.842 1.00 0.00 H new ATOM 0 HA SER A 54 -5.001 -21.832 -18.842 1.00 0.00 H new ATOM 0 HB2 SER A 54 -7.914 -21.037 -18.514 1.00 0.00 H new ATOM 0 HB3 SER A 54 -7.064 -20.774 -20.025 1.00 0.00 H new ATOM 0 HG SER A 54 -8.150 -22.823 -19.972 1.00 0.00 H new ATOM 714 N SER A 55 -6.028 -18.934 -17.622 1.00 0.00 N ATOM 715 CA SER A 55 -5.712 -17.512 -17.560 1.00 0.00 C ATOM 716 C SER A 55 -5.292 -17.110 -16.149 1.00 0.00 C ATOM 717 O SER A 55 -5.608 -17.795 -15.177 1.00 0.00 O ATOM 718 CB SER A 55 -6.917 -16.681 -18.002 1.00 0.00 C ATOM 719 OG SER A 55 -7.922 -16.667 -17.003 1.00 0.00 O ATOM 0 H SER A 55 -6.815 -19.217 -17.038 1.00 0.00 H new ATOM 0 HA SER A 55 -4.879 -17.320 -18.237 1.00 0.00 H new ATOM 0 HB2 SER A 55 -6.600 -15.661 -18.217 1.00 0.00 H new ATOM 0 HB3 SER A 55 -7.325 -17.090 -18.927 1.00 0.00 H new ATOM 0 HG SER A 55 -8.681 -16.128 -17.310 1.00 0.00 H new ATOM 725 N GLY A 56 -4.578 -15.993 -16.046 1.00 0.00 N ATOM 726 CA GLY A 56 -4.126 -15.519 -14.752 1.00 0.00 C ATOM 727 C GLY A 56 -2.820 -16.158 -14.323 1.00 0.00 C ATOM 728 O GLY A 56 -2.708 -16.670 -13.209 1.00 0.00 O ATOM 0 H GLY A 56 -4.305 -15.408 -16.836 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -4.002 -14.437 -14.788 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -4.892 -15.728 -14.005 1.00 0.00 H new ATOM 732 N ASP A 57 -1.831 -16.130 -15.209 1.00 0.00 N ATOM 733 CA ASP A 57 -0.526 -16.711 -14.917 1.00 0.00 C ATOM 734 C ASP A 57 0.531 -15.623 -14.756 1.00 0.00 C ATOM 735 O ASP A 57 1.311 -15.635 -13.803 1.00 0.00 O ATOM 736 CB ASP A 57 -0.114 -17.678 -16.029 1.00 0.00 C ATOM 737 CG ASP A 57 -1.269 -18.538 -16.505 1.00 0.00 C ATOM 738 OD1 ASP A 57 -2.253 -17.973 -17.027 1.00 0.00 O ATOM 739 OD2 ASP A 57 -1.189 -19.775 -16.355 1.00 0.00 O ATOM 0 H ASP A 57 -1.908 -15.711 -16.136 1.00 0.00 H new ATOM 0 HA ASP A 57 -0.603 -17.259 -13.978 1.00 0.00 H new ATOM 0 HB2 ASP A 57 0.284 -17.111 -16.871 1.00 0.00 H new ATOM 0 HB3 ASP A 57 0.689 -18.321 -15.669 1.00 0.00 H new ATOM 744 N LYS A 58 0.552 -14.682 -15.694 1.00 0.00 N ATOM 745 CA LYS A 58 1.512 -13.585 -15.658 1.00 0.00 C ATOM 746 C LYS A 58 1.089 -12.526 -14.645 1.00 0.00 C ATOM 747 O LYS A 58 0.511 -11.502 -15.010 1.00 0.00 O ATOM 748 CB LYS A 58 1.649 -12.954 -17.045 1.00 0.00 C ATOM 749 CG LYS A 58 2.981 -12.257 -17.267 1.00 0.00 C ATOM 750 CD LYS A 58 3.319 -12.158 -18.745 1.00 0.00 C ATOM 751 CE LYS A 58 4.730 -11.634 -18.960 1.00 0.00 C ATOM 752 NZ LYS A 58 5.734 -12.734 -18.975 1.00 0.00 N ATOM 0 H LYS A 58 -0.086 -14.657 -16.490 1.00 0.00 H new ATOM 0 HA LYS A 58 2.477 -13.989 -15.353 1.00 0.00 H new ATOM 0 HB2 LYS A 58 1.523 -13.729 -17.801 1.00 0.00 H new ATOM 0 HB3 LYS A 58 0.843 -12.234 -17.189 1.00 0.00 H new ATOM 0 HG2 LYS A 58 2.947 -11.258 -16.833 1.00 0.00 H new ATOM 0 HG3 LYS A 58 3.769 -12.803 -16.748 1.00 0.00 H new ATOM 0 HD2 LYS A 58 3.220 -13.140 -19.209 1.00 0.00 H new ATOM 0 HD3 LYS A 58 2.606 -11.498 -19.239 1.00 0.00 H new ATOM 0 HE2 LYS A 58 4.775 -11.088 -19.903 1.00 0.00 H new ATOM 0 HE3 LYS A 58 4.979 -10.926 -18.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 6.683 -12.336 -19.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 5.709 -13.239 -18.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 5.512 -13.396 -19.745 1.00 0.00 H new ATOM 766 N GLU A 59 1.382 -12.778 -13.373 1.00 0.00 N ATOM 767 CA GLU A 59 1.032 -11.845 -12.309 1.00 0.00 C ATOM 768 C GLU A 59 2.131 -10.803 -12.116 1.00 0.00 C ATOM 769 O GLU A 59 3.310 -11.084 -12.329 1.00 0.00 O ATOM 770 CB GLU A 59 0.791 -12.597 -10.999 1.00 0.00 C ATOM 771 CG GLU A 59 -0.527 -13.352 -10.964 1.00 0.00 C ATOM 772 CD GLU A 59 -0.543 -14.450 -9.918 1.00 0.00 C ATOM 773 OE1 GLU A 59 0.280 -15.383 -10.023 1.00 0.00 O ATOM 774 OE2 GLU A 59 -1.380 -14.375 -8.994 1.00 0.00 O ATOM 0 H GLU A 59 1.861 -13.620 -13.055 1.00 0.00 H new ATOM 0 HA GLU A 59 0.115 -11.332 -12.598 1.00 0.00 H new ATOM 0 HB2 GLU A 59 1.608 -13.301 -10.838 1.00 0.00 H new ATOM 0 HB3 GLU A 59 0.815 -11.887 -10.172 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -1.337 -12.651 -10.762 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -0.718 -13.787 -11.945 1.00 0.00 H new ATOM 781 N ARG A 60 1.734 -9.601 -11.711 1.00 0.00 N ATOM 782 CA ARG A 60 2.684 -8.517 -11.491 1.00 0.00 C ATOM 783 C ARG A 60 3.235 -8.558 -10.069 1.00 0.00 C ATOM 784 O ARG A 60 2.499 -8.809 -9.113 1.00 0.00 O ATOM 785 CB ARG A 60 2.017 -7.166 -11.752 1.00 0.00 C ATOM 786 CG ARG A 60 2.977 -6.099 -12.251 1.00 0.00 C ATOM 787 CD ARG A 60 2.238 -4.962 -12.939 1.00 0.00 C ATOM 788 NE ARG A 60 2.006 -5.237 -14.354 1.00 0.00 N ATOM 789 CZ ARG A 60 1.056 -4.647 -15.071 1.00 0.00 C ATOM 790 NH1 ARG A 60 0.254 -3.753 -14.509 1.00 0.00 N ATOM 791 NH2 ARG A 60 0.906 -4.951 -16.354 1.00 0.00 N ATOM 0 H ARG A 60 0.761 -9.353 -11.529 1.00 0.00 H new ATOM 0 HA ARG A 60 3.513 -8.646 -12.187 1.00 0.00 H new ATOM 0 HB2 ARG A 60 1.222 -7.299 -12.485 1.00 0.00 H new ATOM 0 HB3 ARG A 60 1.547 -6.818 -10.832 1.00 0.00 H new ATOM 0 HG2 ARG A 60 3.553 -5.706 -11.413 1.00 0.00 H new ATOM 0 HG3 ARG A 60 3.689 -6.545 -12.946 1.00 0.00 H new ATOM 0 HD2 ARG A 60 1.283 -4.796 -12.441 1.00 0.00 H new ATOM 0 HD3 ARG A 60 2.814 -4.042 -12.838 1.00 0.00 H new ATOM 0 HE ARG A 60 2.606 -5.919 -14.817 1.00 0.00 H new ATOM 0 HH11 ARG A 60 0.365 -3.516 -13.523 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -0.474 -3.302 -15.063 1.00 0.00 H new ATOM 0 HH21 ARG A 60 1.520 -5.638 -16.790 1.00 0.00 H new ATOM 0 HH22 ARG A 60 0.176 -4.497 -16.904 1.00 0.00 H new ATOM 805 N HIS A 61 4.534 -8.312 -9.936 1.00 0.00 N ATOM 806 CA HIS A 61 5.185 -8.320 -8.630 1.00 0.00 C ATOM 807 C HIS A 61 5.246 -6.913 -8.045 1.00 0.00 C ATOM 808 O HIS A 61 5.784 -5.995 -8.663 1.00 0.00 O ATOM 809 CB HIS A 61 6.595 -8.900 -8.743 1.00 0.00 C ATOM 810 CG HIS A 61 7.030 -9.659 -7.528 1.00 0.00 C ATOM 811 ND1 HIS A 61 8.089 -9.269 -6.736 1.00 0.00 N ATOM 812 CD2 HIS A 61 6.541 -10.791 -6.969 1.00 0.00 C ATOM 813 CE1 HIS A 61 8.234 -10.129 -5.743 1.00 0.00 C ATOM 814 NE2 HIS A 61 7.306 -11.062 -5.861 1.00 0.00 N ATOM 0 H HIS A 61 5.157 -8.105 -10.716 1.00 0.00 H new ATOM 0 HA HIS A 61 4.595 -8.947 -7.961 1.00 0.00 H new ATOM 0 HB2 HIS A 61 6.639 -9.561 -9.609 1.00 0.00 H new ATOM 0 HB3 HIS A 61 7.299 -8.088 -8.926 1.00 0.00 H new ATOM 0 HD2 HIS A 61 5.705 -11.373 -7.328 1.00 0.00 H new ATOM 0 HE1 HIS A 61 8.984 -10.078 -4.967 1.00 0.00 H new ATOM 0 HE2 HIS A 61 7.178 -11.855 -5.232 1.00 0.00 H new ATOM 823 N GLY A 62 4.690 -6.751 -6.848 1.00 0.00 N ATOM 824 CA GLY A 62 4.692 -5.452 -6.199 1.00 0.00 C ATOM 825 C GLY A 62 5.141 -5.527 -4.753 1.00 0.00 C ATOM 826 O GLY A 62 5.213 -6.610 -4.173 1.00 0.00 O ATOM 0 H GLY A 62 4.239 -7.495 -6.316 1.00 0.00 H new ATOM 0 HA2 GLY A 62 5.350 -4.777 -6.746 1.00 0.00 H new ATOM 0 HA3 GLY A 62 3.690 -5.026 -6.243 1.00 0.00 H new ATOM 830 N VAL A 63 5.448 -4.372 -4.170 1.00 0.00 N ATOM 831 CA VAL A 63 5.894 -4.311 -2.784 1.00 0.00 C ATOM 832 C VAL A 63 5.285 -3.113 -2.063 1.00 0.00 C ATOM 833 O VAL A 63 5.376 -1.980 -2.534 1.00 0.00 O ATOM 834 CB VAL A 63 7.429 -4.225 -2.691 1.00 0.00 C ATOM 835 CG1 VAL A 63 7.855 -3.720 -1.321 1.00 0.00 C ATOM 836 CG2 VAL A 63 8.057 -5.579 -2.989 1.00 0.00 C ATOM 0 H VAL A 63 5.396 -3.466 -4.637 1.00 0.00 H new ATOM 0 HA VAL A 63 5.559 -5.230 -2.303 1.00 0.00 H new ATOM 0 HB VAL A 63 7.781 -3.514 -3.438 1.00 0.00 H new ATOM 0 HG11 VAL A 63 8.943 -3.666 -1.275 1.00 0.00 H new ATOM 0 HG12 VAL A 63 7.435 -2.728 -1.152 1.00 0.00 H new ATOM 0 HG13 VAL A 63 7.493 -4.403 -0.553 1.00 0.00 H new ATOM 0 HG21 VAL A 63 9.142 -5.500 -2.919 1.00 0.00 H new ATOM 0 HG22 VAL A 63 7.699 -6.313 -2.267 1.00 0.00 H new ATOM 0 HG23 VAL A 63 7.780 -5.895 -3.995 1.00 0.00 H new ATOM 846 N ALA A 64 4.665 -3.373 -0.917 1.00 0.00 N ATOM 847 CA ALA A 64 4.042 -2.316 -0.129 1.00 0.00 C ATOM 848 C ALA A 64 5.090 -1.359 0.430 1.00 0.00 C ATOM 849 O ALA A 64 5.979 -1.765 1.178 1.00 0.00 O ATOM 850 CB ALA A 64 3.217 -2.916 1.000 1.00 0.00 C ATOM 0 H ALA A 64 4.581 -4.306 -0.513 1.00 0.00 H new ATOM 0 HA ALA A 64 3.382 -1.748 -0.785 1.00 0.00 H new ATOM 0 HB1 ALA A 64 2.758 -2.116 1.580 1.00 0.00 H new ATOM 0 HB2 ALA A 64 2.438 -3.554 0.582 1.00 0.00 H new ATOM 0 HB3 ALA A 64 3.863 -3.509 1.648 1.00 0.00 H new ATOM 856 N ILE A 65 4.978 -0.087 0.062 1.00 0.00 N ATOM 857 CA ILE A 65 5.916 0.927 0.527 1.00 0.00 C ATOM 858 C ILE A 65 5.357 1.683 1.728 1.00 0.00 C ATOM 859 O ILE A 65 6.105 2.118 2.604 1.00 0.00 O ATOM 860 CB ILE A 65 6.254 1.935 -0.588 1.00 0.00 C ATOM 861 CG1 ILE A 65 4.972 2.540 -1.164 1.00 0.00 C ATOM 862 CG2 ILE A 65 7.068 1.262 -1.682 1.00 0.00 C ATOM 863 CD1 ILE A 65 5.222 3.590 -2.223 1.00 0.00 C ATOM 0 H ILE A 65 4.247 0.266 -0.556 1.00 0.00 H new ATOM 0 HA ILE A 65 6.826 0.404 0.821 1.00 0.00 H new ATOM 0 HB ILE A 65 6.853 2.740 -0.161 1.00 0.00 H new ATOM 0 HG12 ILE A 65 4.364 1.743 -1.591 1.00 0.00 H new ATOM 0 HG13 ILE A 65 4.393 2.983 -0.354 1.00 0.00 H new ATOM 0 HG21 ILE A 65 7.299 1.987 -2.462 1.00 0.00 H new ATOM 0 HG22 ILE A 65 7.996 0.876 -1.260 1.00 0.00 H new ATOM 0 HG23 ILE A 65 6.494 0.440 -2.109 1.00 0.00 H new ATOM 0 HD11 ILE A 65 4.269 3.975 -2.586 1.00 0.00 H new ATOM 0 HD12 ILE A 65 5.804 4.407 -1.796 1.00 0.00 H new ATOM 0 HD13 ILE A 65 5.774 3.147 -3.052 1.00 0.00 H new ATOM 875 N TYR A 66 4.038 1.834 1.763 1.00 0.00 N ATOM 876 CA TYR A 66 3.378 2.538 2.856 1.00 0.00 C ATOM 877 C TYR A 66 2.490 1.590 3.657 1.00 0.00 C ATOM 878 O TYR A 66 1.807 0.737 3.093 1.00 0.00 O ATOM 879 CB TYR A 66 2.544 3.699 2.314 1.00 0.00 C ATOM 880 CG TYR A 66 3.349 4.705 1.522 1.00 0.00 C ATOM 881 CD1 TYR A 66 4.471 5.314 2.072 1.00 0.00 C ATOM 882 CD2 TYR A 66 2.989 5.045 0.224 1.00 0.00 C ATOM 883 CE1 TYR A 66 5.209 6.234 1.352 1.00 0.00 C ATOM 884 CE2 TYR A 66 3.722 5.963 -0.503 1.00 0.00 C ATOM 885 CZ TYR A 66 4.830 6.555 0.065 1.00 0.00 C ATOM 886 OH TYR A 66 5.564 7.470 -0.655 1.00 0.00 O ATOM 0 H TYR A 66 3.405 1.478 1.047 1.00 0.00 H new ATOM 0 HA TYR A 66 4.149 2.932 3.518 1.00 0.00 H new ATOM 0 HB2 TYR A 66 1.751 3.301 1.681 1.00 0.00 H new ATOM 0 HB3 TYR A 66 2.061 4.208 3.148 1.00 0.00 H new ATOM 0 HD1 TYR A 66 4.771 5.064 3.079 1.00 0.00 H new ATOM 0 HD2 TYR A 66 2.121 4.584 -0.224 1.00 0.00 H new ATOM 0 HE1 TYR A 66 6.078 6.699 1.794 1.00 0.00 H new ATOM 0 HE2 TYR A 66 3.429 6.216 -1.511 1.00 0.00 H new ATOM 0 HH TYR A 66 5.165 7.583 -1.543 1.00 0.00 H new ATOM 896 N ASN A 67 2.506 1.748 4.977 1.00 0.00 N ATOM 897 CA ASN A 67 1.703 0.907 5.857 1.00 0.00 C ATOM 898 C ASN A 67 0.216 1.204 5.685 1.00 0.00 C ATOM 899 O ASN A 67 -0.265 2.266 6.078 1.00 0.00 O ATOM 900 CB ASN A 67 2.112 1.122 7.315 1.00 0.00 C ATOM 901 CG ASN A 67 2.266 2.590 7.662 1.00 0.00 C ATOM 902 OD1 ASN A 67 3.429 2.954 8.192 1.00 0.00 O flip ATOM 903 ND2 ASN A 67 1.352 3.388 7.455 1.00 0.00 N flip ATOM 0 H ASN A 67 3.066 2.450 5.460 1.00 0.00 H new ATOM 0 HA ASN A 67 1.881 -0.134 5.586 1.00 0.00 H new ATOM 0 HB2 ASN A 67 1.364 0.673 7.969 1.00 0.00 H new ATOM 0 HB3 ASN A 67 3.053 0.606 7.505 1.00 0.00 H new ATOM 0 HD21 ASN A 67 0.475 3.064 7.046 1.00 0.00 H new ATOM 0 HD22 ASN A 67 1.471 4.373 7.692 1.00 0.00 H new ATOM 910 N PHE A 68 -0.506 0.257 5.095 1.00 0.00 N ATOM 911 CA PHE A 68 -1.938 0.416 4.870 1.00 0.00 C ATOM 912 C PHE A 68 -2.741 -0.285 5.961 1.00 0.00 C ATOM 913 O PHE A 68 -2.316 -1.307 6.499 1.00 0.00 O ATOM 914 CB PHE A 68 -2.326 -0.140 3.498 1.00 0.00 C ATOM 915 CG PHE A 68 -3.800 -0.070 3.218 1.00 0.00 C ATOM 916 CD1 PHE A 68 -4.645 -1.090 3.624 1.00 0.00 C ATOM 917 CD2 PHE A 68 -4.340 1.016 2.548 1.00 0.00 C ATOM 918 CE1 PHE A 68 -6.002 -1.029 3.367 1.00 0.00 C ATOM 919 CE2 PHE A 68 -5.696 1.083 2.290 1.00 0.00 C ATOM 920 CZ PHE A 68 -6.528 0.059 2.699 1.00 0.00 C ATOM 0 H PHE A 68 -0.123 -0.629 4.764 1.00 0.00 H new ATOM 0 HA PHE A 68 -2.169 1.481 4.901 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -1.791 0.413 2.726 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -2.000 -1.178 3.430 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -4.239 -1.943 4.147 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -3.694 1.819 2.224 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -6.650 -1.831 3.688 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -6.105 1.936 1.769 1.00 0.00 H new ATOM 0 HZ PHE A 68 -7.588 0.109 2.497 1.00 0.00 H new ATOM 930 N GLN A 69 -3.904 0.272 6.283 1.00 0.00 N ATOM 931 CA GLN A 69 -4.767 -0.299 7.311 1.00 0.00 C ATOM 932 C GLN A 69 -6.224 -0.295 6.863 1.00 0.00 C ATOM 933 O GLN A 69 -6.760 0.740 6.470 1.00 0.00 O ATOM 934 CB GLN A 69 -4.620 0.479 8.619 1.00 0.00 C ATOM 935 CG GLN A 69 -4.865 -0.365 9.860 1.00 0.00 C ATOM 936 CD GLN A 69 -4.803 0.446 11.139 1.00 0.00 C ATOM 937 OE1 GLN A 69 -3.875 0.301 11.935 1.00 0.00 O ATOM 938 NE2 GLN A 69 -5.793 1.307 11.343 1.00 0.00 N ATOM 0 H GLN A 69 -4.271 1.118 5.847 1.00 0.00 H new ATOM 0 HA GLN A 69 -4.460 -1.332 7.475 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -3.617 0.902 8.670 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -5.319 1.316 8.615 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -5.842 -0.841 9.783 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -4.124 -1.163 9.904 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -6.542 1.395 10.656 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -5.804 1.881 12.186 1.00 0.00 H new ATOM 947 N GLY A 70 -6.861 -1.461 6.923 1.00 0.00 N ATOM 948 CA GLY A 70 -8.251 -1.569 6.520 1.00 0.00 C ATOM 949 C GLY A 70 -9.122 -2.180 7.600 1.00 0.00 C ATOM 950 O GLY A 70 -8.643 -2.493 8.690 1.00 0.00 O ATOM 0 H GLY A 70 -6.439 -2.333 7.244 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -8.631 -0.579 6.268 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -8.318 -2.176 5.617 1.00 0.00 H new ATOM 954 N SER A 71 -10.405 -2.349 7.298 1.00 0.00 N ATOM 955 CA SER A 71 -11.346 -2.921 8.253 1.00 0.00 C ATOM 956 C SER A 71 -11.770 -4.323 7.825 1.00 0.00 C ATOM 957 O SER A 71 -11.944 -5.212 8.657 1.00 0.00 O ATOM 958 CB SER A 71 -12.577 -2.023 8.389 1.00 0.00 C ATOM 959 OG SER A 71 -13.522 -2.585 9.284 1.00 0.00 O ATOM 0 H SER A 71 -10.817 -2.098 6.399 1.00 0.00 H new ATOM 0 HA SER A 71 -10.847 -2.990 9.220 1.00 0.00 H new ATOM 0 HB2 SER A 71 -12.275 -1.038 8.745 1.00 0.00 H new ATOM 0 HB3 SER A 71 -13.037 -1.881 7.411 1.00 0.00 H new ATOM 0 HG SER A 71 -14.299 -1.992 9.355 1.00 0.00 H new ATOM 965 N GLY A 72 -11.936 -4.511 6.519 1.00 0.00 N ATOM 966 CA GLY A 72 -12.339 -5.806 6.002 1.00 0.00 C ATOM 967 C GLY A 72 -12.629 -5.771 4.515 1.00 0.00 C ATOM 968 O GLY A 72 -12.866 -4.705 3.947 1.00 0.00 O ATOM 0 H GLY A 72 -11.799 -3.790 5.810 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -11.551 -6.533 6.199 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -13.227 -6.146 6.534 1.00 0.00 H new ATOM 972 N ALA A 73 -12.610 -6.939 3.882 1.00 0.00 N ATOM 973 CA ALA A 73 -12.874 -7.038 2.452 1.00 0.00 C ATOM 974 C ALA A 73 -14.007 -6.106 2.037 1.00 0.00 C ATOM 975 O ALA A 73 -14.898 -5.785 2.823 1.00 0.00 O ATOM 976 CB ALA A 73 -13.204 -8.474 2.074 1.00 0.00 C ATOM 0 H ALA A 73 -12.414 -7.831 4.337 1.00 0.00 H new ATOM 0 HA ALA A 73 -11.973 -6.732 1.920 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -13.399 -8.533 1.003 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -12.362 -9.119 2.326 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -14.088 -8.801 2.622 1.00 0.00 H new ATOM 982 N PRO A 74 -13.975 -5.660 0.772 1.00 0.00 N ATOM 983 CA PRO A 74 -12.919 -6.035 -0.173 1.00 0.00 C ATOM 984 C PRO A 74 -11.573 -5.414 0.185 1.00 0.00 C ATOM 985 O PRO A 74 -10.564 -5.681 -0.467 1.00 0.00 O ATOM 986 CB PRO A 74 -13.425 -5.484 -1.508 1.00 0.00 C ATOM 987 CG PRO A 74 -14.328 -4.359 -1.135 1.00 0.00 C ATOM 988 CD PRO A 74 -14.966 -4.754 0.168 1.00 0.00 C ATOM 0 HA PRO A 74 -12.742 -7.111 -0.180 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -12.601 -5.140 -2.132 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -13.957 -6.248 -2.075 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -13.770 -3.429 -1.030 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -15.082 -4.193 -1.904 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -15.157 -3.887 0.801 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -15.923 -5.252 0.012 1.00 0.00 H new ATOM 996 N GLN A 75 -11.567 -4.584 1.223 1.00 0.00 N ATOM 997 CA GLN A 75 -10.344 -3.925 1.666 1.00 0.00 C ATOM 998 C GLN A 75 -9.399 -4.920 2.331 1.00 0.00 C ATOM 999 O GLN A 75 -9.814 -5.722 3.168 1.00 0.00 O ATOM 1000 CB GLN A 75 -10.675 -2.790 2.637 1.00 0.00 C ATOM 1001 CG GLN A 75 -11.341 -1.596 1.974 1.00 0.00 C ATOM 1002 CD GLN A 75 -11.903 -0.609 2.978 1.00 0.00 C ATOM 1003 OE1 GLN A 75 -13.080 -0.069 2.682 1.00 0.00 O flip ATOM 1004 NE2 GLN A 75 -11.287 -0.334 4.008 1.00 0.00 N flip ATOM 0 H GLN A 75 -12.394 -4.352 1.772 1.00 0.00 H new ATOM 0 HA GLN A 75 -9.846 -3.511 0.789 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -11.330 -3.172 3.420 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -9.757 -2.460 3.123 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -10.617 -1.088 1.337 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -12.144 -1.946 1.326 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -10.385 -0.773 4.196 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -11.678 0.332 4.674 1.00 0.00 H new ATOM 1013 N LEU A 76 -8.127 -4.863 1.952 1.00 0.00 N ATOM 1014 CA LEU A 76 -7.121 -5.760 2.511 1.00 0.00 C ATOM 1015 C LEU A 76 -5.989 -4.972 3.160 1.00 0.00 C ATOM 1016 O LEU A 76 -5.535 -3.962 2.623 1.00 0.00 O ATOM 1017 CB LEU A 76 -6.561 -6.674 1.420 1.00 0.00 C ATOM 1018 CG LEU A 76 -5.313 -7.476 1.791 1.00 0.00 C ATOM 1019 CD1 LEU A 76 -5.692 -8.718 2.581 1.00 0.00 C ATOM 1020 CD2 LEU A 76 -4.531 -7.854 0.541 1.00 0.00 C ATOM 0 H LEU A 76 -7.768 -4.205 1.260 1.00 0.00 H new ATOM 0 HA LEU A 76 -7.600 -6.370 3.277 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -7.343 -7.373 1.123 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -6.330 -6.064 0.546 1.00 0.00 H new ATOM 0 HG LEU A 76 -4.677 -6.852 2.419 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -4.791 -9.276 2.836 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -6.208 -8.424 3.495 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -6.349 -9.346 1.979 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -3.646 -8.424 0.824 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -5.159 -8.459 -0.112 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -4.227 -6.949 0.015 1.00 0.00 H new ATOM 1032 N SER A 77 -5.536 -5.441 4.319 1.00 0.00 N ATOM 1033 CA SER A 77 -4.457 -4.779 5.042 1.00 0.00 C ATOM 1034 C SER A 77 -3.104 -5.101 4.414 1.00 0.00 C ATOM 1035 O SER A 77 -2.937 -6.135 3.767 1.00 0.00 O ATOM 1036 CB SER A 77 -4.464 -5.204 6.512 1.00 0.00 C ATOM 1037 OG SER A 77 -5.277 -4.342 7.288 1.00 0.00 O ATOM 0 H SER A 77 -5.900 -6.277 4.777 1.00 0.00 H new ATOM 0 HA SER A 77 -4.619 -3.703 4.981 1.00 0.00 H new ATOM 0 HB2 SER A 77 -4.830 -6.227 6.596 1.00 0.00 H new ATOM 0 HB3 SER A 77 -3.446 -5.196 6.901 1.00 0.00 H new ATOM 0 HG SER A 77 -5.266 -4.636 8.223 1.00 0.00 H new ATOM 1043 N LEU A 78 -2.141 -4.208 4.611 1.00 0.00 N ATOM 1044 CA LEU A 78 -0.801 -4.395 4.065 1.00 0.00 C ATOM 1045 C LEU A 78 0.249 -3.751 4.965 1.00 0.00 C ATOM 1046 O LEU A 78 -0.040 -2.797 5.687 1.00 0.00 O ATOM 1047 CB LEU A 78 -0.715 -3.802 2.657 1.00 0.00 C ATOM 1048 CG LEU A 78 -1.252 -4.679 1.526 1.00 0.00 C ATOM 1049 CD1 LEU A 78 -1.270 -3.907 0.215 1.00 0.00 C ATOM 1050 CD2 LEU A 78 -0.418 -5.944 1.390 1.00 0.00 C ATOM 0 H LEU A 78 -2.263 -3.347 5.145 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.602 -5.466 4.015 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -1.260 -2.858 2.648 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.329 -3.570 2.445 1.00 0.00 H new ATOM 0 HG LEU A 78 -2.275 -4.967 1.769 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -1.655 -4.547 -0.579 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.910 -3.031 0.317 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -0.258 -3.589 -0.034 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.815 -6.556 0.580 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.615 -5.677 1.170 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.456 -6.507 2.323 1.00 0.00 H new ATOM 1062 N GLN A 79 1.468 -4.279 4.915 1.00 0.00 N ATOM 1063 CA GLN A 79 2.561 -3.755 5.725 1.00 0.00 C ATOM 1064 C GLN A 79 3.797 -3.497 4.870 1.00 0.00 C ATOM 1065 O GLN A 79 4.153 -4.309 4.015 1.00 0.00 O ATOM 1066 CB GLN A 79 2.901 -4.730 6.853 1.00 0.00 C ATOM 1067 CG GLN A 79 2.066 -4.524 8.107 1.00 0.00 C ATOM 1068 CD GLN A 79 2.449 -5.473 9.226 1.00 0.00 C ATOM 1069 OE1 GLN A 79 3.438 -6.200 9.127 1.00 0.00 O ATOM 1070 NE2 GLN A 79 1.667 -5.470 10.299 1.00 0.00 N ATOM 0 H GLN A 79 1.723 -5.069 4.322 1.00 0.00 H new ATOM 0 HA GLN A 79 2.237 -2.809 6.158 1.00 0.00 H new ATOM 0 HB2 GLN A 79 2.759 -5.750 6.496 1.00 0.00 H new ATOM 0 HB3 GLN A 79 3.956 -4.625 7.107 1.00 0.00 H new ATOM 0 HG2 GLN A 79 2.182 -3.496 8.452 1.00 0.00 H new ATOM 0 HG3 GLN A 79 1.012 -4.661 7.864 1.00 0.00 H new ATOM 0 HE21 GLN A 79 0.857 -4.851 10.338 1.00 0.00 H new ATOM 0 HE22 GLN A 79 1.876 -6.087 11.084 1.00 0.00 H new ATOM 1079 N ILE A 80 4.448 -2.363 5.106 1.00 0.00 N ATOM 1080 CA ILE A 80 5.645 -1.999 4.357 1.00 0.00 C ATOM 1081 C ILE A 80 6.632 -3.160 4.301 1.00 0.00 C ATOM 1082 O ILE A 80 6.890 -3.818 5.308 1.00 0.00 O ATOM 1083 CB ILE A 80 6.345 -0.774 4.975 1.00 0.00 C ATOM 1084 CG1 ILE A 80 5.379 0.411 5.046 1.00 0.00 C ATOM 1085 CG2 ILE A 80 7.582 -0.409 4.169 1.00 0.00 C ATOM 1086 CD1 ILE A 80 5.927 1.592 5.816 1.00 0.00 C ATOM 0 H ILE A 80 4.167 -1.680 5.810 1.00 0.00 H new ATOM 0 HA ILE A 80 5.322 -1.751 3.346 1.00 0.00 H new ATOM 0 HB ILE A 80 6.657 -1.025 5.989 1.00 0.00 H new ATOM 0 HG12 ILE A 80 5.133 0.730 4.033 1.00 0.00 H new ATOM 0 HG13 ILE A 80 4.449 0.084 5.511 1.00 0.00 H new ATOM 0 HG21 ILE A 80 8.066 0.458 4.618 1.00 0.00 H new ATOM 0 HG22 ILE A 80 8.275 -1.250 4.166 1.00 0.00 H new ATOM 0 HG23 ILE A 80 7.293 -0.173 3.145 1.00 0.00 H new ATOM 0 HD11 ILE A 80 5.189 2.394 5.825 1.00 0.00 H new ATOM 0 HD12 ILE A 80 6.146 1.289 6.840 1.00 0.00 H new ATOM 0 HD13 ILE A 80 6.841 1.945 5.339 1.00 0.00 H new ATOM 1098 N GLY A 81 7.182 -3.405 3.116 1.00 0.00 N ATOM 1099 CA GLY A 81 8.136 -4.486 2.951 1.00 0.00 C ATOM 1100 C GLY A 81 7.465 -5.811 2.650 1.00 0.00 C ATOM 1101 O GLY A 81 8.084 -6.869 2.764 1.00 0.00 O ATOM 0 H GLY A 81 6.984 -2.875 2.268 1.00 0.00 H new ATOM 0 HA2 GLY A 81 8.824 -4.239 2.143 1.00 0.00 H new ATOM 0 HA3 GLY A 81 8.732 -4.582 3.859 1.00 0.00 H new ATOM 1105 N ASP A 82 6.194 -5.755 2.266 1.00 0.00 N ATOM 1106 CA ASP A 82 5.438 -6.961 1.949 1.00 0.00 C ATOM 1107 C ASP A 82 5.147 -7.043 0.454 1.00 0.00 C ATOM 1108 O ASP A 82 4.935 -6.024 -0.205 1.00 0.00 O ATOM 1109 CB ASP A 82 4.127 -6.989 2.738 1.00 0.00 C ATOM 1110 CG ASP A 82 4.346 -7.256 4.214 1.00 0.00 C ATOM 1111 OD1 ASP A 82 5.502 -7.520 4.604 1.00 0.00 O ATOM 1112 OD2 ASP A 82 3.360 -7.203 4.979 1.00 0.00 O ATOM 0 H ASP A 82 5.666 -4.888 2.167 1.00 0.00 H new ATOM 0 HA ASP A 82 6.042 -7.823 2.231 1.00 0.00 H new ATOM 0 HB2 ASP A 82 3.613 -6.036 2.616 1.00 0.00 H new ATOM 0 HB3 ASP A 82 3.474 -7.758 2.325 1.00 0.00 H new ATOM 1117 N VAL A 83 5.141 -8.261 -0.077 1.00 0.00 N ATOM 1118 CA VAL A 83 4.877 -8.476 -1.495 1.00 0.00 C ATOM 1119 C VAL A 83 3.524 -9.146 -1.707 1.00 0.00 C ATOM 1120 O VAL A 83 3.106 -9.990 -0.914 1.00 0.00 O ATOM 1121 CB VAL A 83 5.973 -9.342 -2.145 1.00 0.00 C ATOM 1122 CG1 VAL A 83 5.622 -9.650 -3.592 1.00 0.00 C ATOM 1123 CG2 VAL A 83 7.324 -8.649 -2.051 1.00 0.00 C ATOM 0 H VAL A 83 5.316 -9.115 0.453 1.00 0.00 H new ATOM 0 HA VAL A 83 4.871 -7.494 -1.968 1.00 0.00 H new ATOM 0 HB VAL A 83 6.036 -10.286 -1.603 1.00 0.00 H new ATOM 0 HG11 VAL A 83 6.408 -10.262 -4.035 1.00 0.00 H new ATOM 0 HG12 VAL A 83 4.676 -10.190 -3.630 1.00 0.00 H new ATOM 0 HG13 VAL A 83 5.530 -8.718 -4.150 1.00 0.00 H new ATOM 0 HG21 VAL A 83 8.087 -9.274 -2.515 1.00 0.00 H new ATOM 0 HG22 VAL A 83 7.278 -7.690 -2.567 1.00 0.00 H new ATOM 0 HG23 VAL A 83 7.577 -8.485 -1.003 1.00 0.00 H new ATOM 1133 N VAL A 84 2.842 -8.763 -2.782 1.00 0.00 N ATOM 1134 CA VAL A 84 1.536 -9.327 -3.100 1.00 0.00 C ATOM 1135 C VAL A 84 1.457 -9.740 -4.565 1.00 0.00 C ATOM 1136 O VAL A 84 2.031 -9.086 -5.436 1.00 0.00 O ATOM 1137 CB VAL A 84 0.404 -8.327 -2.798 1.00 0.00 C ATOM 1138 CG1 VAL A 84 0.359 -8.003 -1.312 1.00 0.00 C ATOM 1139 CG2 VAL A 84 0.578 -7.061 -3.623 1.00 0.00 C ATOM 0 H VAL A 84 3.173 -8.064 -3.447 1.00 0.00 H new ATOM 0 HA VAL A 84 1.410 -10.208 -2.470 1.00 0.00 H new ATOM 0 HB VAL A 84 -0.546 -8.786 -3.074 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.447 -7.295 -1.118 1.00 0.00 H new ATOM 0 HG12 VAL A 84 0.183 -8.917 -0.745 1.00 0.00 H new ATOM 0 HG13 VAL A 84 1.309 -7.564 -1.006 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -0.230 -6.366 -3.397 1.00 0.00 H new ATOM 0 HG22 VAL A 84 1.534 -6.597 -3.380 1.00 0.00 H new ATOM 0 HG23 VAL A 84 0.555 -7.312 -4.684 1.00 0.00 H new ATOM 1149 N ARG A 85 0.742 -10.828 -4.830 1.00 0.00 N ATOM 1150 CA ARG A 85 0.588 -11.328 -6.191 1.00 0.00 C ATOM 1151 C ARG A 85 -0.541 -10.600 -6.914 1.00 0.00 C ATOM 1152 O ARG A 85 -1.715 -10.930 -6.742 1.00 0.00 O ATOM 1153 CB ARG A 85 0.312 -12.833 -6.176 1.00 0.00 C ATOM 1154 CG ARG A 85 0.813 -13.557 -7.415 1.00 0.00 C ATOM 1155 CD ARG A 85 2.322 -13.738 -7.382 1.00 0.00 C ATOM 1156 NE ARG A 85 2.710 -14.990 -6.738 1.00 0.00 N ATOM 1157 CZ ARG A 85 3.937 -15.240 -6.294 1.00 0.00 C ATOM 1158 NH1 ARG A 85 4.890 -14.328 -6.424 1.00 0.00 N ATOM 1159 NH2 ARG A 85 4.212 -16.403 -5.719 1.00 0.00 N ATOM 0 H ARG A 85 0.260 -11.380 -4.121 1.00 0.00 H new ATOM 0 HA ARG A 85 1.519 -11.141 -6.727 1.00 0.00 H new ATOM 0 HB2 ARG A 85 0.781 -13.271 -5.295 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -0.761 -12.996 -6.080 1.00 0.00 H new ATOM 0 HG2 ARG A 85 0.330 -14.531 -7.489 1.00 0.00 H new ATOM 0 HG3 ARG A 85 0.532 -12.994 -8.305 1.00 0.00 H new ATOM 0 HD2 ARG A 85 2.712 -13.718 -8.400 1.00 0.00 H new ATOM 0 HD3 ARG A 85 2.776 -12.901 -6.851 1.00 0.00 H new ATOM 0 HE ARG A 85 1.999 -15.713 -6.623 1.00 0.00 H new ATOM 0 HH11 ARG A 85 4.682 -13.432 -6.866 1.00 0.00 H new ATOM 0 HH12 ARG A 85 5.831 -14.522 -6.082 1.00 0.00 H new ATOM 0 HH21 ARG A 85 3.481 -17.107 -5.617 1.00 0.00 H new ATOM 0 HH22 ARG A 85 5.154 -16.593 -5.379 1.00 0.00 H new ATOM 1173 N ILE A 86 -0.178 -9.609 -7.721 1.00 0.00 N ATOM 1174 CA ILE A 86 -1.161 -8.836 -8.470 1.00 0.00 C ATOM 1175 C ILE A 86 -1.776 -9.666 -9.591 1.00 0.00 C ATOM 1176 O ILE A 86 -1.080 -10.096 -10.511 1.00 0.00 O ATOM 1177 CB ILE A 86 -0.535 -7.563 -9.072 1.00 0.00 C ATOM 1178 CG1 ILE A 86 0.054 -6.686 -7.966 1.00 0.00 C ATOM 1179 CG2 ILE A 86 -1.573 -6.791 -9.872 1.00 0.00 C ATOM 1180 CD1 ILE A 86 0.942 -5.576 -8.484 1.00 0.00 C ATOM 0 H ILE A 86 0.789 -9.322 -7.873 1.00 0.00 H new ATOM 0 HA ILE A 86 -1.941 -8.549 -7.765 1.00 0.00 H new ATOM 0 HB ILE A 86 0.271 -7.855 -9.745 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -0.760 -6.249 -7.387 1.00 0.00 H new ATOM 0 HG13 ILE A 86 0.629 -7.312 -7.284 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -1.116 -5.894 -10.291 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -1.950 -7.418 -10.680 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -2.398 -6.507 -9.219 1.00 0.00 H new ATOM 0 HD11 ILE A 86 1.325 -4.995 -7.645 1.00 0.00 H new ATOM 0 HD12 ILE A 86 1.776 -6.006 -9.038 1.00 0.00 H new ATOM 0 HD13 ILE A 86 0.366 -4.926 -9.143 1.00 0.00 H new ATOM 1192 N GLN A 87 -3.084 -9.886 -9.508 1.00 0.00 N ATOM 1193 CA GLN A 87 -3.793 -10.664 -10.517 1.00 0.00 C ATOM 1194 C GLN A 87 -4.580 -9.753 -11.454 1.00 0.00 C ATOM 1195 O GLN A 87 -4.590 -9.955 -12.667 1.00 0.00 O ATOM 1196 CB GLN A 87 -4.736 -11.666 -9.850 1.00 0.00 C ATOM 1197 CG GLN A 87 -4.040 -12.595 -8.868 1.00 0.00 C ATOM 1198 CD GLN A 87 -4.793 -13.894 -8.660 1.00 0.00 C ATOM 1199 OE1 GLN A 87 -6.022 -13.906 -8.576 1.00 0.00 O ATOM 1200 NE2 GLN A 87 -4.059 -14.998 -8.575 1.00 0.00 N ATOM 0 H GLN A 87 -3.674 -9.537 -8.753 1.00 0.00 H new ATOM 0 HA GLN A 87 -3.054 -11.208 -11.105 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -5.522 -11.121 -9.327 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -5.222 -12.264 -10.621 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -3.036 -12.815 -9.231 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -3.928 -12.087 -7.910 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -3.043 -14.942 -8.650 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -4.511 -15.901 -8.435 1.00 0.00 H new ATOM 1209 N GLU A 88 -5.238 -8.750 -10.881 1.00 0.00 N ATOM 1210 CA GLU A 88 -6.029 -7.809 -11.665 1.00 0.00 C ATOM 1211 C GLU A 88 -5.769 -6.374 -11.217 1.00 0.00 C ATOM 1212 O GLU A 88 -5.305 -6.133 -10.102 1.00 0.00 O ATOM 1213 CB GLU A 88 -7.519 -8.132 -11.539 1.00 0.00 C ATOM 1214 CG GLU A 88 -8.334 -7.727 -12.756 1.00 0.00 C ATOM 1215 CD GLU A 88 -8.002 -8.554 -13.983 1.00 0.00 C ATOM 1216 OE1 GLU A 88 -7.710 -9.758 -13.825 1.00 0.00 O ATOM 1217 OE2 GLU A 88 -8.033 -7.997 -15.100 1.00 0.00 O ATOM 0 H GLU A 88 -5.239 -8.568 -9.877 1.00 0.00 H new ATOM 0 HA GLU A 88 -5.731 -7.905 -12.709 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -7.637 -9.203 -11.373 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -7.919 -7.627 -10.660 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -9.395 -7.831 -12.529 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -8.156 -6.674 -12.973 1.00 0.00 H new ATOM 1224 N THR A 89 -6.071 -5.422 -12.095 1.00 0.00 N ATOM 1225 CA THR A 89 -5.868 -4.011 -11.792 1.00 0.00 C ATOM 1226 C THR A 89 -7.052 -3.173 -12.261 1.00 0.00 C ATOM 1227 O THR A 89 -7.465 -3.257 -13.418 1.00 0.00 O ATOM 1228 CB THR A 89 -4.582 -3.474 -12.447 1.00 0.00 C ATOM 1229 OG1 THR A 89 -3.460 -4.270 -12.048 1.00 0.00 O ATOM 1230 CG2 THR A 89 -4.343 -2.022 -12.061 1.00 0.00 C ATOM 0 H THR A 89 -6.457 -5.603 -13.022 1.00 0.00 H new ATOM 0 HA THR A 89 -5.775 -3.931 -10.709 1.00 0.00 H new ATOM 0 HB THR A 89 -4.701 -3.530 -13.529 1.00 0.00 H new ATOM 0 HG1 THR A 89 -2.946 -3.792 -11.364 1.00 0.00 H new ATOM 0 HG21 THR A 89 -3.429 -1.665 -12.536 1.00 0.00 H new ATOM 0 HG22 THR A 89 -5.185 -1.414 -12.392 1.00 0.00 H new ATOM 0 HG23 THR A 89 -4.243 -1.945 -10.978 1.00 0.00 H new ATOM 1238 N CYS A 90 -7.594 -2.365 -11.356 1.00 0.00 N ATOM 1239 CA CYS A 90 -8.732 -1.510 -11.678 1.00 0.00 C ATOM 1240 C CYS A 90 -8.452 -0.063 -11.288 1.00 0.00 C ATOM 1241 O CYS A 90 -7.855 0.206 -10.247 1.00 0.00 O ATOM 1242 CB CYS A 90 -9.989 -2.010 -10.965 1.00 0.00 C ATOM 1243 SG CYS A 90 -10.398 -3.736 -11.313 1.00 0.00 S ATOM 0 H CYS A 90 -7.264 -2.284 -10.394 1.00 0.00 H new ATOM 0 HA CYS A 90 -8.894 -1.551 -12.755 1.00 0.00 H new ATOM 0 HB2 CYS A 90 -9.856 -1.889 -9.890 1.00 0.00 H new ATOM 0 HB3 CYS A 90 -10.832 -1.383 -11.255 1.00 0.00 H new ATOM 0 HG CYS A 90 -11.633 -3.818 -11.710 1.00 0.00 H new ATOM 1249 N GLY A 91 -8.887 0.867 -12.133 1.00 0.00 N ATOM 1250 CA GLY A 91 -8.673 2.276 -11.860 1.00 0.00 C ATOM 1251 C GLY A 91 -7.349 2.538 -11.169 1.00 0.00 C ATOM 1252 O GLY A 91 -6.286 2.385 -11.771 1.00 0.00 O ATOM 0 H GLY A 91 -9.384 0.670 -13.002 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -8.707 2.834 -12.796 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -9.485 2.650 -11.236 1.00 0.00 H new ATOM 1256 N ASP A 92 -7.413 2.935 -9.903 1.00 0.00 N ATOM 1257 CA ASP A 92 -6.210 3.219 -9.129 1.00 0.00 C ATOM 1258 C ASP A 92 -6.107 2.290 -7.924 1.00 0.00 C ATOM 1259 O ASP A 92 -5.801 2.727 -6.815 1.00 0.00 O ATOM 1260 CB ASP A 92 -6.209 4.677 -8.665 1.00 0.00 C ATOM 1261 CG ASP A 92 -5.611 5.612 -9.697 1.00 0.00 C ATOM 1262 OD1 ASP A 92 -4.482 5.343 -10.159 1.00 0.00 O ATOM 1263 OD2 ASP A 92 -6.271 6.614 -10.044 1.00 0.00 O ATOM 0 H ASP A 92 -8.285 3.067 -9.391 1.00 0.00 H new ATOM 0 HA ASP A 92 -5.346 3.049 -9.771 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -7.231 4.987 -8.447 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -5.646 4.759 -7.735 1.00 0.00 H new ATOM 1268 N TRP A 93 -6.364 1.007 -8.150 1.00 0.00 N ATOM 1269 CA TRP A 93 -6.301 0.015 -7.083 1.00 0.00 C ATOM 1270 C TRP A 93 -5.927 -1.356 -7.635 1.00 0.00 C ATOM 1271 O TRP A 93 -6.353 -1.733 -8.727 1.00 0.00 O ATOM 1272 CB TRP A 93 -7.642 -0.064 -6.352 1.00 0.00 C ATOM 1273 CG TRP A 93 -7.950 1.158 -5.541 1.00 0.00 C ATOM 1274 CD1 TRP A 93 -8.322 2.384 -6.015 1.00 0.00 C ATOM 1275 CD2 TRP A 93 -7.909 1.273 -4.114 1.00 0.00 C ATOM 1276 NE1 TRP A 93 -8.515 3.254 -4.968 1.00 0.00 N ATOM 1277 CE2 TRP A 93 -8.269 2.596 -3.792 1.00 0.00 C ATOM 1278 CE3 TRP A 93 -7.606 0.386 -3.078 1.00 0.00 C ATOM 1279 CZ2 TRP A 93 -8.332 3.051 -2.478 1.00 0.00 C ATOM 1280 CZ3 TRP A 93 -7.669 0.839 -1.774 1.00 0.00 C ATOM 1281 CH2 TRP A 93 -8.030 2.161 -1.483 1.00 0.00 C ATOM 0 H TRP A 93 -6.618 0.629 -9.063 1.00 0.00 H new ATOM 0 HA TRP A 93 -5.529 0.325 -6.379 1.00 0.00 H new ATOM 0 HB2 TRP A 93 -8.437 -0.217 -7.082 1.00 0.00 H new ATOM 0 HB3 TRP A 93 -7.640 -0.935 -5.697 1.00 0.00 H new ATOM 0 HD1 TRP A 93 -8.446 2.633 -7.058 1.00 0.00 H new ATOM 0 HE1 TRP A 93 -8.796 4.231 -5.053 1.00 0.00 H new ATOM 0 HE3 TRP A 93 -7.328 -0.635 -3.292 1.00 0.00 H new ATOM 0 HZ2 TRP A 93 -8.609 4.070 -2.252 1.00 0.00 H new ATOM 0 HZ3 TRP A 93 -7.436 0.162 -0.965 1.00 0.00 H new ATOM 0 HH2 TRP A 93 -8.071 2.484 -0.453 1.00 0.00 H new ATOM 1292 N TYR A 94 -5.131 -2.099 -6.874 1.00 0.00 N ATOM 1293 CA TYR A 94 -4.699 -3.428 -7.289 1.00 0.00 C ATOM 1294 C TYR A 94 -5.617 -4.503 -6.717 1.00 0.00 C ATOM 1295 O TYR A 94 -6.254 -4.305 -5.681 1.00 0.00 O ATOM 1296 CB TYR A 94 -3.258 -3.682 -6.842 1.00 0.00 C ATOM 1297 CG TYR A 94 -2.224 -3.033 -7.734 1.00 0.00 C ATOM 1298 CD1 TYR A 94 -2.245 -3.226 -9.109 1.00 0.00 C ATOM 1299 CD2 TYR A 94 -1.227 -2.225 -7.201 1.00 0.00 C ATOM 1300 CE1 TYR A 94 -1.301 -2.636 -9.928 1.00 0.00 C ATOM 1301 CE2 TYR A 94 -0.280 -1.630 -8.012 1.00 0.00 C ATOM 1302 CZ TYR A 94 -0.321 -1.838 -9.374 1.00 0.00 C ATOM 1303 OH TYR A 94 0.619 -1.248 -10.187 1.00 0.00 O ATOM 0 H TYR A 94 -4.772 -1.803 -5.966 1.00 0.00 H new ATOM 0 HA TYR A 94 -4.749 -3.475 -8.377 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -3.132 -3.312 -5.825 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -3.079 -4.757 -6.815 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -3.012 -3.848 -9.546 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -1.192 -2.059 -6.134 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -1.330 -2.799 -10.995 1.00 0.00 H new ATOM 0 HE2 TYR A 94 0.488 -1.005 -7.581 1.00 0.00 H new ATOM 0 HH TYR A 94 1.082 -0.540 -9.692 1.00 0.00 H new ATOM 1313 N ARG A 95 -5.681 -5.642 -7.398 1.00 0.00 N ATOM 1314 CA ARG A 95 -6.521 -6.750 -6.959 1.00 0.00 C ATOM 1315 C ARG A 95 -5.706 -8.033 -6.830 1.00 0.00 C ATOM 1316 O ARG A 95 -5.282 -8.614 -7.828 1.00 0.00 O ATOM 1317 CB ARG A 95 -7.675 -6.962 -7.941 1.00 0.00 C ATOM 1318 CG ARG A 95 -8.932 -7.520 -7.292 1.00 0.00 C ATOM 1319 CD ARG A 95 -8.933 -9.040 -7.296 1.00 0.00 C ATOM 1320 NE ARG A 95 -8.309 -9.592 -6.097 1.00 0.00 N ATOM 1321 CZ ARG A 95 -8.296 -10.887 -5.804 1.00 0.00 C ATOM 1322 NH1 ARG A 95 -8.870 -11.760 -6.620 1.00 0.00 N ATOM 1323 NH2 ARG A 95 -7.707 -11.312 -4.693 1.00 0.00 N ATOM 0 H ARG A 95 -5.161 -5.822 -8.257 1.00 0.00 H new ATOM 0 HA ARG A 95 -6.928 -6.499 -5.979 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -7.914 -6.012 -8.418 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -7.350 -7.642 -8.729 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -9.005 -7.158 -6.267 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -9.810 -7.153 -7.823 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -9.959 -9.401 -7.370 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -8.404 -9.400 -8.178 1.00 0.00 H new ATOM 0 HE ARG A 95 -7.858 -8.947 -5.448 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -9.323 -11.437 -7.475 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -8.859 -12.754 -6.393 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -7.264 -10.643 -4.063 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -7.698 -12.307 -4.469 1.00 0.00 H new ATOM 1337 N GLY A 96 -5.490 -8.469 -5.593 1.00 0.00 N ATOM 1338 CA GLY A 96 -4.726 -9.680 -5.356 1.00 0.00 C ATOM 1339 C GLY A 96 -4.791 -10.133 -3.910 1.00 0.00 C ATOM 1340 O GLY A 96 -5.819 -9.980 -3.250 1.00 0.00 O ATOM 0 H GLY A 96 -5.830 -8.005 -4.751 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -5.102 -10.475 -6.000 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -3.686 -9.510 -5.634 1.00 0.00 H new ATOM 1344 N TYR A 97 -3.691 -10.692 -3.418 1.00 0.00 N ATOM 1345 CA TYR A 97 -3.628 -11.172 -2.043 1.00 0.00 C ATOM 1346 C TYR A 97 -2.183 -11.258 -1.561 1.00 0.00 C ATOM 1347 O TYR A 97 -1.249 -11.284 -2.364 1.00 0.00 O ATOM 1348 CB TYR A 97 -4.298 -12.543 -1.928 1.00 0.00 C ATOM 1349 CG TYR A 97 -3.669 -13.600 -2.808 1.00 0.00 C ATOM 1350 CD1 TYR A 97 -2.357 -14.009 -2.606 1.00 0.00 C ATOM 1351 CD2 TYR A 97 -4.387 -14.188 -3.842 1.00 0.00 C ATOM 1352 CE1 TYR A 97 -1.778 -14.973 -3.408 1.00 0.00 C ATOM 1353 CE2 TYR A 97 -3.817 -15.154 -4.648 1.00 0.00 C ATOM 1354 CZ TYR A 97 -2.512 -15.543 -4.427 1.00 0.00 C ATOM 1355 OH TYR A 97 -1.940 -16.504 -5.229 1.00 0.00 O ATOM 0 H TYR A 97 -2.831 -10.824 -3.951 1.00 0.00 H new ATOM 0 HA TYR A 97 -4.160 -10.460 -1.412 1.00 0.00 H new ATOM 0 HB2 TYR A 97 -4.255 -12.873 -0.890 1.00 0.00 H new ATOM 0 HB3 TYR A 97 -5.352 -12.446 -2.188 1.00 0.00 H new ATOM 0 HD1 TYR A 97 -1.780 -13.566 -1.808 1.00 0.00 H new ATOM 0 HD2 TYR A 97 -5.408 -13.885 -4.019 1.00 0.00 H new ATOM 0 HE1 TYR A 97 -0.756 -15.279 -3.238 1.00 0.00 H new ATOM 0 HE2 TYR A 97 -4.390 -15.602 -5.447 1.00 0.00 H new ATOM 0 HH TYR A 97 -2.592 -16.803 -5.897 1.00 0.00 H new ATOM 1365 N LEU A 98 -2.007 -11.302 -0.245 1.00 0.00 N ATOM 1366 CA LEU A 98 -0.676 -11.386 0.346 1.00 0.00 C ATOM 1367 C LEU A 98 -0.056 -12.758 0.102 1.00 0.00 C ATOM 1368 O LEU A 98 -0.550 -13.770 0.599 1.00 0.00 O ATOM 1369 CB LEU A 98 -0.745 -11.105 1.848 1.00 0.00 C ATOM 1370 CG LEU A 98 0.546 -10.608 2.498 1.00 0.00 C ATOM 1371 CD1 LEU A 98 0.920 -9.235 1.962 1.00 0.00 C ATOM 1372 CD2 LEU A 98 0.401 -10.569 4.013 1.00 0.00 C ATOM 0 H LEU A 98 -2.769 -11.281 0.433 1.00 0.00 H new ATOM 0 HA LEU A 98 -0.047 -10.634 -0.130 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -1.525 -10.364 2.023 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -1.054 -12.019 2.354 1.00 0.00 H new ATOM 0 HG LEU A 98 1.346 -11.304 2.247 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.842 -8.898 2.436 1.00 0.00 H new ATOM 0 HD12 LEU A 98 1.067 -9.293 0.884 1.00 0.00 H new ATOM 0 HD13 LEU A 98 0.120 -8.528 2.181 1.00 0.00 H new ATOM 0 HD21 LEU A 98 1.330 -10.213 4.458 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -0.413 -9.896 4.283 1.00 0.00 H new ATOM 0 HD23 LEU A 98 0.182 -11.570 4.383 1.00 0.00 H new ATOM 1384 N ILE A 99 1.028 -12.784 -0.666 1.00 0.00 N ATOM 1385 CA ILE A 99 1.716 -14.031 -0.973 1.00 0.00 C ATOM 1386 C ILE A 99 2.151 -14.747 0.301 1.00 0.00 C ATOM 1387 O ILE A 99 1.814 -15.911 0.519 1.00 0.00 O ATOM 1388 CB ILE A 99 2.952 -13.788 -1.859 1.00 0.00 C ATOM 1389 CG1 ILE A 99 2.560 -13.012 -3.118 1.00 0.00 C ATOM 1390 CG2 ILE A 99 3.607 -15.111 -2.229 1.00 0.00 C ATOM 1391 CD1 ILE A 99 3.743 -12.451 -3.876 1.00 0.00 C ATOM 0 H ILE A 99 1.448 -11.955 -1.087 1.00 0.00 H new ATOM 0 HA ILE A 99 1.007 -14.657 -1.515 1.00 0.00 H new ATOM 0 HB ILE A 99 3.672 -13.193 -1.297 1.00 0.00 H new ATOM 0 HG12 ILE A 99 1.994 -13.669 -3.778 1.00 0.00 H new ATOM 0 HG13 ILE A 99 1.897 -12.193 -2.838 1.00 0.00 H new ATOM 0 HG21 ILE A 99 4.479 -14.923 -2.855 1.00 0.00 H new ATOM 0 HG22 ILE A 99 3.917 -15.630 -1.322 1.00 0.00 H new ATOM 0 HG23 ILE A 99 2.895 -15.729 -2.775 1.00 0.00 H new ATOM 0 HD11 ILE A 99 3.390 -11.914 -4.756 1.00 0.00 H new ATOM 0 HD12 ILE A 99 4.297 -11.768 -3.232 1.00 0.00 H new ATOM 0 HD13 ILE A 99 4.396 -13.267 -4.187 1.00 0.00 H new ATOM 1403 N LYS A 100 2.901 -14.043 1.142 1.00 0.00 N ATOM 1404 CA LYS A 100 3.381 -14.609 2.398 1.00 0.00 C ATOM 1405 C LYS A 100 2.218 -15.121 3.243 1.00 0.00 C ATOM 1406 O LYS A 100 2.368 -16.071 4.012 1.00 0.00 O ATOM 1407 CB LYS A 100 4.174 -13.563 3.183 1.00 0.00 C ATOM 1408 CG LYS A 100 3.466 -12.224 3.300 1.00 0.00 C ATOM 1409 CD LYS A 100 4.302 -11.216 4.070 1.00 0.00 C ATOM 1410 CE LYS A 100 5.228 -10.438 3.148 1.00 0.00 C ATOM 1411 NZ LYS A 100 6.544 -11.115 2.984 1.00 0.00 N ATOM 0 H LYS A 100 3.190 -13.079 0.977 1.00 0.00 H new ATOM 0 HA LYS A 100 4.034 -15.449 2.163 1.00 0.00 H new ATOM 0 HB2 LYS A 100 4.375 -13.947 4.183 1.00 0.00 H new ATOM 0 HB3 LYS A 100 5.139 -13.413 2.699 1.00 0.00 H new ATOM 0 HG2 LYS A 100 3.253 -11.836 2.304 1.00 0.00 H new ATOM 0 HG3 LYS A 100 2.507 -12.361 3.801 1.00 0.00 H new ATOM 0 HD2 LYS A 100 3.645 -10.523 4.596 1.00 0.00 H new ATOM 0 HD3 LYS A 100 4.891 -11.733 4.827 1.00 0.00 H new ATOM 0 HE2 LYS A 100 4.755 -10.321 2.173 1.00 0.00 H new ATOM 0 HE3 LYS A 100 5.382 -9.436 3.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 7.307 -10.412 3.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 6.663 -11.828 3.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 6.582 -11.579 2.054 1.00 0.00 H new ATOM 1425 N HIS A 101 1.060 -14.485 3.095 1.00 0.00 N ATOM 1426 CA HIS A 101 -0.128 -14.878 3.844 1.00 0.00 C ATOM 1427 C HIS A 101 -1.352 -14.928 2.934 1.00 0.00 C ATOM 1428 O HIS A 101 -2.058 -13.933 2.770 1.00 0.00 O ATOM 1429 CB HIS A 101 -0.375 -13.904 4.996 1.00 0.00 C ATOM 1430 CG HIS A 101 0.709 -13.912 6.030 1.00 0.00 C ATOM 1431 ND1 HIS A 101 1.179 -15.066 6.619 1.00 0.00 N ATOM 1432 CD2 HIS A 101 1.417 -12.897 6.577 1.00 0.00 C ATOM 1433 CE1 HIS A 101 2.128 -14.761 7.485 1.00 0.00 C ATOM 1434 NE2 HIS A 101 2.292 -13.451 7.479 1.00 0.00 N ATOM 0 H HIS A 101 0.919 -13.696 2.464 1.00 0.00 H new ATOM 0 HA HIS A 101 0.042 -15.875 4.250 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -0.475 -12.896 4.594 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -1.323 -14.152 5.473 1.00 0.00 H new ATOM 0 HD2 HIS A 101 1.313 -11.847 6.347 1.00 0.00 H new ATOM 0 HE1 HIS A 101 2.677 -15.464 8.095 1.00 0.00 H new ATOM 0 HE2 HIS A 101 2.960 -12.934 8.051 1.00 0.00 H new ATOM 1443 N LYS A 102 -1.597 -16.093 2.343 1.00 0.00 N ATOM 1444 CA LYS A 102 -2.734 -16.274 1.449 1.00 0.00 C ATOM 1445 C LYS A 102 -4.046 -16.245 2.227 1.00 0.00 C ATOM 1446 O LYS A 102 -5.125 -16.369 1.647 1.00 0.00 O ATOM 1447 CB LYS A 102 -2.608 -17.597 0.691 1.00 0.00 C ATOM 1448 CG LYS A 102 -1.268 -17.775 -0.003 1.00 0.00 C ATOM 1449 CD LYS A 102 -1.294 -17.216 -1.416 1.00 0.00 C ATOM 1450 CE LYS A 102 -0.135 -17.746 -2.246 1.00 0.00 C ATOM 1451 NZ LYS A 102 -0.294 -19.193 -2.560 1.00 0.00 N ATOM 0 H LYS A 102 -1.022 -16.926 2.468 1.00 0.00 H new ATOM 0 HA LYS A 102 -2.737 -15.452 0.734 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -2.759 -18.421 1.388 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -3.403 -17.658 -0.052 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -0.489 -17.275 0.573 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -1.011 -18.834 -0.034 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -2.237 -17.480 -1.895 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -1.249 -16.128 -1.379 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -0.064 -17.179 -3.174 1.00 0.00 H new ATOM 0 HE3 LYS A 102 0.799 -17.592 -1.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 0.325 -19.446 -3.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -0.035 -19.759 -1.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -1.283 -19.386 -2.816 1.00 0.00 H new ATOM 1465 N MET A 103 -3.947 -16.080 3.542 1.00 0.00 N ATOM 1466 CA MET A 103 -5.127 -16.032 4.397 1.00 0.00 C ATOM 1467 C MET A 103 -5.765 -14.647 4.366 1.00 0.00 C ATOM 1468 O MET A 103 -6.728 -14.380 5.086 1.00 0.00 O ATOM 1469 CB MET A 103 -4.756 -16.403 5.834 1.00 0.00 C ATOM 1470 CG MET A 103 -4.818 -17.897 6.111 1.00 0.00 C ATOM 1471 SD MET A 103 -6.447 -18.597 5.784 1.00 0.00 S ATOM 1472 CE MET A 103 -7.506 -17.320 6.457 1.00 0.00 C ATOM 0 H MET A 103 -3.062 -15.977 4.038 1.00 0.00 H new ATOM 0 HA MET A 103 -5.850 -16.754 4.017 1.00 0.00 H new ATOM 0 HB2 MET A 103 -3.749 -16.044 6.045 1.00 0.00 H new ATOM 0 HB3 MET A 103 -5.428 -15.886 6.519 1.00 0.00 H new ATOM 0 HG2 MET A 103 -4.077 -18.408 5.496 1.00 0.00 H new ATOM 0 HG3 MET A 103 -4.550 -18.081 7.151 1.00 0.00 H new ATOM 0 HE1 MET A 103 -8.488 -17.739 6.675 1.00 0.00 H new ATOM 0 HE2 MET A 103 -7.067 -16.929 7.375 1.00 0.00 H new ATOM 0 HE3 MET A 103 -7.609 -16.513 5.732 1.00 0.00 H new ATOM 1482 N LEU A 104 -5.222 -13.769 3.529 1.00 0.00 N ATOM 1483 CA LEU A 104 -5.739 -12.411 3.405 1.00 0.00 C ATOM 1484 C LEU A 104 -5.824 -11.993 1.940 1.00 0.00 C ATOM 1485 O LEU A 104 -4.807 -11.893 1.254 1.00 0.00 O ATOM 1486 CB LEU A 104 -4.850 -11.433 4.176 1.00 0.00 C ATOM 1487 CG LEU A 104 -4.469 -11.850 5.597 1.00 0.00 C ATOM 1488 CD1 LEU A 104 -3.184 -12.663 5.588 1.00 0.00 C ATOM 1489 CD2 LEU A 104 -4.323 -10.627 6.490 1.00 0.00 C ATOM 0 H LEU A 104 -4.425 -13.973 2.927 1.00 0.00 H new ATOM 0 HA LEU A 104 -6.743 -12.390 3.829 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -3.934 -11.279 3.606 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -5.360 -10.471 4.225 1.00 0.00 H new ATOM 0 HG LEU A 104 -5.267 -12.475 5.999 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -2.928 -12.951 6.608 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -3.324 -13.558 4.982 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -2.377 -12.063 5.167 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -4.052 -10.942 7.497 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -3.545 -9.976 6.091 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -5.268 -10.085 6.522 1.00 0.00 H new ATOM 1501 N GLN A 105 -7.042 -11.748 1.469 1.00 0.00 N ATOM 1502 CA GLN A 105 -7.259 -11.339 0.087 1.00 0.00 C ATOM 1503 C GLN A 105 -8.154 -10.106 0.017 1.00 0.00 C ATOM 1504 O GLN A 105 -9.009 -9.898 0.877 1.00 0.00 O ATOM 1505 CB GLN A 105 -7.883 -12.483 -0.714 1.00 0.00 C ATOM 1506 CG GLN A 105 -7.162 -13.810 -0.543 1.00 0.00 C ATOM 1507 CD GLN A 105 -7.770 -14.917 -1.382 1.00 0.00 C ATOM 1508 OE1 GLN A 105 -8.301 -15.893 -0.851 1.00 0.00 O ATOM 1509 NE2 GLN A 105 -7.697 -14.770 -2.699 1.00 0.00 N ATOM 0 H GLN A 105 -7.894 -11.826 2.024 1.00 0.00 H new ATOM 0 HA GLN A 105 -6.291 -11.087 -0.346 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -8.923 -12.603 -0.411 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -7.888 -12.215 -1.771 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -6.114 -13.687 -0.815 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -7.187 -14.100 0.507 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -7.248 -13.945 -3.096 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -8.090 -15.482 -3.314 1.00 0.00 H new ATOM 1518 N GLY A 106 -7.949 -9.289 -1.012 1.00 0.00 N ATOM 1519 CA GLY A 106 -8.745 -8.086 -1.174 1.00 0.00 C ATOM 1520 C GLY A 106 -8.148 -7.128 -2.185 1.00 0.00 C ATOM 1521 O GLY A 106 -7.606 -7.552 -3.207 1.00 0.00 O ATOM 0 H GLY A 106 -7.246 -9.439 -1.736 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -9.752 -8.360 -1.488 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -8.837 -7.583 -0.212 1.00 0.00 H new ATOM 1525 N ILE A 107 -8.249 -5.834 -1.903 1.00 0.00 N ATOM 1526 CA ILE A 107 -7.715 -4.813 -2.797 1.00 0.00 C ATOM 1527 C ILE A 107 -6.936 -3.756 -2.021 1.00 0.00 C ATOM 1528 O ILE A 107 -7.046 -3.661 -0.798 1.00 0.00 O ATOM 1529 CB ILE A 107 -8.835 -4.125 -3.598 1.00 0.00 C ATOM 1530 CG1 ILE A 107 -9.938 -3.635 -2.657 1.00 0.00 C ATOM 1531 CG2 ILE A 107 -9.405 -5.077 -4.639 1.00 0.00 C ATOM 1532 CD1 ILE A 107 -10.893 -2.656 -3.303 1.00 0.00 C ATOM 0 H ILE A 107 -8.696 -5.467 -1.063 1.00 0.00 H new ATOM 0 HA ILE A 107 -7.043 -5.320 -3.490 1.00 0.00 H new ATOM 0 HB ILE A 107 -8.414 -3.263 -4.115 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -10.502 -4.494 -2.293 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -9.480 -3.163 -1.788 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -10.196 -4.575 -5.197 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -8.615 -5.382 -5.325 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -9.814 -5.957 -4.142 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -11.648 -2.352 -2.578 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -10.341 -1.779 -3.642 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -11.379 -3.131 -4.155 1.00 0.00 H new ATOM 1544 N PHE A 108 -6.150 -2.962 -2.740 1.00 0.00 N ATOM 1545 CA PHE A 108 -5.353 -1.910 -2.120 1.00 0.00 C ATOM 1546 C PHE A 108 -4.964 -0.847 -3.143 1.00 0.00 C ATOM 1547 O PHE A 108 -4.995 -1.074 -4.353 1.00 0.00 O ATOM 1548 CB PHE A 108 -4.096 -2.503 -1.480 1.00 0.00 C ATOM 1549 CG PHE A 108 -3.591 -3.733 -2.180 1.00 0.00 C ATOM 1550 CD1 PHE A 108 -2.704 -3.628 -3.239 1.00 0.00 C ATOM 1551 CD2 PHE A 108 -4.003 -4.993 -1.779 1.00 0.00 C ATOM 1552 CE1 PHE A 108 -2.237 -4.757 -3.885 1.00 0.00 C ATOM 1553 CE2 PHE A 108 -3.539 -6.126 -2.420 1.00 0.00 C ATOM 1554 CZ PHE A 108 -2.656 -6.007 -3.476 1.00 0.00 C ATOM 0 H PHE A 108 -6.048 -3.027 -3.753 1.00 0.00 H new ATOM 0 HA PHE A 108 -5.959 -1.439 -1.346 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -3.310 -1.748 -1.475 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -4.309 -2.748 -0.439 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -2.374 -2.652 -3.564 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -4.695 -5.091 -0.956 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -1.545 -4.661 -4.709 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -3.866 -7.103 -2.096 1.00 0.00 H new ATOM 0 HZ PHE A 108 -2.294 -6.891 -3.981 1.00 0.00 H new ATOM 1564 N PRO A 109 -4.589 0.341 -2.648 1.00 0.00 N ATOM 1565 CA PRO A 109 -4.187 1.463 -3.502 1.00 0.00 C ATOM 1566 C PRO A 109 -2.848 1.217 -4.189 1.00 0.00 C ATOM 1567 O PRO A 109 -1.841 0.949 -3.533 1.00 0.00 O ATOM 1568 CB PRO A 109 -4.078 2.633 -2.521 1.00 0.00 C ATOM 1569 CG PRO A 109 -3.802 1.998 -1.202 1.00 0.00 C ATOM 1570 CD PRO A 109 -4.529 0.682 -1.217 1.00 0.00 C ATOM 0 HA PRO A 109 -4.895 1.633 -4.313 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -3.278 3.316 -2.807 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -4.999 3.215 -2.495 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -2.732 1.851 -1.056 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -4.152 2.628 -0.384 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -3.996 -0.078 -0.645 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -5.525 0.768 -0.782 1.00 0.00 H new ATOM 1578 N LYS A 110 -2.843 1.311 -5.514 1.00 0.00 N ATOM 1579 CA LYS A 110 -1.627 1.101 -6.292 1.00 0.00 C ATOM 1580 C LYS A 110 -0.509 2.022 -5.814 1.00 0.00 C ATOM 1581 O LYS A 110 0.662 1.642 -5.809 1.00 0.00 O ATOM 1582 CB LYS A 110 -1.900 1.341 -7.778 1.00 0.00 C ATOM 1583 CG LYS A 110 -2.852 0.330 -8.393 1.00 0.00 C ATOM 1584 CD LYS A 110 -3.382 0.807 -9.735 1.00 0.00 C ATOM 1585 CE LYS A 110 -2.275 0.884 -10.776 1.00 0.00 C ATOM 1586 NZ LYS A 110 -2.719 1.594 -12.007 1.00 0.00 N ATOM 0 H LYS A 110 -3.668 1.531 -6.072 1.00 0.00 H new ATOM 0 HA LYS A 110 -1.308 0.068 -6.150 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -2.314 2.341 -7.906 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -0.955 1.315 -8.321 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -2.339 -0.623 -8.522 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -3.686 0.154 -7.713 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -4.162 0.129 -10.081 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -3.842 1.788 -9.618 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -1.413 1.398 -10.352 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -1.950 -0.124 -11.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -1.936 1.625 -12.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -3.526 1.090 -12.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -3.005 2.564 -11.764 1.00 0.00 H new ATOM 1600 N SER A 111 -0.879 3.234 -5.411 1.00 0.00 N ATOM 1601 CA SER A 111 0.094 4.210 -4.933 1.00 0.00 C ATOM 1602 C SER A 111 0.855 3.671 -3.725 1.00 0.00 C ATOM 1603 O SER A 111 1.862 4.243 -3.307 1.00 0.00 O ATOM 1604 CB SER A 111 -0.606 5.520 -4.567 1.00 0.00 C ATOM 1605 OG SER A 111 -1.577 5.315 -3.556 1.00 0.00 O ATOM 0 H SER A 111 -1.844 3.563 -5.406 1.00 0.00 H new ATOM 0 HA SER A 111 0.808 4.399 -5.735 1.00 0.00 H new ATOM 0 HB2 SER A 111 0.131 6.247 -4.225 1.00 0.00 H new ATOM 0 HB3 SER A 111 -1.082 5.941 -5.453 1.00 0.00 H new ATOM 0 HG SER A 111 -2.009 6.168 -3.339 1.00 0.00 H new ATOM 1611 N PHE A 112 0.366 2.568 -3.169 1.00 0.00 N ATOM 1612 CA PHE A 112 0.998 1.952 -2.009 1.00 0.00 C ATOM 1613 C PHE A 112 1.837 0.746 -2.423 1.00 0.00 C ATOM 1614 O PHE A 112 2.707 0.296 -1.677 1.00 0.00 O ATOM 1615 CB PHE A 112 -0.061 1.525 -0.991 1.00 0.00 C ATOM 1616 CG PHE A 112 -0.610 2.666 -0.183 1.00 0.00 C ATOM 1617 CD1 PHE A 112 -1.133 3.786 -0.810 1.00 0.00 C ATOM 1618 CD2 PHE A 112 -0.605 2.619 1.201 1.00 0.00 C ATOM 1619 CE1 PHE A 112 -1.639 4.838 -0.069 1.00 0.00 C ATOM 1620 CE2 PHE A 112 -1.109 3.668 1.947 1.00 0.00 C ATOM 1621 CZ PHE A 112 -1.628 4.778 1.311 1.00 0.00 C ATOM 0 H PHE A 112 -0.466 2.082 -3.503 1.00 0.00 H new ATOM 0 HA PHE A 112 1.656 2.690 -1.550 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -0.881 1.034 -1.516 1.00 0.00 H new ATOM 0 HB3 PHE A 112 0.372 0.787 -0.316 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -1.145 3.838 -1.889 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -0.202 1.752 1.704 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -2.043 5.706 -0.569 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -1.097 3.619 3.026 1.00 0.00 H new ATOM 0 HZ PHE A 112 -2.025 5.598 1.891 1.00 0.00 H new ATOM 1631 N ILE A 113 1.568 0.227 -3.616 1.00 0.00 N ATOM 1632 CA ILE A 113 2.297 -0.926 -4.129 1.00 0.00 C ATOM 1633 C ILE A 113 3.373 -0.498 -5.122 1.00 0.00 C ATOM 1634 O ILE A 113 3.110 0.275 -6.044 1.00 0.00 O ATOM 1635 CB ILE A 113 1.352 -1.930 -4.815 1.00 0.00 C ATOM 1636 CG1 ILE A 113 0.236 -2.350 -3.856 1.00 0.00 C ATOM 1637 CG2 ILE A 113 2.130 -3.146 -5.296 1.00 0.00 C ATOM 1638 CD1 ILE A 113 0.741 -3.021 -2.598 1.00 0.00 C ATOM 0 H ILE A 113 0.851 0.587 -4.245 1.00 0.00 H new ATOM 0 HA ILE A 113 2.767 -1.409 -3.272 1.00 0.00 H new ATOM 0 HB ILE A 113 0.899 -1.447 -5.681 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -0.345 -1.470 -3.580 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -0.441 -3.030 -4.374 1.00 0.00 H new ATOM 0 HG21 ILE A 113 1.448 -3.846 -5.779 1.00 0.00 H new ATOM 0 HG22 ILE A 113 2.892 -2.832 -6.009 1.00 0.00 H new ATOM 0 HG23 ILE A 113 2.608 -3.632 -4.445 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -0.104 -3.291 -1.965 1.00 0.00 H new ATOM 0 HD12 ILE A 113 1.298 -3.920 -2.863 1.00 0.00 H new ATOM 0 HD13 ILE A 113 1.394 -2.336 -2.057 1.00 0.00 H new ATOM 1650 N HIS A 114 4.585 -1.008 -4.928 1.00 0.00 N ATOM 1651 CA HIS A 114 5.702 -0.680 -5.808 1.00 0.00 C ATOM 1652 C HIS A 114 5.946 -1.800 -6.815 1.00 0.00 C ATOM 1653 O HIS A 114 6.451 -2.866 -6.461 1.00 0.00 O ATOM 1654 CB HIS A 114 6.968 -0.430 -4.988 1.00 0.00 C ATOM 1655 CG HIS A 114 8.154 -0.047 -5.820 1.00 0.00 C ATOM 1656 ND1 HIS A 114 8.211 1.116 -6.557 1.00 0.00 N ATOM 1657 CD2 HIS A 114 9.332 -0.681 -6.026 1.00 0.00 C ATOM 1658 CE1 HIS A 114 9.373 1.181 -7.183 1.00 0.00 C ATOM 1659 NE2 HIS A 114 10.072 0.103 -6.877 1.00 0.00 N ATOM 0 H HIS A 114 4.819 -1.649 -4.170 1.00 0.00 H new ATOM 0 HA HIS A 114 5.448 0.228 -6.355 1.00 0.00 H new ATOM 0 HB2 HIS A 114 6.772 0.361 -4.264 1.00 0.00 H new ATOM 0 HB3 HIS A 114 7.207 -1.330 -4.421 1.00 0.00 H new ATOM 0 HD2 HIS A 114 9.634 -1.627 -5.601 1.00 0.00 H new ATOM 0 HE1 HIS A 114 9.696 1.980 -7.834 1.00 0.00 H new ATOM 0 HE2 HIS A 114 11.009 -0.112 -7.217 1.00 0.00 H new ATOM 1668 N ILE A 115 5.584 -1.551 -8.069 1.00 0.00 N ATOM 1669 CA ILE A 115 5.764 -2.539 -9.126 1.00 0.00 C ATOM 1670 C ILE A 115 7.244 -2.805 -9.383 1.00 0.00 C ATOM 1671 O ILE A 115 7.984 -1.911 -9.794 1.00 0.00 O ATOM 1672 CB ILE A 115 5.100 -2.085 -10.439 1.00 0.00 C ATOM 1673 CG1 ILE A 115 3.608 -1.827 -10.219 1.00 0.00 C ATOM 1674 CG2 ILE A 115 5.308 -3.129 -11.526 1.00 0.00 C ATOM 1675 CD1 ILE A 115 2.860 -3.028 -9.682 1.00 0.00 C ATOM 0 H ILE A 115 5.165 -0.674 -8.378 1.00 0.00 H new ATOM 0 HA ILE A 115 5.286 -3.457 -8.785 1.00 0.00 H new ATOM 0 HB ILE A 115 5.566 -1.154 -10.762 1.00 0.00 H new ATOM 0 HG12 ILE A 115 3.490 -0.995 -9.525 1.00 0.00 H new ATOM 0 HG13 ILE A 115 3.157 -1.521 -11.163 1.00 0.00 H new ATOM 0 HG21 ILE A 115 4.833 -2.794 -12.448 1.00 0.00 H new ATOM 0 HG22 ILE A 115 6.375 -3.268 -11.697 1.00 0.00 H new ATOM 0 HG23 ILE A 115 4.865 -4.074 -11.212 1.00 0.00 H new ATOM 0 HD11 ILE A 115 1.808 -2.773 -9.550 1.00 0.00 H new ATOM 0 HD12 ILE A 115 2.947 -3.856 -10.386 1.00 0.00 H new ATOM 0 HD13 ILE A 115 3.285 -3.322 -8.722 1.00 0.00 H new ATOM 1687 N LYS A 116 7.668 -4.040 -9.139 1.00 0.00 N ATOM 1688 CA LYS A 116 9.059 -4.427 -9.347 1.00 0.00 C ATOM 1689 C LYS A 116 9.325 -4.729 -10.818 1.00 0.00 C ATOM 1690 O LYS A 116 8.920 -5.772 -11.330 1.00 0.00 O ATOM 1691 CB LYS A 116 9.402 -5.650 -8.493 1.00 0.00 C ATOM 1692 CG LYS A 116 9.829 -5.303 -7.078 1.00 0.00 C ATOM 1693 CD LYS A 116 10.008 -6.550 -6.228 1.00 0.00 C ATOM 1694 CE LYS A 116 11.078 -6.352 -5.165 1.00 0.00 C ATOM 1695 NZ LYS A 116 12.422 -6.774 -5.646 1.00 0.00 N ATOM 0 H LYS A 116 7.068 -4.791 -8.797 1.00 0.00 H new ATOM 0 HA LYS A 116 9.692 -3.592 -9.046 1.00 0.00 H new ATOM 0 HB2 LYS A 116 8.534 -6.308 -8.451 1.00 0.00 H new ATOM 0 HB3 LYS A 116 10.202 -6.209 -8.978 1.00 0.00 H new ATOM 0 HG2 LYS A 116 10.764 -4.743 -7.106 1.00 0.00 H new ATOM 0 HG3 LYS A 116 9.082 -4.654 -6.621 1.00 0.00 H new ATOM 0 HD2 LYS A 116 9.062 -6.805 -5.750 1.00 0.00 H new ATOM 0 HD3 LYS A 116 10.279 -7.391 -6.866 1.00 0.00 H new ATOM 0 HE2 LYS A 116 11.110 -5.302 -4.873 1.00 0.00 H new ATOM 0 HE3 LYS A 116 10.815 -6.923 -4.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 13.123 -6.623 -4.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 12.399 -7.782 -5.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 12.684 -6.212 -6.481 1.00 0.00 H new ATOM 1709 N GLU A 117 10.011 -3.810 -11.491 1.00 0.00 N ATOM 1710 CA GLU A 117 10.332 -3.980 -12.903 1.00 0.00 C ATOM 1711 C GLU A 117 11.769 -4.464 -13.080 1.00 0.00 C ATOM 1712 O GLU A 117 12.525 -3.918 -13.883 1.00 0.00 O ATOM 1713 CB GLU A 117 10.129 -2.665 -13.657 1.00 0.00 C ATOM 1714 CG GLU A 117 8.762 -2.040 -13.435 1.00 0.00 C ATOM 1715 CD GLU A 117 8.789 -0.527 -13.529 1.00 0.00 C ATOM 1716 OE1 GLU A 117 9.725 0.084 -12.972 1.00 0.00 O ATOM 1717 OE2 GLU A 117 7.876 0.045 -14.158 1.00 0.00 O ATOM 0 H GLU A 117 10.355 -2.941 -11.081 1.00 0.00 H new ATOM 0 HA GLU A 117 9.660 -4.733 -13.314 1.00 0.00 H new ATOM 0 HB2 GLU A 117 10.897 -1.956 -13.348 1.00 0.00 H new ATOM 0 HB3 GLU A 117 10.269 -2.842 -14.723 1.00 0.00 H new ATOM 0 HG2 GLU A 117 8.063 -2.433 -14.173 1.00 0.00 H new ATOM 0 HG3 GLU A 117 8.388 -2.333 -12.454 1.00 0.00 H new ATOM 1724 N VAL A 118 12.137 -5.494 -12.324 1.00 0.00 N ATOM 1725 CA VAL A 118 13.482 -6.053 -12.397 1.00 0.00 C ATOM 1726 C VAL A 118 13.607 -7.036 -13.556 1.00 0.00 C ATOM 1727 O VAL A 118 14.533 -6.948 -14.363 1.00 0.00 O ATOM 1728 CB VAL A 118 13.864 -6.768 -11.088 1.00 0.00 C ATOM 1729 CG1 VAL A 118 15.289 -7.296 -11.163 1.00 0.00 C ATOM 1730 CG2 VAL A 118 13.696 -5.832 -9.901 1.00 0.00 C ATOM 0 H VAL A 118 11.523 -5.958 -11.654 1.00 0.00 H new ATOM 0 HA VAL A 118 14.164 -5.218 -12.558 1.00 0.00 H new ATOM 0 HB VAL A 118 13.194 -7.617 -10.950 1.00 0.00 H new ATOM 0 HG11 VAL A 118 15.541 -7.798 -10.229 1.00 0.00 H new ATOM 0 HG12 VAL A 118 15.372 -8.003 -11.989 1.00 0.00 H new ATOM 0 HG13 VAL A 118 15.977 -6.466 -11.325 1.00 0.00 H new ATOM 0 HG21 VAL A 118 13.970 -6.354 -8.984 1.00 0.00 H new ATOM 0 HG22 VAL A 118 14.340 -4.962 -10.030 1.00 0.00 H new ATOM 0 HG23 VAL A 118 12.657 -5.508 -9.837 1.00 0.00 H new ATOM 1740 N THR A 119 12.667 -7.973 -13.633 1.00 0.00 N ATOM 1741 CA THR A 119 12.671 -8.974 -14.693 1.00 0.00 C ATOM 1742 C THR A 119 11.279 -9.152 -15.286 1.00 0.00 C ATOM 1743 O THR A 119 10.275 -8.839 -14.646 1.00 0.00 O ATOM 1744 CB THR A 119 13.176 -10.335 -14.178 1.00 0.00 C ATOM 1745 OG1 THR A 119 14.497 -10.198 -13.644 1.00 0.00 O ATOM 1746 CG2 THR A 119 13.178 -11.369 -15.294 1.00 0.00 C ATOM 0 H THR A 119 11.893 -8.060 -12.974 1.00 0.00 H new ATOM 0 HA THR A 119 13.348 -8.613 -15.467 1.00 0.00 H new ATOM 0 HB THR A 119 12.501 -10.674 -13.392 1.00 0.00 H new ATOM 0 HG1 THR A 119 14.810 -11.068 -13.318 1.00 0.00 H new ATOM 0 HG21 THR A 119 13.538 -12.322 -14.906 1.00 0.00 H new ATOM 0 HG22 THR A 119 12.165 -11.493 -15.677 1.00 0.00 H new ATOM 0 HG23 THR A 119 13.832 -11.034 -16.099 1.00 0.00 H new TER 1754 THR A 119