USER MOD reduce.3.24.130724 H: found=0, std=0, add=1535, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1535 hydrogens (26 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 21 THR OG1 : rot 124:sc= 0.012 USER MOD Set 1.2: A 153 TYR OH : rot 150:sc= 1.03 USER MOD Set 2.1: A 6 ASN : amide:sc= 1.09 K(o=1.3,f=-2.5!) USER MOD Set 2.2: A 163 SER OG : rot 106:sc= 0.217 USER MOD Single : A 1 MET CE :methyl 158:sc= -0.155 (180deg=-1.24) USER MOD Single : A 1 MET N :NH3+ -157:sc= -0.0565 (180deg=-0.447) USER MOD Single : A 7 GLN : amide:sc= -0.44 X(o=-0.44,f=-0.14) USER MOD Single : A 9 SER OG : rot 60:sc= -0.191 USER MOD Single : A 10 GLN :FLIP amide:sc= -4! C(o=-7.7!,f=-4!) USER MOD Single : A 18 MET CE :methyl 149:sc= -0.0504 (180deg=-1.28) USER MOD Single : A 28 THR OG1 : rot -78:sc= 0.38 USER MOD Single : A 33 GLN : amide:sc= -0.957 X(o=-0.96,f=-0.9) USER MOD Single : A 34 HIS : no HD1:sc= -0.25 X(o=-0.25,f=-0.46) USER MOD Single : A 36 MET CE :methyl -111:sc=-0.00897 (180deg=-3.02!) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot -30:sc= 1.1 USER MOD Single : A 46 TYR OH : rot 150:sc= -0.287 USER MOD Single : A 66 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.0967) USER MOD Single : A 67 THR OG1 : rot 180:sc= -0.791 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot -48:sc= 0.543 USER MOD Single : A 86 GLN : amide:sc= -1.11 K(o=-1.1,f=-2.6!) USER MOD Single : A 88 THR OG1 : rot 6:sc= -1.32 USER MOD Single : A 89 TYR OH : rot -55:sc= 0.863 USER MOD Single : A 91 HIS : no HE2:sc= -1.43 K(o=-1.4,f=-3.5!) USER MOD Single : A 92 THR OG1 : rot -17:sc= 0.446 USER MOD Single : A 93 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -0.98 K(o=-0.98,f=-1.8!) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= -0.431 USER MOD Single : A 103 THR OG1 : rot 34:sc= 0.214 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 134 GLN :FLIP amide:sc= 0.00656 F(o=-0.75,f=0.0066) USER MOD Single : A 142 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 144 GLN :FLIP amide:sc= -0.288 F(o=-2.6!,f=-0.29) USER MOD Single : A 164 GLN :FLIP amide:sc= 0 F(o=-0.82,f=0) USER MOD Single : A 167 LYS NZ :NH3+ 159:sc= -0.0214 (180deg=-0.325) USER MOD Single : A 169 LYS NZ :NH3+ 162:sc= -0.0866 (180deg=-0.827) USER MOD Single : A 170 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 178 HIS : no HD1:sc= -0.762 K(o=-0.76,f=-1.6) USER MOD Single : A 179 HIS : no HD1:sc= -0.652 K(o=-0.65,f=-2!) USER MOD Single : A 180 HIS : no HD1:sc= -0.261 X(o=-0.26,f=-0.32) USER MOD Single : A 181 HIS : no HD1:sc= -0.0197 X(o=-0.02,f=-0.14) USER MOD Single : A 182 HIS : no HD1:sc= -0.314 X(o=-0.31,f=-0.29) USER MOD Single : A 183 HIS : no HE2:sc= -0.288! C(o=-0.29!,f=-5!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 14.618 -23.895 -2.476 1.00 0.00 N ATOM 2 CA MET A 1 13.873 -22.867 -1.693 1.00 0.00 C ATOM 3 C MET A 1 12.775 -22.266 -2.564 1.00 0.00 C ATOM 4 O MET A 1 11.626 -22.147 -2.136 1.00 0.00 O ATOM 5 CB MET A 1 14.842 -21.772 -1.243 1.00 0.00 C ATOM 6 CG MET A 1 15.744 -22.309 -0.130 1.00 0.00 C ATOM 7 SD MET A 1 17.176 -21.220 0.065 1.00 0.00 S ATOM 8 CE MET A 1 16.259 -19.691 0.373 1.00 0.00 C ATOM 0 H1 MET A 1 15.078 -24.562 -1.824 1.00 0.00 H new ATOM 0 H2 MET A 1 13.956 -24.411 -3.089 1.00 0.00 H new ATOM 0 H3 MET A 1 15.341 -23.429 -3.061 1.00 0.00 H new ATOM 0 HA MET A 1 13.421 -23.328 -0.815 1.00 0.00 H new ATOM 0 HB2 MET A 1 15.447 -21.439 -2.086 1.00 0.00 H new ATOM 0 HB3 MET A 1 14.286 -20.904 -0.887 1.00 0.00 H new ATOM 0 HG2 MET A 1 15.189 -22.368 0.806 1.00 0.00 H new ATOM 0 HG3 MET A 1 16.073 -23.320 -0.370 1.00 0.00 H new ATOM 0 HE1 MET A 1 16.900 -18.981 0.896 1.00 0.00 H new ATOM 0 HE2 MET A 1 15.940 -19.261 -0.576 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.384 -19.909 0.985 1.00 0.00 H new ATOM 20 N LEU A 2 13.132 -21.893 -3.788 1.00 0.00 N ATOM 21 CA LEU A 2 12.163 -21.312 -4.710 1.00 0.00 C ATOM 22 C LEU A 2 11.141 -22.361 -5.133 1.00 0.00 C ATOM 23 O LEU A 2 9.945 -22.082 -5.210 1.00 0.00 O ATOM 24 CB LEU A 2 12.875 -20.759 -5.950 1.00 0.00 C ATOM 25 CG LEU A 2 13.787 -19.583 -5.557 1.00 0.00 C ATOM 26 CD1 LEU A 2 15.227 -20.074 -5.388 1.00 0.00 C ATOM 27 CD2 LEU A 2 13.748 -18.514 -6.653 1.00 0.00 C ATOM 0 H LEU A 2 14.077 -21.981 -4.163 1.00 0.00 H new ATOM 0 HA LEU A 2 11.648 -20.497 -4.200 1.00 0.00 H new ATOM 0 HB2 LEU A 2 13.465 -21.545 -6.421 1.00 0.00 H new ATOM 0 HB3 LEU A 2 12.140 -20.429 -6.684 1.00 0.00 H new ATOM 0 HG LEU A 2 13.434 -19.160 -4.616 1.00 0.00 H new ATOM 0 HD11 LEU A 2 15.867 -19.236 -5.110 1.00 0.00 H new ATOM 0 HD12 LEU A 2 15.263 -20.833 -4.607 1.00 0.00 H new ATOM 0 HD13 LEU A 2 15.578 -20.502 -6.327 1.00 0.00 H new ATOM 0 HD21 LEU A 2 14.394 -17.682 -6.373 1.00 0.00 H new ATOM 0 HD22 LEU A 2 14.096 -18.943 -7.593 1.00 0.00 H new ATOM 0 HD23 LEU A 2 12.726 -18.155 -6.775 1.00 0.00 H new ATOM 39 N ARG A 3 11.622 -23.571 -5.402 1.00 0.00 N ATOM 40 CA ARG A 3 10.741 -24.656 -5.812 1.00 0.00 C ATOM 41 C ARG A 3 9.590 -24.803 -4.821 1.00 0.00 C ATOM 42 O ARG A 3 8.442 -25.008 -5.215 1.00 0.00 O ATOM 43 CB ARG A 3 11.529 -25.967 -5.891 1.00 0.00 C ATOM 44 CG ARG A 3 12.563 -26.012 -4.764 1.00 0.00 C ATOM 45 CD ARG A 3 13.072 -27.445 -4.590 1.00 0.00 C ATOM 46 NE ARG A 3 14.357 -27.443 -3.901 1.00 0.00 N ATOM 47 CZ ARG A 3 15.493 -27.264 -4.567 1.00 0.00 C ATOM 48 NH1 ARG A 3 15.472 -27.085 -5.860 1.00 0.00 N ATOM 49 NH2 ARG A 3 16.632 -27.266 -3.928 1.00 0.00 N ATOM 0 H ARG A 3 12.609 -23.822 -5.344 1.00 0.00 H new ATOM 0 HA ARG A 3 10.333 -24.424 -6.796 1.00 0.00 H new ATOM 0 HB2 ARG A 3 10.851 -26.816 -5.810 1.00 0.00 H new ATOM 0 HB3 ARG A 3 12.026 -26.047 -6.858 1.00 0.00 H new ATOM 0 HG2 ARG A 3 13.394 -25.345 -4.993 1.00 0.00 H new ATOM 0 HG3 ARG A 3 12.118 -25.658 -3.834 1.00 0.00 H new ATOM 0 HD2 ARG A 3 12.348 -28.029 -4.022 1.00 0.00 H new ATOM 0 HD3 ARG A 3 13.174 -27.923 -5.564 1.00 0.00 H new ATOM 0 HE ARG A 3 14.384 -27.581 -2.891 1.00 0.00 H new ATOM 0 HH11 ARG A 3 14.583 -27.082 -6.360 1.00 0.00 H new ATOM 0 HH12 ARG A 3 16.345 -26.948 -6.370 1.00 0.00 H new ATOM 0 HH21 ARG A 3 16.650 -27.405 -2.918 1.00 0.00 H new ATOM 0 HH22 ARG A 3 17.504 -27.129 -4.439 1.00 0.00 H new ATOM 63 N PHE A 4 9.905 -24.690 -3.535 1.00 0.00 N ATOM 64 CA PHE A 4 8.887 -24.806 -2.498 1.00 0.00 C ATOM 65 C PHE A 4 7.875 -23.673 -2.629 1.00 0.00 C ATOM 66 O PHE A 4 6.667 -23.894 -2.541 1.00 0.00 O ATOM 67 CB PHE A 4 9.541 -24.762 -1.112 1.00 0.00 C ATOM 68 CG PHE A 4 10.007 -26.148 -0.725 1.00 0.00 C ATOM 69 CD1 PHE A 4 9.081 -27.095 -0.269 1.00 0.00 C ATOM 70 CD2 PHE A 4 11.363 -26.485 -0.821 1.00 0.00 C ATOM 71 CE1 PHE A 4 9.511 -28.378 0.090 1.00 0.00 C ATOM 72 CE2 PHE A 4 11.792 -27.768 -0.461 1.00 0.00 C ATOM 73 CZ PHE A 4 10.866 -28.715 -0.006 1.00 0.00 C ATOM 0 H PHE A 4 10.849 -24.520 -3.188 1.00 0.00 H new ATOM 0 HA PHE A 4 8.371 -25.759 -2.617 1.00 0.00 H new ATOM 0 HB2 PHE A 4 10.385 -24.073 -1.119 1.00 0.00 H new ATOM 0 HB3 PHE A 4 8.830 -24.388 -0.375 1.00 0.00 H new ATOM 0 HD1 PHE A 4 8.035 -26.835 -0.194 1.00 0.00 H new ATOM 0 HD2 PHE A 4 12.077 -25.755 -1.173 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.797 -29.108 0.441 1.00 0.00 H new ATOM 0 HE2 PHE A 4 12.838 -28.028 -0.534 1.00 0.00 H new ATOM 0 HZ PHE A 4 11.197 -29.705 0.271 1.00 0.00 H new ATOM 83 N LEU A 5 8.375 -22.460 -2.843 1.00 0.00 N ATOM 84 CA LEU A 5 7.502 -21.301 -2.990 1.00 0.00 C ATOM 85 C LEU A 5 6.347 -21.629 -3.932 1.00 0.00 C ATOM 86 O LEU A 5 5.200 -21.262 -3.680 1.00 0.00 O ATOM 87 CB LEU A 5 8.304 -20.111 -3.536 1.00 0.00 C ATOM 88 CG LEU A 5 7.768 -18.804 -2.944 1.00 0.00 C ATOM 89 CD1 LEU A 5 8.554 -17.625 -3.520 1.00 0.00 C ATOM 90 CD2 LEU A 5 6.285 -18.650 -3.296 1.00 0.00 C ATOM 0 H LEU A 5 9.371 -22.255 -2.918 1.00 0.00 H new ATOM 0 HA LEU A 5 7.094 -21.038 -2.014 1.00 0.00 H new ATOM 0 HB2 LEU A 5 9.359 -20.227 -3.287 1.00 0.00 H new ATOM 0 HB3 LEU A 5 8.235 -20.083 -4.623 1.00 0.00 H new ATOM 0 HG LEU A 5 7.882 -18.824 -1.860 1.00 0.00 H new ATOM 0 HD11 LEU A 5 8.174 -16.694 -3.100 1.00 0.00 H new ATOM 0 HD12 LEU A 5 9.609 -17.733 -3.268 1.00 0.00 H new ATOM 0 HD13 LEU A 5 8.440 -17.607 -4.604 1.00 0.00 H new ATOM 0 HD21 LEU A 5 5.906 -17.719 -2.874 1.00 0.00 H new ATOM 0 HD22 LEU A 5 6.168 -18.631 -4.380 1.00 0.00 H new ATOM 0 HD23 LEU A 5 5.724 -19.490 -2.885 1.00 0.00 H new ATOM 102 N ASN A 6 6.661 -22.331 -5.017 1.00 0.00 N ATOM 103 CA ASN A 6 5.642 -22.714 -5.989 1.00 0.00 C ATOM 104 C ASN A 6 4.689 -23.731 -5.372 1.00 0.00 C ATOM 105 O ASN A 6 3.519 -23.813 -5.747 1.00 0.00 O ATOM 106 CB ASN A 6 6.304 -23.317 -7.230 1.00 0.00 C ATOM 107 CG ASN A 6 5.272 -23.497 -8.337 1.00 0.00 C ATOM 108 OD1 ASN A 6 4.667 -22.524 -8.787 1.00 0.00 O ATOM 109 ND2 ASN A 6 5.033 -24.691 -8.806 1.00 0.00 N ATOM 0 H ASN A 6 7.605 -22.644 -5.244 1.00 0.00 H new ATOM 0 HA ASN A 6 5.080 -21.826 -6.278 1.00 0.00 H new ATOM 0 HB2 ASN A 6 7.109 -22.668 -7.574 1.00 0.00 H new ATOM 0 HB3 ASN A 6 6.754 -24.278 -6.981 1.00 0.00 H new ATOM 0 HD21 ASN A 6 4.344 -24.819 -9.547 1.00 0.00 H new ATOM 0 HD22 ASN A 6 5.535 -25.496 -8.432 1.00 0.00 H new ATOM 116 N GLN A 7 5.206 -24.504 -4.425 1.00 0.00 N ATOM 117 CA GLN A 7 4.403 -25.519 -3.755 1.00 0.00 C ATOM 118 C GLN A 7 3.465 -24.872 -2.741 1.00 0.00 C ATOM 119 O GLN A 7 2.262 -25.133 -2.737 1.00 0.00 O ATOM 120 CB GLN A 7 5.319 -26.520 -3.043 1.00 0.00 C ATOM 121 CG GLN A 7 4.548 -27.814 -2.762 1.00 0.00 C ATOM 122 CD GLN A 7 4.454 -28.651 -4.035 1.00 0.00 C ATOM 123 OE1 GLN A 7 3.366 -29.086 -4.412 1.00 0.00 O ATOM 124 NE2 GLN A 7 5.535 -28.903 -4.721 1.00 0.00 N ATOM 0 H GLN A 7 6.173 -24.448 -4.105 1.00 0.00 H new ATOM 0 HA GLN A 7 3.807 -26.041 -4.503 1.00 0.00 H new ATOM 0 HB2 GLN A 7 6.192 -26.732 -3.660 1.00 0.00 H new ATOM 0 HB3 GLN A 7 5.685 -26.093 -2.109 1.00 0.00 H new ATOM 0 HG2 GLN A 7 5.049 -28.383 -1.979 1.00 0.00 H new ATOM 0 HG3 GLN A 7 3.548 -27.580 -2.396 1.00 0.00 H new ATOM 0 HE21 GLN A 7 6.435 -28.541 -4.406 1.00 0.00 H new ATOM 0 HE22 GLN A 7 5.480 -29.462 -5.572 1.00 0.00 H new ATOM 133 N ALA A 8 4.026 -24.027 -1.882 1.00 0.00 N ATOM 134 CA ALA A 8 3.233 -23.347 -0.867 1.00 0.00 C ATOM 135 C ALA A 8 2.203 -22.429 -1.517 1.00 0.00 C ATOM 136 O ALA A 8 1.113 -22.225 -0.983 1.00 0.00 O ATOM 137 CB ALA A 8 4.147 -22.527 0.047 1.00 0.00 C ATOM 0 H ALA A 8 5.020 -23.798 -1.869 1.00 0.00 H new ATOM 0 HA ALA A 8 2.710 -24.100 -0.277 1.00 0.00 H new ATOM 0 HB1 ALA A 8 3.547 -22.021 0.803 1.00 0.00 H new ATOM 0 HB2 ALA A 8 4.863 -23.189 0.535 1.00 0.00 H new ATOM 0 HB3 ALA A 8 4.684 -21.786 -0.545 1.00 0.00 H new ATOM 143 N SER A 9 2.554 -21.879 -2.675 1.00 0.00 N ATOM 144 CA SER A 9 1.649 -20.984 -3.387 1.00 0.00 C ATOM 145 C SER A 9 0.554 -21.779 -4.088 1.00 0.00 C ATOM 146 O SER A 9 -0.615 -21.395 -4.068 1.00 0.00 O ATOM 147 CB SER A 9 2.428 -20.164 -4.415 1.00 0.00 C ATOM 148 OG SER A 9 3.503 -19.498 -3.766 1.00 0.00 O ATOM 0 H SER A 9 3.450 -22.035 -3.137 1.00 0.00 H new ATOM 0 HA SER A 9 1.187 -20.312 -2.664 1.00 0.00 H new ATOM 0 HB2 SER A 9 2.810 -20.814 -5.202 1.00 0.00 H new ATOM 0 HB3 SER A 9 1.770 -19.438 -4.892 1.00 0.00 H new ATOM 0 HG SER A 9 4.099 -20.160 -3.358 1.00 0.00 H new ATOM 154 N GLN A 10 0.941 -22.891 -4.704 1.00 0.00 N ATOM 155 CA GLN A 10 -0.016 -23.737 -5.405 1.00 0.00 C ATOM 156 C GLN A 10 -0.990 -24.370 -4.416 1.00 0.00 C ATOM 157 O GLN A 10 -1.861 -25.154 -4.796 1.00 0.00 O ATOM 158 CB GLN A 10 0.726 -24.832 -6.180 1.00 0.00 C ATOM 159 CG GLN A 10 -0.283 -25.752 -6.887 1.00 0.00 C ATOM 160 CD GLN A 10 -0.558 -26.993 -6.042 1.00 0.00 C ATOM 161 OE1 GLN A 10 -0.277 -26.984 -4.768 1.00 0.00 O flip ATOM 162 NE2 GLN A 10 -1.042 -28.000 -6.558 1.00 0.00 N flip ATOM 0 H GLN A 10 1.904 -23.225 -4.732 1.00 0.00 H new ATOM 0 HA GLN A 10 -0.580 -23.121 -6.105 1.00 0.00 H new ATOM 0 HB2 GLN A 10 1.395 -24.381 -6.913 1.00 0.00 H new ATOM 0 HB3 GLN A 10 1.346 -25.414 -5.499 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -1.213 -25.213 -7.065 1.00 0.00 H new ATOM 0 HG3 GLN A 10 0.106 -26.047 -7.862 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -1.262 -28.007 -7.554 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -1.223 -28.827 -5.990 1.00 0.00 H new ATOM 171 N GLY A 11 -0.849 -24.001 -3.146 1.00 0.00 N ATOM 172 CA GLY A 11 -1.729 -24.513 -2.099 1.00 0.00 C ATOM 173 C GLY A 11 -2.801 -23.479 -1.778 1.00 0.00 C ATOM 174 O GLY A 11 -2.551 -22.273 -1.815 1.00 0.00 O ATOM 0 H GLY A 11 -0.135 -23.351 -2.817 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -2.194 -25.444 -2.424 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -1.151 -24.741 -1.204 1.00 0.00 H new ATOM 178 N ARG A 12 -3.997 -23.962 -1.460 1.00 0.00 N ATOM 179 CA ARG A 12 -5.109 -23.079 -1.135 1.00 0.00 C ATOM 180 C ARG A 12 -4.869 -22.368 0.192 1.00 0.00 C ATOM 181 O ARG A 12 -5.012 -21.149 0.284 1.00 0.00 O ATOM 182 CB ARG A 12 -6.410 -23.887 -1.057 1.00 0.00 C ATOM 183 CG ARG A 12 -6.894 -24.235 -2.472 1.00 0.00 C ATOM 184 CD ARG A 12 -7.731 -23.082 -3.036 1.00 0.00 C ATOM 185 NE ARG A 12 -8.835 -22.768 -2.137 1.00 0.00 N ATOM 186 CZ ARG A 12 -9.853 -23.608 -1.980 1.00 0.00 C ATOM 187 NH1 ARG A 12 -9.875 -24.737 -2.633 1.00 0.00 N ATOM 188 NH2 ARG A 12 -10.831 -23.303 -1.171 1.00 0.00 N ATOM 0 H ARG A 12 -4.220 -24.957 -1.421 1.00 0.00 H new ATOM 0 HA ARG A 12 -5.191 -22.328 -1.921 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -6.248 -24.800 -0.484 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -7.174 -23.313 -0.533 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -6.040 -24.427 -3.121 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -7.488 -25.149 -2.448 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -7.103 -22.201 -3.173 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -8.119 -23.352 -4.018 1.00 0.00 H new ATOM 0 HE ARG A 12 -8.826 -21.889 -1.620 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -9.111 -24.976 -3.265 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -10.657 -25.381 -2.512 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -10.814 -22.420 -0.660 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -11.613 -23.947 -1.050 1.00 0.00 H new ATOM 202 N GLY A 13 -4.509 -23.131 1.220 1.00 0.00 N ATOM 203 CA GLY A 13 -4.256 -22.560 2.536 1.00 0.00 C ATOM 204 C GLY A 13 -3.459 -21.271 2.417 1.00 0.00 C ATOM 205 O GLY A 13 -3.788 -20.261 3.038 1.00 0.00 O ATOM 0 H GLY A 13 -4.387 -24.142 1.166 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -5.202 -22.364 3.041 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -3.710 -23.276 3.150 1.00 0.00 H new ATOM 209 N ALA A 14 -2.411 -21.317 1.603 1.00 0.00 N ATOM 210 CA ALA A 14 -1.571 -20.147 1.393 1.00 0.00 C ATOM 211 C ALA A 14 -2.393 -19.017 0.792 1.00 0.00 C ATOM 212 O ALA A 14 -2.332 -17.877 1.254 1.00 0.00 O ATOM 213 CB ALA A 14 -0.413 -20.496 0.457 1.00 0.00 C ATOM 0 H ALA A 14 -2.125 -22.146 1.082 1.00 0.00 H new ATOM 0 HA ALA A 14 -1.170 -19.825 2.354 1.00 0.00 H new ATOM 0 HB1 ALA A 14 0.210 -19.615 0.305 1.00 0.00 H new ATOM 0 HB2 ALA A 14 0.185 -21.292 0.900 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -0.808 -20.830 -0.502 1.00 0.00 H new ATOM 219 N TRP A 15 -3.166 -19.339 -0.241 1.00 0.00 N ATOM 220 CA TRP A 15 -3.999 -18.338 -0.895 1.00 0.00 C ATOM 221 C TRP A 15 -4.964 -17.712 0.109 1.00 0.00 C ATOM 222 O TRP A 15 -5.090 -16.489 0.182 1.00 0.00 O ATOM 223 CB TRP A 15 -4.786 -18.978 -2.042 1.00 0.00 C ATOM 224 CG TRP A 15 -3.901 -19.119 -3.240 1.00 0.00 C ATOM 225 CD1 TRP A 15 -3.535 -20.295 -3.802 1.00 0.00 C ATOM 226 CD2 TRP A 15 -3.265 -18.074 -4.031 1.00 0.00 C ATOM 227 NE1 TRP A 15 -2.714 -20.037 -4.884 1.00 0.00 N ATOM 228 CE2 TRP A 15 -2.519 -18.683 -5.067 1.00 0.00 C ATOM 229 CE3 TRP A 15 -3.264 -16.669 -3.950 1.00 0.00 C ATOM 230 CZ2 TRP A 15 -1.797 -17.927 -5.990 1.00 0.00 C ATOM 231 CZ3 TRP A 15 -2.538 -15.904 -4.879 1.00 0.00 C ATOM 232 CH2 TRP A 15 -1.806 -16.532 -5.896 1.00 0.00 C ATOM 0 H TRP A 15 -3.232 -20.276 -0.639 1.00 0.00 H new ATOM 0 HA TRP A 15 -3.353 -17.557 -1.297 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -5.162 -19.955 -1.738 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -5.653 -18.365 -2.288 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -3.835 -21.275 -3.461 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -2.303 -20.759 -5.475 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -3.824 -16.176 -3.169 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -1.235 -18.416 -6.772 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -2.544 -14.826 -4.809 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -1.249 -15.939 -6.606 1.00 0.00 H new ATOM 243 N LEU A 16 -5.638 -18.555 0.885 1.00 0.00 N ATOM 244 CA LEU A 16 -6.583 -18.067 1.883 1.00 0.00 C ATOM 245 C LEU A 16 -5.867 -17.180 2.898 1.00 0.00 C ATOM 246 O LEU A 16 -6.464 -16.268 3.470 1.00 0.00 O ATOM 247 CB LEU A 16 -7.241 -19.246 2.605 1.00 0.00 C ATOM 248 CG LEU A 16 -8.048 -20.085 1.603 1.00 0.00 C ATOM 249 CD1 LEU A 16 -8.243 -21.498 2.159 1.00 0.00 C ATOM 250 CD2 LEU A 16 -9.420 -19.441 1.371 1.00 0.00 C ATOM 0 H LEU A 16 -5.549 -19.570 0.843 1.00 0.00 H new ATOM 0 HA LEU A 16 -7.351 -17.482 1.377 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -6.479 -19.864 3.080 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -7.895 -18.880 3.397 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.505 -20.132 0.659 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.816 -22.093 1.448 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -7.270 -21.963 2.321 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.782 -21.446 3.105 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -9.988 -20.041 0.659 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -9.962 -19.389 2.315 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -9.287 -18.435 0.973 1.00 0.00 H new ATOM 262 N LEU A 17 -4.586 -17.457 3.116 1.00 0.00 N ATOM 263 CA LEU A 17 -3.797 -16.681 4.068 1.00 0.00 C ATOM 264 C LEU A 17 -3.551 -15.271 3.534 1.00 0.00 C ATOM 265 O LEU A 17 -3.443 -14.317 4.305 1.00 0.00 O ATOM 266 CB LEU A 17 -2.453 -17.386 4.327 1.00 0.00 C ATOM 267 CG LEU A 17 -2.410 -17.966 5.752 1.00 0.00 C ATOM 268 CD1 LEU A 17 -2.369 -16.829 6.783 1.00 0.00 C ATOM 269 CD2 LEU A 17 -3.648 -18.845 5.997 1.00 0.00 C ATOM 0 H LEU A 17 -4.074 -18.207 2.651 1.00 0.00 H new ATOM 0 HA LEU A 17 -4.351 -16.606 5.004 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -2.309 -18.185 3.599 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -1.634 -16.680 4.191 1.00 0.00 H new ATOM 0 HG LEU A 17 -1.512 -18.574 5.858 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -2.339 -17.250 7.788 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -1.480 -16.220 6.618 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -3.259 -16.209 6.676 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -3.611 -19.252 7.007 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -4.550 -18.244 5.881 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -3.662 -19.663 5.277 1.00 0.00 H new ATOM 281 N MET A 18 -3.469 -15.144 2.213 1.00 0.00 N ATOM 282 CA MET A 18 -3.239 -13.843 1.597 1.00 0.00 C ATOM 283 C MET A 18 -4.490 -12.980 1.710 1.00 0.00 C ATOM 284 O MET A 18 -4.401 -11.760 1.842 1.00 0.00 O ATOM 285 CB MET A 18 -2.866 -14.020 0.123 1.00 0.00 C ATOM 286 CG MET A 18 -2.197 -12.744 -0.393 1.00 0.00 C ATOM 287 SD MET A 18 -0.519 -12.632 0.276 1.00 0.00 S ATOM 288 CE MET A 18 0.247 -11.836 -1.157 1.00 0.00 C ATOM 0 H MET A 18 -3.557 -15.918 1.555 1.00 0.00 H new ATOM 0 HA MET A 18 -2.418 -13.350 2.118 1.00 0.00 H new ATOM 0 HB2 MET A 18 -2.192 -14.869 0.007 1.00 0.00 H new ATOM 0 HB3 MET A 18 -3.758 -14.239 -0.465 1.00 0.00 H new ATOM 0 HG2 MET A 18 -2.166 -12.751 -1.483 1.00 0.00 H new ATOM 0 HG3 MET A 18 -2.778 -11.870 -0.097 1.00 0.00 H new ATOM 0 HE1 MET A 18 1.064 -11.195 -0.824 1.00 0.00 H new ATOM 0 HE2 MET A 18 0.636 -12.598 -1.832 1.00 0.00 H new ATOM 0 HE3 MET A 18 -0.496 -11.234 -1.679 1.00 0.00 H new ATOM 298 N ALA A 19 -5.654 -13.618 1.651 1.00 0.00 N ATOM 299 CA ALA A 19 -6.916 -12.896 1.741 1.00 0.00 C ATOM 300 C ALA A 19 -7.087 -12.282 3.124 1.00 0.00 C ATOM 301 O ALA A 19 -7.386 -11.095 3.253 1.00 0.00 O ATOM 302 CB ALA A 19 -8.080 -13.846 1.455 1.00 0.00 C ATOM 0 H ALA A 19 -5.749 -14.628 1.542 1.00 0.00 H new ATOM 0 HA ALA A 19 -6.908 -12.095 1.001 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -9.021 -13.300 1.524 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -7.974 -14.260 0.452 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -8.076 -14.656 2.185 1.00 0.00 H new ATOM 308 N PHE A 20 -6.901 -13.097 4.157 1.00 0.00 N ATOM 309 CA PHE A 20 -7.044 -12.625 5.528 1.00 0.00 C ATOM 310 C PHE A 20 -6.189 -11.385 5.762 1.00 0.00 C ATOM 311 O PHE A 20 -6.676 -10.369 6.256 1.00 0.00 O ATOM 312 CB PHE A 20 -6.625 -13.725 6.505 1.00 0.00 C ATOM 313 CG PHE A 20 -7.072 -13.356 7.901 1.00 0.00 C ATOM 314 CD1 PHE A 20 -8.436 -13.315 8.209 1.00 0.00 C ATOM 315 CD2 PHE A 20 -6.122 -13.053 8.885 1.00 0.00 C ATOM 316 CE1 PHE A 20 -8.851 -12.971 9.501 1.00 0.00 C ATOM 317 CE2 PHE A 20 -6.537 -12.710 10.177 1.00 0.00 C ATOM 318 CZ PHE A 20 -7.903 -12.669 10.485 1.00 0.00 C ATOM 0 H PHE A 20 -6.652 -14.082 4.071 1.00 0.00 H new ATOM 0 HA PHE A 20 -8.090 -12.368 5.695 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -7.067 -14.676 6.210 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -5.543 -13.855 6.481 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -9.168 -13.549 7.450 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -5.069 -13.084 8.647 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -9.904 -12.939 9.739 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -5.805 -12.477 10.936 1.00 0.00 H new ATOM 0 HZ PHE A 20 -8.224 -12.404 11.482 1.00 0.00 H new ATOM 328 N THR A 21 -4.912 -11.476 5.407 1.00 0.00 N ATOM 329 CA THR A 21 -4.002 -10.352 5.587 1.00 0.00 C ATOM 330 C THR A 21 -4.587 -9.084 4.973 1.00 0.00 C ATOM 331 O THR A 21 -4.631 -8.036 5.615 1.00 0.00 O ATOM 332 CB THR A 21 -2.650 -10.665 4.939 1.00 0.00 C ATOM 333 OG1 THR A 21 -2.863 -11.317 3.695 1.00 0.00 O ATOM 334 CG2 THR A 21 -1.838 -11.577 5.861 1.00 0.00 C ATOM 0 H THR A 21 -4.487 -12.308 4.997 1.00 0.00 H new ATOM 0 HA THR A 21 -3.861 -10.189 6.656 1.00 0.00 H new ATOM 0 HB THR A 21 -2.102 -9.737 4.775 1.00 0.00 H new ATOM 0 HG1 THR A 21 -2.421 -10.812 2.981 1.00 0.00 H new ATOM 0 HG21 THR A 21 -0.876 -11.799 5.398 1.00 0.00 H new ATOM 0 HG22 THR A 21 -1.675 -11.077 6.816 1.00 0.00 H new ATOM 0 HG23 THR A 21 -2.384 -12.506 6.027 1.00 0.00 H new ATOM 342 N ALA A 22 -5.037 -9.187 3.726 1.00 0.00 N ATOM 343 CA ALA A 22 -5.617 -8.041 3.037 1.00 0.00 C ATOM 344 C ALA A 22 -6.762 -7.447 3.851 1.00 0.00 C ATOM 345 O ALA A 22 -6.890 -6.228 3.966 1.00 0.00 O ATOM 346 CB ALA A 22 -6.133 -8.463 1.660 1.00 0.00 C ATOM 0 H ALA A 22 -5.011 -10.046 3.176 1.00 0.00 H new ATOM 0 HA ALA A 22 -4.841 -7.285 2.917 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.565 -7.600 1.153 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -5.307 -8.857 1.067 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -6.895 -9.233 1.777 1.00 0.00 H new ATOM 352 N LEU A 23 -7.594 -8.317 4.415 1.00 0.00 N ATOM 353 CA LEU A 23 -8.725 -7.865 5.216 1.00 0.00 C ATOM 354 C LEU A 23 -8.240 -7.245 6.522 1.00 0.00 C ATOM 355 O LEU A 23 -8.796 -6.254 6.996 1.00 0.00 O ATOM 356 CB LEU A 23 -9.655 -9.045 5.520 1.00 0.00 C ATOM 357 CG LEU A 23 -11.034 -8.524 5.949 1.00 0.00 C ATOM 358 CD1 LEU A 23 -11.916 -8.312 4.714 1.00 0.00 C ATOM 359 CD2 LEU A 23 -11.703 -9.545 6.875 1.00 0.00 C ATOM 0 H LEU A 23 -7.508 -9.330 4.333 1.00 0.00 H new ATOM 0 HA LEU A 23 -9.271 -7.110 4.650 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.754 -9.678 4.638 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -9.228 -9.662 6.310 1.00 0.00 H new ATOM 0 HG LEU A 23 -10.910 -7.577 6.474 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -12.893 -7.942 5.024 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -11.446 -7.585 4.052 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -12.037 -9.258 4.186 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -12.682 -9.174 7.179 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -11.821 -10.492 6.348 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -11.082 -9.697 7.758 1.00 0.00 H new ATOM 371 N ALA A 24 -7.197 -7.834 7.097 1.00 0.00 N ATOM 372 CA ALA A 24 -6.639 -7.335 8.349 1.00 0.00 C ATOM 373 C ALA A 24 -6.325 -5.846 8.240 1.00 0.00 C ATOM 374 O ALA A 24 -6.471 -5.099 9.207 1.00 0.00 O ATOM 375 CB ALA A 24 -5.361 -8.102 8.691 1.00 0.00 C ATOM 0 H ALA A 24 -6.723 -8.654 6.718 1.00 0.00 H new ATOM 0 HA ALA A 24 -7.376 -7.483 9.138 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -4.949 -7.724 9.627 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -5.590 -9.162 8.797 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -4.631 -7.967 7.893 1.00 0.00 H new ATOM 381 N LEU A 25 -5.893 -5.423 7.057 1.00 0.00 N ATOM 382 CA LEU A 25 -5.559 -4.022 6.833 1.00 0.00 C ATOM 383 C LEU A 25 -6.826 -3.179 6.729 1.00 0.00 C ATOM 384 O LEU A 25 -6.892 -2.073 7.263 1.00 0.00 O ATOM 385 CB LEU A 25 -4.741 -3.880 5.548 1.00 0.00 C ATOM 386 CG LEU A 25 -3.545 -4.835 5.592 1.00 0.00 C ATOM 387 CD1 LEU A 25 -2.821 -4.806 4.244 1.00 0.00 C ATOM 388 CD2 LEU A 25 -2.579 -4.404 6.702 1.00 0.00 C ATOM 0 H LEU A 25 -5.767 -6.026 6.244 1.00 0.00 H new ATOM 0 HA LEU A 25 -4.970 -3.668 7.679 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -5.364 -4.102 4.682 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -4.395 -2.852 5.437 1.00 0.00 H new ATOM 0 HG LEU A 25 -3.897 -5.846 5.795 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -1.969 -5.485 4.274 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -3.507 -5.118 3.456 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -2.471 -3.794 4.041 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -1.729 -5.086 6.730 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -2.226 -3.392 6.504 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -3.094 -4.427 7.662 1.00 0.00 H new ATOM 400 N GLU A 26 -7.829 -3.710 6.037 1.00 0.00 N ATOM 401 CA GLU A 26 -9.089 -2.996 5.868 1.00 0.00 C ATOM 402 C GLU A 26 -9.820 -2.866 7.201 1.00 0.00 C ATOM 403 O GLU A 26 -10.160 -1.762 7.627 1.00 0.00 O ATOM 404 CB GLU A 26 -9.977 -3.733 4.864 1.00 0.00 C ATOM 405 CG GLU A 26 -9.367 -3.621 3.464 1.00 0.00 C ATOM 406 CD GLU A 26 -10.323 -4.205 2.428 1.00 0.00 C ATOM 407 OE1 GLU A 26 -11.496 -4.327 2.738 1.00 0.00 O ATOM 408 OE2 GLU A 26 -9.866 -4.521 1.343 1.00 0.00 O ATOM 0 H GLU A 26 -7.795 -4.625 5.587 1.00 0.00 H new ATOM 0 HA GLU A 26 -8.869 -1.997 5.492 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.073 -4.781 5.148 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -10.981 -3.308 4.870 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -9.160 -2.576 3.231 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -8.414 -4.150 3.430 1.00 0.00 H new ATOM 415 N LEU A 27 -10.061 -3.997 7.855 1.00 0.00 N ATOM 416 CA LEU A 27 -10.756 -3.994 9.139 1.00 0.00 C ATOM 417 C LEU A 27 -10.050 -3.071 10.130 1.00 0.00 C ATOM 418 O LEU A 27 -10.669 -2.186 10.721 1.00 0.00 O ATOM 419 CB LEU A 27 -10.808 -5.419 9.706 1.00 0.00 C ATOM 420 CG LEU A 27 -12.062 -5.592 10.570 1.00 0.00 C ATOM 421 CD1 LEU A 27 -12.084 -7.002 11.161 1.00 0.00 C ATOM 422 CD2 LEU A 27 -12.050 -4.562 11.705 1.00 0.00 C ATOM 0 H LEU A 27 -9.788 -4.921 7.521 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.771 -3.628 8.983 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -10.814 -6.144 8.892 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -9.916 -5.616 10.301 1.00 0.00 H new ATOM 0 HG LEU A 27 -12.949 -5.442 9.954 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -12.976 -7.125 11.776 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -12.095 -7.735 10.354 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -11.196 -7.153 11.775 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -12.942 -4.686 12.319 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -11.163 -4.709 12.321 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -12.036 -3.557 11.284 1.00 0.00 H new ATOM 434 N THR A 28 -8.752 -3.289 10.310 1.00 0.00 N ATOM 435 CA THR A 28 -7.968 -2.480 11.237 1.00 0.00 C ATOM 436 C THR A 28 -8.204 -0.991 11.002 1.00 0.00 C ATOM 437 O THR A 28 -8.387 -0.228 11.952 1.00 0.00 O ATOM 438 CB THR A 28 -6.478 -2.793 11.068 1.00 0.00 C ATOM 439 OG1 THR A 28 -6.151 -2.794 9.686 1.00 0.00 O ATOM 440 CG2 THR A 28 -6.168 -4.166 11.668 1.00 0.00 C ATOM 0 H THR A 28 -8.222 -4.016 9.829 1.00 0.00 H new ATOM 0 HA THR A 28 -8.284 -2.725 12.251 1.00 0.00 H new ATOM 0 HB THR A 28 -5.888 -2.035 11.583 1.00 0.00 H new ATOM 0 HG1 THR A 28 -6.446 -3.636 9.281 1.00 0.00 H new ATOM 0 HG21 THR A 28 -5.107 -4.385 11.546 1.00 0.00 H new ATOM 0 HG22 THR A 28 -6.419 -4.164 12.729 1.00 0.00 H new ATOM 0 HG23 THR A 28 -6.757 -4.928 11.157 1.00 0.00 H new ATOM 448 N ALA A 29 -8.192 -0.577 9.740 1.00 0.00 N ATOM 449 CA ALA A 29 -8.401 0.827 9.406 1.00 0.00 C ATOM 450 C ALA A 29 -9.857 1.231 9.622 1.00 0.00 C ATOM 451 O ALA A 29 -10.140 2.303 10.160 1.00 0.00 O ATOM 452 CB ALA A 29 -8.003 1.083 7.949 1.00 0.00 C ATOM 0 H ALA A 29 -8.041 -1.188 8.937 1.00 0.00 H new ATOM 0 HA ALA A 29 -7.776 1.430 10.065 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -8.162 2.134 7.708 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -6.951 0.834 7.810 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.612 0.463 7.291 1.00 0.00 H new ATOM 458 N LEU A 30 -10.778 0.374 9.197 1.00 0.00 N ATOM 459 CA LEU A 30 -12.202 0.652 9.342 1.00 0.00 C ATOM 460 C LEU A 30 -12.542 0.977 10.795 1.00 0.00 C ATOM 461 O LEU A 30 -13.572 1.588 11.077 1.00 0.00 O ATOM 462 CB LEU A 30 -13.018 -0.561 8.871 1.00 0.00 C ATOM 463 CG LEU A 30 -14.248 -0.093 8.086 1.00 0.00 C ATOM 464 CD1 LEU A 30 -15.019 -1.312 7.574 1.00 0.00 C ATOM 465 CD2 LEU A 30 -15.154 0.739 8.997 1.00 0.00 C ATOM 0 H LEU A 30 -10.565 -0.518 8.750 1.00 0.00 H new ATOM 0 HA LEU A 30 -12.453 1.517 8.728 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -12.400 -1.204 8.245 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -13.329 -1.156 9.730 1.00 0.00 H new ATOM 0 HG LEU A 30 -13.928 0.517 7.241 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -15.894 -0.981 7.015 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -14.375 -1.903 6.922 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -15.338 -1.922 8.419 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -16.028 1.071 8.436 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -15.475 0.132 9.844 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -14.605 1.608 9.361 1.00 0.00 H new ATOM 477 N TRP A 31 -11.673 0.566 11.714 1.00 0.00 N ATOM 478 CA TRP A 31 -11.894 0.816 13.134 1.00 0.00 C ATOM 479 C TRP A 31 -11.234 2.124 13.556 1.00 0.00 C ATOM 480 O TRP A 31 -11.795 2.885 14.344 1.00 0.00 O ATOM 481 CB TRP A 31 -11.323 -0.345 13.958 1.00 0.00 C ATOM 482 CG TRP A 31 -11.986 -0.387 15.298 1.00 0.00 C ATOM 483 CD1 TRP A 31 -11.351 -0.235 16.483 1.00 0.00 C ATOM 484 CD2 TRP A 31 -13.394 -0.594 15.611 1.00 0.00 C ATOM 485 NE1 TRP A 31 -12.280 -0.333 17.503 1.00 0.00 N ATOM 486 CE2 TRP A 31 -13.553 -0.554 17.017 1.00 0.00 C ATOM 487 CE3 TRP A 31 -14.537 -0.810 14.821 1.00 0.00 C ATOM 488 CZ2 TRP A 31 -14.802 -0.723 17.616 1.00 0.00 C ATOM 489 CZ3 TRP A 31 -15.795 -0.979 15.420 1.00 0.00 C ATOM 490 CH2 TRP A 31 -15.928 -0.936 16.815 1.00 0.00 C ATOM 0 H TRP A 31 -10.813 0.061 11.502 1.00 0.00 H new ATOM 0 HA TRP A 31 -12.966 0.895 13.313 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -11.481 -1.288 13.434 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -10.246 -0.223 14.078 1.00 0.00 H new ATOM 0 HD1 TRP A 31 -10.292 -0.065 16.611 1.00 0.00 H new ATOM 0 HE1 TRP A 31 -12.052 -0.252 18.494 1.00 0.00 H new ATOM 0 HE3 TRP A 31 -14.446 -0.846 13.745 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 -14.898 -0.689 18.691 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 -16.666 -1.143 14.803 1.00 0.00 H new ATOM 0 HH2 TRP A 31 -16.899 -1.067 17.270 1.00 0.00 H new ATOM 501 N PHE A 32 -10.044 2.382 13.024 1.00 0.00 N ATOM 502 CA PHE A 32 -9.325 3.607 13.356 1.00 0.00 C ATOM 503 C PHE A 32 -10.254 4.811 13.217 1.00 0.00 C ATOM 504 O PHE A 32 -10.195 5.748 14.011 1.00 0.00 O ATOM 505 CB PHE A 32 -8.111 3.771 12.426 1.00 0.00 C ATOM 506 CG PHE A 32 -6.845 3.372 13.153 1.00 0.00 C ATOM 507 CD1 PHE A 32 -6.329 4.196 14.162 1.00 0.00 C ATOM 508 CD2 PHE A 32 -6.188 2.183 12.816 1.00 0.00 C ATOM 509 CE1 PHE A 32 -5.156 3.829 14.832 1.00 0.00 C ATOM 510 CE2 PHE A 32 -5.015 1.816 13.487 1.00 0.00 C ATOM 511 CZ PHE A 32 -4.499 2.639 14.495 1.00 0.00 C ATOM 0 H PHE A 32 -9.561 1.767 12.369 1.00 0.00 H new ATOM 0 HA PHE A 32 -8.977 3.545 14.387 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -8.239 3.155 11.536 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -8.037 4.805 12.090 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -6.836 5.113 14.423 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -6.586 1.548 12.038 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -4.757 4.464 15.609 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -4.509 0.898 13.227 1.00 0.00 H new ATOM 0 HZ PHE A 32 -3.594 2.356 15.013 1.00 0.00 H new ATOM 521 N GLN A 33 -11.109 4.774 12.200 1.00 0.00 N ATOM 522 CA GLN A 33 -12.047 5.868 11.965 1.00 0.00 C ATOM 523 C GLN A 33 -13.105 5.918 13.068 1.00 0.00 C ATOM 524 O GLN A 33 -13.513 6.994 13.503 1.00 0.00 O ATOM 525 CB GLN A 33 -12.724 5.685 10.599 1.00 0.00 C ATOM 526 CG GLN A 33 -14.072 6.417 10.575 1.00 0.00 C ATOM 527 CD GLN A 33 -14.511 6.658 9.134 1.00 0.00 C ATOM 528 OE1 GLN A 33 -14.593 7.804 8.693 1.00 0.00 O ATOM 529 NE2 GLN A 33 -14.800 5.640 8.372 1.00 0.00 N ATOM 0 H GLN A 33 -11.173 4.007 11.531 1.00 0.00 H new ATOM 0 HA GLN A 33 -11.495 6.808 11.973 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -12.078 6.071 9.810 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -12.874 4.624 10.398 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -14.824 5.827 11.099 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -13.988 7.368 11.102 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -14.731 4.691 8.740 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -15.095 5.792 7.408 1.00 0.00 H new ATOM 538 N HIS A 34 -13.547 4.745 13.509 1.00 0.00 N ATOM 539 CA HIS A 34 -14.565 4.665 14.555 1.00 0.00 C ATOM 540 C HIS A 34 -13.944 4.852 15.937 1.00 0.00 C ATOM 541 O HIS A 34 -14.654 4.909 16.940 1.00 0.00 O ATOM 542 CB HIS A 34 -15.275 3.311 14.493 1.00 0.00 C ATOM 543 CG HIS A 34 -16.564 3.384 15.266 1.00 0.00 C ATOM 544 ND1 HIS A 34 -17.473 4.416 15.090 1.00 0.00 N ATOM 545 CD2 HIS A 34 -17.112 2.562 16.220 1.00 0.00 C ATOM 546 CE1 HIS A 34 -18.509 4.191 15.919 1.00 0.00 C ATOM 547 NE2 HIS A 34 -18.339 3.074 16.630 1.00 0.00 N ATOM 0 H HIS A 34 -13.221 3.843 13.163 1.00 0.00 H new ATOM 0 HA HIS A 34 -15.287 5.464 14.387 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -15.475 3.041 13.456 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -14.634 2.533 14.907 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -16.659 1.656 16.595 1.00 0.00 H new ATOM 0 HE1 HIS A 34 -19.372 4.835 15.999 1.00 0.00 H new ATOM 0 HE2 HIS A 34 -18.973 2.680 17.325 1.00 0.00 H new ATOM 556 N VAL A 35 -12.617 4.942 15.983 1.00 0.00 N ATOM 557 CA VAL A 35 -11.915 5.117 17.253 1.00 0.00 C ATOM 558 C VAL A 35 -11.327 6.522 17.361 1.00 0.00 C ATOM 559 O VAL A 35 -11.470 7.186 18.387 1.00 0.00 O ATOM 560 CB VAL A 35 -10.794 4.081 17.370 1.00 0.00 C ATOM 561 CG1 VAL A 35 -9.919 4.403 18.585 1.00 0.00 C ATOM 562 CG2 VAL A 35 -11.406 2.689 17.542 1.00 0.00 C ATOM 0 H VAL A 35 -12.010 4.897 15.164 1.00 0.00 H new ATOM 0 HA VAL A 35 -12.630 4.978 18.064 1.00 0.00 H new ATOM 0 HB VAL A 35 -10.184 4.106 16.467 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -9.122 3.664 18.666 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -9.483 5.395 18.467 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -10.528 4.380 19.489 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -10.610 1.949 17.626 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -12.016 2.669 18.445 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -12.029 2.456 16.678 1.00 0.00 H new ATOM 572 N MET A 36 -10.660 6.966 16.299 1.00 0.00 N ATOM 573 CA MET A 36 -10.045 8.293 16.292 1.00 0.00 C ATOM 574 C MET A 36 -10.911 9.292 15.525 1.00 0.00 C ATOM 575 O MET A 36 -10.486 10.415 15.257 1.00 0.00 O ATOM 576 CB MET A 36 -8.654 8.215 15.651 1.00 0.00 C ATOM 577 CG MET A 36 -7.638 7.734 16.688 1.00 0.00 C ATOM 578 SD MET A 36 -6.084 7.313 15.861 1.00 0.00 S ATOM 579 CE MET A 36 -5.038 7.306 17.338 1.00 0.00 C ATOM 0 H MET A 36 -10.531 6.433 15.439 1.00 0.00 H new ATOM 0 HA MET A 36 -9.955 8.636 17.323 1.00 0.00 H new ATOM 0 HB2 MET A 36 -8.672 7.533 14.801 1.00 0.00 H new ATOM 0 HB3 MET A 36 -8.363 9.193 15.269 1.00 0.00 H new ATOM 0 HG2 MET A 36 -7.467 8.511 17.433 1.00 0.00 H new ATOM 0 HG3 MET A 36 -8.027 6.865 17.218 1.00 0.00 H new ATOM 0 HE1 MET A 36 -4.351 8.151 17.301 1.00 0.00 H new ATOM 0 HE2 MET A 36 -5.663 7.386 18.227 1.00 0.00 H new ATOM 0 HE3 MET A 36 -4.469 6.377 17.377 1.00 0.00 H new ATOM 589 N LEU A 37 -12.127 8.881 15.184 1.00 0.00 N ATOM 590 CA LEU A 37 -13.042 9.756 14.456 1.00 0.00 C ATOM 591 C LEU A 37 -12.358 10.347 13.224 1.00 0.00 C ATOM 592 O LEU A 37 -12.511 11.532 12.927 1.00 0.00 O ATOM 593 CB LEU A 37 -13.525 10.885 15.382 1.00 0.00 C ATOM 594 CG LEU A 37 -14.993 11.214 15.092 1.00 0.00 C ATOM 595 CD1 LEU A 37 -15.487 12.266 16.088 1.00 0.00 C ATOM 596 CD2 LEU A 37 -15.125 11.762 13.670 1.00 0.00 C ATOM 0 H LEU A 37 -12.501 7.956 15.397 1.00 0.00 H new ATOM 0 HA LEU A 37 -13.898 9.168 14.125 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -13.411 10.585 16.424 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -12.910 11.773 15.237 1.00 0.00 H new ATOM 0 HG LEU A 37 -15.592 10.308 15.190 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -16.531 12.500 15.882 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -15.396 11.878 17.102 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -14.886 13.170 15.990 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -16.170 11.995 13.466 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -14.525 12.667 13.572 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -14.774 11.015 12.958 1.00 0.00 H new ATOM 608 N LEU A 38 -11.608 9.515 12.507 1.00 0.00 N ATOM 609 CA LEU A 38 -10.913 9.971 11.307 1.00 0.00 C ATOM 610 C LEU A 38 -11.826 9.842 10.091 1.00 0.00 C ATOM 611 O LEU A 38 -12.744 9.023 10.079 1.00 0.00 O ATOM 612 CB LEU A 38 -9.641 9.148 11.092 1.00 0.00 C ATOM 613 CG LEU A 38 -8.796 9.161 12.371 1.00 0.00 C ATOM 614 CD1 LEU A 38 -7.760 8.036 12.311 1.00 0.00 C ATOM 615 CD2 LEU A 38 -8.076 10.508 12.505 1.00 0.00 C ATOM 0 H LEU A 38 -11.466 8.530 12.733 1.00 0.00 H new ATOM 0 HA LEU A 38 -10.641 11.018 11.436 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -9.900 8.123 10.826 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -9.067 9.558 10.261 1.00 0.00 H new ATOM 0 HG LEU A 38 -9.448 9.013 13.232 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -7.159 8.046 13.221 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -8.270 7.076 12.223 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -7.112 8.184 11.447 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -7.477 10.511 13.416 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -7.427 10.661 11.643 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -8.812 11.311 12.552 1.00 0.00 H new ATOM 627 N LYS A 39 -11.580 10.665 9.074 1.00 0.00 N ATOM 628 CA LYS A 39 -12.399 10.642 7.863 1.00 0.00 C ATOM 629 C LYS A 39 -11.542 10.342 6.631 1.00 0.00 C ATOM 630 O LYS A 39 -10.414 10.822 6.521 1.00 0.00 O ATOM 631 CB LYS A 39 -13.093 11.994 7.684 1.00 0.00 C ATOM 632 CG LYS A 39 -12.128 13.117 8.070 1.00 0.00 C ATOM 633 CD LYS A 39 -12.763 14.472 7.747 1.00 0.00 C ATOM 634 CE LYS A 39 -11.995 15.584 8.466 1.00 0.00 C ATOM 635 NZ LYS A 39 -12.273 16.889 7.805 1.00 0.00 N ATOM 0 H LYS A 39 -10.826 11.352 9.063 1.00 0.00 H new ATOM 0 HA LYS A 39 -13.145 9.855 7.968 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -13.415 12.116 6.650 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -13.988 12.040 8.304 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -11.892 13.058 9.133 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -11.189 13.006 7.528 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -12.749 14.644 6.671 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -13.808 14.479 8.057 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -12.291 15.625 9.514 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -10.926 15.374 8.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -11.751 17.644 8.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -11.970 16.846 6.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -13.293 17.090 7.848 1.00 0.00 H new ATOM 649 N PRO A 40 -12.055 9.565 5.704 1.00 0.00 N ATOM 650 CA PRO A 40 -11.319 9.207 4.455 1.00 0.00 C ATOM 651 C PRO A 40 -11.344 10.334 3.425 1.00 0.00 C ATOM 652 O PRO A 40 -12.058 11.323 3.586 1.00 0.00 O ATOM 653 CB PRO A 40 -12.088 7.991 3.936 1.00 0.00 C ATOM 654 CG PRO A 40 -13.490 8.204 4.401 1.00 0.00 C ATOM 655 CD PRO A 40 -13.390 8.939 5.742 1.00 0.00 C ATOM 0 HA PRO A 40 -10.262 9.016 4.640 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -12.037 7.924 2.849 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -11.676 7.063 4.332 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -14.055 8.791 3.677 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -14.010 7.253 4.516 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -14.178 9.684 5.849 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -13.485 8.252 6.583 1.00 0.00 H new ATOM 663 N CYS A 41 -10.567 10.165 2.359 1.00 0.00 N ATOM 664 CA CYS A 41 -10.511 11.158 1.291 1.00 0.00 C ATOM 665 C CYS A 41 -10.655 10.476 -0.065 1.00 0.00 C ATOM 666 O CYS A 41 -10.905 9.274 -0.140 1.00 0.00 O ATOM 667 CB CYS A 41 -9.188 11.923 1.342 1.00 0.00 C ATOM 668 SG CYS A 41 -9.355 13.464 0.408 1.00 0.00 S ATOM 0 H CYS A 41 -9.969 9.352 2.212 1.00 0.00 H new ATOM 0 HA CYS A 41 -11.332 11.861 1.430 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -8.918 12.138 2.376 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -8.386 11.315 0.923 1.00 0.00 H new ATOM 673 N VAL A 42 -10.491 11.249 -1.132 1.00 0.00 N ATOM 674 CA VAL A 42 -10.603 10.707 -2.480 1.00 0.00 C ATOM 675 C VAL A 42 -9.504 9.681 -2.743 1.00 0.00 C ATOM 676 O VAL A 42 -9.771 8.583 -3.230 1.00 0.00 O ATOM 677 CB VAL A 42 -10.501 11.839 -3.504 1.00 0.00 C ATOM 678 CG1 VAL A 42 -10.861 11.308 -4.893 1.00 0.00 C ATOM 679 CG2 VAL A 42 -11.471 12.959 -3.122 1.00 0.00 C ATOM 0 H VAL A 42 -10.281 12.246 -1.091 1.00 0.00 H new ATOM 0 HA VAL A 42 -11.571 10.214 -2.573 1.00 0.00 H new ATOM 0 HB VAL A 42 -9.482 12.226 -3.516 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -10.788 12.116 -5.621 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -10.172 10.509 -5.167 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -11.880 10.921 -4.882 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -11.400 13.766 -3.851 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -12.489 12.570 -3.110 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -11.216 13.339 -2.133 1.00 0.00 H new ATOM 689 N LEU A 43 -8.267 10.051 -2.424 1.00 0.00 N ATOM 690 CA LEU A 43 -7.128 9.163 -2.638 1.00 0.00 C ATOM 691 C LEU A 43 -7.281 7.866 -1.845 1.00 0.00 C ATOM 692 O LEU A 43 -7.075 6.775 -2.378 1.00 0.00 O ATOM 693 CB LEU A 43 -5.831 9.870 -2.222 1.00 0.00 C ATOM 694 CG LEU A 43 -5.252 10.662 -3.405 1.00 0.00 C ATOM 695 CD1 LEU A 43 -4.710 9.700 -4.473 1.00 0.00 C ATOM 696 CD2 LEU A 43 -6.344 11.549 -4.017 1.00 0.00 C ATOM 0 H LEU A 43 -8.028 10.956 -2.018 1.00 0.00 H new ATOM 0 HA LEU A 43 -7.088 8.914 -3.698 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -6.027 10.542 -1.387 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -5.103 9.136 -1.876 1.00 0.00 H new ATOM 0 HG LEU A 43 -4.435 11.288 -3.045 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -4.303 10.273 -5.306 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.924 9.081 -4.040 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -5.518 9.062 -4.832 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -5.930 12.109 -4.855 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -7.166 10.925 -4.368 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -6.713 12.244 -3.263 1.00 0.00 H new ATOM 708 N SER A 44 -7.643 7.993 -0.571 1.00 0.00 N ATOM 709 CA SER A 44 -7.815 6.822 0.282 1.00 0.00 C ATOM 710 C SER A 44 -8.672 5.776 -0.421 1.00 0.00 C ATOM 711 O SER A 44 -8.355 4.587 -0.403 1.00 0.00 O ATOM 712 CB SER A 44 -8.478 7.226 1.600 1.00 0.00 C ATOM 713 OG SER A 44 -9.732 7.836 1.326 1.00 0.00 O ATOM 0 H SER A 44 -7.821 8.886 -0.111 1.00 0.00 H new ATOM 0 HA SER A 44 -6.833 6.396 0.488 1.00 0.00 H new ATOM 0 HB2 SER A 44 -8.617 6.350 2.234 1.00 0.00 H new ATOM 0 HB3 SER A 44 -7.836 7.917 2.147 1.00 0.00 H new ATOM 0 HG SER A 44 -9.694 8.285 0.456 1.00 0.00 H new ATOM 719 N ILE A 45 -9.753 6.227 -1.046 1.00 0.00 N ATOM 720 CA ILE A 45 -10.640 5.317 -1.759 1.00 0.00 C ATOM 721 C ILE A 45 -9.881 4.631 -2.889 1.00 0.00 C ATOM 722 O ILE A 45 -10.010 3.425 -3.095 1.00 0.00 O ATOM 723 CB ILE A 45 -11.830 6.094 -2.332 1.00 0.00 C ATOM 724 CG1 ILE A 45 -12.678 6.667 -1.185 1.00 0.00 C ATOM 725 CG2 ILE A 45 -12.688 5.168 -3.196 1.00 0.00 C ATOM 726 CD1 ILE A 45 -13.186 5.543 -0.273 1.00 0.00 C ATOM 0 H ILE A 45 -10.034 7.207 -1.074 1.00 0.00 H new ATOM 0 HA ILE A 45 -11.006 4.561 -1.065 1.00 0.00 H new ATOM 0 HB ILE A 45 -11.458 6.913 -2.947 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -12.084 7.373 -0.604 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -13.523 7.221 -1.593 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -13.532 5.726 -3.600 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -12.087 4.775 -4.016 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -13.057 4.342 -2.588 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -13.784 5.970 0.532 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -13.799 4.853 -0.853 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -12.337 5.007 0.151 1.00 0.00 H new ATOM 738 N TYR A 46 -9.087 5.410 -3.614 1.00 0.00 N ATOM 739 CA TYR A 46 -8.310 4.855 -4.716 1.00 0.00 C ATOM 740 C TYR A 46 -7.445 3.700 -4.220 1.00 0.00 C ATOM 741 O TYR A 46 -7.427 2.625 -4.820 1.00 0.00 O ATOM 742 CB TYR A 46 -7.419 5.933 -5.337 1.00 0.00 C ATOM 743 CG TYR A 46 -6.843 5.414 -6.633 1.00 0.00 C ATOM 744 CD1 TYR A 46 -5.738 4.555 -6.613 1.00 0.00 C ATOM 745 CD2 TYR A 46 -7.415 5.790 -7.855 1.00 0.00 C ATOM 746 CE1 TYR A 46 -5.205 4.071 -7.814 1.00 0.00 C ATOM 747 CE2 TYR A 46 -6.884 5.304 -9.055 1.00 0.00 C ATOM 748 CZ TYR A 46 -5.778 4.445 -9.035 1.00 0.00 C ATOM 749 OH TYR A 46 -5.253 3.966 -10.219 1.00 0.00 O ATOM 0 H TYR A 46 -8.965 6.411 -3.463 1.00 0.00 H new ATOM 0 HA TYR A 46 -9.002 4.487 -5.474 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -7.997 6.839 -5.519 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -6.617 6.199 -4.649 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -5.296 4.265 -5.671 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -8.266 6.455 -7.871 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -4.352 3.409 -7.798 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -7.327 5.591 -9.997 1.00 0.00 H new ATOM 0 HH TYR A 46 -5.966 3.894 -10.888 1.00 0.00 H new ATOM 759 N GLU A 47 -6.734 3.927 -3.119 1.00 0.00 N ATOM 760 CA GLU A 47 -5.876 2.896 -2.551 1.00 0.00 C ATOM 761 C GLU A 47 -6.705 1.679 -2.152 1.00 0.00 C ATOM 762 O GLU A 47 -6.310 0.539 -2.395 1.00 0.00 O ATOM 763 CB GLU A 47 -5.138 3.444 -1.323 1.00 0.00 C ATOM 764 CG GLU A 47 -3.893 4.214 -1.770 1.00 0.00 C ATOM 765 CD GLU A 47 -4.295 5.381 -2.664 1.00 0.00 C ATOM 766 OE1 GLU A 47 -4.759 6.377 -2.133 1.00 0.00 O ATOM 767 OE2 GLU A 47 -4.129 5.264 -3.867 1.00 0.00 O ATOM 0 H GLU A 47 -6.736 4.809 -2.607 1.00 0.00 H new ATOM 0 HA GLU A 47 -5.147 2.597 -3.304 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -5.797 4.099 -0.753 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -4.853 2.625 -0.663 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -3.351 4.582 -0.899 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.218 3.549 -2.308 1.00 0.00 H new ATOM 774 N ARG A 48 -7.858 1.931 -1.541 1.00 0.00 N ATOM 775 CA ARG A 48 -8.737 0.849 -1.116 1.00 0.00 C ATOM 776 C ARG A 48 -9.250 0.078 -2.326 1.00 0.00 C ATOM 777 O ARG A 48 -9.380 -1.143 -2.285 1.00 0.00 O ATOM 778 CB ARG A 48 -9.920 1.417 -0.327 1.00 0.00 C ATOM 779 CG ARG A 48 -10.576 0.303 0.492 1.00 0.00 C ATOM 780 CD ARG A 48 -11.868 0.824 1.129 1.00 0.00 C ATOM 781 NE ARG A 48 -12.196 0.043 2.317 1.00 0.00 N ATOM 782 CZ ARG A 48 -12.699 -1.183 2.218 1.00 0.00 C ATOM 783 NH1 ARG A 48 -12.904 -1.713 1.043 1.00 0.00 N ATOM 784 NH2 ARG A 48 -12.987 -1.859 3.296 1.00 0.00 N ATOM 0 H ARG A 48 -8.203 2.867 -1.331 1.00 0.00 H new ATOM 0 HA ARG A 48 -8.171 0.170 -0.478 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -9.580 2.215 0.333 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -10.647 1.856 -1.010 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -10.794 -0.552 -0.148 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -9.892 -0.044 1.266 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -11.752 1.874 1.396 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -12.685 0.766 0.410 1.00 0.00 H new ATOM 0 HE ARG A 48 -12.036 0.445 3.241 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -12.678 -1.186 0.199 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -13.290 -2.654 0.968 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -12.826 -1.446 4.215 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -13.373 -2.800 3.220 1.00 0.00 H new ATOM 798 N ALA A 49 -9.543 0.803 -3.401 1.00 0.00 N ATOM 799 CA ALA A 49 -10.044 0.179 -4.621 1.00 0.00 C ATOM 800 C ALA A 49 -8.955 -0.653 -5.289 1.00 0.00 C ATOM 801 O ALA A 49 -9.212 -1.754 -5.776 1.00 0.00 O ATOM 802 CB ALA A 49 -10.534 1.255 -5.592 1.00 0.00 C ATOM 0 H ALA A 49 -9.443 1.817 -3.453 1.00 0.00 H new ATOM 0 HA ALA A 49 -10.872 -0.478 -4.355 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -10.907 0.782 -6.501 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -11.336 1.828 -5.126 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -9.709 1.922 -5.842 1.00 0.00 H new ATOM 808 N ALA A 50 -7.737 -0.118 -5.312 1.00 0.00 N ATOM 809 CA ALA A 50 -6.617 -0.819 -5.928 1.00 0.00 C ATOM 810 C ALA A 50 -6.432 -2.197 -5.299 1.00 0.00 C ATOM 811 O ALA A 50 -6.323 -3.201 -6.002 1.00 0.00 O ATOM 812 CB ALA A 50 -5.333 -0.004 -5.761 1.00 0.00 C ATOM 0 H ALA A 50 -7.503 0.792 -4.914 1.00 0.00 H new ATOM 0 HA ALA A 50 -6.833 -0.943 -6.989 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -4.502 -0.536 -6.224 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -5.454 0.968 -6.240 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -5.127 0.137 -4.700 1.00 0.00 H new ATOM 818 N LEU A 51 -6.399 -2.237 -3.971 1.00 0.00 N ATOM 819 CA LEU A 51 -6.227 -3.500 -3.260 1.00 0.00 C ATOM 820 C LEU A 51 -7.544 -4.272 -3.225 1.00 0.00 C ATOM 821 O LEU A 51 -7.588 -5.443 -3.602 1.00 0.00 O ATOM 822 CB LEU A 51 -5.741 -3.230 -1.830 1.00 0.00 C ATOM 823 CG LEU A 51 -4.852 -4.385 -1.357 1.00 0.00 C ATOM 824 CD1 LEU A 51 -4.419 -4.137 0.090 1.00 0.00 C ATOM 825 CD2 LEU A 51 -5.634 -5.699 -1.435 1.00 0.00 C ATOM 0 H LEU A 51 -6.488 -1.418 -3.370 1.00 0.00 H new ATOM 0 HA LEU A 51 -5.483 -4.100 -3.784 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -5.185 -2.293 -1.796 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -6.594 -3.118 -1.161 1.00 0.00 H new ATOM 0 HG LEU A 51 -3.971 -4.448 -1.996 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -3.787 -4.959 0.426 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -3.861 -3.202 0.148 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -5.301 -4.073 0.728 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -5.001 -6.520 -1.098 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -6.516 -5.636 -0.797 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -5.943 -5.878 -2.465 1.00 0.00 H new ATOM 837 N PHE A 52 -8.616 -3.620 -2.790 1.00 0.00 N ATOM 838 CA PHE A 52 -9.915 -4.283 -2.741 1.00 0.00 C ATOM 839 C PHE A 52 -10.136 -5.075 -4.026 1.00 0.00 C ATOM 840 O PHE A 52 -10.655 -6.191 -4.003 1.00 0.00 O ATOM 841 CB PHE A 52 -11.033 -3.250 -2.573 1.00 0.00 C ATOM 842 CG PHE A 52 -12.375 -3.940 -2.653 1.00 0.00 C ATOM 843 CD1 PHE A 52 -12.749 -4.856 -1.663 1.00 0.00 C ATOM 844 CD2 PHE A 52 -13.244 -3.665 -3.717 1.00 0.00 C ATOM 845 CE1 PHE A 52 -13.992 -5.496 -1.735 1.00 0.00 C ATOM 846 CE2 PHE A 52 -14.487 -4.306 -3.788 1.00 0.00 C ATOM 847 CZ PHE A 52 -14.861 -5.221 -2.798 1.00 0.00 C ATOM 0 H PHE A 52 -8.614 -2.651 -2.471 1.00 0.00 H new ATOM 0 HA PHE A 52 -9.932 -4.962 -1.888 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -10.931 -2.741 -1.615 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -10.958 -2.488 -3.349 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -12.079 -5.069 -0.843 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -12.955 -2.959 -4.482 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -14.281 -6.202 -0.970 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -15.157 -4.094 -4.608 1.00 0.00 H new ATOM 0 HZ PHE A 52 -15.820 -5.715 -2.854 1.00 0.00 H new ATOM 857 N GLY A 53 -9.728 -4.484 -5.146 1.00 0.00 N ATOM 858 CA GLY A 53 -9.870 -5.131 -6.445 1.00 0.00 C ATOM 859 C GLY A 53 -8.957 -6.346 -6.543 1.00 0.00 C ATOM 860 O GLY A 53 -9.374 -7.414 -6.991 1.00 0.00 O ATOM 0 H GLY A 53 -9.297 -3.560 -5.179 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -10.906 -5.435 -6.594 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -9.628 -4.423 -7.238 1.00 0.00 H new ATOM 864 N VAL A 54 -7.707 -6.178 -6.116 1.00 0.00 N ATOM 865 CA VAL A 54 -6.746 -7.273 -6.157 1.00 0.00 C ATOM 866 C VAL A 54 -7.204 -8.402 -5.243 1.00 0.00 C ATOM 867 O VAL A 54 -7.219 -9.568 -5.637 1.00 0.00 O ATOM 868 CB VAL A 54 -5.368 -6.773 -5.716 1.00 0.00 C ATOM 869 CG1 VAL A 54 -4.425 -7.962 -5.518 1.00 0.00 C ATOM 870 CG2 VAL A 54 -4.797 -5.845 -6.791 1.00 0.00 C ATOM 0 H VAL A 54 -7.341 -5.303 -5.742 1.00 0.00 H new ATOM 0 HA VAL A 54 -6.679 -7.648 -7.178 1.00 0.00 H new ATOM 0 HB VAL A 54 -5.465 -6.230 -4.776 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -3.445 -7.601 -5.204 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -4.830 -8.624 -4.753 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -4.327 -8.509 -6.456 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -3.816 -5.488 -6.479 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -4.703 -6.390 -7.730 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -5.465 -4.995 -6.930 1.00 0.00 H new ATOM 880 N LEU A 55 -7.589 -8.044 -4.022 1.00 0.00 N ATOM 881 CA LEU A 55 -8.061 -9.038 -3.067 1.00 0.00 C ATOM 882 C LEU A 55 -9.019 -9.993 -3.767 1.00 0.00 C ATOM 883 O LEU A 55 -8.866 -11.215 -3.697 1.00 0.00 O ATOM 884 CB LEU A 55 -8.771 -8.342 -1.900 1.00 0.00 C ATOM 885 CG LEU A 55 -9.470 -9.378 -1.012 1.00 0.00 C ATOM 886 CD1 LEU A 55 -8.475 -10.468 -0.602 1.00 0.00 C ATOM 887 CD2 LEU A 55 -10.009 -8.684 0.241 1.00 0.00 C ATOM 0 H LEU A 55 -7.584 -7.085 -3.674 1.00 0.00 H new ATOM 0 HA LEU A 55 -7.213 -9.600 -2.676 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -8.049 -7.776 -1.311 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -9.501 -7.628 -2.282 1.00 0.00 H new ATOM 0 HG LEU A 55 -10.291 -9.833 -1.565 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -8.978 -11.201 0.029 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -8.088 -10.961 -1.494 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.650 -10.018 -0.049 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -10.507 -9.416 0.876 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -9.183 -8.230 0.789 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -10.721 -7.911 -0.049 1.00 0.00 H new ATOM 899 N GLY A 56 -9.998 -9.425 -4.462 1.00 0.00 N ATOM 900 CA GLY A 56 -10.965 -10.233 -5.190 1.00 0.00 C ATOM 901 C GLY A 56 -10.247 -11.126 -6.194 1.00 0.00 C ATOM 902 O GLY A 56 -10.478 -12.332 -6.256 1.00 0.00 O ATOM 0 H GLY A 56 -10.141 -8.418 -4.536 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -11.539 -10.844 -4.493 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -11.675 -9.587 -5.707 1.00 0.00 H new ATOM 906 N ALA A 57 -9.362 -10.507 -6.971 1.00 0.00 N ATOM 907 CA ALA A 57 -8.596 -11.241 -7.969 1.00 0.00 C ATOM 908 C ALA A 57 -7.949 -12.468 -7.339 1.00 0.00 C ATOM 909 O ALA A 57 -7.787 -13.502 -7.988 1.00 0.00 O ATOM 910 CB ALA A 57 -7.514 -10.341 -8.566 1.00 0.00 C ATOM 0 H ALA A 57 -9.160 -9.508 -6.929 1.00 0.00 H new ATOM 0 HA ALA A 57 -9.274 -11.562 -8.760 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -6.947 -10.899 -9.311 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -7.980 -9.476 -9.038 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -6.843 -10.006 -7.775 1.00 0.00 H new ATOM 916 N ALA A 58 -7.585 -12.345 -6.066 1.00 0.00 N ATOM 917 CA ALA A 58 -6.958 -13.448 -5.350 1.00 0.00 C ATOM 918 C ALA A 58 -7.954 -14.588 -5.162 1.00 0.00 C ATOM 919 O ALA A 58 -7.586 -15.761 -5.215 1.00 0.00 O ATOM 920 CB ALA A 58 -6.462 -12.969 -3.983 1.00 0.00 C ATOM 0 H ALA A 58 -7.713 -11.498 -5.513 1.00 0.00 H new ATOM 0 HA ALA A 58 -6.111 -13.808 -5.935 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -5.995 -13.800 -3.454 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -5.733 -12.170 -4.120 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -7.304 -12.596 -3.401 1.00 0.00 H new ATOM 926 N LEU A 59 -9.214 -14.231 -4.942 1.00 0.00 N ATOM 927 CA LEU A 59 -10.257 -15.235 -4.746 1.00 0.00 C ATOM 928 C LEU A 59 -10.553 -15.965 -6.055 1.00 0.00 C ATOM 929 O LEU A 59 -10.906 -17.144 -6.049 1.00 0.00 O ATOM 930 CB LEU A 59 -11.537 -14.565 -4.228 1.00 0.00 C ATOM 931 CG LEU A 59 -11.507 -14.500 -2.699 1.00 0.00 C ATOM 932 CD1 LEU A 59 -10.288 -13.698 -2.242 1.00 0.00 C ATOM 933 CD2 LEU A 59 -12.782 -13.819 -2.197 1.00 0.00 C ATOM 0 H LEU A 59 -9.538 -13.265 -4.895 1.00 0.00 H new ATOM 0 HA LEU A 59 -9.905 -15.960 -4.012 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -11.626 -13.561 -4.642 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -12.411 -15.125 -4.560 1.00 0.00 H new ATOM 0 HG LEU A 59 -11.446 -15.510 -2.294 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -10.269 -13.653 -1.153 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -9.379 -14.181 -2.601 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -10.345 -12.687 -2.646 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -12.764 -13.771 -1.108 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -12.840 -12.809 -2.604 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -13.652 -14.391 -2.521 1.00 0.00 H new ATOM 945 N ILE A 60 -10.412 -15.259 -7.171 1.00 0.00 N ATOM 946 CA ILE A 60 -10.673 -15.856 -8.478 1.00 0.00 C ATOM 947 C ILE A 60 -9.510 -16.753 -8.901 1.00 0.00 C ATOM 948 O ILE A 60 -9.715 -17.808 -9.497 1.00 0.00 O ATOM 949 CB ILE A 60 -10.895 -14.750 -9.521 1.00 0.00 C ATOM 950 CG1 ILE A 60 -12.367 -14.319 -9.506 1.00 0.00 C ATOM 951 CG2 ILE A 60 -10.535 -15.265 -10.919 1.00 0.00 C ATOM 952 CD1 ILE A 60 -12.747 -13.831 -8.107 1.00 0.00 C ATOM 0 H ILE A 60 -10.121 -14.282 -7.199 1.00 0.00 H new ATOM 0 HA ILE A 60 -11.572 -16.469 -8.409 1.00 0.00 H new ATOM 0 HB ILE A 60 -10.258 -13.900 -9.276 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -12.531 -13.526 -10.235 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -13.004 -15.155 -9.795 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -10.696 -14.473 -11.651 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -9.488 -15.568 -10.937 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -11.165 -16.120 -11.165 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -13.793 -13.526 -8.100 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -12.599 -14.637 -7.388 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -12.119 -12.982 -7.835 1.00 0.00 H new ATOM 964 N GLY A 61 -8.292 -16.324 -8.602 1.00 0.00 N ATOM 965 CA GLY A 61 -7.110 -17.099 -8.967 1.00 0.00 C ATOM 966 C GLY A 61 -6.843 -18.213 -7.959 1.00 0.00 C ATOM 967 O GLY A 61 -6.121 -19.167 -8.251 1.00 0.00 O ATOM 0 H GLY A 61 -8.095 -15.451 -8.112 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -7.247 -17.529 -9.959 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -6.243 -16.440 -9.022 1.00 0.00 H new ATOM 971 N ALA A 62 -7.419 -18.082 -6.767 1.00 0.00 N ATOM 972 CA ALA A 62 -7.224 -19.080 -5.720 1.00 0.00 C ATOM 973 C ALA A 62 -8.165 -20.269 -5.905 1.00 0.00 C ATOM 974 O ALA A 62 -8.188 -21.181 -5.079 1.00 0.00 O ATOM 975 CB ALA A 62 -7.471 -18.447 -4.350 1.00 0.00 C ATOM 0 H ALA A 62 -8.020 -17.301 -6.503 1.00 0.00 H new ATOM 0 HA ALA A 62 -6.197 -19.440 -5.785 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -7.324 -19.196 -3.571 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -6.773 -17.624 -4.198 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -8.492 -18.069 -4.302 1.00 0.00 H new ATOM 981 N ILE A 63 -8.938 -20.258 -6.986 1.00 0.00 N ATOM 982 CA ILE A 63 -9.869 -21.352 -7.250 1.00 0.00 C ATOM 983 C ILE A 63 -9.158 -22.510 -7.946 1.00 0.00 C ATOM 984 O ILE A 63 -9.580 -23.661 -7.840 1.00 0.00 O ATOM 985 CB ILE A 63 -11.032 -20.861 -8.115 1.00 0.00 C ATOM 986 CG1 ILE A 63 -10.542 -20.628 -9.551 1.00 0.00 C ATOM 987 CG2 ILE A 63 -11.578 -19.555 -7.533 1.00 0.00 C ATOM 988 CD1 ILE A 63 -11.600 -19.856 -10.347 1.00 0.00 C ATOM 0 H ILE A 63 -8.940 -19.515 -7.685 1.00 0.00 H new ATOM 0 HA ILE A 63 -10.259 -21.706 -6.295 1.00 0.00 H new ATOM 0 HB ILE A 63 -11.823 -21.611 -8.126 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -9.606 -20.070 -9.539 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -10.337 -21.584 -10.034 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -12.407 -19.202 -8.146 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -11.928 -19.728 -6.515 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -10.789 -18.803 -7.522 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -11.244 -19.695 -11.365 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -12.526 -20.430 -10.373 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -11.783 -18.893 -9.870 1.00 0.00 H new ATOM 1000 N ALA A 64 -8.076 -22.199 -8.657 1.00 0.00 N ATOM 1001 CA ALA A 64 -7.317 -23.225 -9.364 1.00 0.00 C ATOM 1002 C ALA A 64 -6.167 -22.596 -10.151 1.00 0.00 C ATOM 1003 O ALA A 64 -6.224 -22.505 -11.378 1.00 0.00 O ATOM 1004 CB ALA A 64 -8.235 -23.986 -10.323 1.00 0.00 C ATOM 0 H ALA A 64 -7.709 -21.253 -8.758 1.00 0.00 H new ATOM 0 HA ALA A 64 -6.905 -23.916 -8.629 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -7.661 -24.750 -10.847 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -9.039 -24.459 -9.759 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -8.660 -23.292 -11.047 1.00 0.00 H new ATOM 1010 N PRO A 65 -5.135 -22.164 -9.474 1.00 0.00 N ATOM 1011 CA PRO A 65 -3.954 -21.533 -10.127 1.00 0.00 C ATOM 1012 C PRO A 65 -3.039 -22.569 -10.776 1.00 0.00 C ATOM 1013 O PRO A 65 -1.838 -22.344 -10.930 1.00 0.00 O ATOM 1014 CB PRO A 65 -3.251 -20.816 -8.973 1.00 0.00 C ATOM 1015 CG PRO A 65 -3.605 -21.601 -7.751 1.00 0.00 C ATOM 1016 CD PRO A 65 -4.980 -22.231 -8.010 1.00 0.00 C ATOM 0 HA PRO A 65 -4.235 -20.863 -10.939 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -2.172 -20.789 -9.125 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -3.587 -19.783 -8.888 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -2.858 -22.371 -7.556 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -3.635 -20.956 -6.873 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -5.021 -23.259 -7.651 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -5.772 -21.683 -7.500 1.00 0.00 H new ATOM 1024 N LYS A 66 -3.619 -23.704 -11.153 1.00 0.00 N ATOM 1025 CA LYS A 66 -2.857 -24.779 -11.786 1.00 0.00 C ATOM 1026 C LYS A 66 -3.149 -24.815 -13.284 1.00 0.00 C ATOM 1027 O LYS A 66 -2.497 -25.538 -14.038 1.00 0.00 O ATOM 1028 CB LYS A 66 -3.231 -26.126 -11.146 1.00 0.00 C ATOM 1029 CG LYS A 66 -2.001 -26.749 -10.472 1.00 0.00 C ATOM 1030 CD LYS A 66 -1.007 -27.237 -11.541 1.00 0.00 C ATOM 1031 CE LYS A 66 -1.012 -28.768 -11.600 1.00 0.00 C ATOM 1032 NZ LYS A 66 -2.365 -29.247 -11.998 1.00 0.00 N ATOM 0 H LYS A 66 -4.612 -23.905 -11.032 1.00 0.00 H new ATOM 0 HA LYS A 66 -1.793 -24.596 -11.639 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -4.023 -25.981 -10.412 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -3.621 -26.803 -11.906 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -1.520 -26.016 -9.824 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -2.306 -27.582 -9.839 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -1.276 -26.826 -12.514 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -0.005 -26.877 -11.309 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -0.267 -29.117 -12.315 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -0.740 -29.181 -10.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -2.316 -30.254 -12.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -3.025 -29.121 -11.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -2.700 -28.700 -12.817 1.00 0.00 H new ATOM 1046 N THR A 67 -4.130 -24.023 -13.704 1.00 0.00 N ATOM 1047 CA THR A 67 -4.511 -23.955 -15.112 1.00 0.00 C ATOM 1048 C THR A 67 -4.198 -22.564 -15.663 1.00 0.00 C ATOM 1049 O THR A 67 -3.752 -21.687 -14.923 1.00 0.00 O ATOM 1050 CB THR A 67 -6.010 -24.256 -15.261 1.00 0.00 C ATOM 1051 OG1 THR A 67 -6.710 -23.057 -15.567 1.00 0.00 O ATOM 1052 CG2 THR A 67 -6.553 -24.841 -13.955 1.00 0.00 C ATOM 0 H THR A 67 -4.676 -23.419 -13.090 1.00 0.00 H new ATOM 0 HA THR A 67 -3.944 -24.697 -15.675 1.00 0.00 H new ATOM 0 HB THR A 67 -6.151 -24.976 -16.067 1.00 0.00 H new ATOM 0 HG1 THR A 67 -7.666 -23.252 -15.663 1.00 0.00 H new ATOM 0 HG21 THR A 67 -7.616 -25.053 -14.066 1.00 0.00 H new ATOM 0 HG22 THR A 67 -6.022 -25.764 -13.721 1.00 0.00 H new ATOM 0 HG23 THR A 67 -6.408 -24.124 -13.147 1.00 0.00 H new ATOM 1060 N PRO A 68 -4.419 -22.341 -16.933 1.00 0.00 N ATOM 1061 CA PRO A 68 -4.148 -21.017 -17.569 1.00 0.00 C ATOM 1062 C PRO A 68 -4.789 -19.866 -16.796 1.00 0.00 C ATOM 1063 O PRO A 68 -4.628 -18.699 -17.155 1.00 0.00 O ATOM 1064 CB PRO A 68 -4.755 -21.154 -18.970 1.00 0.00 C ATOM 1065 CG PRO A 68 -4.752 -22.620 -19.252 1.00 0.00 C ATOM 1066 CD PRO A 68 -4.949 -23.314 -17.904 1.00 0.00 C ATOM 0 HA PRO A 68 -3.084 -20.780 -17.588 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -5.766 -20.748 -19.003 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -4.168 -20.609 -19.709 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -5.550 -22.884 -19.946 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -3.813 -22.926 -19.714 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -6.000 -23.536 -17.717 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -4.410 -24.261 -17.858 1.00 0.00 H new ATOM 1074 N LEU A 69 -5.515 -20.202 -15.732 1.00 0.00 N ATOM 1075 CA LEU A 69 -6.173 -19.187 -14.916 1.00 0.00 C ATOM 1076 C LEU A 69 -5.169 -18.131 -14.462 1.00 0.00 C ATOM 1077 O LEU A 69 -5.507 -16.956 -14.331 1.00 0.00 O ATOM 1078 CB LEU A 69 -6.825 -19.838 -13.691 1.00 0.00 C ATOM 1079 CG LEU A 69 -8.128 -20.535 -14.102 1.00 0.00 C ATOM 1080 CD1 LEU A 69 -8.594 -21.449 -12.965 1.00 0.00 C ATOM 1081 CD2 LEU A 69 -9.218 -19.492 -14.394 1.00 0.00 C ATOM 0 H LEU A 69 -5.661 -21.161 -15.417 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.942 -18.705 -15.520 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.141 -20.560 -13.245 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -7.030 -19.082 -12.933 1.00 0.00 H new ATOM 0 HG LEU A 69 -7.948 -21.123 -15.002 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -9.520 -21.946 -13.254 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.828 -22.198 -12.763 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -8.766 -20.855 -12.068 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -10.138 -19.999 -14.685 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -9.399 -18.895 -13.500 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -8.891 -18.841 -15.205 1.00 0.00 H new ATOM 1093 N ARG A 70 -3.932 -18.555 -14.221 1.00 0.00 N ATOM 1094 CA ARG A 70 -2.893 -17.626 -13.782 1.00 0.00 C ATOM 1095 C ARG A 70 -2.992 -16.306 -14.547 1.00 0.00 C ATOM 1096 O ARG A 70 -3.255 -15.267 -13.940 1.00 0.00 O ATOM 1097 CB ARG A 70 -1.503 -18.249 -13.980 1.00 0.00 C ATOM 1098 CG ARG A 70 -1.470 -19.067 -15.277 1.00 0.00 C ATOM 1099 CD ARG A 70 -0.115 -19.768 -15.408 1.00 0.00 C ATOM 1100 NE ARG A 70 -0.120 -21.021 -14.661 1.00 0.00 N ATOM 1101 CZ ARG A 70 0.712 -22.010 -14.970 1.00 0.00 C ATOM 1102 NH1 ARG A 70 1.554 -21.869 -15.957 1.00 0.00 N ATOM 1103 NH2 ARG A 70 0.687 -23.122 -14.289 1.00 0.00 N ATOM 0 H ARG A 70 -3.626 -19.523 -14.320 1.00 0.00 H new ATOM 0 HA ARG A 70 -3.040 -17.423 -12.721 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -0.747 -17.465 -14.016 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -1.259 -18.888 -13.132 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -2.273 -19.804 -15.275 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -1.638 -18.415 -16.134 1.00 0.00 H new ATOM 0 HD2 ARG A 70 0.101 -19.964 -16.458 1.00 0.00 H new ATOM 0 HD3 ARG A 70 0.676 -19.118 -15.035 1.00 0.00 H new ATOM 0 HE ARG A 70 -0.774 -21.140 -13.887 1.00 0.00 H new ATOM 0 HH11 ARG A 70 1.573 -21.000 -16.491 1.00 0.00 H new ATOM 0 HH12 ARG A 70 2.193 -22.628 -16.195 1.00 0.00 H new ATOM 0 HH21 ARG A 70 0.028 -23.233 -13.518 1.00 0.00 H new ATOM 0 HH22 ARG A 70 1.326 -23.880 -14.527 1.00 0.00 H new ATOM 1117 N TYR A 71 -2.792 -16.319 -15.863 1.00 0.00 N ATOM 1118 CA TYR A 71 -2.882 -15.081 -16.634 1.00 0.00 C ATOM 1119 C TYR A 71 -4.249 -14.429 -16.427 1.00 0.00 C ATOM 1120 O TYR A 71 -4.373 -13.210 -16.518 1.00 0.00 O ATOM 1121 CB TYR A 71 -2.666 -15.382 -18.125 1.00 0.00 C ATOM 1122 CG TYR A 71 -1.912 -14.245 -18.777 1.00 0.00 C ATOM 1123 CD1 TYR A 71 -2.598 -13.098 -19.193 1.00 0.00 C ATOM 1124 CD2 TYR A 71 -0.529 -14.340 -18.965 1.00 0.00 C ATOM 1125 CE1 TYR A 71 -1.899 -12.045 -19.798 1.00 0.00 C ATOM 1126 CE2 TYR A 71 0.171 -13.288 -19.568 1.00 0.00 C ATOM 1127 CZ TYR A 71 -0.516 -12.140 -19.985 1.00 0.00 C ATOM 1128 OH TYR A 71 0.173 -11.102 -20.579 1.00 0.00 O ATOM 0 H TYR A 71 -2.571 -17.152 -16.408 1.00 0.00 H new ATOM 0 HA TYR A 71 -2.110 -14.393 -16.291 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -2.109 -16.312 -18.240 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -3.627 -15.523 -18.619 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -3.666 -13.025 -19.048 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -0.001 -15.226 -18.645 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -2.428 -11.160 -20.120 1.00 0.00 H new ATOM 0 HE2 TYR A 71 1.239 -13.361 -19.712 1.00 0.00 H new ATOM 0 HH TYR A 71 1.125 -11.329 -20.632 1.00 0.00 H new ATOM 1138 N VAL A 72 -5.276 -15.232 -16.176 1.00 0.00 N ATOM 1139 CA VAL A 72 -6.621 -14.691 -15.995 1.00 0.00 C ATOM 1140 C VAL A 72 -6.737 -13.874 -14.709 1.00 0.00 C ATOM 1141 O VAL A 72 -7.298 -12.779 -14.725 1.00 0.00 O ATOM 1142 CB VAL A 72 -7.650 -15.824 -15.980 1.00 0.00 C ATOM 1143 CG1 VAL A 72 -9.058 -15.236 -16.076 1.00 0.00 C ATOM 1144 CG2 VAL A 72 -7.405 -16.748 -17.175 1.00 0.00 C ATOM 0 H VAL A 72 -5.208 -16.246 -16.094 1.00 0.00 H new ATOM 0 HA VAL A 72 -6.820 -14.026 -16.835 1.00 0.00 H new ATOM 0 HB VAL A 72 -7.554 -16.390 -15.053 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -9.791 -16.043 -16.065 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -9.235 -14.574 -15.228 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -9.154 -14.671 -17.003 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -8.137 -17.556 -17.166 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -7.502 -16.180 -18.100 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -6.401 -17.167 -17.111 1.00 0.00 H new ATOM 1154 N ALA A 73 -6.208 -14.378 -13.601 1.00 0.00 N ATOM 1155 CA ALA A 73 -6.271 -13.641 -12.342 1.00 0.00 C ATOM 1156 C ALA A 73 -5.204 -12.546 -12.318 1.00 0.00 C ATOM 1157 O ALA A 73 -5.397 -11.478 -11.728 1.00 0.00 O ATOM 1158 CB ALA A 73 -6.057 -14.595 -11.165 1.00 0.00 C ATOM 0 H ALA A 73 -5.737 -15.281 -13.546 1.00 0.00 H new ATOM 0 HA ALA A 73 -7.255 -13.181 -12.256 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -6.106 -14.036 -10.230 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -6.833 -15.360 -11.171 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -5.079 -15.069 -11.254 1.00 0.00 H new ATOM 1164 N MET A 74 -4.077 -12.820 -12.965 1.00 0.00 N ATOM 1165 CA MET A 74 -2.986 -11.857 -13.017 1.00 0.00 C ATOM 1166 C MET A 74 -3.400 -10.613 -13.796 1.00 0.00 C ATOM 1167 O MET A 74 -2.786 -9.556 -13.665 1.00 0.00 O ATOM 1168 CB MET A 74 -1.760 -12.490 -13.680 1.00 0.00 C ATOM 1169 CG MET A 74 -0.589 -11.507 -13.634 1.00 0.00 C ATOM 1170 SD MET A 74 0.913 -12.327 -14.226 1.00 0.00 S ATOM 1171 CE MET A 74 0.857 -11.714 -15.929 1.00 0.00 C ATOM 0 H MET A 74 -3.896 -13.695 -13.457 1.00 0.00 H new ATOM 0 HA MET A 74 -2.739 -11.566 -11.996 1.00 0.00 H new ATOM 0 HB2 MET A 74 -1.493 -13.414 -13.167 1.00 0.00 H new ATOM 0 HB3 MET A 74 -1.987 -12.753 -14.713 1.00 0.00 H new ATOM 0 HG2 MET A 74 -0.808 -10.636 -14.251 1.00 0.00 H new ATOM 0 HG3 MET A 74 -0.442 -11.147 -12.616 1.00 0.00 H new ATOM 0 HE1 MET A 74 1.709 -12.105 -16.485 1.00 0.00 H new ATOM 0 HE2 MET A 74 -0.067 -12.043 -16.404 1.00 0.00 H new ATOM 0 HE3 MET A 74 0.895 -10.625 -15.925 1.00 0.00 H new ATOM 1181 N VAL A 75 -4.445 -10.740 -14.608 1.00 0.00 N ATOM 1182 CA VAL A 75 -4.921 -9.609 -15.398 1.00 0.00 C ATOM 1183 C VAL A 75 -5.201 -8.411 -14.497 1.00 0.00 C ATOM 1184 O VAL A 75 -4.948 -7.262 -14.861 1.00 0.00 O ATOM 1185 CB VAL A 75 -6.193 -10.001 -16.173 1.00 0.00 C ATOM 1186 CG1 VAL A 75 -7.075 -8.767 -16.402 1.00 0.00 C ATOM 1187 CG2 VAL A 75 -5.806 -10.601 -17.530 1.00 0.00 C ATOM 0 H VAL A 75 -4.973 -11.603 -14.736 1.00 0.00 H new ATOM 0 HA VAL A 75 -4.145 -9.332 -16.112 1.00 0.00 H new ATOM 0 HB VAL A 75 -6.747 -10.736 -15.589 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -7.971 -9.057 -16.951 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -7.361 -8.340 -15.440 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -6.521 -8.026 -16.978 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -6.708 -10.877 -18.076 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -5.244 -9.866 -18.106 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -5.191 -11.487 -17.374 1.00 0.00 H new ATOM 1197 N ILE A 76 -5.724 -8.708 -13.309 1.00 0.00 N ATOM 1198 CA ILE A 76 -6.049 -7.669 -12.338 1.00 0.00 C ATOM 1199 C ILE A 76 -4.850 -7.368 -11.450 1.00 0.00 C ATOM 1200 O ILE A 76 -4.666 -6.236 -11.003 1.00 0.00 O ATOM 1201 CB ILE A 76 -7.227 -8.115 -11.472 1.00 0.00 C ATOM 1202 CG1 ILE A 76 -8.464 -8.315 -12.353 1.00 0.00 C ATOM 1203 CG2 ILE A 76 -7.522 -7.043 -10.420 1.00 0.00 C ATOM 1204 CD1 ILE A 76 -9.513 -9.123 -11.586 1.00 0.00 C ATOM 0 H ILE A 76 -5.931 -9.657 -12.998 1.00 0.00 H new ATOM 0 HA ILE A 76 -6.318 -6.764 -12.882 1.00 0.00 H new ATOM 0 HB ILE A 76 -6.977 -9.053 -10.977 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -8.876 -7.349 -12.645 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -8.189 -8.835 -13.271 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -8.362 -7.361 -9.802 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -6.643 -6.899 -9.791 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -7.771 -6.105 -10.916 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -10.393 -9.265 -12.213 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -9.099 -10.095 -11.317 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -9.796 -8.586 -10.681 1.00 0.00 H new ATOM 1216 N TRP A 77 -4.030 -8.385 -11.201 1.00 0.00 N ATOM 1217 CA TRP A 77 -2.848 -8.205 -10.368 1.00 0.00 C ATOM 1218 C TRP A 77 -1.853 -7.288 -11.069 1.00 0.00 C ATOM 1219 O TRP A 77 -1.321 -6.356 -10.466 1.00 0.00 O ATOM 1220 CB TRP A 77 -2.192 -9.561 -10.080 1.00 0.00 C ATOM 1221 CG TRP A 77 -1.465 -9.510 -8.769 1.00 0.00 C ATOM 1222 CD1 TRP A 77 -0.243 -8.961 -8.576 1.00 0.00 C ATOM 1223 CD2 TRP A 77 -1.895 -10.018 -7.472 1.00 0.00 C ATOM 1224 NE1 TRP A 77 0.109 -9.110 -7.244 1.00 0.00 N ATOM 1225 CE2 TRP A 77 -0.879 -9.750 -6.523 1.00 0.00 C ATOM 1226 CE3 TRP A 77 -3.055 -10.679 -7.033 1.00 0.00 C ATOM 1227 CZ2 TRP A 77 -1.012 -10.127 -5.186 1.00 0.00 C ATOM 1228 CZ3 TRP A 77 -3.191 -11.058 -5.688 1.00 0.00 C ATOM 1229 CH2 TRP A 77 -2.172 -10.782 -4.767 1.00 0.00 C ATOM 0 H TRP A 77 -4.160 -9.331 -11.560 1.00 0.00 H new ATOM 0 HA TRP A 77 -3.149 -7.751 -9.424 1.00 0.00 H new ATOM 0 HB2 TRP A 77 -2.951 -10.343 -10.055 1.00 0.00 H new ATOM 0 HB3 TRP A 77 -1.498 -9.816 -10.881 1.00 0.00 H new ATOM 0 HD1 TRP A 77 0.359 -8.485 -9.336 1.00 0.00 H new ATOM 0 HE1 TRP A 77 0.990 -8.786 -6.845 1.00 0.00 H new ATOM 0 HE3 TRP A 77 -3.847 -10.897 -7.735 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 -0.223 -9.914 -4.480 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 -4.087 -11.565 -5.361 1.00 0.00 H new ATOM 0 HH2 TRP A 77 -2.284 -11.076 -3.734 1.00 0.00 H new ATOM 1240 N LEU A 78 -1.609 -7.556 -12.350 1.00 0.00 N ATOM 1241 CA LEU A 78 -0.680 -6.754 -13.133 1.00 0.00 C ATOM 1242 C LEU A 78 -1.222 -5.336 -13.318 1.00 0.00 C ATOM 1243 O LEU A 78 -0.508 -4.358 -13.100 1.00 0.00 O ATOM 1244 CB LEU A 78 -0.458 -7.411 -14.507 1.00 0.00 C ATOM 1245 CG LEU A 78 1.027 -7.749 -14.705 1.00 0.00 C ATOM 1246 CD1 LEU A 78 1.868 -6.465 -14.648 1.00 0.00 C ATOM 1247 CD2 LEU A 78 1.488 -8.729 -13.610 1.00 0.00 C ATOM 0 H LEU A 78 -2.043 -8.322 -12.865 1.00 0.00 H new ATOM 0 HA LEU A 78 0.269 -6.697 -12.600 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -1.057 -8.318 -14.585 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -0.793 -6.739 -15.297 1.00 0.00 H new ATOM 0 HG LEU A 78 1.161 -8.216 -15.681 1.00 0.00 H new ATOM 0 HD11 LEU A 78 2.920 -6.713 -14.789 1.00 0.00 H new ATOM 0 HD12 LEU A 78 1.546 -5.784 -15.436 1.00 0.00 H new ATOM 0 HD13 LEU A 78 1.735 -5.986 -13.678 1.00 0.00 H new ATOM 0 HD21 LEU A 78 2.542 -8.966 -13.754 1.00 0.00 H new ATOM 0 HD22 LEU A 78 1.350 -8.271 -12.630 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.899 -9.644 -13.669 1.00 0.00 H new ATOM 1259 N TYR A 79 -2.487 -5.231 -13.723 1.00 0.00 N ATOM 1260 CA TYR A 79 -3.097 -3.921 -13.932 1.00 0.00 C ATOM 1261 C TYR A 79 -2.757 -2.984 -12.776 1.00 0.00 C ATOM 1262 O TYR A 79 -2.421 -1.820 -12.989 1.00 0.00 O ATOM 1263 CB TYR A 79 -4.622 -4.061 -14.054 1.00 0.00 C ATOM 1264 CG TYR A 79 -5.142 -3.118 -15.116 1.00 0.00 C ATOM 1265 CD1 TYR A 79 -5.147 -3.513 -16.460 1.00 0.00 C ATOM 1266 CD2 TYR A 79 -5.617 -1.851 -14.756 1.00 0.00 C ATOM 1267 CE1 TYR A 79 -5.627 -2.640 -17.443 1.00 0.00 C ATOM 1268 CE2 TYR A 79 -6.098 -0.979 -15.740 1.00 0.00 C ATOM 1269 CZ TYR A 79 -6.103 -1.373 -17.084 1.00 0.00 C ATOM 1270 OH TYR A 79 -6.577 -0.513 -18.054 1.00 0.00 O ATOM 0 H TYR A 79 -3.100 -6.024 -13.910 1.00 0.00 H new ATOM 0 HA TYR A 79 -2.701 -3.500 -14.856 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -4.882 -5.088 -14.308 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -5.094 -3.840 -13.097 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -4.781 -4.490 -16.737 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -5.612 -1.547 -13.720 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -5.630 -2.944 -18.479 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -6.465 -0.002 -15.463 1.00 0.00 H new ATOM 0 HH TYR A 79 -6.870 0.323 -17.635 1.00 0.00 H new ATOM 1280 N SER A 80 -2.849 -3.500 -11.556 1.00 0.00 N ATOM 1281 CA SER A 80 -2.551 -2.695 -10.374 1.00 0.00 C ATOM 1282 C SER A 80 -1.044 -2.516 -10.204 1.00 0.00 C ATOM 1283 O SER A 80 -0.593 -1.567 -9.567 1.00 0.00 O ATOM 1284 CB SER A 80 -3.130 -3.363 -9.128 1.00 0.00 C ATOM 1285 OG SER A 80 -2.273 -4.420 -8.720 1.00 0.00 O ATOM 0 H SER A 80 -3.125 -4.462 -11.358 1.00 0.00 H new ATOM 0 HA SER A 80 -3.006 -1.713 -10.507 1.00 0.00 H new ATOM 0 HB2 SER A 80 -3.234 -2.633 -8.325 1.00 0.00 H new ATOM 0 HB3 SER A 80 -4.127 -3.749 -9.339 1.00 0.00 H new ATOM 0 HG SER A 80 -2.049 -4.977 -9.495 1.00 0.00 H new ATOM 1291 N ALA A 81 -0.271 -3.439 -10.759 1.00 0.00 N ATOM 1292 CA ALA A 81 1.181 -3.367 -10.638 1.00 0.00 C ATOM 1293 C ALA A 81 1.723 -2.078 -11.244 1.00 0.00 C ATOM 1294 O ALA A 81 2.356 -1.276 -10.557 1.00 0.00 O ATOM 1295 CB ALA A 81 1.825 -4.565 -11.336 1.00 0.00 C ATOM 0 H ALA A 81 -0.618 -4.237 -11.291 1.00 0.00 H new ATOM 0 HA ALA A 81 1.428 -3.382 -9.577 1.00 0.00 H new ATOM 0 HB1 ALA A 81 2.909 -4.502 -11.240 1.00 0.00 H new ATOM 0 HB2 ALA A 81 1.473 -5.488 -10.875 1.00 0.00 H new ATOM 0 HB3 ALA A 81 1.553 -4.560 -12.392 1.00 0.00 H new ATOM 1301 N PHE A 82 1.482 -1.891 -12.534 1.00 0.00 N ATOM 1302 CA PHE A 82 1.964 -0.701 -13.226 1.00 0.00 C ATOM 1303 C PHE A 82 1.149 0.534 -12.843 1.00 0.00 C ATOM 1304 O PHE A 82 1.710 1.557 -12.458 1.00 0.00 O ATOM 1305 CB PHE A 82 1.888 -0.918 -14.740 1.00 0.00 C ATOM 1306 CG PHE A 82 2.225 0.368 -15.457 1.00 0.00 C ATOM 1307 CD1 PHE A 82 1.211 1.281 -15.770 1.00 0.00 C ATOM 1308 CD2 PHE A 82 3.551 0.646 -15.811 1.00 0.00 C ATOM 1309 CE1 PHE A 82 1.522 2.473 -16.434 1.00 0.00 C ATOM 1310 CE2 PHE A 82 3.862 1.838 -16.478 1.00 0.00 C ATOM 1311 CZ PHE A 82 2.847 2.752 -16.789 1.00 0.00 C ATOM 0 H PHE A 82 0.960 -2.542 -13.120 1.00 0.00 H new ATOM 0 HA PHE A 82 2.999 -0.532 -12.927 1.00 0.00 H new ATOM 0 HB2 PHE A 82 2.581 -1.705 -15.039 1.00 0.00 H new ATOM 0 HB3 PHE A 82 0.888 -1.250 -15.020 1.00 0.00 H new ATOM 0 HD1 PHE A 82 0.188 1.065 -15.499 1.00 0.00 H new ATOM 0 HD2 PHE A 82 4.334 -0.058 -15.570 1.00 0.00 H new ATOM 0 HE1 PHE A 82 0.739 3.178 -16.673 1.00 0.00 H new ATOM 0 HE2 PHE A 82 4.884 2.052 -16.752 1.00 0.00 H new ATOM 0 HZ PHE A 82 3.087 3.671 -17.302 1.00 0.00 H new ATOM 1321 N ARG A 83 -0.169 0.448 -12.981 1.00 0.00 N ATOM 1322 CA ARG A 83 -1.034 1.586 -12.676 1.00 0.00 C ATOM 1323 C ARG A 83 -1.054 1.916 -11.185 1.00 0.00 C ATOM 1324 O ARG A 83 -0.981 3.085 -10.809 1.00 0.00 O ATOM 1325 CB ARG A 83 -2.461 1.299 -13.153 1.00 0.00 C ATOM 1326 CG ARG A 83 -3.357 2.518 -12.877 1.00 0.00 C ATOM 1327 CD ARG A 83 -4.337 2.718 -14.037 1.00 0.00 C ATOM 1328 NE ARG A 83 -5.162 3.899 -13.799 1.00 0.00 N ATOM 1329 CZ ARG A 83 -5.640 4.623 -14.808 1.00 0.00 C ATOM 1330 NH1 ARG A 83 -5.383 4.279 -16.041 1.00 0.00 N ATOM 1331 NH2 ARG A 83 -6.370 5.677 -14.563 1.00 0.00 N ATOM 0 H ARG A 83 -0.660 -0.388 -13.299 1.00 0.00 H new ATOM 0 HA ARG A 83 -0.627 2.450 -13.202 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -2.459 1.071 -14.219 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -2.856 0.422 -12.640 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -3.906 2.373 -11.947 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -2.743 3.410 -12.750 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -3.788 2.831 -14.972 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -4.971 1.838 -14.144 1.00 0.00 H new ATOM 0 HE ARG A 83 -5.376 4.174 -12.841 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -4.815 3.454 -16.232 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -5.750 4.835 -16.813 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -6.573 5.944 -13.600 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -6.737 6.233 -15.335 1.00 0.00 H new ATOM 1345 N GLY A 84 -1.150 0.901 -10.336 1.00 0.00 N ATOM 1346 CA GLY A 84 -1.173 1.144 -8.896 1.00 0.00 C ATOM 1347 C GLY A 84 0.110 1.831 -8.438 1.00 0.00 C ATOM 1348 O GLY A 84 0.071 2.783 -7.661 1.00 0.00 O ATOM 0 H GLY A 84 -1.212 -0.080 -10.609 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -2.033 1.764 -8.642 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -1.293 0.199 -8.366 1.00 0.00 H new ATOM 1352 N VAL A 85 1.249 1.327 -8.903 1.00 0.00 N ATOM 1353 CA VAL A 85 2.540 1.887 -8.509 1.00 0.00 C ATOM 1354 C VAL A 85 2.832 3.207 -9.224 1.00 0.00 C ATOM 1355 O VAL A 85 3.353 4.144 -8.619 1.00 0.00 O ATOM 1356 CB VAL A 85 3.654 0.882 -8.812 1.00 0.00 C ATOM 1357 CG1 VAL A 85 5.005 1.489 -8.433 1.00 0.00 C ATOM 1358 CG2 VAL A 85 3.424 -0.394 -7.997 1.00 0.00 C ATOM 0 H VAL A 85 1.306 0.539 -9.548 1.00 0.00 H new ATOM 0 HA VAL A 85 2.500 2.089 -7.439 1.00 0.00 H new ATOM 0 HB VAL A 85 3.648 0.642 -9.875 1.00 0.00 H new ATOM 0 HG11 VAL A 85 5.799 0.774 -8.649 1.00 0.00 H new ATOM 0 HG12 VAL A 85 5.170 2.399 -9.010 1.00 0.00 H new ATOM 0 HG13 VAL A 85 5.011 1.728 -7.370 1.00 0.00 H new ATOM 0 HG21 VAL A 85 4.217 -1.111 -8.212 1.00 0.00 H new ATOM 0 HG22 VAL A 85 3.431 -0.153 -6.934 1.00 0.00 H new ATOM 0 HG23 VAL A 85 2.460 -0.828 -8.264 1.00 0.00 H new ATOM 1368 N GLN A 86 2.510 3.274 -10.511 1.00 0.00 N ATOM 1369 CA GLN A 86 2.761 4.484 -11.290 1.00 0.00 C ATOM 1370 C GLN A 86 1.960 5.671 -10.756 1.00 0.00 C ATOM 1371 O GLN A 86 2.489 6.774 -10.624 1.00 0.00 O ATOM 1372 CB GLN A 86 2.395 4.243 -12.759 1.00 0.00 C ATOM 1373 CG GLN A 86 2.808 5.451 -13.615 1.00 0.00 C ATOM 1374 CD GLN A 86 1.863 5.599 -14.803 1.00 0.00 C ATOM 1375 OE1 GLN A 86 2.270 5.411 -15.949 1.00 0.00 O ATOM 1376 NE2 GLN A 86 0.616 5.927 -14.596 1.00 0.00 N ATOM 0 H GLN A 86 2.078 2.513 -11.035 1.00 0.00 H new ATOM 0 HA GLN A 86 3.821 4.721 -11.204 1.00 0.00 H new ATOM 0 HB2 GLN A 86 2.892 3.344 -13.122 1.00 0.00 H new ATOM 0 HB3 GLN A 86 1.322 4.073 -12.851 1.00 0.00 H new ATOM 0 HG2 GLN A 86 2.790 6.358 -13.011 1.00 0.00 H new ATOM 0 HG3 GLN A 86 3.831 5.324 -13.968 1.00 0.00 H new ATOM 0 HE21 GLN A 86 0.281 6.082 -13.645 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -0.023 6.028 -15.385 1.00 0.00 H new ATOM 1385 N LEU A 87 0.683 5.448 -10.466 1.00 0.00 N ATOM 1386 CA LEU A 87 -0.170 6.522 -9.967 1.00 0.00 C ATOM 1387 C LEU A 87 0.210 6.905 -8.538 1.00 0.00 C ATOM 1388 O LEU A 87 0.267 8.086 -8.199 1.00 0.00 O ATOM 1389 CB LEU A 87 -1.645 6.092 -10.019 1.00 0.00 C ATOM 1390 CG LEU A 87 -2.523 7.279 -10.443 1.00 0.00 C ATOM 1391 CD1 LEU A 87 -2.534 7.394 -11.970 1.00 0.00 C ATOM 1392 CD2 LEU A 87 -3.954 7.062 -9.946 1.00 0.00 C ATOM 0 H LEU A 87 0.219 4.545 -10.566 1.00 0.00 H new ATOM 0 HA LEU A 87 -0.026 7.394 -10.605 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -1.768 5.269 -10.722 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -1.961 5.726 -9.042 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.119 8.194 -10.011 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -3.158 8.237 -12.267 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -1.517 7.550 -12.330 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -2.935 6.477 -12.401 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.576 7.905 -10.248 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.354 6.144 -10.377 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -3.953 6.982 -8.859 1.00 0.00 H new ATOM 1404 N THR A 88 0.465 5.903 -7.703 1.00 0.00 N ATOM 1405 CA THR A 88 0.834 6.162 -6.316 1.00 0.00 C ATOM 1406 C THR A 88 1.938 7.212 -6.241 1.00 0.00 C ATOM 1407 O THR A 88 1.853 8.164 -5.466 1.00 0.00 O ATOM 1408 CB THR A 88 1.307 4.867 -5.646 1.00 0.00 C ATOM 1409 OG1 THR A 88 2.120 4.140 -6.555 1.00 0.00 O ATOM 1410 CG2 THR A 88 0.097 4.016 -5.245 1.00 0.00 C ATOM 0 H THR A 88 0.424 4.916 -7.958 1.00 0.00 H new ATOM 0 HA THR A 88 -0.044 6.539 -5.792 1.00 0.00 H new ATOM 0 HB THR A 88 1.882 5.111 -4.753 1.00 0.00 H new ATOM 0 HG1 THR A 88 2.266 4.675 -7.363 1.00 0.00 H new ATOM 0 HG21 THR A 88 0.440 3.097 -4.769 1.00 0.00 H new ATOM 0 HG22 THR A 88 -0.526 4.575 -4.547 1.00 0.00 H new ATOM 0 HG23 THR A 88 -0.485 3.770 -6.133 1.00 0.00 H new ATOM 1418 N TYR A 89 2.973 7.030 -7.058 1.00 0.00 N ATOM 1419 CA TYR A 89 4.090 7.968 -7.081 1.00 0.00 C ATOM 1420 C TYR A 89 3.581 9.398 -7.248 1.00 0.00 C ATOM 1421 O TYR A 89 4.177 10.343 -6.730 1.00 0.00 O ATOM 1422 CB TYR A 89 5.039 7.614 -8.233 1.00 0.00 C ATOM 1423 CG TYR A 89 5.982 8.767 -8.499 1.00 0.00 C ATOM 1424 CD1 TYR A 89 6.799 9.255 -7.471 1.00 0.00 C ATOM 1425 CD2 TYR A 89 6.040 9.348 -9.773 1.00 0.00 C ATOM 1426 CE1 TYR A 89 7.673 10.322 -7.718 1.00 0.00 C ATOM 1427 CE2 TYR A 89 6.913 10.414 -10.018 1.00 0.00 C ATOM 1428 CZ TYR A 89 7.729 10.902 -8.991 1.00 0.00 C ATOM 1429 OH TYR A 89 8.590 11.953 -9.233 1.00 0.00 O ATOM 0 H TYR A 89 3.061 6.248 -7.707 1.00 0.00 H new ATOM 0 HA TYR A 89 4.628 7.898 -6.135 1.00 0.00 H new ATOM 0 HB2 TYR A 89 5.608 6.718 -7.984 1.00 0.00 H new ATOM 0 HB3 TYR A 89 4.465 7.388 -9.132 1.00 0.00 H new ATOM 0 HD1 TYR A 89 6.755 8.809 -6.488 1.00 0.00 H new ATOM 0 HD2 TYR A 89 5.411 8.973 -10.566 1.00 0.00 H new ATOM 0 HE1 TYR A 89 8.304 10.697 -6.926 1.00 0.00 H new ATOM 0 HE2 TYR A 89 6.957 10.860 -11.000 1.00 0.00 H new ATOM 0 HH TYR A 89 8.421 12.670 -8.586 1.00 0.00 H new ATOM 1439 N GLU A 90 2.476 9.549 -7.970 1.00 0.00 N ATOM 1440 CA GLU A 90 1.899 10.868 -8.194 1.00 0.00 C ATOM 1441 C GLU A 90 1.280 11.404 -6.906 1.00 0.00 C ATOM 1442 O GLU A 90 1.341 12.602 -6.626 1.00 0.00 O ATOM 1443 CB GLU A 90 0.828 10.792 -9.285 1.00 0.00 C ATOM 1444 CG GLU A 90 0.480 12.204 -9.761 1.00 0.00 C ATOM 1445 CD GLU A 90 1.598 12.747 -10.645 1.00 0.00 C ATOM 1446 OE1 GLU A 90 1.601 12.431 -11.823 1.00 0.00 O ATOM 1447 OE2 GLU A 90 2.434 13.471 -10.131 1.00 0.00 O ATOM 0 H GLU A 90 1.966 8.781 -8.407 1.00 0.00 H new ATOM 0 HA GLU A 90 2.693 11.544 -8.513 1.00 0.00 H new ATOM 0 HB2 GLU A 90 1.189 10.194 -10.122 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -0.063 10.297 -8.900 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -0.458 12.189 -10.316 1.00 0.00 H new ATOM 0 HG3 GLU A 90 0.333 12.860 -8.903 1.00 0.00 H new ATOM 1454 N HIS A 91 0.688 10.507 -6.125 1.00 0.00 N ATOM 1455 CA HIS A 91 0.062 10.895 -4.866 1.00 0.00 C ATOM 1456 C HIS A 91 1.121 11.279 -3.837 1.00 0.00 C ATOM 1457 O HIS A 91 0.928 12.203 -3.047 1.00 0.00 O ATOM 1458 CB HIS A 91 -0.783 9.741 -4.326 1.00 0.00 C ATOM 1459 CG HIS A 91 -1.418 10.149 -3.026 1.00 0.00 C ATOM 1460 ND1 HIS A 91 -1.491 11.473 -2.623 1.00 0.00 N ATOM 1461 CD2 HIS A 91 -2.015 9.420 -2.027 1.00 0.00 C ATOM 1462 CE1 HIS A 91 -2.111 11.500 -1.429 1.00 0.00 C ATOM 1463 NE2 HIS A 91 -2.451 10.275 -1.020 1.00 0.00 N ATOM 0 H HIS A 91 0.628 9.512 -6.340 1.00 0.00 H new ATOM 0 HA HIS A 91 -0.578 11.758 -5.051 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -1.552 9.470 -5.049 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -0.160 8.859 -4.178 1.00 0.00 H new ATOM 0 HD1 HIS A 91 -1.139 12.280 -3.138 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -2.129 8.346 -2.024 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -2.309 12.402 -0.870 1.00 0.00 H new ATOM 1472 N THR A 92 2.242 10.565 -3.854 1.00 0.00 N ATOM 1473 CA THR A 92 3.326 10.841 -2.919 1.00 0.00 C ATOM 1474 C THR A 92 4.064 12.115 -3.318 1.00 0.00 C ATOM 1475 O THR A 92 4.570 12.844 -2.464 1.00 0.00 O ATOM 1476 CB THR A 92 4.310 9.668 -2.895 1.00 0.00 C ATOM 1477 OG1 THR A 92 4.848 9.478 -4.196 1.00 0.00 O ATOM 1478 CG2 THR A 92 3.582 8.398 -2.450 1.00 0.00 C ATOM 0 H THR A 92 2.423 9.797 -4.500 1.00 0.00 H new ATOM 0 HA THR A 92 2.897 10.976 -1.926 1.00 0.00 H new ATOM 0 HB THR A 92 5.118 9.884 -2.196 1.00 0.00 H new ATOM 0 HG1 THR A 92 4.286 9.939 -4.853 1.00 0.00 H new ATOM 0 HG21 THR A 92 4.283 7.564 -2.433 1.00 0.00 H new ATOM 0 HG22 THR A 92 3.170 8.546 -1.452 1.00 0.00 H new ATOM 0 HG23 THR A 92 2.774 8.179 -3.148 1.00 0.00 H new ATOM 1486 N MET A 93 4.121 12.378 -4.619 1.00 0.00 N ATOM 1487 CA MET A 93 4.800 13.567 -5.118 1.00 0.00 C ATOM 1488 C MET A 93 4.121 14.828 -4.592 1.00 0.00 C ATOM 1489 O MET A 93 4.788 15.774 -4.177 1.00 0.00 O ATOM 1490 CB MET A 93 4.785 13.571 -6.650 1.00 0.00 C ATOM 1491 CG MET A 93 5.857 14.530 -7.175 1.00 0.00 C ATOM 1492 SD MET A 93 7.500 13.856 -6.823 1.00 0.00 S ATOM 1493 CE MET A 93 8.438 15.385 -7.068 1.00 0.00 C ATOM 0 H MET A 93 3.708 11.789 -5.342 1.00 0.00 H new ATOM 0 HA MET A 93 5.832 13.552 -4.767 1.00 0.00 H new ATOM 0 HB2 MET A 93 4.967 12.565 -7.028 1.00 0.00 H new ATOM 0 HB3 MET A 93 3.803 13.874 -7.013 1.00 0.00 H new ATOM 0 HG2 MET A 93 5.735 14.676 -8.248 1.00 0.00 H new ATOM 0 HG3 MET A 93 5.746 15.508 -6.706 1.00 0.00 H new ATOM 0 HE1 MET A 93 9.497 15.193 -6.898 1.00 0.00 H new ATOM 0 HE2 MET A 93 8.293 15.741 -8.088 1.00 0.00 H new ATOM 0 HE3 MET A 93 8.089 16.142 -6.366 1.00 0.00 H new ATOM 1503 N LEU A 94 2.793 14.833 -4.610 1.00 0.00 N ATOM 1504 CA LEU A 94 2.037 15.985 -4.130 1.00 0.00 C ATOM 1505 C LEU A 94 2.274 16.196 -2.637 1.00 0.00 C ATOM 1506 O LEU A 94 2.569 17.307 -2.197 1.00 0.00 O ATOM 1507 CB LEU A 94 0.542 15.771 -4.383 1.00 0.00 C ATOM 1508 CG LEU A 94 -0.211 17.099 -4.211 1.00 0.00 C ATOM 1509 CD1 LEU A 94 -0.202 17.876 -5.530 1.00 0.00 C ATOM 1510 CD2 LEU A 94 -1.659 16.818 -3.803 1.00 0.00 C ATOM 0 H LEU A 94 2.221 14.059 -4.949 1.00 0.00 H new ATOM 0 HA LEU A 94 2.375 16.869 -4.671 1.00 0.00 H new ATOM 0 HB2 LEU A 94 0.386 15.382 -5.389 1.00 0.00 H new ATOM 0 HB3 LEU A 94 0.149 15.027 -3.689 1.00 0.00 H new ATOM 0 HG LEU A 94 0.281 17.690 -3.438 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -0.737 18.817 -5.402 1.00 0.00 H new ATOM 0 HD12 LEU A 94 0.827 18.081 -5.824 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.689 17.284 -6.304 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -2.192 17.761 -3.681 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -2.146 16.223 -4.576 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -1.672 16.270 -2.861 1.00 0.00 H new ATOM 1522 N GLN A 95 2.142 15.123 -1.864 1.00 0.00 N ATOM 1523 CA GLN A 95 2.341 15.202 -0.422 1.00 0.00 C ATOM 1524 C GLN A 95 3.725 15.754 -0.094 1.00 0.00 C ATOM 1525 O GLN A 95 3.868 16.637 0.752 1.00 0.00 O ATOM 1526 CB GLN A 95 2.184 13.813 0.204 1.00 0.00 C ATOM 1527 CG GLN A 95 1.989 13.951 1.716 1.00 0.00 C ATOM 1528 CD GLN A 95 2.172 12.596 2.392 1.00 0.00 C ATOM 1529 OE1 GLN A 95 1.202 11.998 2.857 1.00 0.00 O ATOM 1530 NE2 GLN A 95 3.366 12.074 2.475 1.00 0.00 N ATOM 0 H GLN A 95 1.900 14.194 -2.209 1.00 0.00 H new ATOM 0 HA GLN A 95 1.589 15.876 -0.011 1.00 0.00 H new ATOM 0 HB2 GLN A 95 1.331 13.298 -0.238 1.00 0.00 H new ATOM 0 HB3 GLN A 95 3.065 13.207 -0.005 1.00 0.00 H new ATOM 0 HG2 GLN A 95 2.705 14.667 2.119 1.00 0.00 H new ATOM 0 HG3 GLN A 95 0.994 14.341 1.928 1.00 0.00 H new ATOM 0 HE21 GLN A 95 4.168 12.572 2.089 1.00 0.00 H new ATOM 0 HE22 GLN A 95 3.497 11.168 2.926 1.00 0.00 H new ATOM 1539 N LEU A 96 4.743 15.222 -0.764 1.00 0.00 N ATOM 1540 CA LEU A 96 6.115 15.663 -0.531 1.00 0.00 C ATOM 1541 C LEU A 96 6.443 16.887 -1.385 1.00 0.00 C ATOM 1542 O LEU A 96 7.441 17.569 -1.145 1.00 0.00 O ATOM 1543 CB LEU A 96 7.090 14.522 -0.864 1.00 0.00 C ATOM 1544 CG LEU A 96 7.445 13.745 0.413 1.00 0.00 C ATOM 1545 CD1 LEU A 96 7.900 12.332 0.042 1.00 0.00 C ATOM 1546 CD2 LEU A 96 8.580 14.461 1.154 1.00 0.00 C ATOM 0 H LEU A 96 4.646 14.490 -1.468 1.00 0.00 H new ATOM 0 HA LEU A 96 6.217 15.936 0.519 1.00 0.00 H new ATOM 0 HB2 LEU A 96 6.640 13.850 -1.595 1.00 0.00 H new ATOM 0 HB3 LEU A 96 7.995 14.927 -1.317 1.00 0.00 H new ATOM 0 HG LEU A 96 6.566 13.691 1.056 1.00 0.00 H new ATOM 0 HD11 LEU A 96 8.152 11.781 0.948 1.00 0.00 H new ATOM 0 HD12 LEU A 96 7.096 11.817 -0.484 1.00 0.00 H new ATOM 0 HD13 LEU A 96 8.777 12.390 -0.603 1.00 0.00 H new ATOM 0 HD21 LEU A 96 8.830 13.908 2.059 1.00 0.00 H new ATOM 0 HD22 LEU A 96 9.457 14.517 0.509 1.00 0.00 H new ATOM 0 HD23 LEU A 96 8.261 15.469 1.421 1.00 0.00 H new ATOM 1558 N TYR A 97 5.606 17.160 -2.380 1.00 0.00 N ATOM 1559 CA TYR A 97 5.831 18.306 -3.257 1.00 0.00 C ATOM 1560 C TYR A 97 4.509 18.826 -3.822 1.00 0.00 C ATOM 1561 O TYR A 97 4.179 18.578 -4.981 1.00 0.00 O ATOM 1562 CB TYR A 97 6.758 17.903 -4.409 1.00 0.00 C ATOM 1563 CG TYR A 97 7.380 19.139 -5.015 1.00 0.00 C ATOM 1564 CD1 TYR A 97 8.490 19.734 -4.402 1.00 0.00 C ATOM 1565 CD2 TYR A 97 6.848 19.690 -6.187 1.00 0.00 C ATOM 1566 CE1 TYR A 97 9.069 20.878 -4.963 1.00 0.00 C ATOM 1567 CE2 TYR A 97 7.426 20.835 -6.746 1.00 0.00 C ATOM 1568 CZ TYR A 97 8.537 21.430 -6.134 1.00 0.00 C ATOM 1569 OH TYR A 97 9.107 22.559 -6.686 1.00 0.00 O ATOM 0 H TYR A 97 4.774 16.611 -2.599 1.00 0.00 H new ATOM 0 HA TYR A 97 6.296 19.100 -2.672 1.00 0.00 H new ATOM 0 HB2 TYR A 97 7.537 17.233 -4.045 1.00 0.00 H new ATOM 0 HB3 TYR A 97 6.196 17.357 -5.167 1.00 0.00 H new ATOM 0 HD1 TYR A 97 8.899 19.310 -3.497 1.00 0.00 H new ATOM 0 HD2 TYR A 97 5.992 19.231 -6.659 1.00 0.00 H new ATOM 0 HE1 TYR A 97 9.927 21.335 -4.492 1.00 0.00 H new ATOM 0 HE2 TYR A 97 7.015 21.260 -7.650 1.00 0.00 H new ATOM 0 HH TYR A 97 8.617 22.810 -7.497 1.00 0.00 H new ATOM 1579 N PRO A 98 3.757 19.539 -3.026 1.00 0.00 N ATOM 1580 CA PRO A 98 2.449 20.107 -3.452 1.00 0.00 C ATOM 1581 C PRO A 98 2.619 21.393 -4.259 1.00 0.00 C ATOM 1582 O PRO A 98 3.199 22.367 -3.777 1.00 0.00 O ATOM 1583 CB PRO A 98 1.733 20.373 -2.127 1.00 0.00 C ATOM 1584 CG PRO A 98 2.824 20.635 -1.136 1.00 0.00 C ATOM 1585 CD PRO A 98 4.069 19.882 -1.629 1.00 0.00 C ATOM 0 HA PRO A 98 1.897 19.437 -4.112 1.00 0.00 H new ATOM 0 HB2 PRO A 98 1.061 21.227 -2.207 1.00 0.00 H new ATOM 0 HB3 PRO A 98 1.127 19.518 -1.828 1.00 0.00 H new ATOM 0 HG2 PRO A 98 3.025 21.703 -1.058 1.00 0.00 H new ATOM 0 HG3 PRO A 98 2.534 20.292 -0.143 1.00 0.00 H new ATOM 0 HD2 PRO A 98 4.962 20.503 -1.562 1.00 0.00 H new ATOM 0 HD3 PRO A 98 4.256 18.989 -1.032 1.00 0.00 H new ATOM 1593 N SER A 99 2.113 21.388 -5.488 1.00 0.00 N ATOM 1594 CA SER A 99 2.219 22.559 -6.351 1.00 0.00 C ATOM 1595 C SER A 99 1.620 23.787 -5.665 1.00 0.00 C ATOM 1596 O SER A 99 0.697 23.664 -4.862 1.00 0.00 O ATOM 1597 CB SER A 99 1.484 22.303 -7.668 1.00 0.00 C ATOM 1598 OG SER A 99 1.051 23.543 -8.213 1.00 0.00 O ATOM 0 H SER A 99 1.629 20.593 -5.906 1.00 0.00 H new ATOM 0 HA SER A 99 3.274 22.745 -6.551 1.00 0.00 H new ATOM 0 HB2 SER A 99 2.142 21.793 -8.372 1.00 0.00 H new ATOM 0 HB3 SER A 99 0.629 21.648 -7.499 1.00 0.00 H new ATOM 0 HG SER A 99 0.581 23.383 -9.058 1.00 0.00 H new ATOM 1604 N PRO A 100 2.122 24.963 -5.966 1.00 0.00 N ATOM 1605 CA PRO A 100 1.616 26.232 -5.366 1.00 0.00 C ATOM 1606 C PRO A 100 0.089 26.284 -5.303 1.00 0.00 C ATOM 1607 O PRO A 100 -0.553 26.928 -6.134 1.00 0.00 O ATOM 1608 CB PRO A 100 2.163 27.311 -6.306 1.00 0.00 C ATOM 1609 CG PRO A 100 3.413 26.732 -6.885 1.00 0.00 C ATOM 1610 CD PRO A 100 3.229 25.211 -6.910 1.00 0.00 C ATOM 0 HA PRO A 100 1.937 26.351 -4.331 1.00 0.00 H new ATOM 0 HB2 PRO A 100 1.443 27.554 -7.088 1.00 0.00 H new ATOM 0 HB3 PRO A 100 2.371 28.235 -5.766 1.00 0.00 H new ATOM 0 HG2 PRO A 100 3.587 27.116 -7.890 1.00 0.00 H new ATOM 0 HG3 PRO A 100 4.280 27.006 -6.284 1.00 0.00 H new ATOM 0 HD2 PRO A 100 2.985 24.856 -7.911 1.00 0.00 H new ATOM 0 HD3 PRO A 100 4.138 24.695 -6.602 1.00 0.00 H new ATOM 1618 N PHE A 101 -0.485 25.606 -4.313 1.00 0.00 N ATOM 1619 CA PHE A 101 -1.937 25.581 -4.145 1.00 0.00 C ATOM 1620 C PHE A 101 -2.642 25.562 -5.501 1.00 0.00 C ATOM 1621 O PHE A 101 -2.872 26.609 -6.107 1.00 0.00 O ATOM 1622 CB PHE A 101 -2.394 26.806 -3.338 1.00 0.00 C ATOM 1623 CG PHE A 101 -1.250 27.314 -2.493 1.00 0.00 C ATOM 1624 CD1 PHE A 101 -0.930 26.674 -1.290 1.00 0.00 C ATOM 1625 CD2 PHE A 101 -0.509 28.425 -2.914 1.00 0.00 C ATOM 1626 CE1 PHE A 101 0.132 27.145 -0.508 1.00 0.00 C ATOM 1627 CE2 PHE A 101 0.553 28.896 -2.132 1.00 0.00 C ATOM 1628 CZ PHE A 101 0.873 28.256 -0.929 1.00 0.00 C ATOM 0 H PHE A 101 0.030 25.068 -3.616 1.00 0.00 H new ATOM 0 HA PHE A 101 -2.203 24.672 -3.605 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -2.737 27.591 -4.012 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -3.239 26.540 -2.702 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -1.502 25.817 -0.965 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -0.757 28.919 -3.842 1.00 0.00 H new ATOM 0 HE1 PHE A 101 0.380 26.651 0.420 1.00 0.00 H new ATOM 0 HE2 PHE A 101 1.125 29.753 -2.457 1.00 0.00 H new ATOM 0 HZ PHE A 101 1.692 28.619 -0.325 1.00 0.00 H new ATOM 1638 N ALA A 102 -2.983 24.366 -5.974 1.00 0.00 N ATOM 1639 CA ALA A 102 -3.659 24.232 -7.259 1.00 0.00 C ATOM 1640 C ALA A 102 -4.393 22.896 -7.349 1.00 0.00 C ATOM 1641 O ALA A 102 -4.315 22.071 -6.438 1.00 0.00 O ATOM 1642 CB ALA A 102 -2.641 24.333 -8.398 1.00 0.00 C ATOM 0 H ALA A 102 -2.804 23.485 -5.492 1.00 0.00 H new ATOM 0 HA ALA A 102 -4.387 25.038 -7.347 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -3.154 24.232 -9.354 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -2.141 25.301 -8.355 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -1.902 23.538 -8.297 1.00 0.00 H new ATOM 1648 N THR A 103 -5.104 22.694 -8.453 1.00 0.00 N ATOM 1649 CA THR A 103 -5.849 21.456 -8.659 1.00 0.00 C ATOM 1650 C THR A 103 -6.710 21.136 -7.441 1.00 0.00 C ATOM 1651 O THR A 103 -6.361 20.277 -6.631 1.00 0.00 O ATOM 1652 CB THR A 103 -4.882 20.300 -8.923 1.00 0.00 C ATOM 1653 OG1 THR A 103 -3.853 20.311 -7.942 1.00 0.00 O ATOM 1654 CG2 THR A 103 -4.267 20.455 -10.314 1.00 0.00 C ATOM 0 H THR A 103 -5.181 23.367 -9.216 1.00 0.00 H new ATOM 0 HA THR A 103 -6.500 21.588 -9.523 1.00 0.00 H new ATOM 0 HB THR A 103 -5.422 19.355 -8.871 1.00 0.00 H new ATOM 0 HG1 THR A 103 -4.219 20.620 -7.087 1.00 0.00 H new ATOM 0 HG21 THR A 103 -3.578 19.631 -10.501 1.00 0.00 H new ATOM 0 HG22 THR A 103 -5.057 20.445 -11.064 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.726 21.400 -10.369 1.00 0.00 H new ATOM 1662 N SER A 104 -7.838 21.828 -7.321 1.00 0.00 N ATOM 1663 CA SER A 104 -8.746 21.606 -6.201 1.00 0.00 C ATOM 1664 C SER A 104 -9.697 20.454 -6.508 1.00 0.00 C ATOM 1665 O SER A 104 -9.995 20.176 -7.669 1.00 0.00 O ATOM 1666 CB SER A 104 -9.552 22.875 -5.923 1.00 0.00 C ATOM 1667 OG SER A 104 -8.668 23.983 -5.830 1.00 0.00 O ATOM 0 H SER A 104 -8.144 22.543 -7.981 1.00 0.00 H new ATOM 0 HA SER A 104 -8.155 21.352 -5.321 1.00 0.00 H new ATOM 0 HB2 SER A 104 -10.278 23.040 -6.719 1.00 0.00 H new ATOM 0 HB3 SER A 104 -10.115 22.766 -4.996 1.00 0.00 H new ATOM 0 HG SER A 104 -9.183 24.798 -5.654 1.00 0.00 H new ATOM 1673 N ASP A 105 -10.169 19.786 -5.460 1.00 0.00 N ATOM 1674 CA ASP A 105 -11.085 18.664 -5.635 1.00 0.00 C ATOM 1675 C ASP A 105 -11.921 18.448 -4.376 1.00 0.00 C ATOM 1676 O ASP A 105 -11.542 18.877 -3.285 1.00 0.00 O ATOM 1677 CB ASP A 105 -10.295 17.392 -5.949 1.00 0.00 C ATOM 1678 CG ASP A 105 -9.398 17.030 -4.770 1.00 0.00 C ATOM 1679 OD1 ASP A 105 -9.908 16.474 -3.811 1.00 0.00 O ATOM 1680 OD2 ASP A 105 -8.214 17.317 -4.842 1.00 0.00 O ATOM 0 H ASP A 105 -9.936 19.999 -4.490 1.00 0.00 H new ATOM 0 HA ASP A 105 -11.754 18.893 -6.464 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -10.980 16.571 -6.160 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -9.691 17.541 -6.844 1.00 0.00 H new ATOM 1685 N PHE A 106 -13.058 17.780 -4.536 1.00 0.00 N ATOM 1686 CA PHE A 106 -13.944 17.508 -3.410 1.00 0.00 C ATOM 1687 C PHE A 106 -14.812 16.288 -3.700 1.00 0.00 C ATOM 1688 O PHE A 106 -14.608 15.217 -3.129 1.00 0.00 O ATOM 1689 CB PHE A 106 -14.839 18.723 -3.142 1.00 0.00 C ATOM 1690 CG PHE A 106 -14.053 19.782 -2.404 1.00 0.00 C ATOM 1691 CD1 PHE A 106 -13.739 19.602 -1.052 1.00 0.00 C ATOM 1692 CD2 PHE A 106 -13.639 20.942 -3.070 1.00 0.00 C ATOM 1693 CE1 PHE A 106 -13.012 20.582 -0.364 1.00 0.00 C ATOM 1694 CE2 PHE A 106 -12.913 21.921 -2.384 1.00 0.00 C ATOM 1695 CZ PHE A 106 -12.599 21.742 -1.031 1.00 0.00 C ATOM 0 H PHE A 106 -13.387 17.418 -5.431 1.00 0.00 H new ATOM 0 HA PHE A 106 -13.334 17.307 -2.529 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -15.214 19.125 -4.083 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -15.707 18.425 -2.554 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -14.057 18.707 -0.539 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -13.880 21.081 -4.114 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -12.770 20.443 0.679 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -12.594 22.816 -2.898 1.00 0.00 H new ATOM 0 HZ PHE A 106 -12.038 22.499 -0.502 1.00 0.00 H new ATOM 1705 N MET A 107 -15.782 16.459 -4.592 1.00 0.00 N ATOM 1706 CA MET A 107 -16.679 15.367 -4.955 1.00 0.00 C ATOM 1707 C MET A 107 -16.059 14.507 -6.052 1.00 0.00 C ATOM 1708 O MET A 107 -15.594 15.023 -7.068 1.00 0.00 O ATOM 1709 CB MET A 107 -18.017 15.932 -5.440 1.00 0.00 C ATOM 1710 CG MET A 107 -18.678 16.729 -4.312 1.00 0.00 C ATOM 1711 SD MET A 107 -19.849 17.915 -5.020 1.00 0.00 S ATOM 1712 CE MET A 107 -21.254 16.785 -5.176 1.00 0.00 C ATOM 0 H MET A 107 -15.967 17.338 -5.075 1.00 0.00 H new ATOM 0 HA MET A 107 -16.844 14.747 -4.074 1.00 0.00 H new ATOM 0 HB2 MET A 107 -17.859 16.573 -6.308 1.00 0.00 H new ATOM 0 HB3 MET A 107 -18.672 15.121 -5.758 1.00 0.00 H new ATOM 0 HG2 MET A 107 -19.195 16.054 -3.629 1.00 0.00 H new ATOM 0 HG3 MET A 107 -17.920 17.253 -3.729 1.00 0.00 H new ATOM 0 HE1 MET A 107 -22.104 17.318 -5.601 1.00 0.00 H new ATOM 0 HE2 MET A 107 -20.983 15.955 -5.829 1.00 0.00 H new ATOM 0 HE3 MET A 107 -21.522 16.400 -4.192 1.00 0.00 H new ATOM 1722 N VAL A 108 -16.057 13.194 -5.841 1.00 0.00 N ATOM 1723 CA VAL A 108 -15.493 12.274 -6.822 1.00 0.00 C ATOM 1724 C VAL A 108 -16.472 12.052 -7.970 1.00 0.00 C ATOM 1725 O VAL A 108 -17.642 11.739 -7.747 1.00 0.00 O ATOM 1726 CB VAL A 108 -15.166 10.935 -6.156 1.00 0.00 C ATOM 1727 CG1 VAL A 108 -16.460 10.272 -5.678 1.00 0.00 C ATOM 1728 CG2 VAL A 108 -14.468 10.022 -7.166 1.00 0.00 C ATOM 0 H VAL A 108 -16.436 12.746 -5.007 1.00 0.00 H new ATOM 0 HA VAL A 108 -14.578 12.711 -7.221 1.00 0.00 H new ATOM 0 HB VAL A 108 -14.509 11.104 -5.303 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -16.227 9.319 -5.204 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -16.958 10.923 -4.959 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -17.118 10.102 -6.530 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -14.234 9.068 -6.693 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -15.125 9.853 -8.019 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -13.546 10.494 -7.506 1.00 0.00 H new ATOM 1738 N ARG A 109 -15.987 12.220 -9.198 1.00 0.00 N ATOM 1739 CA ARG A 109 -16.829 12.039 -10.380 1.00 0.00 C ATOM 1740 C ARG A 109 -16.373 10.824 -11.184 1.00 0.00 C ATOM 1741 O ARG A 109 -15.385 10.888 -11.916 1.00 0.00 O ATOM 1742 CB ARG A 109 -16.764 13.291 -11.260 1.00 0.00 C ATOM 1743 CG ARG A 109 -16.703 14.539 -10.374 1.00 0.00 C ATOM 1744 CD ARG A 109 -17.126 15.772 -11.182 1.00 0.00 C ATOM 1745 NE ARG A 109 -16.381 16.944 -10.734 1.00 0.00 N ATOM 1746 CZ ARG A 109 -15.177 17.223 -11.224 1.00 0.00 C ATOM 1747 NH1 ARG A 109 -14.642 16.441 -12.121 1.00 0.00 N ATOM 1748 NH2 ARG A 109 -14.530 18.277 -10.806 1.00 0.00 N ATOM 0 H ARG A 109 -15.022 12.480 -9.401 1.00 0.00 H new ATOM 0 HA ARG A 109 -17.856 11.876 -10.052 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -15.887 13.248 -11.906 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -17.638 13.337 -11.910 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -17.358 14.416 -9.511 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -15.692 14.674 -9.990 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -16.946 15.601 -12.243 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -18.196 15.944 -11.064 1.00 0.00 H new ATOM 0 HE ARG A 109 -16.791 17.560 -10.032 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -15.147 15.617 -12.446 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -13.718 16.654 -12.498 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -14.948 18.887 -10.103 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -13.606 18.491 -11.182 1.00 0.00 H new ATOM 1762 N PHE A 110 -17.101 9.720 -11.043 1.00 0.00 N ATOM 1763 CA PHE A 110 -16.769 8.492 -11.760 1.00 0.00 C ATOM 1764 C PHE A 110 -17.786 8.235 -12.871 1.00 0.00 C ATOM 1765 O PHE A 110 -18.881 8.797 -12.865 1.00 0.00 O ATOM 1766 CB PHE A 110 -16.752 7.309 -10.779 1.00 0.00 C ATOM 1767 CG PHE A 110 -15.327 6.854 -10.547 1.00 0.00 C ATOM 1768 CD1 PHE A 110 -14.341 7.788 -10.206 1.00 0.00 C ATOM 1769 CD2 PHE A 110 -14.992 5.500 -10.673 1.00 0.00 C ATOM 1770 CE1 PHE A 110 -13.023 7.370 -9.992 1.00 0.00 C ATOM 1771 CE2 PHE A 110 -13.674 5.082 -10.459 1.00 0.00 C ATOM 1772 CZ PHE A 110 -12.689 6.016 -10.120 1.00 0.00 C ATOM 0 H PHE A 110 -17.922 9.650 -10.441 1.00 0.00 H new ATOM 0 HA PHE A 110 -15.782 8.600 -12.210 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -17.208 7.603 -9.833 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -17.346 6.486 -11.177 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -14.598 8.832 -10.108 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -15.751 4.778 -10.935 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -12.264 8.091 -9.728 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -13.417 4.038 -10.556 1.00 0.00 H new ATOM 0 HZ PHE A 110 -11.671 5.693 -9.957 1.00 0.00 H new ATOM 1782 N PRO A 111 -17.443 7.402 -13.820 1.00 0.00 N ATOM 1783 CA PRO A 111 -18.337 7.065 -14.959 1.00 0.00 C ATOM 1784 C PRO A 111 -19.803 6.981 -14.540 1.00 0.00 C ATOM 1785 O PRO A 111 -20.112 6.826 -13.357 1.00 0.00 O ATOM 1786 CB PRO A 111 -17.808 5.709 -15.421 1.00 0.00 C ATOM 1787 CG PRO A 111 -16.346 5.728 -15.098 1.00 0.00 C ATOM 1788 CD PRO A 111 -16.160 6.685 -13.911 1.00 0.00 C ATOM 0 HA PRO A 111 -18.324 7.824 -15.741 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -18.315 4.892 -14.906 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -17.974 5.564 -16.489 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -15.994 4.728 -14.846 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -15.766 6.063 -15.958 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -15.942 6.141 -12.992 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -15.331 7.372 -14.080 1.00 0.00 H new ATOM 1796 N GLU A 112 -20.701 7.095 -15.514 1.00 0.00 N ATOM 1797 CA GLU A 112 -22.135 7.041 -15.236 1.00 0.00 C ATOM 1798 C GLU A 112 -22.684 5.634 -15.471 1.00 0.00 C ATOM 1799 O GLU A 112 -23.885 5.400 -15.339 1.00 0.00 O ATOM 1800 CB GLU A 112 -22.873 8.045 -16.136 1.00 0.00 C ATOM 1801 CG GLU A 112 -23.994 8.731 -15.347 1.00 0.00 C ATOM 1802 CD GLU A 112 -24.885 7.686 -14.685 1.00 0.00 C ATOM 1803 OE1 GLU A 112 -25.734 7.140 -15.370 1.00 0.00 O ATOM 1804 OE2 GLU A 112 -24.706 7.447 -13.502 1.00 0.00 O ATOM 0 H GLU A 112 -20.464 7.225 -16.498 1.00 0.00 H new ATOM 0 HA GLU A 112 -22.295 7.300 -14.189 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -22.173 8.791 -16.513 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -23.289 7.532 -17.003 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -23.566 9.388 -14.590 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -24.588 9.357 -16.013 1.00 0.00 H new ATOM 1811 N TRP A 113 -21.802 4.699 -15.821 1.00 0.00 N ATOM 1812 CA TRP A 113 -22.224 3.320 -16.071 1.00 0.00 C ATOM 1813 C TRP A 113 -21.431 2.346 -15.203 1.00 0.00 C ATOM 1814 O TRP A 113 -21.208 1.198 -15.588 1.00 0.00 O ATOM 1815 CB TRP A 113 -22.041 2.976 -17.556 1.00 0.00 C ATOM 1816 CG TRP A 113 -20.644 2.501 -17.809 1.00 0.00 C ATOM 1817 CD1 TRP A 113 -19.541 3.283 -17.790 1.00 0.00 C ATOM 1818 CD2 TRP A 113 -20.186 1.154 -18.120 1.00 0.00 C ATOM 1819 NE1 TRP A 113 -18.434 2.501 -18.067 1.00 0.00 N ATOM 1820 CE2 TRP A 113 -18.780 1.182 -18.279 1.00 0.00 C ATOM 1821 CE3 TRP A 113 -20.848 -0.077 -18.278 1.00 0.00 C ATOM 1822 CZ2 TRP A 113 -18.056 0.028 -18.584 1.00 0.00 C ATOM 1823 CZ3 TRP A 113 -20.122 -1.240 -18.584 1.00 0.00 C ATOM 1824 CH2 TRP A 113 -18.729 -1.187 -18.737 1.00 0.00 C ATOM 0 H TRP A 113 -20.803 4.867 -15.937 1.00 0.00 H new ATOM 0 HA TRP A 113 -23.279 3.229 -15.812 1.00 0.00 H new ATOM 0 HB2 TRP A 113 -22.754 2.205 -17.848 1.00 0.00 H new ATOM 0 HB3 TRP A 113 -22.251 3.853 -18.168 1.00 0.00 H new ATOM 0 HD1 TRP A 113 -19.527 4.344 -17.591 1.00 0.00 H new ATOM 0 HE1 TRP A 113 -17.479 2.856 -18.109 1.00 0.00 H new ATOM 0 HE3 TRP A 113 -21.921 -0.128 -18.163 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 -16.983 0.074 -18.701 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 -20.640 -2.180 -18.702 1.00 0.00 H new ATOM 0 HH2 TRP A 113 -18.177 -2.085 -18.973 1.00 0.00 H new ATOM 1835 N LEU A 114 -21.015 2.809 -14.025 1.00 0.00 N ATOM 1836 CA LEU A 114 -20.255 1.970 -13.101 1.00 0.00 C ATOM 1837 C LEU A 114 -20.930 1.939 -11.732 1.00 0.00 C ATOM 1838 O LEU A 114 -20.407 2.482 -10.760 1.00 0.00 O ATOM 1839 CB LEU A 114 -18.830 2.513 -12.956 1.00 0.00 C ATOM 1840 CG LEU A 114 -17.931 1.451 -12.308 1.00 0.00 C ATOM 1841 CD1 LEU A 114 -17.362 0.522 -13.385 1.00 0.00 C ATOM 1842 CD2 LEU A 114 -16.775 2.138 -11.574 1.00 0.00 C ATOM 0 H LEU A 114 -21.191 3.756 -13.689 1.00 0.00 H new ATOM 0 HA LEU A 114 -20.219 0.957 -13.501 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -18.435 2.789 -13.934 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -18.836 3.417 -12.348 1.00 0.00 H new ATOM 0 HG LEU A 114 -18.522 0.867 -11.602 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -16.725 -0.229 -12.918 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -18.180 0.029 -13.909 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -16.775 1.105 -14.095 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -16.137 1.384 -11.114 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -16.191 2.724 -12.283 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -17.174 2.796 -10.802 1.00 0.00 H new ATOM 1854 N PRO A 115 -22.078 1.315 -11.643 1.00 0.00 N ATOM 1855 CA PRO A 115 -22.843 1.212 -10.368 1.00 0.00 C ATOM 1856 C PRO A 115 -21.956 0.808 -9.191 1.00 0.00 C ATOM 1857 O PRO A 115 -22.390 0.812 -8.043 1.00 0.00 O ATOM 1858 CB PRO A 115 -23.890 0.133 -10.659 1.00 0.00 C ATOM 1859 CG PRO A 115 -24.087 0.158 -12.139 1.00 0.00 C ATOM 1860 CD PRO A 115 -22.771 0.643 -12.754 1.00 0.00 C ATOM 0 HA PRO A 115 -23.278 2.168 -10.076 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -23.548 -0.846 -10.325 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -24.823 0.340 -10.135 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -24.345 -0.833 -12.511 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -24.908 0.823 -12.408 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -22.184 -0.188 -13.145 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -22.948 1.326 -13.584 1.00 0.00 H new ATOM 1868 N LEU A 116 -20.713 0.453 -9.484 1.00 0.00 N ATOM 1869 CA LEU A 116 -19.776 0.045 -8.448 1.00 0.00 C ATOM 1870 C LEU A 116 -19.692 1.101 -7.352 1.00 0.00 C ATOM 1871 O LEU A 116 -19.496 0.784 -6.180 1.00 0.00 O ATOM 1872 CB LEU A 116 -18.389 -0.174 -9.060 1.00 0.00 C ATOM 1873 CG LEU A 116 -17.476 -0.884 -8.049 1.00 0.00 C ATOM 1874 CD1 LEU A 116 -17.645 -2.400 -8.173 1.00 0.00 C ATOM 1875 CD2 LEU A 116 -16.018 -0.515 -8.334 1.00 0.00 C ATOM 0 H LEU A 116 -20.331 0.439 -10.430 1.00 0.00 H new ATOM 0 HA LEU A 116 -20.131 -0.887 -8.008 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -18.473 -0.771 -9.968 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -17.953 0.783 -9.347 1.00 0.00 H new ATOM 0 HG LEU A 116 -17.746 -0.571 -7.040 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -16.995 -2.899 -7.454 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -18.682 -2.668 -7.972 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -17.378 -2.715 -9.182 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -15.369 -1.018 -7.617 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -15.754 -0.828 -9.344 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -15.891 0.564 -8.243 1.00 0.00 H new ATOM 1887 N ASP A 117 -19.832 2.365 -7.752 1.00 0.00 N ATOM 1888 CA ASP A 117 -19.764 3.477 -6.808 1.00 0.00 C ATOM 1889 C ASP A 117 -21.158 3.911 -6.365 1.00 0.00 C ATOM 1890 O ASP A 117 -21.391 4.161 -5.181 1.00 0.00 O ATOM 1891 CB ASP A 117 -19.045 4.660 -7.456 1.00 0.00 C ATOM 1892 CG ASP A 117 -17.804 4.173 -8.197 1.00 0.00 C ATOM 1893 OD1 ASP A 117 -17.310 3.113 -7.852 1.00 0.00 O ATOM 1894 OD2 ASP A 117 -17.367 4.868 -9.101 1.00 0.00 O ATOM 0 H ASP A 117 -19.993 2.642 -8.720 1.00 0.00 H new ATOM 0 HA ASP A 117 -19.212 3.143 -5.929 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -19.716 5.169 -8.148 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -18.762 5.386 -6.694 1.00 0.00 H new ATOM 1899 N LYS A 118 -22.084 4.007 -7.317 1.00 0.00 N ATOM 1900 CA LYS A 118 -23.447 4.424 -7.001 1.00 0.00 C ATOM 1901 C LYS A 118 -24.177 3.342 -6.211 1.00 0.00 C ATOM 1902 O LYS A 118 -24.846 3.629 -5.219 1.00 0.00 O ATOM 1903 CB LYS A 118 -24.212 4.721 -8.292 1.00 0.00 C ATOM 1904 CG LYS A 118 -25.602 5.261 -7.951 1.00 0.00 C ATOM 1905 CD LYS A 118 -26.215 5.915 -9.192 1.00 0.00 C ATOM 1906 CE LYS A 118 -27.586 6.496 -8.841 1.00 0.00 C ATOM 1907 NZ LYS A 118 -28.001 7.459 -9.898 1.00 0.00 N ATOM 0 H LYS A 118 -21.918 3.804 -8.303 1.00 0.00 H new ATOM 0 HA LYS A 118 -23.396 5.325 -6.390 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -23.665 5.448 -8.892 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -24.300 3.815 -8.892 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -26.242 4.452 -7.600 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -25.533 5.987 -7.141 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -25.559 6.703 -9.562 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -26.314 5.181 -9.991 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -28.321 5.696 -8.754 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -27.544 6.997 -7.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -28.933 7.855 -9.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -27.304 8.228 -9.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -28.056 6.968 -10.813 1.00 0.00 H new ATOM 1921 N TRP A 119 -24.045 2.100 -6.661 1.00 0.00 N ATOM 1922 CA TRP A 119 -24.695 0.979 -5.991 1.00 0.00 C ATOM 1923 C TRP A 119 -23.990 0.658 -4.678 1.00 0.00 C ATOM 1924 O TRP A 119 -24.555 0.001 -3.804 1.00 0.00 O ATOM 1925 CB TRP A 119 -24.682 -0.255 -6.896 1.00 0.00 C ATOM 1926 CG TRP A 119 -25.740 -1.218 -6.454 1.00 0.00 C ATOM 1927 CD1 TRP A 119 -25.625 -2.077 -5.414 1.00 0.00 C ATOM 1928 CD2 TRP A 119 -27.066 -1.433 -7.019 1.00 0.00 C ATOM 1929 NE1 TRP A 119 -26.797 -2.805 -5.306 1.00 0.00 N ATOM 1930 CE2 TRP A 119 -27.715 -2.444 -6.272 1.00 0.00 C ATOM 1931 CE3 TRP A 119 -27.761 -0.855 -8.096 1.00 0.00 C ATOM 1932 CZ2 TRP A 119 -29.009 -2.866 -6.583 1.00 0.00 C ATOM 1933 CZ3 TRP A 119 -29.062 -1.277 -8.412 1.00 0.00 C ATOM 1934 CH2 TRP A 119 -29.685 -2.281 -7.656 1.00 0.00 C ATOM 0 H TRP A 119 -23.497 1.844 -7.482 1.00 0.00 H new ATOM 0 HA TRP A 119 -25.727 1.259 -5.778 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -24.855 0.040 -7.931 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -23.703 -0.734 -6.860 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -24.761 -2.178 -4.774 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -26.962 -3.521 -4.599 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -27.291 -0.081 -8.684 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -29.484 -3.640 -5.998 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -29.586 -0.826 -9.242 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -30.686 -2.601 -7.903 1.00 0.00 H new ATOM 1945 N VAL A 120 -22.751 1.126 -4.545 1.00 0.00 N ATOM 1946 CA VAL A 120 -21.983 0.878 -3.326 1.00 0.00 C ATOM 1947 C VAL A 120 -21.153 2.101 -2.938 1.00 0.00 C ATOM 1948 O VAL A 120 -19.929 2.097 -3.067 1.00 0.00 O ATOM 1949 CB VAL A 120 -21.056 -0.324 -3.526 1.00 0.00 C ATOM 1950 CG1 VAL A 120 -20.531 -0.795 -2.170 1.00 0.00 C ATOM 1951 CG2 VAL A 120 -21.835 -1.461 -4.192 1.00 0.00 C ATOM 0 H VAL A 120 -22.262 1.672 -5.255 1.00 0.00 H new ATOM 0 HA VAL A 120 -22.688 0.669 -2.522 1.00 0.00 H new ATOM 0 HB VAL A 120 -20.218 -0.035 -4.160 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -19.871 -1.651 -2.313 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -19.978 0.014 -1.693 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -21.369 -1.085 -1.536 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -21.177 -2.318 -4.335 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -22.673 -1.749 -3.557 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -22.211 -1.127 -5.159 1.00 0.00 H new ATOM 1961 N PRO A 121 -21.797 3.134 -2.458 1.00 0.00 N ATOM 1962 CA PRO A 121 -21.112 4.385 -2.030 1.00 0.00 C ATOM 1963 C PRO A 121 -20.538 4.256 -0.619 1.00 0.00 C ATOM 1964 O PRO A 121 -19.716 5.066 -0.191 1.00 0.00 O ATOM 1965 CB PRO A 121 -22.229 5.426 -2.080 1.00 0.00 C ATOM 1966 CG PRO A 121 -23.487 4.664 -1.801 1.00 0.00 C ATOM 1967 CD PRO A 121 -23.253 3.222 -2.274 1.00 0.00 C ATOM 0 HA PRO A 121 -20.260 4.639 -2.660 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -22.071 6.210 -1.339 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -22.271 5.912 -3.055 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -23.724 4.687 -0.737 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -24.332 5.110 -2.326 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -23.606 2.499 -1.538 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -23.785 3.016 -3.203 1.00 0.00 H new ATOM 1975 N GLN A 122 -20.993 3.233 0.095 1.00 0.00 N ATOM 1976 CA GLN A 122 -20.540 2.996 1.461 1.00 0.00 C ATOM 1977 C GLN A 122 -19.019 3.039 1.541 1.00 0.00 C ATOM 1978 O GLN A 122 -18.453 3.698 2.414 1.00 0.00 O ATOM 1979 CB GLN A 122 -21.038 1.633 1.948 1.00 0.00 C ATOM 1980 CG GLN A 122 -22.564 1.579 1.853 1.00 0.00 C ATOM 1981 CD GLN A 122 -23.043 0.136 1.971 1.00 0.00 C ATOM 1982 OE1 GLN A 122 -23.198 -0.378 3.079 1.00 0.00 O ATOM 1983 NE2 GLN A 122 -23.288 -0.551 0.890 1.00 0.00 N ATOM 0 H GLN A 122 -21.674 2.555 -0.248 1.00 0.00 H new ATOM 0 HA GLN A 122 -20.947 3.782 2.097 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -20.598 0.838 1.346 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -20.722 1.466 2.978 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -23.007 2.184 2.644 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -22.893 2.004 0.905 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -23.159 -0.123 -0.027 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -23.609 -1.517 0.961 1.00 0.00 H new ATOM 1992 N VAL A 123 -18.366 2.329 0.627 1.00 0.00 N ATOM 1993 CA VAL A 123 -16.907 2.284 0.600 1.00 0.00 C ATOM 1994 C VAL A 123 -16.376 2.864 -0.707 1.00 0.00 C ATOM 1995 O VAL A 123 -15.595 2.223 -1.410 1.00 0.00 O ATOM 1996 CB VAL A 123 -16.430 0.839 0.745 1.00 0.00 C ATOM 1997 CG1 VAL A 123 -16.748 0.334 2.155 1.00 0.00 C ATOM 1998 CG2 VAL A 123 -17.151 -0.039 -0.281 1.00 0.00 C ATOM 0 H VAL A 123 -18.821 1.779 -0.102 1.00 0.00 H new ATOM 0 HA VAL A 123 -16.528 2.880 1.430 1.00 0.00 H new ATOM 0 HB VAL A 123 -15.354 0.793 0.576 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -16.408 -0.696 2.258 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -16.239 0.959 2.889 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -17.824 0.379 2.324 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -16.812 -1.070 -0.179 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -18.226 0.008 -0.109 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -16.928 0.319 -1.286 1.00 0.00 H new ATOM 2008 N PHE A 124 -16.805 4.082 -1.025 1.00 0.00 N ATOM 2009 CA PHE A 124 -16.365 4.739 -2.252 1.00 0.00 C ATOM 2010 C PHE A 124 -16.485 6.255 -2.122 1.00 0.00 C ATOM 2011 O PHE A 124 -15.625 6.996 -2.596 1.00 0.00 O ATOM 2012 CB PHE A 124 -17.208 4.251 -3.436 1.00 0.00 C ATOM 2013 CG PHE A 124 -16.415 4.387 -4.714 1.00 0.00 C ATOM 2014 CD1 PHE A 124 -16.315 5.631 -5.347 1.00 0.00 C ATOM 2015 CD2 PHE A 124 -15.777 3.268 -5.265 1.00 0.00 C ATOM 2016 CE1 PHE A 124 -15.579 5.757 -6.531 1.00 0.00 C ATOM 2017 CE2 PHE A 124 -15.041 3.394 -6.449 1.00 0.00 C ATOM 2018 CZ PHE A 124 -14.942 4.638 -7.081 1.00 0.00 C ATOM 0 H PHE A 124 -17.451 4.630 -0.456 1.00 0.00 H new ATOM 0 HA PHE A 124 -15.319 4.486 -2.425 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -17.497 3.211 -3.285 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -18.128 4.831 -3.504 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -16.806 6.494 -4.922 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -15.853 2.308 -4.776 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -15.503 6.717 -7.020 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -14.550 2.531 -6.874 1.00 0.00 H new ATOM 0 HZ PHE A 124 -14.374 4.735 -7.994 1.00 0.00 H new ATOM 2028 N VAL A 125 -17.556 6.711 -1.479 1.00 0.00 N ATOM 2029 CA VAL A 125 -17.769 8.143 -1.296 1.00 0.00 C ATOM 2030 C VAL A 125 -16.627 8.759 -0.491 1.00 0.00 C ATOM 2031 O VAL A 125 -16.263 8.255 0.571 1.00 0.00 O ATOM 2032 CB VAL A 125 -19.095 8.386 -0.572 1.00 0.00 C ATOM 2033 CG1 VAL A 125 -18.988 7.892 0.872 1.00 0.00 C ATOM 2034 CG2 VAL A 125 -19.409 9.885 -0.576 1.00 0.00 C ATOM 0 H VAL A 125 -18.283 6.117 -1.080 1.00 0.00 H new ATOM 0 HA VAL A 125 -17.800 8.614 -2.279 1.00 0.00 H new ATOM 0 HB VAL A 125 -19.892 7.845 -1.082 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -19.933 8.066 1.387 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -18.763 6.825 0.876 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -18.192 8.433 1.383 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -20.353 10.060 -0.061 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -18.611 10.425 -0.066 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -19.486 10.238 -1.604 1.00 0.00 H new ATOM 2044 N ALA A 126 -16.067 9.851 -1.005 1.00 0.00 N ATOM 2045 CA ALA A 126 -14.965 10.530 -0.325 1.00 0.00 C ATOM 2046 C ALA A 126 -15.495 11.658 0.557 1.00 0.00 C ATOM 2047 O ALA A 126 -16.532 12.253 0.261 1.00 0.00 O ATOM 2048 CB ALA A 126 -13.991 11.098 -1.358 1.00 0.00 C ATOM 0 H ALA A 126 -16.355 10.283 -1.883 1.00 0.00 H new ATOM 0 HA ALA A 126 -14.446 9.807 0.305 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -13.172 11.603 -0.846 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -13.593 10.287 -1.968 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -14.513 11.810 -1.997 1.00 0.00 H new ATOM 2054 N SER A 127 -14.779 11.951 1.640 1.00 0.00 N ATOM 2055 CA SER A 127 -15.190 13.012 2.554 1.00 0.00 C ATOM 2056 C SER A 127 -14.019 13.457 3.428 1.00 0.00 C ATOM 2057 O SER A 127 -13.690 12.806 4.420 1.00 0.00 O ATOM 2058 CB SER A 127 -16.331 12.517 3.443 1.00 0.00 C ATOM 2059 OG SER A 127 -16.443 13.364 4.580 1.00 0.00 O ATOM 0 H SER A 127 -13.918 11.472 1.904 1.00 0.00 H new ATOM 0 HA SER A 127 -15.528 13.863 1.963 1.00 0.00 H new ATOM 0 HB2 SER A 127 -17.267 12.513 2.884 1.00 0.00 H new ATOM 0 HB3 SER A 127 -16.143 11.490 3.757 1.00 0.00 H new ATOM 0 HG SER A 127 -17.175 13.050 5.151 1.00 0.00 H new ATOM 2065 N GLY A 128 -13.394 14.572 3.053 1.00 0.00 N ATOM 2066 CA GLY A 128 -12.260 15.101 3.811 1.00 0.00 C ATOM 2067 C GLY A 128 -11.163 15.600 2.875 1.00 0.00 C ATOM 2068 O GLY A 128 -11.350 15.652 1.659 1.00 0.00 O ATOM 0 H GLY A 128 -13.651 15.124 2.235 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -12.595 15.916 4.452 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -11.861 14.325 4.464 1.00 0.00 H new ATOM 2072 N ASP A 129 -10.016 15.961 3.447 1.00 0.00 N ATOM 2073 CA ASP A 129 -8.896 16.446 2.651 1.00 0.00 C ATOM 2074 C ASP A 129 -8.031 15.275 2.203 1.00 0.00 C ATOM 2075 O ASP A 129 -7.970 14.245 2.874 1.00 0.00 O ATOM 2076 CB ASP A 129 -8.056 17.427 3.471 1.00 0.00 C ATOM 2077 CG ASP A 129 -8.783 18.762 3.597 1.00 0.00 C ATOM 2078 OD1 ASP A 129 -9.784 18.804 4.294 1.00 0.00 O ATOM 2079 OD2 ASP A 129 -8.330 19.720 2.993 1.00 0.00 O ATOM 0 H ASP A 129 -9.841 15.927 4.451 1.00 0.00 H new ATOM 0 HA ASP A 129 -9.285 16.960 1.772 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -7.864 17.014 4.461 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -7.087 17.575 2.994 1.00 0.00 H new ATOM 2084 N CYS A 130 -7.368 15.433 1.061 1.00 0.00 N ATOM 2085 CA CYS A 130 -6.516 14.374 0.529 1.00 0.00 C ATOM 2086 C CYS A 130 -5.043 14.687 0.776 1.00 0.00 C ATOM 2087 O CYS A 130 -4.577 15.785 0.478 1.00 0.00 O ATOM 2088 CB CYS A 130 -6.764 14.213 -0.973 1.00 0.00 C ATOM 2089 SG CYS A 130 -8.222 13.173 -1.239 1.00 0.00 S ATOM 0 H CYS A 130 -7.403 16.277 0.490 1.00 0.00 H new ATOM 0 HA CYS A 130 -6.763 13.444 1.041 1.00 0.00 H new ATOM 0 HB2 CYS A 130 -6.912 15.189 -1.434 1.00 0.00 H new ATOM 0 HB3 CYS A 130 -5.893 13.764 -1.450 1.00 0.00 H new ATOM 2094 N ALA A 131 -4.329 13.702 1.323 1.00 0.00 N ATOM 2095 CA ALA A 131 -2.900 13.837 1.622 1.00 0.00 C ATOM 2096 C ALA A 131 -2.679 14.207 3.085 1.00 0.00 C ATOM 2097 O ALA A 131 -1.548 14.187 3.571 1.00 0.00 O ATOM 2098 CB ALA A 131 -2.243 14.889 0.719 1.00 0.00 C ATOM 0 H ALA A 131 -4.721 12.793 1.570 1.00 0.00 H new ATOM 0 HA ALA A 131 -2.436 12.870 1.429 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -1.184 14.968 0.963 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -2.354 14.593 -0.324 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -2.724 15.854 0.876 1.00 0.00 H new ATOM 2104 N GLU A 132 -3.758 14.537 3.789 1.00 0.00 N ATOM 2105 CA GLU A 132 -3.644 14.897 5.198 1.00 0.00 C ATOM 2106 C GLU A 132 -3.248 13.672 6.019 1.00 0.00 C ATOM 2107 O GLU A 132 -3.571 12.541 5.657 1.00 0.00 O ATOM 2108 CB GLU A 132 -4.975 15.461 5.715 1.00 0.00 C ATOM 2109 CG GLU A 132 -6.137 14.834 4.944 1.00 0.00 C ATOM 2110 CD GLU A 132 -5.982 13.318 4.894 1.00 0.00 C ATOM 2111 OE1 GLU A 132 -6.160 12.689 5.923 1.00 0.00 O ATOM 2112 OE2 GLU A 132 -5.689 12.807 3.825 1.00 0.00 O ATOM 0 H GLU A 132 -4.706 14.563 3.414 1.00 0.00 H new ATOM 0 HA GLU A 132 -2.874 15.662 5.301 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -5.079 15.254 6.780 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -4.991 16.545 5.598 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -7.082 15.094 5.421 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -6.170 15.237 3.932 1.00 0.00 H new ATOM 2119 N ARG A 133 -2.544 13.906 7.122 1.00 0.00 N ATOM 2120 CA ARG A 133 -2.108 12.813 7.985 1.00 0.00 C ATOM 2121 C ARG A 133 -3.202 12.455 8.986 1.00 0.00 C ATOM 2122 O ARG A 133 -3.828 13.334 9.577 1.00 0.00 O ATOM 2123 CB ARG A 133 -0.836 13.216 8.734 1.00 0.00 C ATOM 2124 CG ARG A 133 -0.970 14.657 9.231 1.00 0.00 C ATOM 2125 CD ARG A 133 0.182 14.980 10.184 1.00 0.00 C ATOM 2126 NE ARG A 133 -0.061 14.376 11.490 1.00 0.00 N ATOM 2127 CZ ARG A 133 0.642 14.742 12.557 1.00 0.00 C ATOM 2128 NH1 ARG A 133 1.563 15.660 12.448 1.00 0.00 N ATOM 2129 NH2 ARG A 133 0.410 14.185 13.714 1.00 0.00 N ATOM 0 H ARG A 133 -2.265 14.835 7.438 1.00 0.00 H new ATOM 0 HA ARG A 133 -1.901 11.942 7.364 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -0.669 12.544 9.576 1.00 0.00 H new ATOM 0 HB3 ARG A 133 0.029 13.126 8.077 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -0.961 15.346 8.386 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -1.925 14.790 9.740 1.00 0.00 H new ATOM 0 HD2 ARG A 133 1.120 14.608 9.772 1.00 0.00 H new ATOM 0 HD3 ARG A 133 0.286 16.060 10.288 1.00 0.00 H new ATOM 0 HE ARG A 133 -0.782 13.661 11.586 1.00 0.00 H new ATOM 0 HH11 ARG A 133 1.743 16.097 11.544 1.00 0.00 H new ATOM 0 HH12 ARG A 133 2.102 15.941 13.267 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -0.311 13.469 13.800 1.00 0.00 H new ATOM 0 HH22 ARG A 133 0.950 14.466 14.533 1.00 0.00 H new ATOM 2143 N GLN A 134 -3.428 11.155 9.165 1.00 0.00 N ATOM 2144 CA GLN A 134 -4.454 10.682 10.092 1.00 0.00 C ATOM 2145 C GLN A 134 -3.873 9.669 11.075 1.00 0.00 C ATOM 2146 O GLN A 134 -4.466 9.396 12.119 1.00 0.00 O ATOM 2147 CB GLN A 134 -5.598 10.036 9.310 1.00 0.00 C ATOM 2148 CG GLN A 134 -6.261 11.085 8.416 1.00 0.00 C ATOM 2149 CD GLN A 134 -7.072 12.057 9.266 1.00 0.00 C ATOM 2150 OE1 GLN A 134 -8.361 11.886 9.385 1.00 0.00 O flip ATOM 2151 NE2 GLN A 134 -6.519 12.996 9.837 1.00 0.00 N flip ATOM 0 H GLN A 134 -2.918 10.414 8.684 1.00 0.00 H new ATOM 0 HA GLN A 134 -4.829 11.537 10.655 1.00 0.00 H new ATOM 0 HB2 GLN A 134 -5.219 9.213 8.704 1.00 0.00 H new ATOM 0 HB3 GLN A 134 -6.330 9.614 9.998 1.00 0.00 H new ATOM 0 HG2 GLN A 134 -5.501 11.628 7.853 1.00 0.00 H new ATOM 0 HG3 GLN A 134 -6.909 10.597 7.688 1.00 0.00 H new ATOM 0 HE21 GLN A 134 -5.512 13.128 9.743 1.00 0.00 H new ATOM 0 HE22 GLN A 134 -7.068 13.642 10.404 1.00 0.00 H new ATOM 2160 N TRP A 135 -2.713 9.114 10.739 1.00 0.00 N ATOM 2161 CA TRP A 135 -2.072 8.133 11.608 1.00 0.00 C ATOM 2162 C TRP A 135 -0.680 7.776 11.095 1.00 0.00 C ATOM 2163 O TRP A 135 -0.529 7.324 9.960 1.00 0.00 O ATOM 2164 CB TRP A 135 -2.927 6.867 11.688 1.00 0.00 C ATOM 2165 CG TRP A 135 -2.245 5.861 12.559 1.00 0.00 C ATOM 2166 CD1 TRP A 135 -1.766 4.668 12.139 1.00 0.00 C ATOM 2167 CD2 TRP A 135 -1.955 5.939 13.985 1.00 0.00 C ATOM 2168 NE1 TRP A 135 -1.201 4.009 13.216 1.00 0.00 N ATOM 2169 CE2 TRP A 135 -1.294 4.751 14.376 1.00 0.00 C ATOM 2170 CE3 TRP A 135 -2.200 6.916 14.969 1.00 0.00 C ATOM 2171 CZ2 TRP A 135 -0.888 4.539 15.695 1.00 0.00 C ATOM 2172 CZ3 TRP A 135 -1.793 6.705 16.297 1.00 0.00 C ATOM 2173 CH2 TRP A 135 -1.139 5.518 16.659 1.00 0.00 C ATOM 0 H TRP A 135 -2.202 9.323 9.881 1.00 0.00 H new ATOM 0 HA TRP A 135 -1.975 8.572 12.601 1.00 0.00 H new ATOM 0 HB2 TRP A 135 -3.912 7.105 12.091 1.00 0.00 H new ATOM 0 HB3 TRP A 135 -3.081 6.456 10.691 1.00 0.00 H new ATOM 0 HD1 TRP A 135 -1.816 4.291 11.128 1.00 0.00 H new ATOM 0 HE1 TRP A 135 -0.768 3.087 13.160 1.00 0.00 H new ATOM 0 HE3 TRP A 135 -2.704 7.833 14.701 1.00 0.00 H new ATOM 0 HZ2 TRP A 135 -0.383 3.624 15.968 1.00 0.00 H new ATOM 0 HZ3 TRP A 135 -1.985 7.461 17.044 1.00 0.00 H new ATOM 0 HH2 TRP A 135 -0.830 5.361 17.682 1.00 0.00 H new ATOM 2184 N ASP A 136 0.338 8.012 11.919 1.00 0.00 N ATOM 2185 CA ASP A 136 1.717 7.743 11.511 1.00 0.00 C ATOM 2186 C ASP A 136 2.361 6.636 12.342 1.00 0.00 C ATOM 2187 O ASP A 136 2.064 6.468 13.525 1.00 0.00 O ATOM 2188 CB ASP A 136 2.542 9.023 11.647 1.00 0.00 C ATOM 2189 CG ASP A 136 3.976 8.777 11.188 1.00 0.00 C ATOM 2190 OD1 ASP A 136 4.612 7.898 11.743 1.00 0.00 O ATOM 2191 OD2 ASP A 136 4.417 9.477 10.292 1.00 0.00 O ATOM 0 H ASP A 136 0.238 8.385 12.863 1.00 0.00 H new ATOM 0 HA ASP A 136 1.696 7.407 10.474 1.00 0.00 H new ATOM 0 HB2 ASP A 136 2.093 9.818 11.052 1.00 0.00 H new ATOM 0 HB3 ASP A 136 2.537 9.359 12.684 1.00 0.00 H new ATOM 2196 N PHE A 137 3.270 5.904 11.701 1.00 0.00 N ATOM 2197 CA PHE A 137 4.005 4.822 12.349 1.00 0.00 C ATOM 2198 C PHE A 137 5.499 5.028 12.104 1.00 0.00 C ATOM 2199 O PHE A 137 5.906 5.355 10.991 1.00 0.00 O ATOM 2200 CB PHE A 137 3.559 3.469 11.778 1.00 0.00 C ATOM 2201 CG PHE A 137 3.795 2.380 12.800 1.00 0.00 C ATOM 2202 CD1 PHE A 137 3.075 2.384 14.001 1.00 0.00 C ATOM 2203 CD2 PHE A 137 4.728 1.368 12.547 1.00 0.00 C ATOM 2204 CE1 PHE A 137 3.290 1.377 14.950 1.00 0.00 C ATOM 2205 CE2 PHE A 137 4.943 0.360 13.496 1.00 0.00 C ATOM 2206 CZ PHE A 137 4.224 0.364 14.696 1.00 0.00 C ATOM 0 H PHE A 137 3.517 6.044 10.721 1.00 0.00 H new ATOM 0 HA PHE A 137 3.803 4.828 13.420 1.00 0.00 H new ATOM 0 HB2 PHE A 137 2.503 3.507 11.510 1.00 0.00 H new ATOM 0 HB3 PHE A 137 4.112 3.249 10.864 1.00 0.00 H new ATOM 0 HD1 PHE A 137 2.354 3.164 14.195 1.00 0.00 H new ATOM 0 HD2 PHE A 137 5.282 1.364 11.620 1.00 0.00 H new ATOM 0 HE1 PHE A 137 2.736 1.381 15.877 1.00 0.00 H new ATOM 0 HE2 PHE A 137 5.664 -0.420 13.301 1.00 0.00 H new ATOM 0 HZ PHE A 137 4.389 -0.414 15.427 1.00 0.00 H new ATOM 2216 N LEU A 138 6.312 4.837 13.135 1.00 0.00 N ATOM 2217 CA LEU A 138 7.754 5.014 12.983 1.00 0.00 C ATOM 2218 C LEU A 138 8.065 6.399 12.414 1.00 0.00 C ATOM 2219 O LEU A 138 9.167 6.642 11.921 1.00 0.00 O ATOM 2220 CB LEU A 138 8.320 3.925 12.056 1.00 0.00 C ATOM 2221 CG LEU A 138 9.059 2.863 12.877 1.00 0.00 C ATOM 2222 CD1 LEU A 138 8.062 2.109 13.758 1.00 0.00 C ATOM 2223 CD2 LEU A 138 9.745 1.876 11.930 1.00 0.00 C ATOM 0 H LEU A 138 6.007 4.565 14.070 1.00 0.00 H new ATOM 0 HA LEU A 138 8.222 4.928 13.964 1.00 0.00 H new ATOM 0 HB2 LEU A 138 7.511 3.461 11.492 1.00 0.00 H new ATOM 0 HB3 LEU A 138 8.999 4.372 11.330 1.00 0.00 H new ATOM 0 HG LEU A 138 9.805 3.347 13.507 1.00 0.00 H new ATOM 0 HD11 LEU A 138 8.590 1.354 14.341 1.00 0.00 H new ATOM 0 HD12 LEU A 138 7.570 2.810 14.432 1.00 0.00 H new ATOM 0 HD13 LEU A 138 7.315 1.625 13.129 1.00 0.00 H new ATOM 0 HD21 LEU A 138 10.271 1.119 12.512 1.00 0.00 H new ATOM 0 HD22 LEU A 138 8.996 1.394 11.302 1.00 0.00 H new ATOM 0 HD23 LEU A 138 10.457 2.410 11.301 1.00 0.00 H new ATOM 2235 N GLY A 139 7.097 7.307 12.491 1.00 0.00 N ATOM 2236 CA GLY A 139 7.293 8.664 11.984 1.00 0.00 C ATOM 2237 C GLY A 139 6.930 8.771 10.504 1.00 0.00 C ATOM 2238 O GLY A 139 7.246 9.766 9.851 1.00 0.00 O ATOM 0 H GLY A 139 6.177 7.132 12.895 1.00 0.00 H new ATOM 0 HA2 GLY A 139 6.682 9.360 12.560 1.00 0.00 H new ATOM 0 HA3 GLY A 139 8.333 8.959 12.126 1.00 0.00 H new ATOM 2242 N LEU A 140 6.259 7.747 9.981 1.00 0.00 N ATOM 2243 CA LEU A 140 5.848 7.732 8.577 1.00 0.00 C ATOM 2244 C LEU A 140 4.330 7.600 8.487 1.00 0.00 C ATOM 2245 O LEU A 140 3.706 6.950 9.322 1.00 0.00 O ATOM 2246 CB LEU A 140 6.512 6.553 7.849 1.00 0.00 C ATOM 2247 CG LEU A 140 7.837 7.000 7.220 1.00 0.00 C ATOM 2248 CD1 LEU A 140 8.819 7.424 8.319 1.00 0.00 C ATOM 2249 CD2 LEU A 140 8.431 5.836 6.423 1.00 0.00 C ATOM 0 H LEU A 140 5.988 6.916 10.507 1.00 0.00 H new ATOM 0 HA LEU A 140 6.159 8.664 8.105 1.00 0.00 H new ATOM 0 HB2 LEU A 140 6.690 5.737 8.549 1.00 0.00 H new ATOM 0 HB3 LEU A 140 5.845 6.170 7.077 1.00 0.00 H new ATOM 0 HG LEU A 140 7.658 7.847 6.558 1.00 0.00 H new ATOM 0 HD11 LEU A 140 9.758 7.740 7.865 1.00 0.00 H new ATOM 0 HD12 LEU A 140 8.394 8.251 8.888 1.00 0.00 H new ATOM 0 HD13 LEU A 140 9.004 6.582 8.986 1.00 0.00 H new ATOM 0 HD21 LEU A 140 9.374 6.147 5.973 1.00 0.00 H new ATOM 0 HD22 LEU A 140 8.608 4.992 7.089 1.00 0.00 H new ATOM 0 HD23 LEU A 140 7.735 5.539 5.639 1.00 0.00 H new ATOM 2261 N GLU A 141 3.744 8.217 7.469 1.00 0.00 N ATOM 2262 CA GLU A 141 2.300 8.158 7.284 1.00 0.00 C ATOM 2263 C GLU A 141 1.887 6.808 6.708 1.00 0.00 C ATOM 2264 O GLU A 141 2.658 6.166 5.994 1.00 0.00 O ATOM 2265 CB GLU A 141 1.847 9.277 6.345 1.00 0.00 C ATOM 2266 CG GLU A 141 2.030 10.628 7.039 1.00 0.00 C ATOM 2267 CD GLU A 141 1.671 11.759 6.081 1.00 0.00 C ATOM 2268 OE1 GLU A 141 0.782 11.562 5.270 1.00 0.00 O ATOM 2269 OE2 GLU A 141 2.292 12.805 6.173 1.00 0.00 O ATOM 0 H GLU A 141 4.242 8.760 6.764 1.00 0.00 H new ATOM 0 HA GLU A 141 1.823 8.285 8.256 1.00 0.00 H new ATOM 0 HB2 GLU A 141 2.426 9.249 5.422 1.00 0.00 H new ATOM 0 HB3 GLU A 141 0.802 9.135 6.070 1.00 0.00 H new ATOM 0 HG2 GLU A 141 1.400 10.678 7.927 1.00 0.00 H new ATOM 0 HG3 GLU A 141 3.062 10.737 7.374 1.00 0.00 H new ATOM 2276 N MET A 142 0.669 6.384 7.024 1.00 0.00 N ATOM 2277 CA MET A 142 0.166 5.108 6.532 1.00 0.00 C ATOM 2278 C MET A 142 0.415 4.979 5.027 1.00 0.00 C ATOM 2279 O MET A 142 1.162 4.101 4.593 1.00 0.00 O ATOM 2280 CB MET A 142 -1.333 4.982 6.844 1.00 0.00 C ATOM 2281 CG MET A 142 -1.528 4.165 8.125 1.00 0.00 C ATOM 2282 SD MET A 142 -1.061 2.442 7.818 1.00 0.00 S ATOM 2283 CE MET A 142 0.120 2.268 9.179 1.00 0.00 C ATOM 0 H MET A 142 0.016 6.900 7.614 1.00 0.00 H new ATOM 0 HA MET A 142 0.698 4.301 7.035 1.00 0.00 H new ATOM 0 HB2 MET A 142 -1.774 5.972 6.962 1.00 0.00 H new ATOM 0 HB3 MET A 142 -1.848 4.501 6.013 1.00 0.00 H new ATOM 0 HG2 MET A 142 -0.921 4.580 8.930 1.00 0.00 H new ATOM 0 HG3 MET A 142 -2.567 4.219 8.449 1.00 0.00 H new ATOM 0 HE1 MET A 142 0.535 1.260 9.174 1.00 0.00 H new ATOM 0 HE2 MET A 142 0.925 2.993 9.057 1.00 0.00 H new ATOM 0 HE3 MET A 142 -0.388 2.446 10.127 1.00 0.00 H new ATOM 2293 N PRO A 143 -0.181 5.831 4.228 1.00 0.00 N ATOM 2294 CA PRO A 143 -0.009 5.811 2.754 1.00 0.00 C ATOM 2295 C PRO A 143 1.382 5.335 2.335 1.00 0.00 C ATOM 2296 O PRO A 143 1.528 4.600 1.358 1.00 0.00 O ATOM 2297 CB PRO A 143 -0.232 7.272 2.367 1.00 0.00 C ATOM 2298 CG PRO A 143 -1.183 7.817 3.393 1.00 0.00 C ATOM 2299 CD PRO A 143 -1.093 6.912 4.634 1.00 0.00 C ATOM 0 HA PRO A 143 -0.692 5.117 2.263 1.00 0.00 H new ATOM 0 HB2 PRO A 143 0.707 7.826 2.368 1.00 0.00 H new ATOM 0 HB3 PRO A 143 -0.649 7.353 1.363 1.00 0.00 H new ATOM 0 HG2 PRO A 143 -0.924 8.845 3.648 1.00 0.00 H new ATOM 0 HG3 PRO A 143 -2.201 7.832 3.003 1.00 0.00 H new ATOM 0 HD2 PRO A 143 -0.707 7.456 5.496 1.00 0.00 H new ATOM 0 HD3 PRO A 143 -2.072 6.523 4.915 1.00 0.00 H new ATOM 2307 N GLN A 144 2.398 5.752 3.083 1.00 0.00 N ATOM 2308 CA GLN A 144 3.765 5.352 2.776 1.00 0.00 C ATOM 2309 C GLN A 144 3.957 3.866 3.059 1.00 0.00 C ATOM 2310 O GLN A 144 4.401 3.108 2.195 1.00 0.00 O ATOM 2311 CB GLN A 144 4.753 6.166 3.616 1.00 0.00 C ATOM 2312 CG GLN A 144 6.171 5.954 3.083 1.00 0.00 C ATOM 2313 CD GLN A 144 6.339 6.661 1.742 1.00 0.00 C ATOM 2314 OE1 GLN A 144 5.381 7.428 1.295 1.00 0.00 O flip ATOM 2315 NE2 GLN A 144 7.368 6.512 1.084 1.00 0.00 N flip ATOM 0 H GLN A 144 2.303 6.360 3.897 1.00 0.00 H new ATOM 0 HA GLN A 144 3.952 5.540 1.719 1.00 0.00 H new ATOM 0 HB2 GLN A 144 4.493 7.224 3.578 1.00 0.00 H new ATOM 0 HB3 GLN A 144 4.696 5.861 4.661 1.00 0.00 H new ATOM 0 HG2 GLN A 144 6.898 6.338 3.799 1.00 0.00 H new ATOM 0 HG3 GLN A 144 6.369 4.888 2.968 1.00 0.00 H new ATOM 0 HE21 GLN A 144 8.115 5.913 1.435 1.00 0.00 H new ATOM 0 HE22 GLN A 144 7.474 6.988 0.188 1.00 0.00 H new ATOM 2324 N TRP A 145 3.621 3.456 4.275 1.00 0.00 N ATOM 2325 CA TRP A 145 3.763 2.058 4.655 1.00 0.00 C ATOM 2326 C TRP A 145 2.913 1.171 3.753 1.00 0.00 C ATOM 2327 O TRP A 145 3.426 0.260 3.106 1.00 0.00 O ATOM 2328 CB TRP A 145 3.338 1.864 6.111 1.00 0.00 C ATOM 2329 CG TRP A 145 4.344 2.503 7.013 1.00 0.00 C ATOM 2330 CD1 TRP A 145 4.095 3.547 7.839 1.00 0.00 C ATOM 2331 CD2 TRP A 145 5.748 2.162 7.197 1.00 0.00 C ATOM 2332 NE1 TRP A 145 5.257 3.867 8.515 1.00 0.00 N ATOM 2333 CE2 TRP A 145 6.304 3.043 8.153 1.00 0.00 C ATOM 2334 CE3 TRP A 145 6.586 1.184 6.631 1.00 0.00 C ATOM 2335 CZ2 TRP A 145 7.644 2.958 8.535 1.00 0.00 C ATOM 2336 CZ3 TRP A 145 7.934 1.095 7.013 1.00 0.00 C ATOM 2337 CH2 TRP A 145 8.462 1.981 7.963 1.00 0.00 C ATOM 0 H TRP A 145 3.253 4.064 5.007 1.00 0.00 H new ATOM 0 HA TRP A 145 4.810 1.776 4.544 1.00 0.00 H new ATOM 0 HB2 TRP A 145 2.355 2.304 6.276 1.00 0.00 H new ATOM 0 HB3 TRP A 145 3.254 0.801 6.338 1.00 0.00 H new ATOM 0 HD1 TRP A 145 3.144 4.047 7.951 1.00 0.00 H new ATOM 0 HE1 TRP A 145 5.332 4.620 9.198 1.00 0.00 H new ATOM 0 HE3 TRP A 145 6.190 0.497 5.898 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 8.045 3.643 9.267 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 8.568 0.340 6.573 1.00 0.00 H new ATOM 0 HH2 TRP A 145 9.500 1.908 8.252 1.00 0.00 H new ATOM 2348 N LEU A 146 1.614 1.443 3.710 1.00 0.00 N ATOM 2349 CA LEU A 146 0.714 0.658 2.873 1.00 0.00 C ATOM 2350 C LEU A 146 1.348 0.422 1.502 1.00 0.00 C ATOM 2351 O LEU A 146 1.219 -0.660 0.929 1.00 0.00 O ATOM 2352 CB LEU A 146 -0.623 1.389 2.710 1.00 0.00 C ATOM 2353 CG LEU A 146 -1.523 0.623 1.735 1.00 0.00 C ATOM 2354 CD1 LEU A 146 -1.700 -0.822 2.213 1.00 0.00 C ATOM 2355 CD2 LEU A 146 -2.891 1.308 1.668 1.00 0.00 C ATOM 0 H LEU A 146 1.164 2.191 4.238 1.00 0.00 H new ATOM 0 HA LEU A 146 0.536 -0.304 3.353 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -1.117 1.482 3.677 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -0.451 2.400 2.342 1.00 0.00 H new ATOM 0 HG LEU A 146 -1.063 0.618 0.747 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -2.341 -1.360 1.515 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -0.727 -1.311 2.263 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -2.158 -0.825 3.202 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -3.535 0.767 0.975 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -3.345 1.311 2.659 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -2.767 2.334 1.322 1.00 0.00 H new ATOM 2367 N LEU A 147 2.052 1.432 0.989 1.00 0.00 N ATOM 2368 CA LEU A 147 2.719 1.298 -0.303 1.00 0.00 C ATOM 2369 C LEU A 147 3.756 0.186 -0.212 1.00 0.00 C ATOM 2370 O LEU A 147 3.983 -0.558 -1.165 1.00 0.00 O ATOM 2371 CB LEU A 147 3.402 2.613 -0.692 1.00 0.00 C ATOM 2372 CG LEU A 147 3.794 2.576 -2.176 1.00 0.00 C ATOM 2373 CD1 LEU A 147 2.610 3.025 -3.039 1.00 0.00 C ATOM 2374 CD2 LEU A 147 4.978 3.516 -2.417 1.00 0.00 C ATOM 0 H LEU A 147 2.173 2.338 1.441 1.00 0.00 H new ATOM 0 HA LEU A 147 1.979 1.055 -1.066 1.00 0.00 H new ATOM 0 HB2 LEU A 147 2.731 3.451 -0.504 1.00 0.00 H new ATOM 0 HB3 LEU A 147 4.288 2.770 -0.076 1.00 0.00 H new ATOM 0 HG LEU A 147 4.073 1.557 -2.445 1.00 0.00 H new ATOM 0 HD11 LEU A 147 2.895 2.996 -4.091 1.00 0.00 H new ATOM 0 HD12 LEU A 147 1.765 2.357 -2.874 1.00 0.00 H new ATOM 0 HD13 LEU A 147 2.327 4.042 -2.767 1.00 0.00 H new ATOM 0 HD21 LEU A 147 5.255 3.489 -3.471 1.00 0.00 H new ATOM 0 HD22 LEU A 147 4.697 4.533 -2.142 1.00 0.00 H new ATOM 0 HD23 LEU A 147 5.825 3.197 -1.810 1.00 0.00 H new ATOM 2386 N GLY A 148 4.366 0.086 0.963 1.00 0.00 N ATOM 2387 CA GLY A 148 5.371 -0.947 1.195 1.00 0.00 C ATOM 2388 C GLY A 148 4.764 -2.332 0.987 1.00 0.00 C ATOM 2389 O GLY A 148 5.355 -3.198 0.337 1.00 0.00 O ATOM 0 H GLY A 148 4.187 0.697 1.760 1.00 0.00 H new ATOM 0 HA2 GLY A 148 6.212 -0.805 0.516 1.00 0.00 H new ATOM 0 HA3 GLY A 148 5.762 -0.862 2.209 1.00 0.00 H new ATOM 2393 N ILE A 149 3.569 -2.525 1.532 1.00 0.00 N ATOM 2394 CA ILE A 149 2.873 -3.798 1.398 1.00 0.00 C ATOM 2395 C ILE A 149 2.278 -3.919 -0.002 1.00 0.00 C ATOM 2396 O ILE A 149 2.071 -5.020 -0.508 1.00 0.00 O ATOM 2397 CB ILE A 149 1.764 -3.899 2.450 1.00 0.00 C ATOM 2398 CG1 ILE A 149 2.389 -4.085 3.837 1.00 0.00 C ATOM 2399 CG2 ILE A 149 0.864 -5.098 2.137 1.00 0.00 C ATOM 2400 CD1 ILE A 149 3.188 -2.836 4.223 1.00 0.00 C ATOM 0 H ILE A 149 3.064 -1.820 2.068 1.00 0.00 H new ATOM 0 HA ILE A 149 3.583 -4.611 1.553 1.00 0.00 H new ATOM 0 HB ILE A 149 1.171 -2.985 2.435 1.00 0.00 H new ATOM 0 HG12 ILE A 149 1.608 -4.270 4.575 1.00 0.00 H new ATOM 0 HG13 ILE A 149 3.041 -4.958 3.837 1.00 0.00 H new ATOM 0 HG21 ILE A 149 0.076 -5.167 2.887 1.00 0.00 H new ATOM 0 HG22 ILE A 149 0.416 -4.970 1.151 1.00 0.00 H new ATOM 0 HG23 ILE A 149 1.458 -6.012 2.149 1.00 0.00 H new ATOM 0 HD11 ILE A 149 3.629 -2.977 5.210 1.00 0.00 H new ATOM 0 HD12 ILE A 149 3.980 -2.670 3.492 1.00 0.00 H new ATOM 0 HD13 ILE A 149 2.525 -1.971 4.242 1.00 0.00 H new ATOM 2412 N PHE A 150 2.006 -2.772 -0.617 1.00 0.00 N ATOM 2413 CA PHE A 150 1.434 -2.750 -1.957 1.00 0.00 C ATOM 2414 C PHE A 150 2.390 -3.393 -2.957 1.00 0.00 C ATOM 2415 O PHE A 150 1.980 -4.197 -3.793 1.00 0.00 O ATOM 2416 CB PHE A 150 1.142 -1.308 -2.377 1.00 0.00 C ATOM 2417 CG PHE A 150 0.255 -1.308 -3.600 1.00 0.00 C ATOM 2418 CD1 PHE A 150 -1.094 -1.669 -3.486 1.00 0.00 C ATOM 2419 CD2 PHE A 150 0.779 -0.945 -4.847 1.00 0.00 C ATOM 2420 CE1 PHE A 150 -1.917 -1.667 -4.618 1.00 0.00 C ATOM 2421 CE2 PHE A 150 -0.045 -0.944 -5.979 1.00 0.00 C ATOM 2422 CZ PHE A 150 -1.393 -1.305 -5.865 1.00 0.00 C ATOM 0 H PHE A 150 2.172 -1.851 -0.211 1.00 0.00 H new ATOM 0 HA PHE A 150 0.504 -3.318 -1.945 1.00 0.00 H new ATOM 0 HB2 PHE A 150 0.655 -0.772 -1.562 1.00 0.00 H new ATOM 0 HB3 PHE A 150 2.074 -0.785 -2.591 1.00 0.00 H new ATOM 0 HD1 PHE A 150 -1.499 -1.949 -2.525 1.00 0.00 H new ATOM 0 HD2 PHE A 150 1.819 -0.666 -4.935 1.00 0.00 H new ATOM 0 HE1 PHE A 150 -2.957 -1.945 -4.530 1.00 0.00 H new ATOM 0 HE2 PHE A 150 0.359 -0.665 -6.941 1.00 0.00 H new ATOM 0 HZ PHE A 150 -2.028 -1.304 -6.738 1.00 0.00 H new ATOM 2432 N ILE A 151 3.664 -3.026 -2.869 1.00 0.00 N ATOM 2433 CA ILE A 151 4.666 -3.567 -3.780 1.00 0.00 C ATOM 2434 C ILE A 151 4.899 -5.045 -3.501 1.00 0.00 C ATOM 2435 O ILE A 151 5.070 -5.838 -4.427 1.00 0.00 O ATOM 2436 CB ILE A 151 5.986 -2.801 -3.645 1.00 0.00 C ATOM 2437 CG1 ILE A 151 6.360 -2.670 -2.168 1.00 0.00 C ATOM 2438 CG2 ILE A 151 5.829 -1.406 -4.255 1.00 0.00 C ATOM 2439 CD1 ILE A 151 7.741 -2.021 -2.045 1.00 0.00 C ATOM 0 H ILE A 151 4.025 -2.363 -2.183 1.00 0.00 H new ATOM 0 HA ILE A 151 4.294 -3.453 -4.798 1.00 0.00 H new ATOM 0 HB ILE A 151 6.772 -3.344 -4.169 1.00 0.00 H new ATOM 0 HG12 ILE A 151 5.616 -2.068 -1.646 1.00 0.00 H new ATOM 0 HG13 ILE A 151 6.365 -3.652 -1.695 1.00 0.00 H new ATOM 0 HG21 ILE A 151 6.767 -0.860 -4.160 1.00 0.00 H new ATOM 0 HG22 ILE A 151 5.568 -1.497 -5.309 1.00 0.00 H new ATOM 0 HG23 ILE A 151 5.040 -0.866 -3.731 1.00 0.00 H new ATOM 0 HD11 ILE A 151 8.007 -1.928 -0.992 1.00 0.00 H new ATOM 0 HD12 ILE A 151 8.481 -2.640 -2.553 1.00 0.00 H new ATOM 0 HD13 ILE A 151 7.720 -1.032 -2.503 1.00 0.00 H new ATOM 2451 N ALA A 152 4.898 -5.416 -2.227 1.00 0.00 N ATOM 2452 CA ALA A 152 5.105 -6.812 -1.857 1.00 0.00 C ATOM 2453 C ALA A 152 4.114 -7.710 -2.595 1.00 0.00 C ATOM 2454 O ALA A 152 4.497 -8.729 -3.169 1.00 0.00 O ATOM 2455 CB ALA A 152 4.929 -6.986 -0.348 1.00 0.00 C ATOM 0 H ALA A 152 4.758 -4.781 -1.441 1.00 0.00 H new ATOM 0 HA ALA A 152 6.119 -7.098 -2.137 1.00 0.00 H new ATOM 0 HB1 ALA A 152 5.085 -8.031 -0.082 1.00 0.00 H new ATOM 0 HB2 ALA A 152 5.655 -6.365 0.177 1.00 0.00 H new ATOM 0 HB3 ALA A 152 3.921 -6.686 -0.062 1.00 0.00 H new ATOM 2461 N TYR A 153 2.839 -7.331 -2.572 1.00 0.00 N ATOM 2462 CA TYR A 153 1.807 -8.122 -3.238 1.00 0.00 C ATOM 2463 C TYR A 153 2.086 -8.232 -4.737 1.00 0.00 C ATOM 2464 O TYR A 153 1.915 -9.296 -5.332 1.00 0.00 O ATOM 2465 CB TYR A 153 0.430 -7.480 -3.010 1.00 0.00 C ATOM 2466 CG TYR A 153 -0.230 -8.093 -1.792 1.00 0.00 C ATOM 2467 CD1 TYR A 153 0.483 -8.207 -0.592 1.00 0.00 C ATOM 2468 CD2 TYR A 153 -1.554 -8.545 -1.866 1.00 0.00 C ATOM 2469 CE1 TYR A 153 -0.128 -8.774 0.534 1.00 0.00 C ATOM 2470 CE2 TYR A 153 -2.164 -9.112 -0.740 1.00 0.00 C ATOM 2471 CZ TYR A 153 -1.452 -9.227 0.460 1.00 0.00 C ATOM 2472 OH TYR A 153 -2.053 -9.784 1.570 1.00 0.00 O ATOM 0 H TYR A 153 2.498 -6.491 -2.105 1.00 0.00 H new ATOM 0 HA TYR A 153 1.815 -9.125 -2.812 1.00 0.00 H new ATOM 0 HB2 TYR A 153 0.539 -6.404 -2.872 1.00 0.00 H new ATOM 0 HB3 TYR A 153 -0.199 -7.627 -3.888 1.00 0.00 H new ATOM 0 HD1 TYR A 153 1.503 -7.858 -0.535 1.00 0.00 H new ATOM 0 HD2 TYR A 153 -2.104 -8.456 -2.791 1.00 0.00 H new ATOM 0 HE1 TYR A 153 0.422 -8.862 1.459 1.00 0.00 H new ATOM 0 HE2 TYR A 153 -3.185 -9.461 -0.797 1.00 0.00 H new ATOM 0 HH TYR A 153 -3.017 -9.610 1.542 1.00 0.00 H new ATOM 2482 N LEU A 154 2.506 -7.127 -5.342 1.00 0.00 N ATOM 2483 CA LEU A 154 2.796 -7.109 -6.774 1.00 0.00 C ATOM 2484 C LEU A 154 4.043 -7.932 -7.092 1.00 0.00 C ATOM 2485 O LEU A 154 4.162 -8.504 -8.178 1.00 0.00 O ATOM 2486 CB LEU A 154 3.004 -5.667 -7.238 1.00 0.00 C ATOM 2487 CG LEU A 154 1.771 -4.832 -6.873 1.00 0.00 C ATOM 2488 CD1 LEU A 154 2.085 -3.340 -7.051 1.00 0.00 C ATOM 2489 CD2 LEU A 154 0.591 -5.231 -7.770 1.00 0.00 C ATOM 0 H LEU A 154 2.653 -6.236 -4.868 1.00 0.00 H new ATOM 0 HA LEU A 154 1.949 -7.549 -7.300 1.00 0.00 H new ATOM 0 HB2 LEU A 154 3.893 -5.247 -6.768 1.00 0.00 H new ATOM 0 HB3 LEU A 154 3.169 -5.640 -8.315 1.00 0.00 H new ATOM 0 HG LEU A 154 1.505 -5.018 -5.832 1.00 0.00 H new ATOM 0 HD11 LEU A 154 1.206 -2.750 -6.791 1.00 0.00 H new ATOM 0 HD12 LEU A 154 2.914 -3.063 -6.400 1.00 0.00 H new ATOM 0 HD13 LEU A 154 2.358 -3.147 -8.089 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -0.283 -4.635 -7.507 1.00 0.00 H new ATOM 0 HD22 LEU A 154 0.851 -5.053 -8.814 1.00 0.00 H new ATOM 0 HD23 LEU A 154 0.366 -6.288 -7.627 1.00 0.00 H new ATOM 2501 N ILE A 155 4.970 -7.981 -6.145 1.00 0.00 N ATOM 2502 CA ILE A 155 6.212 -8.725 -6.332 1.00 0.00 C ATOM 2503 C ILE A 155 5.974 -10.225 -6.144 1.00 0.00 C ATOM 2504 O ILE A 155 6.690 -11.052 -6.708 1.00 0.00 O ATOM 2505 CB ILE A 155 7.275 -8.219 -5.335 1.00 0.00 C ATOM 2506 CG1 ILE A 155 8.144 -7.141 -5.998 1.00 0.00 C ATOM 2507 CG2 ILE A 155 8.180 -9.372 -4.882 1.00 0.00 C ATOM 2508 CD1 ILE A 155 7.312 -5.879 -6.239 1.00 0.00 C ATOM 0 H ILE A 155 4.888 -7.516 -5.241 1.00 0.00 H new ATOM 0 HA ILE A 155 6.571 -8.564 -7.348 1.00 0.00 H new ATOM 0 HB ILE A 155 6.759 -7.802 -4.470 1.00 0.00 H new ATOM 0 HG12 ILE A 155 8.998 -6.908 -5.363 1.00 0.00 H new ATOM 0 HG13 ILE A 155 8.541 -7.512 -6.943 1.00 0.00 H new ATOM 0 HG21 ILE A 155 8.924 -8.996 -4.179 1.00 0.00 H new ATOM 0 HG22 ILE A 155 7.577 -10.139 -4.396 1.00 0.00 H new ATOM 0 HG23 ILE A 155 8.684 -9.801 -5.748 1.00 0.00 H new ATOM 0 HD11 ILE A 155 7.934 -5.118 -6.710 1.00 0.00 H new ATOM 0 HD12 ILE A 155 6.472 -6.116 -6.892 1.00 0.00 H new ATOM 0 HD13 ILE A 155 6.937 -5.503 -5.287 1.00 0.00 H new ATOM 2520 N VAL A 156 4.971 -10.566 -5.346 1.00 0.00 N ATOM 2521 CA VAL A 156 4.658 -11.968 -5.089 1.00 0.00 C ATOM 2522 C VAL A 156 3.989 -12.602 -6.306 1.00 0.00 C ATOM 2523 O VAL A 156 4.206 -13.777 -6.599 1.00 0.00 O ATOM 2524 CB VAL A 156 3.736 -12.080 -3.871 1.00 0.00 C ATOM 2525 CG1 VAL A 156 3.195 -13.510 -3.761 1.00 0.00 C ATOM 2526 CG2 VAL A 156 4.523 -11.735 -2.602 1.00 0.00 C ATOM 0 H VAL A 156 4.364 -9.899 -4.869 1.00 0.00 H new ATOM 0 HA VAL A 156 5.588 -12.500 -4.888 1.00 0.00 H new ATOM 0 HB VAL A 156 2.903 -11.387 -3.985 1.00 0.00 H new ATOM 0 HG11 VAL A 156 2.540 -13.585 -2.893 1.00 0.00 H new ATOM 0 HG12 VAL A 156 2.634 -13.757 -4.662 1.00 0.00 H new ATOM 0 HG13 VAL A 156 4.026 -14.206 -3.649 1.00 0.00 H new ATOM 0 HG21 VAL A 156 3.868 -11.814 -1.735 1.00 0.00 H new ATOM 0 HG22 VAL A 156 5.357 -12.428 -2.491 1.00 0.00 H new ATOM 0 HG23 VAL A 156 4.905 -10.717 -2.676 1.00 0.00 H new ATOM 2536 N ALA A 157 3.174 -11.823 -7.006 1.00 0.00 N ATOM 2537 CA ALA A 157 2.478 -12.330 -8.184 1.00 0.00 C ATOM 2538 C ALA A 157 3.450 -12.575 -9.333 1.00 0.00 C ATOM 2539 O ALA A 157 3.470 -13.655 -9.919 1.00 0.00 O ATOM 2540 CB ALA A 157 1.414 -11.331 -8.629 1.00 0.00 C ATOM 0 H ALA A 157 2.979 -10.847 -6.782 1.00 0.00 H new ATOM 0 HA ALA A 157 2.009 -13.277 -7.916 1.00 0.00 H new ATOM 0 HB1 ALA A 157 0.899 -11.716 -9.509 1.00 0.00 H new ATOM 0 HB2 ALA A 157 0.695 -11.182 -7.823 1.00 0.00 H new ATOM 0 HB3 ALA A 157 1.887 -10.380 -8.873 1.00 0.00 H new ATOM 2546 N VAL A 158 4.244 -11.563 -9.663 1.00 0.00 N ATOM 2547 CA VAL A 158 5.200 -11.690 -10.759 1.00 0.00 C ATOM 2548 C VAL A 158 6.159 -12.851 -10.514 1.00 0.00 C ATOM 2549 O VAL A 158 6.589 -13.519 -11.456 1.00 0.00 O ATOM 2550 CB VAL A 158 5.992 -10.390 -10.924 1.00 0.00 C ATOM 2551 CG1 VAL A 158 5.030 -9.245 -11.254 1.00 0.00 C ATOM 2552 CG2 VAL A 158 6.734 -10.073 -9.624 1.00 0.00 C ATOM 0 H VAL A 158 4.247 -10.657 -9.195 1.00 0.00 H new ATOM 0 HA VAL A 158 4.641 -11.889 -11.673 1.00 0.00 H new ATOM 0 HB VAL A 158 6.713 -10.505 -11.734 1.00 0.00 H new ATOM 0 HG11 VAL A 158 5.593 -8.319 -11.372 1.00 0.00 H new ATOM 0 HG12 VAL A 158 4.502 -9.469 -12.181 1.00 0.00 H new ATOM 0 HG13 VAL A 158 4.309 -9.131 -10.445 1.00 0.00 H new ATOM 0 HG21 VAL A 158 7.297 -9.147 -9.743 1.00 0.00 H new ATOM 0 HG22 VAL A 158 6.015 -9.958 -8.813 1.00 0.00 H new ATOM 0 HG23 VAL A 158 7.419 -10.887 -9.388 1.00 0.00 H new ATOM 2562 N LEU A 159 6.495 -13.090 -9.251 1.00 0.00 N ATOM 2563 CA LEU A 159 7.408 -14.175 -8.905 1.00 0.00 C ATOM 2564 C LEU A 159 6.684 -15.520 -8.909 1.00 0.00 C ATOM 2565 O LEU A 159 7.205 -16.515 -9.416 1.00 0.00 O ATOM 2566 CB LEU A 159 8.018 -13.924 -7.523 1.00 0.00 C ATOM 2567 CG LEU A 159 9.086 -14.982 -7.221 1.00 0.00 C ATOM 2568 CD1 LEU A 159 10.263 -14.834 -8.193 1.00 0.00 C ATOM 2569 CD2 LEU A 159 9.583 -14.798 -5.783 1.00 0.00 C ATOM 0 H LEU A 159 6.152 -12.552 -8.455 1.00 0.00 H new ATOM 0 HA LEU A 159 8.200 -14.205 -9.654 1.00 0.00 H new ATOM 0 HB2 LEU A 159 8.460 -12.928 -7.487 1.00 0.00 H new ATOM 0 HB3 LEU A 159 7.239 -13.954 -6.761 1.00 0.00 H new ATOM 0 HG LEU A 159 8.653 -15.975 -7.339 1.00 0.00 H new ATOM 0 HD11 LEU A 159 11.016 -15.590 -7.970 1.00 0.00 H new ATOM 0 HD12 LEU A 159 9.909 -14.965 -9.216 1.00 0.00 H new ATOM 0 HD13 LEU A 159 10.702 -13.842 -8.085 1.00 0.00 H new ATOM 0 HD21 LEU A 159 10.343 -15.548 -5.562 1.00 0.00 H new ATOM 0 HD22 LEU A 159 10.012 -13.802 -5.671 1.00 0.00 H new ATOM 0 HD23 LEU A 159 8.748 -14.913 -5.092 1.00 0.00 H new ATOM 2581 N VAL A 160 5.484 -15.547 -8.337 1.00 0.00 N ATOM 2582 CA VAL A 160 4.705 -16.780 -8.275 1.00 0.00 C ATOM 2583 C VAL A 160 4.222 -17.189 -9.664 1.00 0.00 C ATOM 2584 O VAL A 160 3.999 -18.370 -9.930 1.00 0.00 O ATOM 2585 CB VAL A 160 3.502 -16.591 -7.345 1.00 0.00 C ATOM 2586 CG1 VAL A 160 2.541 -17.776 -7.491 1.00 0.00 C ATOM 2587 CG2 VAL A 160 3.988 -16.507 -5.896 1.00 0.00 C ATOM 0 H VAL A 160 5.032 -14.737 -7.913 1.00 0.00 H new ATOM 0 HA VAL A 160 5.346 -17.570 -7.885 1.00 0.00 H new ATOM 0 HB VAL A 160 2.982 -15.671 -7.612 1.00 0.00 H new ATOM 0 HG11 VAL A 160 1.688 -17.636 -6.827 1.00 0.00 H new ATOM 0 HG12 VAL A 160 2.193 -17.837 -8.522 1.00 0.00 H new ATOM 0 HG13 VAL A 160 3.058 -18.699 -7.227 1.00 0.00 H new ATOM 0 HG21 VAL A 160 3.133 -16.372 -5.233 1.00 0.00 H new ATOM 0 HG22 VAL A 160 4.510 -17.427 -5.633 1.00 0.00 H new ATOM 0 HG23 VAL A 160 4.667 -15.661 -5.789 1.00 0.00 H new ATOM 2597 N VAL A 161 4.065 -16.209 -10.545 1.00 0.00 N ATOM 2598 CA VAL A 161 3.607 -16.483 -11.903 1.00 0.00 C ATOM 2599 C VAL A 161 4.732 -17.102 -12.727 1.00 0.00 C ATOM 2600 O VAL A 161 4.524 -18.080 -13.445 1.00 0.00 O ATOM 2601 CB VAL A 161 3.125 -15.186 -12.560 1.00 0.00 C ATOM 2602 CG1 VAL A 161 2.919 -15.410 -14.061 1.00 0.00 C ATOM 2603 CG2 VAL A 161 1.799 -14.755 -11.922 1.00 0.00 C ATOM 0 H VAL A 161 4.246 -15.225 -10.347 1.00 0.00 H new ATOM 0 HA VAL A 161 2.779 -17.190 -11.860 1.00 0.00 H new ATOM 0 HB VAL A 161 3.874 -14.408 -12.412 1.00 0.00 H new ATOM 0 HG11 VAL A 161 2.576 -14.484 -14.523 1.00 0.00 H new ATOM 0 HG12 VAL A 161 3.861 -15.716 -14.516 1.00 0.00 H new ATOM 0 HG13 VAL A 161 2.173 -16.190 -14.213 1.00 0.00 H new ATOM 0 HG21 VAL A 161 1.454 -13.832 -12.388 1.00 0.00 H new ATOM 0 HG22 VAL A 161 1.053 -15.536 -12.069 1.00 0.00 H new ATOM 0 HG23 VAL A 161 1.946 -14.590 -10.855 1.00 0.00 H new ATOM 2613 N ILE A 162 5.923 -16.521 -12.620 1.00 0.00 N ATOM 2614 CA ILE A 162 7.075 -17.022 -13.362 1.00 0.00 C ATOM 2615 C ILE A 162 7.474 -18.407 -12.863 1.00 0.00 C ATOM 2616 O ILE A 162 8.141 -19.163 -13.569 1.00 0.00 O ATOM 2617 CB ILE A 162 8.253 -16.058 -13.205 1.00 0.00 C ATOM 2618 CG1 ILE A 162 7.902 -14.716 -13.853 1.00 0.00 C ATOM 2619 CG2 ILE A 162 9.489 -16.647 -13.887 1.00 0.00 C ATOM 2620 CD1 ILE A 162 8.853 -13.636 -13.338 1.00 0.00 C ATOM 0 H ILE A 162 6.115 -15.710 -12.032 1.00 0.00 H new ATOM 0 HA ILE A 162 6.804 -17.095 -14.415 1.00 0.00 H new ATOM 0 HB ILE A 162 8.461 -15.907 -12.146 1.00 0.00 H new ATOM 0 HG12 ILE A 162 7.976 -14.794 -14.938 1.00 0.00 H new ATOM 0 HG13 ILE A 162 6.871 -14.448 -13.622 1.00 0.00 H new ATOM 0 HG21 ILE A 162 10.328 -15.960 -13.775 1.00 0.00 H new ATOM 0 HG22 ILE A 162 9.738 -17.603 -13.426 1.00 0.00 H new ATOM 0 HG23 ILE A 162 9.283 -16.798 -14.947 1.00 0.00 H new ATOM 0 HD11 ILE A 162 8.603 -12.681 -13.800 1.00 0.00 H new ATOM 0 HD12 ILE A 162 8.757 -13.552 -12.256 1.00 0.00 H new ATOM 0 HD13 ILE A 162 9.879 -13.904 -13.591 1.00 0.00 H new ATOM 2632 N SER A 163 7.064 -18.731 -11.641 1.00 0.00 N ATOM 2633 CA SER A 163 7.387 -20.028 -11.056 1.00 0.00 C ATOM 2634 C SER A 163 6.854 -21.162 -11.928 1.00 0.00 C ATOM 2635 O SER A 163 7.092 -22.337 -11.648 1.00 0.00 O ATOM 2636 CB SER A 163 6.782 -20.133 -9.655 1.00 0.00 C ATOM 2637 OG SER A 163 5.409 -20.484 -9.762 1.00 0.00 O ATOM 0 H SER A 163 6.512 -18.119 -11.040 1.00 0.00 H new ATOM 0 HA SER A 163 8.472 -20.115 -10.993 1.00 0.00 H new ATOM 0 HB2 SER A 163 7.316 -20.882 -9.071 1.00 0.00 H new ATOM 0 HB3 SER A 163 6.887 -19.184 -9.129 1.00 0.00 H new ATOM 0 HG SER A 163 5.291 -21.423 -9.508 1.00 0.00 H new ATOM 2643 N GLN A 164 6.134 -20.802 -12.986 1.00 0.00 N ATOM 2644 CA GLN A 164 5.572 -21.801 -13.892 1.00 0.00 C ATOM 2645 C GLN A 164 6.621 -22.859 -14.236 1.00 0.00 C ATOM 2646 O GLN A 164 7.820 -22.579 -14.222 1.00 0.00 O ATOM 2647 CB GLN A 164 5.087 -21.120 -15.175 1.00 0.00 C ATOM 2648 CG GLN A 164 6.086 -20.039 -15.589 1.00 0.00 C ATOM 2649 CD GLN A 164 5.813 -19.599 -17.024 1.00 0.00 C ATOM 2650 OE1 GLN A 164 4.663 -19.879 -17.575 1.00 0.00 O flip ATOM 2651 NE2 GLN A 164 6.669 -18.984 -17.659 1.00 0.00 N flip ATOM 0 H GLN A 164 5.927 -19.835 -13.237 1.00 0.00 H new ATOM 0 HA GLN A 164 4.731 -22.288 -13.398 1.00 0.00 H new ATOM 0 HB2 GLN A 164 4.981 -21.856 -15.972 1.00 0.00 H new ATOM 0 HB3 GLN A 164 4.103 -20.679 -15.015 1.00 0.00 H new ATOM 0 HG2 GLN A 164 6.009 -19.184 -14.917 1.00 0.00 H new ATOM 0 HG3 GLN A 164 7.103 -20.421 -15.504 1.00 0.00 H new ATOM 0 HE21 GLN A 164 7.567 -18.766 -17.226 1.00 0.00 H new ATOM 0 HE22 GLN A 164 6.481 -18.692 -18.618 1.00 0.00 H new ATOM 2660 N PRO A 165 6.198 -24.060 -14.547 1.00 0.00 N ATOM 2661 CA PRO A 165 7.124 -25.169 -14.905 1.00 0.00 C ATOM 2662 C PRO A 165 8.311 -24.687 -15.736 1.00 0.00 C ATOM 2663 O PRO A 165 9.357 -25.334 -15.774 1.00 0.00 O ATOM 2664 CB PRO A 165 6.233 -26.116 -15.709 1.00 0.00 C ATOM 2665 CG PRO A 165 4.858 -25.928 -15.148 1.00 0.00 C ATOM 2666 CD PRO A 165 4.791 -24.498 -14.592 1.00 0.00 C ATOM 0 HA PRO A 165 7.575 -25.635 -14.029 1.00 0.00 H new ATOM 0 HB2 PRO A 165 6.261 -25.876 -16.772 1.00 0.00 H new ATOM 0 HB3 PRO A 165 6.563 -27.150 -15.606 1.00 0.00 H new ATOM 0 HG2 PRO A 165 4.103 -26.077 -15.920 1.00 0.00 H new ATOM 0 HG3 PRO A 165 4.659 -26.657 -14.362 1.00 0.00 H new ATOM 0 HD2 PRO A 165 4.193 -23.850 -15.232 1.00 0.00 H new ATOM 0 HD3 PRO A 165 4.336 -24.477 -13.602 1.00 0.00 H new ATOM 2674 N PHE A 166 8.139 -23.547 -16.398 1.00 0.00 N ATOM 2675 CA PHE A 166 9.201 -22.982 -17.225 1.00 0.00 C ATOM 2676 C PHE A 166 9.393 -23.808 -18.494 1.00 0.00 C ATOM 2677 O PHE A 166 10.502 -23.910 -19.018 1.00 0.00 O ATOM 2678 CB PHE A 166 10.514 -22.938 -16.433 1.00 0.00 C ATOM 2679 CG PHE A 166 11.415 -21.864 -16.998 1.00 0.00 C ATOM 2680 CD1 PHE A 166 11.121 -20.515 -16.771 1.00 0.00 C ATOM 2681 CD2 PHE A 166 12.544 -22.219 -17.747 1.00 0.00 C ATOM 2682 CE1 PHE A 166 11.955 -19.519 -17.294 1.00 0.00 C ATOM 2683 CE2 PHE A 166 13.378 -21.223 -18.270 1.00 0.00 C ATOM 2684 CZ PHE A 166 13.084 -19.874 -18.043 1.00 0.00 C ATOM 0 H PHE A 166 7.279 -22.998 -16.379 1.00 0.00 H new ATOM 0 HA PHE A 166 8.915 -21.969 -17.508 1.00 0.00 H new ATOM 0 HB2 PHE A 166 10.309 -22.738 -15.381 1.00 0.00 H new ATOM 0 HB3 PHE A 166 11.012 -23.906 -16.482 1.00 0.00 H new ATOM 0 HD1 PHE A 166 10.251 -20.242 -16.192 1.00 0.00 H new ATOM 0 HD2 PHE A 166 12.771 -23.260 -17.921 1.00 0.00 H new ATOM 0 HE1 PHE A 166 11.728 -18.478 -17.120 1.00 0.00 H new ATOM 0 HE2 PHE A 166 14.248 -21.496 -18.849 1.00 0.00 H new ATOM 0 HZ PHE A 166 13.728 -19.106 -18.446 1.00 0.00 H new ATOM 2694 N LYS A 167 8.305 -24.394 -18.984 1.00 0.00 N ATOM 2695 CA LYS A 167 8.365 -25.207 -20.195 1.00 0.00 C ATOM 2696 C LYS A 167 9.589 -26.117 -20.170 1.00 0.00 C ATOM 2697 O LYS A 167 10.099 -26.517 -21.218 1.00 0.00 O ATOM 2698 CB LYS A 167 8.424 -24.305 -21.431 1.00 0.00 C ATOM 2699 CG LYS A 167 7.237 -23.336 -21.424 1.00 0.00 C ATOM 2700 CD LYS A 167 5.955 -24.077 -21.815 1.00 0.00 C ATOM 2701 CE LYS A 167 4.868 -23.063 -22.176 1.00 0.00 C ATOM 2702 NZ LYS A 167 5.174 -22.457 -23.503 1.00 0.00 N ATOM 0 H LYS A 167 7.378 -24.323 -18.565 1.00 0.00 H new ATOM 0 HA LYS A 167 7.467 -25.824 -20.239 1.00 0.00 H new ATOM 0 HB2 LYS A 167 9.360 -23.747 -21.441 1.00 0.00 H new ATOM 0 HB3 LYS A 167 8.405 -24.912 -22.336 1.00 0.00 H new ATOM 0 HG2 LYS A 167 7.124 -22.893 -20.434 1.00 0.00 H new ATOM 0 HG3 LYS A 167 7.421 -22.518 -22.120 1.00 0.00 H new ATOM 0 HD2 LYS A 167 6.147 -24.736 -22.661 1.00 0.00 H new ATOM 0 HD3 LYS A 167 5.620 -24.706 -20.990 1.00 0.00 H new ATOM 0 HE2 LYS A 167 3.894 -23.552 -22.204 1.00 0.00 H new ATOM 0 HE3 LYS A 167 4.813 -22.286 -21.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 167 4.305 -22.058 -23.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 167 5.880 -21.702 -23.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 167 5.551 -23.188 -24.140 1.00 0.00 H new ATOM 2716 N ALA A 168 10.058 -26.442 -18.969 1.00 0.00 N ATOM 2717 CA ALA A 168 11.224 -27.307 -18.819 1.00 0.00 C ATOM 2718 C ALA A 168 11.146 -28.084 -17.509 1.00 0.00 C ATOM 2719 O ALA A 168 10.831 -27.522 -16.460 1.00 0.00 O ATOM 2720 CB ALA A 168 12.503 -26.468 -18.841 1.00 0.00 C ATOM 0 H ALA A 168 9.652 -26.122 -18.090 1.00 0.00 H new ATOM 0 HA ALA A 168 11.240 -28.014 -19.649 1.00 0.00 H new ATOM 0 HB1 ALA A 168 13.368 -27.121 -18.728 1.00 0.00 H new ATOM 0 HB2 ALA A 168 12.572 -25.934 -19.789 1.00 0.00 H new ATOM 0 HB3 ALA A 168 12.481 -25.750 -18.021 1.00 0.00 H new ATOM 2726 N LYS A 169 11.433 -29.381 -17.577 1.00 0.00 N ATOM 2727 CA LYS A 169 11.391 -30.230 -16.389 1.00 0.00 C ATOM 2728 C LYS A 169 12.797 -30.454 -15.838 1.00 0.00 C ATOM 2729 O LYS A 169 13.194 -29.828 -14.856 1.00 0.00 O ATOM 2730 CB LYS A 169 10.747 -31.576 -16.737 1.00 0.00 C ATOM 2731 CG LYS A 169 10.311 -32.294 -15.452 1.00 0.00 C ATOM 2732 CD LYS A 169 8.956 -31.750 -14.981 1.00 0.00 C ATOM 2733 CE LYS A 169 8.341 -32.719 -13.968 1.00 0.00 C ATOM 2734 NZ LYS A 169 9.420 -33.320 -13.136 1.00 0.00 N ATOM 0 H LYS A 169 11.696 -29.865 -18.436 1.00 0.00 H new ATOM 0 HA LYS A 169 10.796 -29.731 -15.625 1.00 0.00 H new ATOM 0 HB2 LYS A 169 9.886 -31.420 -17.387 1.00 0.00 H new ATOM 0 HB3 LYS A 169 11.454 -32.196 -17.288 1.00 0.00 H new ATOM 0 HG2 LYS A 169 10.239 -33.367 -15.632 1.00 0.00 H new ATOM 0 HG3 LYS A 169 11.060 -32.151 -14.673 1.00 0.00 H new ATOM 0 HD2 LYS A 169 9.084 -30.767 -14.528 1.00 0.00 H new ATOM 0 HD3 LYS A 169 8.287 -31.624 -15.832 1.00 0.00 H new ATOM 0 HE2 LYS A 169 7.628 -32.193 -13.333 1.00 0.00 H new ATOM 0 HE3 LYS A 169 7.789 -33.502 -14.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 169 9.007 -33.727 -12.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 169 9.899 -34.068 -13.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 169 10.109 -32.585 -12.877 1.00 0.00 H new ATOM 2748 N LYS A 170 13.545 -31.351 -16.475 1.00 0.00 N ATOM 2749 CA LYS A 170 14.905 -31.647 -16.038 1.00 0.00 C ATOM 2750 C LYS A 170 14.941 -31.898 -14.532 1.00 0.00 C ATOM 2751 O LYS A 170 13.914 -31.826 -13.856 1.00 0.00 O ATOM 2752 CB LYS A 170 15.833 -30.479 -16.385 1.00 0.00 C ATOM 2753 CG LYS A 170 16.153 -30.496 -17.887 1.00 0.00 C ATOM 2754 CD LYS A 170 17.368 -31.394 -18.154 1.00 0.00 C ATOM 2755 CE LYS A 170 18.659 -30.586 -17.983 1.00 0.00 C ATOM 2756 NZ LYS A 170 19.812 -31.519 -17.840 1.00 0.00 N ATOM 0 H LYS A 170 13.235 -31.882 -17.289 1.00 0.00 H new ATOM 0 HA LYS A 170 15.244 -32.545 -16.554 1.00 0.00 H new ATOM 0 HB2 LYS A 170 15.360 -29.535 -16.115 1.00 0.00 H new ATOM 0 HB3 LYS A 170 16.754 -30.551 -15.807 1.00 0.00 H new ATOM 0 HG2 LYS A 170 15.291 -30.860 -18.447 1.00 0.00 H new ATOM 0 HG3 LYS A 170 16.355 -29.483 -18.236 1.00 0.00 H new ATOM 0 HD2 LYS A 170 17.364 -32.240 -17.467 1.00 0.00 H new ATOM 0 HD3 LYS A 170 17.315 -31.803 -19.163 1.00 0.00 H new ATOM 0 HE2 LYS A 170 18.809 -29.934 -18.843 1.00 0.00 H new ATOM 0 HE3 LYS A 170 18.586 -29.944 -17.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 170 20.689 -30.972 -17.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 170 19.668 -32.124 -17.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 170 19.885 -32.114 -18.690 1.00 0.00 H new ATOM 2770 N ARG A 171 16.130 -32.194 -14.015 1.00 0.00 N ATOM 2771 CA ARG A 171 16.291 -32.454 -12.587 1.00 0.00 C ATOM 2772 C ARG A 171 15.133 -33.299 -12.062 1.00 0.00 C ATOM 2773 O ARG A 171 14.216 -32.785 -11.421 1.00 0.00 O ATOM 2774 CB ARG A 171 16.357 -31.124 -11.821 1.00 0.00 C ATOM 2775 CG ARG A 171 17.819 -30.683 -11.662 1.00 0.00 C ATOM 2776 CD ARG A 171 18.424 -31.330 -10.409 1.00 0.00 C ATOM 2777 NE ARG A 171 17.738 -32.581 -10.100 1.00 0.00 N ATOM 2778 CZ ARG A 171 18.107 -33.329 -9.065 1.00 0.00 C ATOM 2779 NH1 ARG A 171 19.103 -32.954 -8.309 1.00 0.00 N ATOM 2780 NH2 ARG A 171 17.473 -34.440 -8.805 1.00 0.00 N ATOM 0 H ARG A 171 16.991 -32.260 -14.558 1.00 0.00 H new ATOM 0 HA ARG A 171 17.219 -33.005 -12.435 1.00 0.00 H new ATOM 0 HB2 ARG A 171 15.794 -30.359 -12.355 1.00 0.00 H new ATOM 0 HB3 ARG A 171 15.893 -31.236 -10.841 1.00 0.00 H new ATOM 0 HG2 ARG A 171 18.393 -30.969 -12.543 1.00 0.00 H new ATOM 0 HG3 ARG A 171 17.875 -29.597 -11.585 1.00 0.00 H new ATOM 0 HD2 ARG A 171 19.486 -31.519 -10.567 1.00 0.00 H new ATOM 0 HD3 ARG A 171 18.344 -30.646 -9.564 1.00 0.00 H new ATOM 0 HE ARG A 171 16.963 -32.886 -10.688 1.00 0.00 H new ATOM 0 HH11 ARG A 171 19.599 -32.086 -8.512 1.00 0.00 H new ATOM 0 HH12 ARG A 171 19.385 -33.529 -7.515 1.00 0.00 H new ATOM 0 HH21 ARG A 171 16.695 -34.734 -9.396 1.00 0.00 H new ATOM 0 HH22 ARG A 171 17.756 -35.015 -8.011 1.00 0.00 H new ATOM 2794 N ASP A 172 15.183 -34.599 -12.337 1.00 0.00 N ATOM 2795 CA ASP A 172 14.135 -35.507 -11.887 1.00 0.00 C ATOM 2796 C ASP A 172 14.542 -36.956 -12.135 1.00 0.00 C ATOM 2797 O ASP A 172 13.704 -37.804 -12.439 1.00 0.00 O ATOM 2798 CB ASP A 172 12.829 -35.207 -12.626 1.00 0.00 C ATOM 2799 CG ASP A 172 11.667 -35.918 -11.941 1.00 0.00 C ATOM 2800 OD1 ASP A 172 11.831 -36.317 -10.801 1.00 0.00 O ATOM 2801 OD2 ASP A 172 10.629 -36.055 -12.569 1.00 0.00 O ATOM 0 H ASP A 172 15.933 -35.044 -12.866 1.00 0.00 H new ATOM 0 HA ASP A 172 13.987 -35.360 -10.817 1.00 0.00 H new ATOM 0 HB2 ASP A 172 12.650 -34.132 -12.642 1.00 0.00 H new ATOM 0 HB3 ASP A 172 12.905 -35.533 -13.663 1.00 0.00 H new ATOM 2806 N LEU A 173 15.836 -37.230 -12.005 1.00 0.00 N ATOM 2807 CA LEU A 173 16.347 -38.580 -12.218 1.00 0.00 C ATOM 2808 C LEU A 173 16.126 -39.015 -13.664 1.00 0.00 C ATOM 2809 O LEU A 173 16.334 -38.237 -14.595 1.00 0.00 O ATOM 2810 CB LEU A 173 15.645 -39.561 -11.270 1.00 0.00 C ATOM 2811 CG LEU A 173 16.503 -40.824 -11.099 1.00 0.00 C ATOM 2812 CD1 LEU A 173 17.495 -40.623 -9.951 1.00 0.00 C ATOM 2813 CD2 LEU A 173 15.598 -42.017 -10.780 1.00 0.00 C ATOM 0 H LEU A 173 16.546 -36.541 -11.755 1.00 0.00 H new ATOM 0 HA LEU A 173 17.417 -38.581 -12.012 1.00 0.00 H new ATOM 0 HB2 LEU A 173 15.479 -39.089 -10.302 1.00 0.00 H new ATOM 0 HB3 LEU A 173 14.665 -39.827 -11.667 1.00 0.00 H new ATOM 0 HG LEU A 173 17.050 -41.014 -12.023 1.00 0.00 H new ATOM 0 HD11 LEU A 173 18.102 -41.521 -9.833 1.00 0.00 H new ATOM 0 HD12 LEU A 173 18.142 -39.775 -10.174 1.00 0.00 H new ATOM 0 HD13 LEU A 173 16.949 -40.430 -9.028 1.00 0.00 H new ATOM 0 HD21 LEU A 173 16.207 -42.913 -10.659 1.00 0.00 H new ATOM 0 HD22 LEU A 173 15.051 -41.822 -9.858 1.00 0.00 H new ATOM 0 HD23 LEU A 173 14.891 -42.166 -11.596 1.00 0.00 H new ATOM 2825 N PHE A 174 15.704 -40.263 -13.845 1.00 0.00 N ATOM 2826 CA PHE A 174 15.459 -40.790 -15.182 1.00 0.00 C ATOM 2827 C PHE A 174 16.629 -40.452 -16.104 1.00 0.00 C ATOM 2828 O PHE A 174 16.464 -39.753 -17.105 1.00 0.00 O ATOM 2829 CB PHE A 174 14.160 -40.202 -15.748 1.00 0.00 C ATOM 2830 CG PHE A 174 12.983 -41.052 -15.321 1.00 0.00 C ATOM 2831 CD1 PHE A 174 12.883 -41.503 -13.999 1.00 0.00 C ATOM 2832 CD2 PHE A 174 11.990 -41.389 -16.251 1.00 0.00 C ATOM 2833 CE1 PHE A 174 11.792 -42.289 -13.607 1.00 0.00 C ATOM 2834 CE2 PHE A 174 10.901 -42.175 -15.859 1.00 0.00 C ATOM 2835 CZ PHE A 174 10.802 -42.625 -14.537 1.00 0.00 C ATOM 0 H PHE A 174 15.526 -40.923 -13.088 1.00 0.00 H new ATOM 0 HA PHE A 174 15.361 -41.874 -15.120 1.00 0.00 H new ATOM 0 HB2 PHE A 174 14.029 -39.179 -15.395 1.00 0.00 H new ATOM 0 HB3 PHE A 174 14.213 -40.159 -16.836 1.00 0.00 H new ATOM 0 HD1 PHE A 174 13.648 -41.245 -13.281 1.00 0.00 H new ATOM 0 HD2 PHE A 174 12.066 -41.042 -17.271 1.00 0.00 H new ATOM 0 HE1 PHE A 174 11.715 -42.636 -12.587 1.00 0.00 H new ATOM 0 HE2 PHE A 174 10.137 -42.435 -16.576 1.00 0.00 H new ATOM 0 HZ PHE A 174 9.961 -43.232 -14.235 1.00 0.00 H new ATOM 2845 N GLY A 175 17.810 -40.952 -15.759 1.00 0.00 N ATOM 2846 CA GLY A 175 19.000 -40.697 -16.562 1.00 0.00 C ATOM 2847 C GLY A 175 18.780 -41.122 -18.009 1.00 0.00 C ATOM 2848 O GLY A 175 18.565 -40.286 -18.887 1.00 0.00 O ATOM 0 H GLY A 175 17.969 -41.532 -14.935 1.00 0.00 H new ATOM 0 HA2 GLY A 175 19.249 -39.637 -16.524 1.00 0.00 H new ATOM 0 HA3 GLY A 175 19.849 -41.239 -16.144 1.00 0.00 H new ATOM 2852 N ARG A 176 18.832 -42.429 -18.250 1.00 0.00 N ATOM 2853 CA ARG A 176 18.634 -42.957 -19.595 1.00 0.00 C ATOM 2854 C ARG A 176 17.151 -43.177 -19.870 1.00 0.00 C ATOM 2855 O ARG A 176 16.623 -42.720 -20.884 1.00 0.00 O ATOM 2856 CB ARG A 176 19.387 -44.281 -19.751 1.00 0.00 C ATOM 2857 CG ARG A 176 19.482 -44.644 -21.235 1.00 0.00 C ATOM 2858 CD ARG A 176 20.329 -45.905 -21.399 1.00 0.00 C ATOM 2859 NE ARG A 176 20.726 -46.068 -22.793 1.00 0.00 N ATOM 2860 CZ ARG A 176 19.892 -46.583 -23.690 1.00 0.00 C ATOM 2861 NH1 ARG A 176 18.693 -46.952 -23.330 1.00 0.00 N ATOM 2862 NH2 ARG A 176 20.272 -46.719 -24.930 1.00 0.00 N ATOM 0 H ARG A 176 19.008 -43.137 -17.537 1.00 0.00 H new ATOM 0 HA ARG A 176 19.021 -42.232 -20.312 1.00 0.00 H new ATOM 0 HB2 ARG A 176 20.385 -44.196 -19.322 1.00 0.00 H new ATOM 0 HB3 ARG A 176 18.872 -45.071 -19.205 1.00 0.00 H new ATOM 0 HG2 ARG A 176 18.485 -44.807 -21.645 1.00 0.00 H new ATOM 0 HG3 ARG A 176 19.926 -43.820 -21.794 1.00 0.00 H new ATOM 0 HD2 ARG A 176 21.214 -45.842 -20.766 1.00 0.00 H new ATOM 0 HD3 ARG A 176 19.764 -46.777 -21.070 1.00 0.00 H new ATOM 0 HE ARG A 176 21.661 -45.782 -23.084 1.00 0.00 H new ATOM 0 HH11 ARG A 176 18.396 -46.845 -22.360 1.00 0.00 H new ATOM 0 HH12 ARG A 176 18.053 -47.347 -24.019 1.00 0.00 H new ATOM 0 HH21 ARG A 176 21.209 -46.430 -25.211 1.00 0.00 H new ATOM 0 HH22 ARG A 176 19.632 -47.114 -25.619 1.00 0.00 H new ATOM 2876 N GLY A 177 16.483 -43.880 -18.961 1.00 0.00 N ATOM 2877 CA GLY A 177 15.060 -44.154 -19.114 1.00 0.00 C ATOM 2878 C GLY A 177 14.800 -45.014 -20.346 1.00 0.00 C ATOM 2879 O GLY A 177 15.727 -45.572 -20.933 1.00 0.00 O ATOM 0 H GLY A 177 16.902 -44.268 -18.116 1.00 0.00 H new ATOM 0 HA2 GLY A 177 14.686 -44.662 -18.225 1.00 0.00 H new ATOM 0 HA3 GLY A 177 14.512 -43.216 -19.199 1.00 0.00 H new ATOM 2883 N HIS A 178 13.532 -45.116 -20.734 1.00 0.00 N ATOM 2884 CA HIS A 178 13.162 -45.912 -21.899 1.00 0.00 C ATOM 2885 C HIS A 178 11.664 -45.793 -22.173 1.00 0.00 C ATOM 2886 O HIS A 178 10.952 -45.069 -21.478 1.00 0.00 O ATOM 2887 CB HIS A 178 13.535 -47.381 -21.669 1.00 0.00 C ATOM 2888 CG HIS A 178 13.364 -47.721 -20.213 1.00 0.00 C ATOM 2889 ND1 HIS A 178 14.445 -47.851 -19.355 1.00 0.00 N ATOM 2890 CD2 HIS A 178 12.248 -47.963 -19.452 1.00 0.00 C ATOM 2891 CE1 HIS A 178 13.960 -48.158 -18.138 1.00 0.00 C ATOM 2892 NE2 HIS A 178 12.626 -48.238 -18.141 1.00 0.00 N ATOM 0 H HIS A 178 12.750 -44.661 -20.263 1.00 0.00 H new ATOM 0 HA HIS A 178 13.706 -45.535 -22.765 1.00 0.00 H new ATOM 0 HB2 HIS A 178 12.905 -48.027 -22.281 1.00 0.00 H new ATOM 0 HB3 HIS A 178 14.566 -47.558 -21.976 1.00 0.00 H new ATOM 0 HD2 HIS A 178 11.231 -47.943 -19.815 1.00 0.00 H new ATOM 0 HE1 HIS A 178 14.574 -48.320 -17.265 1.00 0.00 H new ATOM 0 HE2 HIS A 178 12.016 -48.454 -17.352 1.00 0.00 H new ATOM 2901 N HIS A 179 11.196 -46.509 -23.191 1.00 0.00 N ATOM 2902 CA HIS A 179 9.783 -46.475 -23.552 1.00 0.00 C ATOM 2903 C HIS A 179 8.906 -46.592 -22.308 1.00 0.00 C ATOM 2904 O HIS A 179 8.062 -45.734 -22.053 1.00 0.00 O ATOM 2905 CB HIS A 179 9.462 -47.621 -24.513 1.00 0.00 C ATOM 2906 CG HIS A 179 10.408 -47.574 -25.682 1.00 0.00 C ATOM 2907 ND1 HIS A 179 11.255 -46.499 -25.905 1.00 0.00 N ATOM 2908 CD2 HIS A 179 10.652 -48.462 -26.700 1.00 0.00 C ATOM 2909 CE1 HIS A 179 11.963 -46.766 -27.018 1.00 0.00 C ATOM 2910 NE2 HIS A 179 11.634 -47.950 -27.543 1.00 0.00 N ATOM 0 H HIS A 179 11.770 -47.116 -23.777 1.00 0.00 H new ATOM 0 HA HIS A 179 9.576 -45.522 -24.039 1.00 0.00 H new ATOM 0 HB2 HIS A 179 9.550 -48.578 -23.998 1.00 0.00 H new ATOM 0 HB3 HIS A 179 8.432 -47.540 -24.861 1.00 0.00 H new ATOM 0 HD2 HIS A 179 10.157 -49.413 -26.827 1.00 0.00 H new ATOM 0 HE1 HIS A 179 12.707 -46.104 -27.436 1.00 0.00 H new ATOM 0 HE2 HIS A 179 12.020 -48.385 -28.381 1.00 0.00 H new ATOM 2919 N HIS A 180 9.111 -47.660 -21.543 1.00 0.00 N ATOM 2920 CA HIS A 180 8.333 -47.884 -20.327 1.00 0.00 C ATOM 2921 C HIS A 180 6.886 -48.232 -20.669 1.00 0.00 C ATOM 2922 O HIS A 180 6.272 -49.079 -20.020 1.00 0.00 O ATOM 2923 CB HIS A 180 8.368 -46.634 -19.442 1.00 0.00 C ATOM 2924 CG HIS A 180 8.017 -47.006 -18.027 1.00 0.00 C ATOM 2925 ND1 HIS A 180 8.461 -48.180 -17.439 1.00 0.00 N ATOM 2926 CD2 HIS A 180 7.262 -46.370 -17.072 1.00 0.00 C ATOM 2927 CE1 HIS A 180 7.976 -48.214 -16.184 1.00 0.00 C ATOM 2928 NE2 HIS A 180 7.238 -47.135 -15.909 1.00 0.00 N ATOM 0 H HIS A 180 9.805 -48.381 -21.741 1.00 0.00 H new ATOM 0 HA HIS A 180 8.776 -48.721 -19.787 1.00 0.00 H new ATOM 0 HB2 HIS A 180 9.359 -46.181 -19.474 1.00 0.00 H new ATOM 0 HB3 HIS A 180 7.665 -45.890 -19.818 1.00 0.00 H new ATOM 0 HD2 HIS A 180 6.763 -45.421 -17.203 1.00 0.00 H new ATOM 0 HE1 HIS A 180 8.161 -49.016 -15.485 1.00 0.00 H new ATOM 0 HE2 HIS A 180 6.760 -46.918 -15.035 1.00 0.00 H new ATOM 2937 N HIS A 181 6.347 -47.575 -21.691 1.00 0.00 N ATOM 2938 CA HIS A 181 4.971 -47.825 -22.107 1.00 0.00 C ATOM 2939 C HIS A 181 4.742 -49.316 -22.332 1.00 0.00 C ATOM 2940 O HIS A 181 3.921 -49.936 -21.658 1.00 0.00 O ATOM 2941 CB HIS A 181 4.669 -47.059 -23.397 1.00 0.00 C ATOM 2942 CG HIS A 181 3.241 -47.303 -23.803 1.00 0.00 C ATOM 2943 ND1 HIS A 181 2.199 -47.289 -22.889 1.00 0.00 N ATOM 2944 CD2 HIS A 181 2.666 -47.569 -25.021 1.00 0.00 C ATOM 2945 CE1 HIS A 181 1.062 -47.539 -23.565 1.00 0.00 C ATOM 2946 NE2 HIS A 181 1.291 -47.717 -24.868 1.00 0.00 N ATOM 0 H HIS A 181 6.837 -46.871 -22.243 1.00 0.00 H new ATOM 0 HA HIS A 181 4.303 -47.482 -21.316 1.00 0.00 H new ATOM 0 HB2 HIS A 181 4.839 -45.993 -23.247 1.00 0.00 H new ATOM 0 HB3 HIS A 181 5.344 -47.381 -24.190 1.00 0.00 H new ATOM 0 HD2 HIS A 181 3.200 -47.651 -25.956 1.00 0.00 H new ATOM 0 HE1 HIS A 181 0.084 -47.589 -23.109 1.00 0.00 H new ATOM 0 HE2 HIS A 181 0.605 -47.918 -25.596 1.00 0.00 H new ATOM 2955 N HIS A 182 5.473 -49.886 -23.285 1.00 0.00 N ATOM 2956 CA HIS A 182 5.339 -51.306 -23.591 1.00 0.00 C ATOM 2957 C HIS A 182 5.723 -52.154 -22.381 1.00 0.00 C ATOM 2958 O HIS A 182 5.381 -51.826 -21.247 1.00 0.00 O ATOM 2959 CB HIS A 182 6.233 -51.672 -24.778 1.00 0.00 C ATOM 2960 CG HIS A 182 6.118 -50.612 -25.839 1.00 0.00 C ATOM 2961 ND1 HIS A 182 7.229 -50.081 -26.475 1.00 0.00 N ATOM 2962 CD2 HIS A 182 5.032 -49.976 -26.387 1.00 0.00 C ATOM 2963 CE1 HIS A 182 6.792 -49.169 -27.361 1.00 0.00 C ATOM 2964 NE2 HIS A 182 5.460 -49.065 -27.349 1.00 0.00 N ATOM 0 H HIS A 182 6.159 -49.391 -23.855 1.00 0.00 H new ATOM 0 HA HIS A 182 4.298 -51.507 -23.845 1.00 0.00 H new ATOM 0 HB2 HIS A 182 7.269 -51.764 -24.452 1.00 0.00 H new ATOM 0 HB3 HIS A 182 5.939 -52.640 -25.183 1.00 0.00 H new ATOM 0 HD2 HIS A 182 4.003 -50.155 -26.114 1.00 0.00 H new ATOM 0 HE1 HIS A 182 7.439 -48.591 -28.004 1.00 0.00 H new ATOM 0 HE2 HIS A 182 4.881 -48.450 -27.921 1.00 0.00 H new ATOM 2973 N HIS A 183 6.437 -53.246 -22.635 1.00 0.00 N ATOM 2974 CA HIS A 183 6.864 -54.137 -21.561 1.00 0.00 C ATOM 2975 C HIS A 183 8.097 -54.930 -21.982 1.00 0.00 C ATOM 2976 O HIS A 183 9.120 -54.313 -22.225 1.00 0.00 O ATOM 2977 CB HIS A 183 5.732 -55.102 -21.202 1.00 0.00 C ATOM 2978 CG HIS A 183 6.070 -55.818 -19.924 1.00 0.00 C ATOM 2979 ND1 HIS A 183 7.038 -56.809 -19.864 1.00 0.00 N ATOM 2980 CD2 HIS A 183 5.578 -55.699 -18.647 1.00 0.00 C ATOM 2981 CE1 HIS A 183 7.098 -57.243 -18.592 1.00 0.00 C ATOM 2982 NE2 HIS A 183 6.227 -56.600 -17.808 1.00 0.00 N ATOM 2983 OXT HIS A 183 7.999 -56.144 -22.055 1.00 0.00 O ATOM 0 H HIS A 183 6.731 -53.534 -23.568 1.00 0.00 H new ATOM 0 HA HIS A 183 7.115 -53.532 -20.690 1.00 0.00 H new ATOM 0 HB2 HIS A 183 4.796 -54.555 -21.088 1.00 0.00 H new ATOM 0 HB3 HIS A 183 5.585 -55.822 -22.007 1.00 0.00 H new ATOM 0 HD1 HIS A 183 7.602 -57.148 -20.643 1.00 0.00 H new ATOM 0 HD2 HIS A 183 4.805 -55.010 -18.340 1.00 0.00 H new ATOM 0 HE1 HIS A 183 7.768 -58.016 -18.247 1.00 0.00 H new TER 2992 HIS A 183 HETATM 2993 C1 UQ2 A 201 -9.915 4.385 4.877 1.00 20.00 C HETATM 2994 C2 UQ2 A 201 -10.093 5.599 5.704 1.00 20.00 C HETATM 2995 C3 UQ2 A 201 -9.083 6.484 5.826 1.00 20.00 C HETATM 2996 C4 UQ2 A 201 -7.799 6.237 5.138 1.00 20.00 C HETATM 2997 C5 UQ2 A 201 -7.618 5.021 4.317 1.00 20.00 C HETATM 2998 C6 UQ2 A 201 -8.630 4.138 4.191 1.00 20.00 C HETATM 2999 CM2 UQ2 A 201 -11.601 4.664 7.117 1.00 20.00 C HETATM 3000 CM3 UQ2 A 201 -9.359 7.242 7.945 1.00 20.00 C HETATM 3001 CM5 UQ2 A 201 -6.304 4.775 3.621 1.00 20.00 C HETATM 3002 C7 UQ2 A 201 -8.464 2.909 3.331 1.00 20.00 C HETATM 3003 C8 UQ2 A 201 -7.788 1.810 4.117 1.00 20.00 C HETATM 3004 C9 UQ2 A 201 -6.979 0.961 3.518 1.00 20.00 C HETATM 3005 C10 UQ2 A 201 -6.712 1.079 2.035 1.00 20.00 C HETATM 3006 C11 UQ2 A 201 -6.315 -0.141 4.314 1.00 20.00 C HETATM 3007 C12 UQ2 A 201 -5.544 0.446 5.500 1.00 20.00 C HETATM 3008 C13 UQ2 A 201 -4.096 0.038 5.403 1.00 20.00 C HETATM 3009 C14 UQ2 A 201 -3.294 0.213 6.426 1.00 20.00 C HETATM 3010 C15 UQ2 A 201 -1.845 -0.198 6.323 1.00 20.00 C HETATM 3011 C16 UQ2 A 201 -3.818 0.822 7.702 1.00 20.00 C HETATM 3012 O1 UQ2 A 201 -10.825 3.588 4.766 1.00 20.00 O HETATM 3013 O2 UQ2 A 201 -11.280 5.830 6.338 1.00 20.00 O HETATM 3014 O3 UQ2 A 201 -9.249 7.618 6.565 1.00 20.00 O HETATM 3015 O4 UQ2 A 201 -6.887 7.032 5.251 1.00 20.00 O HETATM 0 H5M3 UQ2 A 201 -6.099 5.593 2.931 1.00 20.00 H new HETATM 0 H5M2 UQ2 A 201 -5.506 4.716 4.361 1.00 20.00 H new HETATM 0 H5M1 UQ2 A 201 -6.355 3.838 3.067 1.00 20.00 H new HETATM 0 H3M3 UQ2 A 201 -10.216 6.582 8.075 1.00 20.00 H new HETATM 0 H3M2 UQ2 A 201 -8.452 6.723 8.254 1.00 20.00 H new HETATM 0 H3M1 UQ2 A 201 -9.493 8.135 8.556 1.00 20.00 H new HETATM 0 H2M3 UQ2 A 201 -11.688 3.799 6.459 1.00 20.00 H new HETATM 0 H2M2 UQ2 A 201 -10.812 4.486 7.848 1.00 20.00 H new HETATM 0 H2M1 UQ2 A 201 -12.547 4.822 7.635 1.00 20.00 H new HETATM 0 H163 UQ2 A 201 -4.203 1.821 7.497 1.00 20.00 H new HETATM 0 H162 UQ2 A 201 -4.619 0.199 8.100 1.00 20.00 H new HETATM 0 H161 UQ2 A 201 -3.011 0.887 8.432 1.00 20.00 H new HETATM 0 H153 UQ2 A 201 -1.784 -1.267 6.118 1.00 20.00 H new HETATM 0 H152 UQ2 A 201 -1.367 0.354 5.514 1.00 20.00 H new HETATM 0 H151 UQ2 A 201 -1.337 0.021 7.262 1.00 20.00 H new HETATM 0 H122 UQ2 A 201 -5.628 1.533 5.502 1.00 20.00 H new HETATM 0 H121 UQ2 A 201 -5.972 0.092 6.438 1.00 20.00 H new HETATM 0 H112 UQ2 A 201 -7.068 -0.843 4.673 1.00 20.00 H new HETATM 0 H111 UQ2 A 201 -5.636 -0.703 3.673 1.00 20.00 H new HETATM 0 H103 UQ2 A 201 -7.649 0.976 1.487 1.00 20.00 H new HETATM 0 H102 UQ2 A 201 -6.272 2.053 1.821 1.00 20.00 H new HETATM 0 H101 UQ2 A 201 -6.023 0.293 1.726 1.00 20.00 H new HETATM 0 H8 UQ2 A 201 -7.971 1.719 5.188 1.00 20.00 H new HETATM 0 H72 UQ2 A 201 -9.438 2.568 2.979 1.00 20.00 H new HETATM 0 H71 UQ2 A 201 -7.873 3.151 2.448 1.00 20.00 H new HETATM 0 H13 UQ2 A 201 -3.715 -0.403 4.482 1.00 20.00 H new