USER MOD reduce.3.24.130724 H: found=0, std=0, add=1535, rem=0, adj=28 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 95 GLN : amide:sc= -3.64! C(o=-3.6!,f=-7.8!) USER MOD Set 1.2: A 144 GLN : amide:sc= 0.0428 K(o=-3.6,f=-6.7!) USER MOD Set 2.1: A 6 ASN : amide:sc= -3.48! C(o=-2.6!,f=-2.7!) USER MOD Set 2.2: A 163 SER OG : rot -112:sc= 0.831 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= -1.13 (180deg=-1.13) USER MOD Single : A 7 GLN : amide:sc= -0.164 K(o=-0.16,f=-1.3) USER MOD Single : A 9 SER OG : rot -83:sc= 0.777 USER MOD Single : A 10 GLN :FLIP amide:sc= -6.28! C(o=-8.2!,f=-6.3!) USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 21 THR OG1 : rot 77:sc= 1.29 USER MOD Single : A 28 THR OG1 : rot 74:sc= -0.0225 USER MOD Single : A 33 GLN : amide:sc= -0.101 K(o=-0.1,f=-1.7!) USER MOD Single : A 34 HIS : no HE2:sc= -0.397! C(o=-0.4!,f=-6.7!) USER MOD Single : A 36 MET CE :methyl 153:sc= 0 (180deg=-0.6) USER MOD Single : A 39 LYS NZ :NH3+ -161:sc= -0.0195 (180deg=-0.31) USER MOD Single : A 44 SER OG : rot 180:sc= -0.518 USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 THR OG1 : rot 39:sc= 0.307 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 -10:sc= 0.559 USER MOD Single : A 86 GLN : amide:sc= -3.66! C(o=-3.7!,f=-3.8!) USER MOD Single : A 88 THR OG1 : rot -82:sc= -0.0903 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 HIS : no HE2:sc= -2.33 K(o=-2.3,f=-5.1!) USER MOD Single : A 92 THR OG1 : rot -6:sc= -0.117 USER MOD Single : A 93 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 139:sc= 0.21! USER MOD Single : A 103 THR OG1 : rot 180:sc= -0.402 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 -28:sc= 0.457 USER MOD Single : A 134 GLN : amide:sc= -1.05 X(o=-1,f=-0.73) USER MOD Single : A 142 MET CE :methyl 160:sc= -1.32 (180deg=-3.03) USER MOD Single : A 153 TYR OH : rot -179:sc= 0.658 USER MOD Single : A 164 GLN :FLIP amide:sc= -0.453 F(o=-3.4!,f=-0.45) USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 169 LYS NZ :NH3+ -159:sc= -0.0626 (180deg=-0.955) USER MOD Single : A 170 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 178 HIS : no HD1:sc= -2.21 K(o=-2.2,f=-2.9) USER MOD Single : A 179 HIS : no HD1:sc= -0.794 K(o=-0.79,f=-2!) USER MOD Single : A 180 HIS : no HD1:sc= -1.78! C(o=-1.8!,f=-7.4!) USER MOD Single : A 181 HIS : no HD1:sc= -2.95! C(o=-2.9!,f=-11!) USER MOD Single : A 182 HIS : no HD1:sc= -0.129 X(o=-0.13,f=-0.59) USER MOD Single : A 183 HIS : no HE2:sc= -2.55! C(o=-2.6!,f=-6.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 15.418 -23.336 -5.044 1.00 0.00 N ATOM 2 CA MET A 1 14.478 -22.663 -4.105 1.00 0.00 C ATOM 3 C MET A 1 13.292 -22.109 -4.889 1.00 0.00 C ATOM 4 O MET A 1 12.264 -21.755 -4.310 1.00 0.00 O ATOM 5 CB MET A 1 15.206 -21.525 -3.387 1.00 0.00 C ATOM 6 CG MET A 1 15.947 -20.665 -4.412 1.00 0.00 C ATOM 7 SD MET A 1 16.507 -19.132 -3.625 1.00 0.00 S ATOM 8 CE MET A 1 16.071 -18.004 -4.971 1.00 0.00 C ATOM 0 H1 MET A 1 16.228 -23.715 -4.513 1.00 0.00 H new ATOM 0 H2 MET A 1 14.927 -24.114 -5.528 1.00 0.00 H new ATOM 0 H3 MET A 1 15.757 -22.649 -5.748 1.00 0.00 H new ATOM 0 HA MET A 1 14.117 -23.379 -3.367 1.00 0.00 H new ATOM 0 HB2 MET A 1 14.492 -20.915 -2.833 1.00 0.00 H new ATOM 0 HB3 MET A 1 15.910 -21.931 -2.660 1.00 0.00 H new ATOM 0 HG2 MET A 1 16.800 -21.213 -4.813 1.00 0.00 H new ATOM 0 HG3 MET A 1 15.291 -20.436 -5.252 1.00 0.00 H new ATOM 0 HE1 MET A 1 16.336 -16.984 -4.691 1.00 0.00 H new ATOM 0 HE2 MET A 1 16.615 -18.286 -5.873 1.00 0.00 H new ATOM 0 HE3 MET A 1 14.999 -18.061 -5.161 1.00 0.00 H new ATOM 20 N LEU A 2 13.438 -22.045 -6.208 1.00 0.00 N ATOM 21 CA LEU A 2 12.367 -21.540 -7.059 1.00 0.00 C ATOM 22 C LEU A 2 11.301 -22.613 -7.251 1.00 0.00 C ATOM 23 O LEU A 2 10.106 -22.313 -7.306 1.00 0.00 O ATOM 24 CB LEU A 2 12.928 -21.119 -8.422 1.00 0.00 C ATOM 25 CG LEU A 2 13.989 -22.131 -8.885 1.00 0.00 C ATOM 26 CD1 LEU A 2 13.952 -22.255 -10.411 1.00 0.00 C ATOM 27 CD2 LEU A 2 15.382 -21.658 -8.449 1.00 0.00 C ATOM 0 H LEU A 2 14.279 -22.334 -6.707 1.00 0.00 H new ATOM 0 HA LEU A 2 11.918 -20.672 -6.576 1.00 0.00 H new ATOM 0 HB2 LEU A 2 12.123 -21.062 -9.155 1.00 0.00 H new ATOM 0 HB3 LEU A 2 13.367 -20.124 -8.353 1.00 0.00 H new ATOM 0 HG LEU A 2 13.777 -23.101 -8.435 1.00 0.00 H new ATOM 0 HD11 LEU A 2 14.705 -22.973 -10.736 1.00 0.00 H new ATOM 0 HD12 LEU A 2 12.966 -22.597 -10.724 1.00 0.00 H new ATOM 0 HD13 LEU A 2 14.159 -21.284 -10.860 1.00 0.00 H new ATOM 0 HD21 LEU A 2 16.131 -22.378 -8.779 1.00 0.00 H new ATOM 0 HD22 LEU A 2 15.592 -20.686 -8.895 1.00 0.00 H new ATOM 0 HD23 LEU A 2 15.414 -21.574 -7.363 1.00 0.00 H new ATOM 39 N ARG A 3 11.739 -23.863 -7.347 1.00 0.00 N ATOM 40 CA ARG A 3 10.813 -24.975 -7.525 1.00 0.00 C ATOM 41 C ARG A 3 9.848 -25.053 -6.347 1.00 0.00 C ATOM 42 O ARG A 3 8.646 -25.246 -6.530 1.00 0.00 O ATOM 43 CB ARG A 3 11.588 -26.290 -7.640 1.00 0.00 C ATOM 44 CG ARG A 3 12.517 -26.231 -8.855 1.00 0.00 C ATOM 45 CD ARG A 3 13.079 -27.626 -9.142 1.00 0.00 C ATOM 46 NE ARG A 3 14.307 -27.524 -9.923 1.00 0.00 N ATOM 47 CZ ARG A 3 15.473 -27.267 -9.340 1.00 0.00 C ATOM 48 NH1 ARG A 3 15.532 -27.097 -8.048 1.00 0.00 N ATOM 49 NH2 ARG A 3 16.559 -27.184 -10.060 1.00 0.00 N ATOM 0 H ARG A 3 12.722 -24.131 -7.305 1.00 0.00 H new ATOM 0 HA ARG A 3 10.245 -24.810 -8.441 1.00 0.00 H new ATOM 0 HB2 ARG A 3 12.168 -26.463 -6.734 1.00 0.00 H new ATOM 0 HB3 ARG A 3 10.895 -27.125 -7.739 1.00 0.00 H new ATOM 0 HG2 ARG A 3 11.972 -25.862 -9.724 1.00 0.00 H new ATOM 0 HG3 ARG A 3 13.332 -25.531 -8.669 1.00 0.00 H new ATOM 0 HD2 ARG A 3 13.278 -28.146 -8.205 1.00 0.00 H new ATOM 0 HD3 ARG A 3 12.342 -28.218 -9.685 1.00 0.00 H new ATOM 0 HE ARG A 3 14.270 -27.652 -10.934 1.00 0.00 H new ATOM 0 HH11 ARG A 3 14.683 -27.161 -7.486 1.00 0.00 H new ATOM 0 HH12 ARG A 3 16.427 -26.900 -7.600 1.00 0.00 H new ATOM 0 HH21 ARG A 3 16.512 -27.316 -11.070 1.00 0.00 H new ATOM 0 HH22 ARG A 3 17.454 -26.987 -9.612 1.00 0.00 H new ATOM 63 N PHE A 4 10.382 -24.897 -5.141 1.00 0.00 N ATOM 64 CA PHE A 4 9.558 -24.947 -3.938 1.00 0.00 C ATOM 65 C PHE A 4 8.530 -23.822 -3.956 1.00 0.00 C ATOM 66 O PHE A 4 7.339 -24.051 -3.747 1.00 0.00 O ATOM 67 CB PHE A 4 10.442 -24.817 -2.695 1.00 0.00 C ATOM 68 CG PHE A 4 9.646 -25.199 -1.469 1.00 0.00 C ATOM 69 CD1 PHE A 4 9.413 -26.548 -1.179 1.00 0.00 C ATOM 70 CD2 PHE A 4 9.143 -24.203 -0.622 1.00 0.00 C ATOM 71 CE1 PHE A 4 8.677 -26.901 -0.042 1.00 0.00 C ATOM 72 CE2 PHE A 4 8.407 -24.557 0.514 1.00 0.00 C ATOM 73 CZ PHE A 4 8.173 -25.906 0.804 1.00 0.00 C ATOM 0 H PHE A 4 11.375 -24.736 -4.970 1.00 0.00 H new ATOM 0 HA PHE A 4 9.036 -25.904 -3.911 1.00 0.00 H new ATOM 0 HB2 PHE A 4 11.317 -25.460 -2.789 1.00 0.00 H new ATOM 0 HB3 PHE A 4 10.807 -23.794 -2.601 1.00 0.00 H new ATOM 0 HD1 PHE A 4 9.801 -27.316 -1.832 1.00 0.00 H new ATOM 0 HD2 PHE A 4 9.323 -23.162 -0.846 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.498 -27.942 0.183 1.00 0.00 H new ATOM 0 HE2 PHE A 4 8.019 -23.789 1.167 1.00 0.00 H new ATOM 0 HZ PHE A 4 7.604 -26.179 1.680 1.00 0.00 H new ATOM 83 N LEU A 5 8.997 -22.604 -4.208 1.00 0.00 N ATOM 84 CA LEU A 5 8.103 -21.453 -4.251 1.00 0.00 C ATOM 85 C LEU A 5 6.870 -21.773 -5.092 1.00 0.00 C ATOM 86 O LEU A 5 5.760 -21.349 -4.771 1.00 0.00 O ATOM 87 CB LEU A 5 8.831 -20.241 -4.843 1.00 0.00 C ATOM 88 CG LEU A 5 8.083 -18.951 -4.472 1.00 0.00 C ATOM 89 CD1 LEU A 5 8.529 -18.469 -3.087 1.00 0.00 C ATOM 90 CD2 LEU A 5 8.394 -17.866 -5.506 1.00 0.00 C ATOM 0 H LEU A 5 9.979 -22.389 -4.384 1.00 0.00 H new ATOM 0 HA LEU A 5 7.789 -21.220 -3.234 1.00 0.00 H new ATOM 0 HB2 LEU A 5 9.853 -20.200 -4.467 1.00 0.00 H new ATOM 0 HB3 LEU A 5 8.894 -20.337 -5.927 1.00 0.00 H new ATOM 0 HG LEU A 5 7.012 -19.152 -4.457 1.00 0.00 H new ATOM 0 HD11 LEU A 5 7.995 -17.554 -2.831 1.00 0.00 H new ATOM 0 HD12 LEU A 5 8.309 -19.238 -2.346 1.00 0.00 H new ATOM 0 HD13 LEU A 5 9.601 -18.272 -3.098 1.00 0.00 H new ATOM 0 HD21 LEU A 5 7.864 -16.951 -5.244 1.00 0.00 H new ATOM 0 HD22 LEU A 5 9.467 -17.673 -5.519 1.00 0.00 H new ATOM 0 HD23 LEU A 5 8.073 -18.201 -6.492 1.00 0.00 H new ATOM 102 N ASN A 6 7.077 -22.527 -6.167 1.00 0.00 N ATOM 103 CA ASN A 6 5.977 -22.904 -7.049 1.00 0.00 C ATOM 104 C ASN A 6 5.053 -23.895 -6.349 1.00 0.00 C ATOM 105 O ASN A 6 3.868 -23.991 -6.670 1.00 0.00 O ATOM 106 CB ASN A 6 6.527 -23.530 -8.331 1.00 0.00 C ATOM 107 CG ASN A 6 5.399 -23.743 -9.335 1.00 0.00 C ATOM 108 OD1 ASN A 6 4.334 -24.244 -8.975 1.00 0.00 O ATOM 109 ND2 ASN A 6 5.571 -23.393 -10.581 1.00 0.00 N ATOM 0 H ASN A 6 7.989 -22.887 -6.447 1.00 0.00 H new ATOM 0 HA ASN A 6 5.409 -22.008 -7.301 1.00 0.00 H new ATOM 0 HB2 ASN A 6 7.291 -22.883 -8.762 1.00 0.00 H new ATOM 0 HB3 ASN A 6 7.007 -24.482 -8.104 1.00 0.00 H new ATOM 0 HD21 ASN A 6 4.822 -23.535 -11.259 1.00 0.00 H new ATOM 0 HD22 ASN A 6 6.455 -22.978 -10.877 1.00 0.00 H new ATOM 116 N GLN A 7 5.606 -24.633 -5.392 1.00 0.00 N ATOM 117 CA GLN A 7 4.825 -25.618 -4.653 1.00 0.00 C ATOM 118 C GLN A 7 4.047 -24.948 -3.527 1.00 0.00 C ATOM 119 O GLN A 7 2.841 -25.155 -3.385 1.00 0.00 O ATOM 120 CB GLN A 7 5.751 -26.688 -4.071 1.00 0.00 C ATOM 121 CG GLN A 7 6.415 -27.465 -5.210 1.00 0.00 C ATOM 122 CD GLN A 7 5.380 -28.323 -5.928 1.00 0.00 C ATOM 123 OE1 GLN A 7 4.443 -28.820 -5.304 1.00 0.00 O ATOM 124 NE2 GLN A 7 5.493 -28.526 -7.212 1.00 0.00 N ATOM 0 H GLN A 7 6.585 -24.569 -5.112 1.00 0.00 H new ATOM 0 HA GLN A 7 4.118 -26.084 -5.340 1.00 0.00 H new ATOM 0 HB2 GLN A 7 6.511 -26.223 -3.443 1.00 0.00 H new ATOM 0 HB3 GLN A 7 5.184 -27.368 -3.435 1.00 0.00 H new ATOM 0 HG2 GLN A 7 6.876 -26.772 -5.914 1.00 0.00 H new ATOM 0 HG3 GLN A 7 7.212 -28.096 -4.815 1.00 0.00 H new ATOM 0 HE21 GLN A 7 6.270 -28.113 -7.727 1.00 0.00 H new ATOM 0 HE22 GLN A 7 4.804 -29.098 -7.701 1.00 0.00 H new ATOM 133 N ALA A 8 4.742 -24.146 -2.729 1.00 0.00 N ATOM 134 CA ALA A 8 4.104 -23.453 -1.616 1.00 0.00 C ATOM 135 C ALA A 8 3.011 -22.516 -2.121 1.00 0.00 C ATOM 136 O ALA A 8 1.994 -22.318 -1.458 1.00 0.00 O ATOM 137 CB ALA A 8 5.146 -22.653 -0.834 1.00 0.00 C ATOM 0 H ALA A 8 5.740 -23.960 -2.830 1.00 0.00 H new ATOM 0 HA ALA A 8 3.651 -24.197 -0.961 1.00 0.00 H new ATOM 0 HB1 ALA A 8 4.662 -22.138 -0.004 1.00 0.00 H new ATOM 0 HB2 ALA A 8 5.908 -23.329 -0.446 1.00 0.00 H new ATOM 0 HB3 ALA A 8 5.612 -21.921 -1.493 1.00 0.00 H new ATOM 143 N SER A 9 3.228 -21.942 -3.299 1.00 0.00 N ATOM 144 CA SER A 9 2.254 -21.026 -3.879 1.00 0.00 C ATOM 145 C SER A 9 1.072 -21.798 -4.455 1.00 0.00 C ATOM 146 O SER A 9 -0.066 -21.334 -4.408 1.00 0.00 O ATOM 147 CB SER A 9 2.910 -20.196 -4.983 1.00 0.00 C ATOM 148 OG SER A 9 3.359 -21.062 -6.018 1.00 0.00 O ATOM 0 H SER A 9 4.062 -22.093 -3.867 1.00 0.00 H new ATOM 0 HA SER A 9 1.893 -20.363 -3.093 1.00 0.00 H new ATOM 0 HB2 SER A 9 2.199 -19.473 -5.381 1.00 0.00 H new ATOM 0 HB3 SER A 9 3.748 -19.629 -4.578 1.00 0.00 H new ATOM 0 HG SER A 9 4.237 -21.428 -5.781 1.00 0.00 H new ATOM 154 N GLN A 10 1.350 -22.979 -4.994 1.00 0.00 N ATOM 155 CA GLN A 10 0.299 -23.808 -5.574 1.00 0.00 C ATOM 156 C GLN A 10 -0.593 -24.386 -4.479 1.00 0.00 C ATOM 157 O GLN A 10 -1.459 -25.220 -4.742 1.00 0.00 O ATOM 158 CB GLN A 10 0.922 -24.946 -6.387 1.00 0.00 C ATOM 159 CG GLN A 10 1.371 -24.418 -7.753 1.00 0.00 C ATOM 160 CD GLN A 10 0.173 -24.306 -8.689 1.00 0.00 C ATOM 161 OE1 GLN A 10 -1.035 -24.385 -8.202 1.00 0.00 O flip ATOM 162 NE2 GLN A 10 0.342 -24.142 -9.898 1.00 0.00 N flip ATOM 0 H GLN A 10 2.286 -23.382 -5.042 1.00 0.00 H new ATOM 0 HA GLN A 10 -0.310 -23.186 -6.230 1.00 0.00 H new ATOM 0 HB2 GLN A 10 1.773 -25.366 -5.851 1.00 0.00 H new ATOM 0 HB3 GLN A 10 0.199 -25.751 -6.517 1.00 0.00 H new ATOM 0 HG2 GLN A 10 1.845 -23.443 -7.637 1.00 0.00 H new ATOM 0 HG3 GLN A 10 2.117 -25.086 -8.183 1.00 0.00 H new ATOM 0 HE21 GLN A 10 1.287 -24.080 -10.277 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -0.463 -24.068 -10.520 1.00 0.00 H new ATOM 171 N GLY A 11 -0.387 -23.913 -3.251 1.00 0.00 N ATOM 172 CA GLY A 11 -1.190 -24.362 -2.115 1.00 0.00 C ATOM 173 C GLY A 11 -2.274 -23.334 -1.814 1.00 0.00 C ATOM 174 O GLY A 11 -2.045 -22.126 -1.903 1.00 0.00 O ATOM 0 H GLY A 11 0.326 -23.222 -3.018 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -1.643 -25.328 -2.337 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -0.554 -24.501 -1.240 1.00 0.00 H new ATOM 178 N ARG A 12 -3.458 -23.823 -1.456 1.00 0.00 N ATOM 179 CA ARG A 12 -4.578 -22.945 -1.145 1.00 0.00 C ATOM 180 C ARG A 12 -4.336 -22.202 0.163 1.00 0.00 C ATOM 181 O ARG A 12 -4.477 -20.982 0.229 1.00 0.00 O ATOM 182 CB ARG A 12 -5.870 -23.761 -1.044 1.00 0.00 C ATOM 183 CG ARG A 12 -5.837 -24.902 -2.064 1.00 0.00 C ATOM 184 CD ARG A 12 -7.252 -25.455 -2.265 1.00 0.00 C ATOM 185 NE ARG A 12 -7.192 -26.862 -2.647 1.00 0.00 N ATOM 186 CZ ARG A 12 -7.096 -27.820 -1.731 1.00 0.00 C ATOM 187 NH1 ARG A 12 -7.057 -27.510 -0.464 1.00 0.00 N ATOM 188 NH2 ARG A 12 -7.041 -29.071 -2.098 1.00 0.00 N ATOM 0 H ARG A 12 -3.665 -24.819 -1.375 1.00 0.00 H new ATOM 0 HA ARG A 12 -4.673 -22.214 -1.948 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -5.980 -24.163 -0.037 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -6.732 -23.120 -1.228 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -5.438 -24.543 -3.013 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -5.172 -25.693 -1.718 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -7.828 -25.344 -1.346 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -7.768 -24.883 -3.036 1.00 0.00 H new ATOM 0 HE ARG A 12 -7.224 -27.115 -3.635 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -7.100 -26.532 -0.177 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -6.983 -28.245 0.239 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -7.072 -29.314 -3.088 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -6.967 -29.806 -1.395 1.00 0.00 H new ATOM 202 N GLY A 13 -3.971 -22.942 1.208 1.00 0.00 N ATOM 203 CA GLY A 13 -3.715 -22.342 2.510 1.00 0.00 C ATOM 204 C GLY A 13 -2.916 -21.058 2.357 1.00 0.00 C ATOM 205 O GLY A 13 -3.228 -20.037 2.971 1.00 0.00 O ATOM 0 H GLY A 13 -3.847 -23.954 1.176 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -4.659 -22.132 3.012 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -3.169 -23.044 3.140 1.00 0.00 H new ATOM 209 N ALA A 14 -1.884 -21.119 1.522 1.00 0.00 N ATOM 210 CA ALA A 14 -1.043 -19.958 1.278 1.00 0.00 C ATOM 211 C ALA A 14 -1.870 -18.836 0.665 1.00 0.00 C ATOM 212 O ALA A 14 -1.793 -17.686 1.099 1.00 0.00 O ATOM 213 CB ALA A 14 0.104 -20.328 0.335 1.00 0.00 C ATOM 0 H ALA A 14 -1.613 -21.956 1.006 1.00 0.00 H new ATOM 0 HA ALA A 14 -0.628 -19.620 2.227 1.00 0.00 H new ATOM 0 HB1 ALA A 14 0.728 -19.451 0.159 1.00 0.00 H new ATOM 0 HB2 ALA A 14 0.706 -21.117 0.786 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -0.303 -20.680 -0.613 1.00 0.00 H new ATOM 219 N TRP A 15 -2.665 -19.179 -0.344 1.00 0.00 N ATOM 220 CA TRP A 15 -3.506 -18.184 -1.001 1.00 0.00 C ATOM 221 C TRP A 15 -4.483 -17.571 -0.002 1.00 0.00 C ATOM 222 O TRP A 15 -4.634 -16.351 0.062 1.00 0.00 O ATOM 223 CB TRP A 15 -4.279 -18.829 -2.157 1.00 0.00 C ATOM 224 CG TRP A 15 -3.376 -18.967 -3.342 1.00 0.00 C ATOM 225 CD1 TRP A 15 -3.008 -20.139 -3.905 1.00 0.00 C ATOM 226 CD2 TRP A 15 -2.723 -17.919 -4.114 1.00 0.00 C ATOM 227 NE1 TRP A 15 -2.169 -19.878 -4.975 1.00 0.00 N ATOM 228 CE2 TRP A 15 -1.964 -18.523 -5.143 1.00 0.00 C ATOM 229 CE3 TRP A 15 -2.715 -16.515 -4.023 1.00 0.00 C ATOM 230 CZ2 TRP A 15 -1.223 -17.765 -6.050 1.00 0.00 C ATOM 231 CZ3 TRP A 15 -1.970 -15.748 -4.933 1.00 0.00 C ATOM 232 CH2 TRP A 15 -1.227 -16.371 -5.944 1.00 0.00 C ATOM 0 H TRP A 15 -2.745 -20.124 -0.720 1.00 0.00 H new ATOM 0 HA TRP A 15 -2.866 -17.395 -1.396 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -4.655 -19.807 -1.857 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -5.145 -18.220 -2.415 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -3.318 -21.119 -3.574 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -1.754 -20.598 -5.566 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -3.285 -16.024 -3.248 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -0.651 -18.251 -6.827 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -1.970 -14.671 -4.853 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -0.657 -15.775 -6.641 1.00 0.00 H new ATOM 243 N LEU A 16 -5.137 -18.422 0.784 1.00 0.00 N ATOM 244 CA LEU A 16 -6.087 -17.944 1.782 1.00 0.00 C ATOM 245 C LEU A 16 -5.386 -17.015 2.768 1.00 0.00 C ATOM 246 O LEU A 16 -5.997 -16.100 3.319 1.00 0.00 O ATOM 247 CB LEU A 16 -6.699 -19.130 2.536 1.00 0.00 C ATOM 248 CG LEU A 16 -7.652 -19.901 1.611 1.00 0.00 C ATOM 249 CD1 LEU A 16 -7.775 -21.348 2.094 1.00 0.00 C ATOM 250 CD2 LEU A 16 -9.038 -19.246 1.626 1.00 0.00 C ATOM 0 H LEU A 16 -5.028 -19.436 0.750 1.00 0.00 H new ATOM 0 HA LEU A 16 -6.881 -17.395 1.276 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -5.910 -19.792 2.893 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -7.238 -18.775 3.414 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.254 -19.883 0.596 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.452 -21.895 1.437 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -6.793 -21.821 2.079 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.168 -21.360 3.111 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -9.709 -19.798 0.968 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -9.435 -19.258 2.641 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -8.957 -18.216 1.280 1.00 0.00 H new ATOM 262 N LEU A 17 -4.098 -17.264 2.986 1.00 0.00 N ATOM 263 CA LEU A 17 -3.314 -16.451 3.910 1.00 0.00 C ATOM 264 C LEU A 17 -3.106 -15.050 3.341 1.00 0.00 C ATOM 265 O LEU A 17 -2.994 -14.076 4.088 1.00 0.00 O ATOM 266 CB LEU A 17 -1.952 -17.121 4.162 1.00 0.00 C ATOM 267 CG LEU A 17 -1.831 -17.542 5.632 1.00 0.00 C ATOM 268 CD1 LEU A 17 -0.683 -18.544 5.782 1.00 0.00 C ATOM 269 CD2 LEU A 17 -1.545 -16.311 6.497 1.00 0.00 C ATOM 0 H LEU A 17 -3.577 -18.018 2.538 1.00 0.00 H new ATOM 0 HA LEU A 17 -3.856 -16.367 4.852 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -1.843 -17.993 3.517 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -1.147 -16.432 3.906 1.00 0.00 H new ATOM 0 HG LEU A 17 -2.765 -18.003 5.954 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -0.596 -18.844 6.826 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -0.884 -19.422 5.168 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.249 -18.080 5.459 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -1.459 -16.612 7.541 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.612 -15.849 6.175 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -2.360 -15.595 6.392 1.00 0.00 H new ATOM 281 N MET A 18 -3.058 -14.953 2.017 1.00 0.00 N ATOM 282 CA MET A 18 -2.863 -13.666 1.363 1.00 0.00 C ATOM 283 C MET A 18 -4.133 -12.834 1.456 1.00 0.00 C ATOM 284 O MET A 18 -4.078 -11.606 1.507 1.00 0.00 O ATOM 285 CB MET A 18 -2.490 -13.875 -0.106 1.00 0.00 C ATOM 286 CG MET A 18 -1.060 -14.408 -0.198 1.00 0.00 C ATOM 287 SD MET A 18 0.106 -13.074 0.172 1.00 0.00 S ATOM 288 CE MET A 18 1.622 -14.054 0.045 1.00 0.00 C ATOM 0 H MET A 18 -3.151 -15.744 1.380 1.00 0.00 H new ATOM 0 HA MET A 18 -2.053 -13.137 1.866 1.00 0.00 H new ATOM 0 HB2 MET A 18 -3.182 -14.577 -0.572 1.00 0.00 H new ATOM 0 HB3 MET A 18 -2.575 -12.935 -0.651 1.00 0.00 H new ATOM 0 HG2 MET A 18 -0.922 -15.231 0.503 1.00 0.00 H new ATOM 0 HG3 MET A 18 -0.872 -14.804 -1.196 1.00 0.00 H new ATOM 0 HE1 MET A 18 2.485 -13.417 0.240 1.00 0.00 H new ATOM 0 HE2 MET A 18 1.595 -14.862 0.776 1.00 0.00 H new ATOM 0 HE3 MET A 18 1.701 -14.474 -0.958 1.00 0.00 H new ATOM 298 N ALA A 19 -5.278 -13.507 1.470 1.00 0.00 N ATOM 299 CA ALA A 19 -6.555 -12.817 1.550 1.00 0.00 C ATOM 300 C ALA A 19 -6.762 -12.230 2.939 1.00 0.00 C ATOM 301 O ALA A 19 -7.039 -11.039 3.083 1.00 0.00 O ATOM 302 CB ALA A 19 -7.694 -13.787 1.228 1.00 0.00 C ATOM 0 H ALA A 19 -5.346 -14.524 1.427 1.00 0.00 H new ATOM 0 HA ALA A 19 -6.553 -12.005 0.823 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -8.647 -13.262 1.290 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -7.562 -14.182 0.221 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -7.685 -14.609 1.944 1.00 0.00 H new ATOM 308 N PHE A 20 -6.635 -13.069 3.963 1.00 0.00 N ATOM 309 CA PHE A 20 -6.819 -12.619 5.338 1.00 0.00 C ATOM 310 C PHE A 20 -5.884 -11.457 5.661 1.00 0.00 C ATOM 311 O PHE A 20 -6.228 -10.576 6.446 1.00 0.00 O ATOM 312 CB PHE A 20 -6.552 -13.777 6.304 1.00 0.00 C ATOM 313 CG PHE A 20 -7.174 -13.470 7.646 1.00 0.00 C ATOM 314 CD1 PHE A 20 -8.567 -13.447 7.781 1.00 0.00 C ATOM 315 CD2 PHE A 20 -6.358 -13.211 8.755 1.00 0.00 C ATOM 316 CE1 PHE A 20 -9.145 -13.164 9.024 1.00 0.00 C ATOM 317 CE2 PHE A 20 -6.937 -12.927 9.997 1.00 0.00 C ATOM 318 CZ PHE A 20 -8.331 -12.903 10.132 1.00 0.00 C ATOM 0 H PHE A 20 -6.407 -14.059 3.867 1.00 0.00 H new ATOM 0 HA PHE A 20 -7.848 -12.277 5.451 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -6.966 -14.702 5.903 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -5.479 -13.931 6.416 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -9.196 -13.648 6.926 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -5.283 -13.230 8.652 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -10.220 -13.147 9.128 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -6.309 -12.726 10.852 1.00 0.00 H new ATOM 0 HZ PHE A 20 -8.777 -12.683 11.091 1.00 0.00 H new ATOM 328 N THR A 21 -4.703 -11.460 5.054 1.00 0.00 N ATOM 329 CA THR A 21 -3.734 -10.395 5.295 1.00 0.00 C ATOM 330 C THR A 21 -4.256 -9.065 4.762 1.00 0.00 C ATOM 331 O THR A 21 -4.450 -8.113 5.520 1.00 0.00 O ATOM 332 CB THR A 21 -2.405 -10.734 4.616 1.00 0.00 C ATOM 333 OG1 THR A 21 -1.896 -11.943 5.161 1.00 0.00 O ATOM 334 CG2 THR A 21 -1.405 -9.601 4.854 1.00 0.00 C ATOM 0 H THR A 21 -4.395 -12.178 4.399 1.00 0.00 H new ATOM 0 HA THR A 21 -3.580 -10.307 6.370 1.00 0.00 H new ATOM 0 HB THR A 21 -2.562 -10.855 3.544 1.00 0.00 H new ATOM 0 HG1 THR A 21 -2.391 -12.703 4.790 1.00 0.00 H new ATOM 0 HG21 THR A 21 -0.459 -9.843 4.370 1.00 0.00 H new ATOM 0 HG22 THR A 21 -1.799 -8.674 4.437 1.00 0.00 H new ATOM 0 HG23 THR A 21 -1.244 -9.477 5.925 1.00 0.00 H new ATOM 342 N ALA A 22 -4.480 -9.007 3.454 1.00 0.00 N ATOM 343 CA ALA A 22 -4.978 -7.789 2.826 1.00 0.00 C ATOM 344 C ALA A 22 -6.319 -7.386 3.429 1.00 0.00 C ATOM 345 O ALA A 22 -6.705 -6.218 3.385 1.00 0.00 O ATOM 346 CB ALA A 22 -5.137 -8.006 1.320 1.00 0.00 C ATOM 0 H ALA A 22 -4.326 -9.784 2.811 1.00 0.00 H new ATOM 0 HA ALA A 22 -4.258 -6.990 3.003 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -5.509 -7.092 0.858 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -4.171 -8.265 0.886 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.844 -8.816 1.142 1.00 0.00 H new ATOM 352 N LEU A 23 -7.027 -8.360 3.993 1.00 0.00 N ATOM 353 CA LEU A 23 -8.324 -8.091 4.604 1.00 0.00 C ATOM 354 C LEU A 23 -8.144 -7.542 6.015 1.00 0.00 C ATOM 355 O LEU A 23 -8.838 -6.611 6.423 1.00 0.00 O ATOM 356 CB LEU A 23 -9.155 -9.379 4.658 1.00 0.00 C ATOM 357 CG LEU A 23 -10.638 -9.032 4.852 1.00 0.00 C ATOM 358 CD1 LEU A 23 -11.307 -8.840 3.488 1.00 0.00 C ATOM 359 CD2 LEU A 23 -11.336 -10.168 5.604 1.00 0.00 C ATOM 0 H LEU A 23 -6.728 -9.334 4.040 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.844 -7.349 3.998 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.022 -9.947 3.737 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -8.810 -10.012 5.476 1.00 0.00 H new ATOM 0 HG LEU A 23 -10.718 -8.110 5.427 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -12.359 -8.594 3.630 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -10.814 -8.029 2.952 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -11.225 -9.760 2.910 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -12.389 -9.921 5.741 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -11.252 -11.090 5.029 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -10.865 -10.303 6.578 1.00 0.00 H new ATOM 371 N ALA A 24 -7.214 -8.129 6.760 1.00 0.00 N ATOM 372 CA ALA A 24 -6.962 -7.694 8.128 1.00 0.00 C ATOM 373 C ALA A 24 -6.792 -6.181 8.188 1.00 0.00 C ATOM 374 O ALA A 24 -7.434 -5.505 8.991 1.00 0.00 O ATOM 375 CB ALA A 24 -5.701 -8.373 8.667 1.00 0.00 C ATOM 0 H ALA A 24 -6.627 -8.901 6.443 1.00 0.00 H new ATOM 0 HA ALA A 24 -7.818 -7.975 8.742 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -5.519 -8.043 9.690 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -5.836 -9.455 8.653 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -4.849 -8.106 8.042 1.00 0.00 H new ATOM 381 N LEU A 25 -5.923 -5.656 7.332 1.00 0.00 N ATOM 382 CA LEU A 25 -5.668 -4.220 7.290 1.00 0.00 C ATOM 383 C LEU A 25 -6.941 -3.459 6.932 1.00 0.00 C ATOM 384 O LEU A 25 -7.165 -2.347 7.408 1.00 0.00 O ATOM 385 CB LEU A 25 -4.572 -3.912 6.264 1.00 0.00 C ATOM 386 CG LEU A 25 -3.198 -4.189 6.880 1.00 0.00 C ATOM 387 CD1 LEU A 25 -3.171 -5.606 7.455 1.00 0.00 C ATOM 388 CD2 LEU A 25 -2.120 -4.057 5.801 1.00 0.00 C ATOM 0 H LEU A 25 -5.384 -6.201 6.659 1.00 0.00 H new ATOM 0 HA LEU A 25 -5.336 -3.899 8.277 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -4.712 -4.524 5.373 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -4.637 -2.871 5.949 1.00 0.00 H new ATOM 0 HG LEU A 25 -3.007 -3.470 7.677 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -2.192 -5.802 7.893 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -3.938 -5.702 8.223 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -3.363 -6.325 6.659 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -1.141 -4.254 6.238 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -2.313 -4.776 5.004 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -2.137 -3.047 5.391 1.00 0.00 H new ATOM 400 N GLU A 26 -7.772 -4.067 6.093 1.00 0.00 N ATOM 401 CA GLU A 26 -9.020 -3.436 5.681 1.00 0.00 C ATOM 402 C GLU A 26 -9.898 -3.135 6.892 1.00 0.00 C ATOM 403 O GLU A 26 -10.511 -2.072 6.979 1.00 0.00 O ATOM 404 CB GLU A 26 -9.776 -4.356 4.719 1.00 0.00 C ATOM 405 CG GLU A 26 -10.848 -3.556 3.975 1.00 0.00 C ATOM 406 CD GLU A 26 -11.516 -4.433 2.923 1.00 0.00 C ATOM 407 OE1 GLU A 26 -10.828 -4.848 2.004 1.00 0.00 O ATOM 408 OE2 GLU A 26 -12.704 -4.678 3.051 1.00 0.00 O ATOM 0 H GLU A 26 -7.606 -4.988 5.688 1.00 0.00 H new ATOM 0 HA GLU A 26 -8.781 -2.498 5.179 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.082 -4.802 4.007 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -10.237 -5.175 5.271 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -11.593 -3.188 4.680 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -10.399 -2.683 3.501 1.00 0.00 H new ATOM 415 N LEU A 27 -9.956 -4.081 7.824 1.00 0.00 N ATOM 416 CA LEU A 27 -10.768 -3.908 9.025 1.00 0.00 C ATOM 417 C LEU A 27 -10.046 -3.035 10.049 1.00 0.00 C ATOM 418 O LEU A 27 -10.605 -2.057 10.545 1.00 0.00 O ATOM 419 CB LEU A 27 -11.081 -5.275 9.646 1.00 0.00 C ATOM 420 CG LEU A 27 -12.271 -5.922 8.924 1.00 0.00 C ATOM 421 CD1 LEU A 27 -13.561 -5.142 9.220 1.00 0.00 C ATOM 422 CD2 LEU A 27 -12.010 -5.925 7.414 1.00 0.00 C ATOM 0 H LEU A 27 -9.455 -4.968 7.773 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.697 -3.414 8.740 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -10.207 -5.923 9.577 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -11.308 -5.158 10.706 1.00 0.00 H new ATOM 0 HG LEU A 27 -12.388 -6.946 9.280 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -14.397 -5.612 8.702 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -13.751 -5.146 10.293 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -13.452 -4.114 8.875 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -12.854 -6.384 6.900 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -11.886 -4.900 7.064 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -11.104 -6.493 7.203 1.00 0.00 H new ATOM 434 N THR A 28 -8.806 -3.396 10.366 1.00 0.00 N ATOM 435 CA THR A 28 -8.026 -2.638 11.339 1.00 0.00 C ATOM 436 C THR A 28 -8.212 -1.139 11.122 1.00 0.00 C ATOM 437 O THR A 28 -8.323 -0.372 12.078 1.00 0.00 O ATOM 438 CB THR A 28 -6.539 -2.999 11.218 1.00 0.00 C ATOM 439 OG1 THR A 28 -6.416 -4.317 10.710 1.00 0.00 O ATOM 440 CG2 THR A 28 -5.871 -2.917 12.593 1.00 0.00 C ATOM 0 H THR A 28 -8.323 -4.201 9.967 1.00 0.00 H new ATOM 0 HA THR A 28 -8.378 -2.894 12.338 1.00 0.00 H new ATOM 0 HB THR A 28 -6.051 -2.298 10.541 1.00 0.00 H new ATOM 0 HG1 THR A 28 -6.638 -4.322 9.756 1.00 0.00 H new ATOM 0 HG21 THR A 28 -4.816 -3.174 12.501 1.00 0.00 H new ATOM 0 HG22 THR A 28 -5.965 -1.904 12.983 1.00 0.00 H new ATOM 0 HG23 THR A 28 -6.356 -3.615 13.275 1.00 0.00 H new ATOM 448 N ALA A 29 -8.239 -0.729 9.858 1.00 0.00 N ATOM 449 CA ALA A 29 -8.408 0.680 9.529 1.00 0.00 C ATOM 450 C ALA A 29 -9.867 1.101 9.667 1.00 0.00 C ATOM 451 O ALA A 29 -10.163 2.184 10.173 1.00 0.00 O ATOM 452 CB ALA A 29 -7.937 0.938 8.099 1.00 0.00 C ATOM 0 H ALA A 29 -8.147 -1.347 9.052 1.00 0.00 H new ATOM 0 HA ALA A 29 -7.809 1.267 10.226 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -8.066 1.993 7.858 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -6.884 0.671 8.009 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.525 0.334 7.408 1.00 0.00 H new ATOM 458 N LEU A 30 -10.775 0.245 9.208 1.00 0.00 N ATOM 459 CA LEU A 30 -12.202 0.538 9.276 1.00 0.00 C ATOM 460 C LEU A 30 -12.627 0.851 10.709 1.00 0.00 C ATOM 461 O LEU A 30 -13.692 1.423 10.937 1.00 0.00 O ATOM 462 CB LEU A 30 -13.000 -0.660 8.754 1.00 0.00 C ATOM 463 CG LEU A 30 -14.419 -0.219 8.367 1.00 0.00 C ATOM 464 CD1 LEU A 30 -14.431 0.277 6.919 1.00 0.00 C ATOM 465 CD2 LEU A 30 -15.376 -1.407 8.497 1.00 0.00 C ATOM 0 H LEU A 30 -10.548 -0.655 8.786 1.00 0.00 H new ATOM 0 HA LEU A 30 -12.403 1.412 8.657 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -12.497 -1.094 7.890 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -13.047 -1.436 9.518 1.00 0.00 H new ATOM 0 HG LEU A 30 -14.736 0.586 9.030 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -15.440 0.589 6.650 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -13.751 1.123 6.819 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -14.110 -0.527 6.256 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -16.383 -1.094 8.222 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -15.052 -2.210 7.834 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -15.375 -1.764 9.527 1.00 0.00 H new ATOM 477 N TRP A 31 -11.794 0.469 11.672 1.00 0.00 N ATOM 478 CA TRP A 31 -12.102 0.710 13.080 1.00 0.00 C ATOM 479 C TRP A 31 -11.463 2.010 13.554 1.00 0.00 C ATOM 480 O TRP A 31 -12.031 2.730 14.374 1.00 0.00 O ATOM 481 CB TRP A 31 -11.584 -0.456 13.927 1.00 0.00 C ATOM 482 CG TRP A 31 -12.240 -0.436 15.273 1.00 0.00 C ATOM 483 CD1 TRP A 31 -13.575 -0.477 15.487 1.00 0.00 C ATOM 484 CD2 TRP A 31 -11.615 -0.372 16.587 1.00 0.00 C ATOM 485 NE1 TRP A 31 -13.809 -0.442 16.851 1.00 0.00 N ATOM 486 CE2 TRP A 31 -12.632 -0.377 17.570 1.00 0.00 C ATOM 487 CE3 TRP A 31 -10.278 -0.309 17.017 1.00 0.00 C ATOM 488 CZ2 TRP A 31 -12.333 -0.323 18.932 1.00 0.00 C ATOM 489 CZ3 TRP A 31 -9.973 -0.255 18.388 1.00 0.00 C ATOM 490 CH2 TRP A 31 -10.999 -0.261 19.343 1.00 0.00 C ATOM 0 H TRP A 31 -10.906 -0.005 11.507 1.00 0.00 H new ATOM 0 HA TRP A 31 -13.183 0.792 13.191 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -11.791 -1.402 13.426 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -10.502 -0.384 14.038 1.00 0.00 H new ATOM 0 HD1 TRP A 31 -14.334 -0.529 14.720 1.00 0.00 H new ATOM 0 HE1 TRP A 31 -14.737 -0.462 17.273 1.00 0.00 H new ATOM 0 HE3 TRP A 31 -9.480 -0.302 16.289 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 -13.127 -0.329 19.664 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 -8.942 -0.209 18.707 1.00 0.00 H new ATOM 0 HH2 TRP A 31 -10.759 -0.218 20.395 1.00 0.00 H new ATOM 501 N PHE A 32 -10.278 2.305 13.033 1.00 0.00 N ATOM 502 CA PHE A 32 -9.572 3.522 13.415 1.00 0.00 C ATOM 503 C PHE A 32 -10.452 4.747 13.168 1.00 0.00 C ATOM 504 O PHE A 32 -10.453 5.690 13.960 1.00 0.00 O ATOM 505 CB PHE A 32 -8.266 3.642 12.616 1.00 0.00 C ATOM 506 CG PHE A 32 -7.107 3.155 13.459 1.00 0.00 C ATOM 507 CD1 PHE A 32 -6.706 3.888 14.581 1.00 0.00 C ATOM 508 CD2 PHE A 32 -6.435 1.973 13.121 1.00 0.00 C ATOM 509 CE1 PHE A 32 -5.636 3.443 15.365 1.00 0.00 C ATOM 510 CE2 PHE A 32 -5.364 1.527 13.905 1.00 0.00 C ATOM 511 CZ PHE A 32 -4.965 2.262 15.027 1.00 0.00 C ATOM 0 H PHE A 32 -9.789 1.725 12.351 1.00 0.00 H new ATOM 0 HA PHE A 32 -9.336 3.471 14.478 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -8.334 3.056 11.700 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -8.103 4.678 12.320 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -7.223 4.799 14.843 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -6.743 1.406 12.255 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -5.328 4.011 16.231 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -4.846 0.616 13.644 1.00 0.00 H new ATOM 0 HZ PHE A 32 -4.139 1.918 15.632 1.00 0.00 H new ATOM 521 N GLN A 33 -11.198 4.728 12.069 1.00 0.00 N ATOM 522 CA GLN A 33 -12.076 5.846 11.731 1.00 0.00 C ATOM 523 C GLN A 33 -13.326 5.843 12.605 1.00 0.00 C ATOM 524 O GLN A 33 -13.839 6.899 12.975 1.00 0.00 O ATOM 525 CB GLN A 33 -12.485 5.766 10.258 1.00 0.00 C ATOM 526 CG GLN A 33 -13.157 4.420 9.985 1.00 0.00 C ATOM 527 CD GLN A 33 -13.289 4.199 8.482 1.00 0.00 C ATOM 528 OE1 GLN A 33 -12.500 4.736 7.704 1.00 0.00 O ATOM 529 NE2 GLN A 33 -14.244 3.437 8.024 1.00 0.00 N ATOM 0 H GLN A 33 -11.214 3.958 11.400 1.00 0.00 H new ATOM 0 HA GLN A 33 -11.528 6.771 11.909 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -13.167 6.581 10.015 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -11.609 5.883 9.620 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -12.572 3.615 10.429 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -14.141 4.394 10.453 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -14.897 2.993 8.670 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -14.338 3.285 7.020 1.00 0.00 H new ATOM 538 N HIS A 34 -13.810 4.652 12.933 1.00 0.00 N ATOM 539 CA HIS A 34 -15.001 4.530 13.767 1.00 0.00 C ATOM 540 C HIS A 34 -14.665 4.850 15.218 1.00 0.00 C ATOM 541 O HIS A 34 -15.554 4.989 16.058 1.00 0.00 O ATOM 542 CB HIS A 34 -15.565 3.109 13.665 1.00 0.00 C ATOM 543 CG HIS A 34 -16.988 3.091 14.155 1.00 0.00 C ATOM 544 ND1 HIS A 34 -17.491 4.060 15.008 1.00 0.00 N ATOM 545 CD2 HIS A 34 -18.027 2.224 13.920 1.00 0.00 C ATOM 546 CE1 HIS A 34 -18.778 3.755 15.255 1.00 0.00 C ATOM 547 NE2 HIS A 34 -19.155 2.645 14.617 1.00 0.00 N ATOM 0 H HIS A 34 -13.402 3.765 12.639 1.00 0.00 H new ATOM 0 HA HIS A 34 -15.750 5.240 13.415 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -15.522 2.764 12.632 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -14.958 2.423 14.256 1.00 0.00 H new ATOM 0 HD1 HIS A 34 -16.979 4.859 15.381 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -17.976 1.348 13.290 1.00 0.00 H new ATOM 0 HE1 HIS A 34 -19.427 4.338 15.892 1.00 0.00 H new ATOM 556 N VAL A 35 -13.373 4.967 15.508 1.00 0.00 N ATOM 557 CA VAL A 35 -12.924 5.272 16.863 1.00 0.00 C ATOM 558 C VAL A 35 -12.369 6.691 16.943 1.00 0.00 C ATOM 559 O VAL A 35 -12.770 7.475 17.804 1.00 0.00 O ATOM 560 CB VAL A 35 -11.845 4.276 17.288 1.00 0.00 C ATOM 561 CG1 VAL A 35 -11.255 4.703 18.634 1.00 0.00 C ATOM 562 CG2 VAL A 35 -12.465 2.883 17.423 1.00 0.00 C ATOM 0 H VAL A 35 -12.622 4.856 14.827 1.00 0.00 H new ATOM 0 HA VAL A 35 -13.779 5.194 17.534 1.00 0.00 H new ATOM 0 HB VAL A 35 -11.055 4.254 16.537 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -10.486 3.992 18.936 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -10.815 5.696 18.540 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -12.044 4.726 19.386 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -11.697 2.171 17.726 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -13.254 2.907 18.174 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -12.885 2.577 16.465 1.00 0.00 H new ATOM 572 N MET A 36 -11.442 7.016 16.047 1.00 0.00 N ATOM 573 CA MET A 36 -10.835 8.346 16.036 1.00 0.00 C ATOM 574 C MET A 36 -11.612 9.289 15.121 1.00 0.00 C ATOM 575 O MET A 36 -11.132 10.369 14.777 1.00 0.00 O ATOM 576 CB MET A 36 -9.375 8.255 15.571 1.00 0.00 C ATOM 577 CG MET A 36 -8.468 7.915 16.758 1.00 0.00 C ATOM 578 SD MET A 36 -6.967 7.103 16.150 1.00 0.00 S ATOM 579 CE MET A 36 -5.974 7.268 17.655 1.00 0.00 C ATOM 0 H MET A 36 -11.096 6.384 15.325 1.00 0.00 H new ATOM 0 HA MET A 36 -10.866 8.744 17.050 1.00 0.00 H new ATOM 0 HB2 MET A 36 -9.278 7.493 14.798 1.00 0.00 H new ATOM 0 HB3 MET A 36 -9.067 9.201 15.126 1.00 0.00 H new ATOM 0 HG2 MET A 36 -8.209 8.822 17.304 1.00 0.00 H new ATOM 0 HG3 MET A 36 -8.992 7.261 17.456 1.00 0.00 H new ATOM 0 HE1 MET A 36 -5.238 6.465 17.695 1.00 0.00 H new ATOM 0 HE2 MET A 36 -5.461 8.230 17.649 1.00 0.00 H new ATOM 0 HE3 MET A 36 -6.624 7.209 18.528 1.00 0.00 H new ATOM 589 N LEU A 37 -12.819 8.882 14.736 1.00 0.00 N ATOM 590 CA LEU A 37 -13.651 9.709 13.869 1.00 0.00 C ATOM 591 C LEU A 37 -12.816 10.335 12.757 1.00 0.00 C ATOM 592 O LEU A 37 -13.003 11.502 12.409 1.00 0.00 O ATOM 593 CB LEU A 37 -14.321 10.813 14.691 1.00 0.00 C ATOM 594 CG LEU A 37 -14.809 10.236 16.022 1.00 0.00 C ATOM 595 CD1 LEU A 37 -15.499 11.335 16.833 1.00 0.00 C ATOM 596 CD2 LEU A 37 -15.804 9.103 15.754 1.00 0.00 C ATOM 0 H LEU A 37 -13.239 7.993 15.008 1.00 0.00 H new ATOM 0 HA LEU A 37 -14.414 9.075 13.418 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -13.616 11.625 14.871 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -15.159 11.235 14.137 1.00 0.00 H new ATOM 0 HG LEU A 37 -13.958 9.849 16.582 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -15.847 10.924 17.781 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -14.793 12.143 17.025 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -16.350 11.722 16.272 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -16.151 8.692 16.702 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -16.654 9.491 15.193 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -15.315 8.319 15.176 1.00 0.00 H new ATOM 608 N LEU A 38 -11.896 9.554 12.203 1.00 0.00 N ATOM 609 CA LEU A 38 -11.039 10.051 11.129 1.00 0.00 C ATOM 610 C LEU A 38 -11.862 10.315 9.872 1.00 0.00 C ATOM 611 O LEU A 38 -12.894 9.681 9.650 1.00 0.00 O ATOM 612 CB LEU A 38 -9.937 9.032 10.814 1.00 0.00 C ATOM 613 CG LEU A 38 -9.163 8.686 12.094 1.00 0.00 C ATOM 614 CD1 LEU A 38 -8.517 7.304 11.949 1.00 0.00 C ATOM 615 CD2 LEU A 38 -8.065 9.726 12.334 1.00 0.00 C ATOM 0 H LEU A 38 -11.724 8.586 12.474 1.00 0.00 H new ATOM 0 HA LEU A 38 -10.582 10.984 11.459 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -10.375 8.129 10.389 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -9.257 9.439 10.066 1.00 0.00 H new ATOM 0 HG LEU A 38 -9.855 8.683 12.936 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -7.968 7.061 12.859 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -9.292 6.556 11.782 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -7.830 7.310 11.102 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -7.519 9.475 13.244 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -7.378 9.731 11.488 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -8.516 10.713 12.441 1.00 0.00 H new ATOM 627 N LYS A 39 -11.399 11.255 9.054 1.00 0.00 N ATOM 628 CA LYS A 39 -12.097 11.601 7.818 1.00 0.00 C ATOM 629 C LYS A 39 -11.309 11.103 6.601 1.00 0.00 C ATOM 630 O LYS A 39 -10.190 11.556 6.362 1.00 0.00 O ATOM 631 CB LYS A 39 -12.262 13.121 7.725 1.00 0.00 C ATOM 632 CG LYS A 39 -13.326 13.589 8.728 1.00 0.00 C ATOM 633 CD LYS A 39 -14.711 13.539 8.076 1.00 0.00 C ATOM 634 CE LYS A 39 -15.775 13.921 9.107 1.00 0.00 C ATOM 635 NZ LYS A 39 -15.908 12.829 10.111 1.00 0.00 N ATOM 0 H LYS A 39 -10.547 11.790 9.223 1.00 0.00 H new ATOM 0 HA LYS A 39 -13.077 11.124 7.828 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -11.312 13.613 7.932 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -12.553 13.404 6.713 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -13.308 12.954 9.614 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -13.106 14.604 9.058 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -14.750 14.222 7.227 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -14.907 12.539 7.689 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -15.500 14.853 9.601 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -16.731 14.093 8.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -16.818 12.922 10.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -15.868 11.908 9.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -15.131 12.894 10.799 1.00 0.00 H new ATOM 649 N PRO A 40 -11.855 10.186 5.835 1.00 0.00 N ATOM 650 CA PRO A 40 -11.165 9.640 4.632 1.00 0.00 C ATOM 651 C PRO A 40 -11.258 10.584 3.436 1.00 0.00 C ATOM 652 O PRO A 40 -12.246 11.300 3.271 1.00 0.00 O ATOM 653 CB PRO A 40 -11.911 8.333 4.363 1.00 0.00 C ATOM 654 CG PRO A 40 -13.298 8.568 4.867 1.00 0.00 C ATOM 655 CD PRO A 40 -13.183 9.569 6.022 1.00 0.00 C ATOM 0 HA PRO A 40 -10.096 9.503 4.793 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -11.913 8.091 3.300 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -11.440 7.496 4.879 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -13.936 8.962 4.076 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -13.750 7.636 5.206 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -13.977 10.314 5.984 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -13.259 9.072 6.989 1.00 0.00 H new ATOM 663 N CYS A 41 -10.222 10.575 2.602 1.00 0.00 N ATOM 664 CA CYS A 41 -10.188 11.427 1.416 1.00 0.00 C ATOM 665 C CYS A 41 -10.612 10.635 0.183 1.00 0.00 C ATOM 666 O CYS A 41 -10.781 9.417 0.247 1.00 0.00 O ATOM 667 CB CYS A 41 -8.773 11.977 1.213 1.00 0.00 C ATOM 668 SG CYS A 41 -8.843 13.461 0.178 1.00 0.00 S ATOM 0 H CYS A 41 -9.396 9.989 2.725 1.00 0.00 H new ATOM 0 HA CYS A 41 -10.882 12.255 1.560 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -8.322 12.214 2.177 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -8.142 11.222 0.743 1.00 0.00 H new ATOM 673 N VAL A 42 -10.780 11.330 -0.939 1.00 0.00 N ATOM 674 CA VAL A 42 -11.182 10.667 -2.175 1.00 0.00 C ATOM 675 C VAL A 42 -10.156 9.608 -2.565 1.00 0.00 C ATOM 676 O VAL A 42 -10.511 8.515 -3.007 1.00 0.00 O ATOM 677 CB VAL A 42 -11.322 11.693 -3.303 1.00 0.00 C ATOM 678 CG1 VAL A 42 -9.940 12.212 -3.704 1.00 0.00 C ATOM 679 CG2 VAL A 42 -11.982 11.030 -4.515 1.00 0.00 C ATOM 0 H VAL A 42 -10.646 12.338 -1.018 1.00 0.00 H new ATOM 0 HA VAL A 42 -12.145 10.183 -2.012 1.00 0.00 H new ATOM 0 HB VAL A 42 -11.936 12.525 -2.958 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -10.044 12.942 -4.507 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -9.465 12.684 -2.844 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -9.325 11.380 -4.047 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -12.082 11.759 -5.319 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -11.366 10.198 -4.855 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -12.969 10.660 -4.235 1.00 0.00 H new ATOM 689 N LEU A 43 -8.881 9.949 -2.404 1.00 0.00 N ATOM 690 CA LEU A 43 -7.799 9.033 -2.748 1.00 0.00 C ATOM 691 C LEU A 43 -7.846 7.778 -1.880 1.00 0.00 C ATOM 692 O LEU A 43 -7.708 6.661 -2.378 1.00 0.00 O ATOM 693 CB LEU A 43 -6.448 9.728 -2.564 1.00 0.00 C ATOM 694 CG LEU A 43 -6.361 10.945 -3.489 1.00 0.00 C ATOM 695 CD1 LEU A 43 -5.117 11.765 -3.136 1.00 0.00 C ATOM 696 CD2 LEU A 43 -6.269 10.485 -4.951 1.00 0.00 C ATOM 0 H LEU A 43 -8.573 10.850 -2.039 1.00 0.00 H new ATOM 0 HA LEU A 43 -7.923 8.740 -3.790 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -6.327 10.039 -1.526 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -5.638 9.033 -2.785 1.00 0.00 H new ATOM 0 HG LEU A 43 -7.254 11.557 -3.360 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -5.054 12.632 -3.794 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -5.183 12.099 -2.101 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.227 11.148 -3.262 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -6.207 11.356 -5.603 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -5.380 9.869 -5.083 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -7.155 9.903 -5.206 1.00 0.00 H new ATOM 708 N SER A 44 -8.041 7.974 -0.580 1.00 0.00 N ATOM 709 CA SER A 44 -8.105 6.853 0.352 1.00 0.00 C ATOM 710 C SER A 44 -9.055 5.782 -0.170 1.00 0.00 C ATOM 711 O SER A 44 -8.791 4.587 -0.036 1.00 0.00 O ATOM 712 CB SER A 44 -8.581 7.341 1.723 1.00 0.00 C ATOM 713 OG SER A 44 -9.296 6.298 2.371 1.00 0.00 O ATOM 0 H SER A 44 -8.157 8.892 -0.150 1.00 0.00 H new ATOM 0 HA SER A 44 -7.108 6.423 0.448 1.00 0.00 H new ATOM 0 HB2 SER A 44 -7.728 7.644 2.330 1.00 0.00 H new ATOM 0 HB3 SER A 44 -9.218 8.218 1.608 1.00 0.00 H new ATOM 0 HG SER A 44 -9.601 6.607 3.250 1.00 0.00 H new ATOM 719 N ILE A 45 -10.157 6.217 -0.771 1.00 0.00 N ATOM 720 CA ILE A 45 -11.135 5.281 -1.314 1.00 0.00 C ATOM 721 C ILE A 45 -10.560 4.568 -2.532 1.00 0.00 C ATOM 722 O ILE A 45 -10.691 3.352 -2.673 1.00 0.00 O ATOM 723 CB ILE A 45 -12.412 6.027 -1.707 1.00 0.00 C ATOM 724 CG1 ILE A 45 -12.910 6.838 -0.506 1.00 0.00 C ATOM 725 CG2 ILE A 45 -13.492 5.019 -2.139 1.00 0.00 C ATOM 726 CD1 ILE A 45 -14.166 7.619 -0.901 1.00 0.00 C ATOM 0 H ILE A 45 -10.394 7.201 -0.894 1.00 0.00 H new ATOM 0 HA ILE A 45 -11.374 4.542 -0.550 1.00 0.00 H new ATOM 0 HB ILE A 45 -12.202 6.699 -2.539 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -13.130 6.173 0.329 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -12.133 7.525 -0.170 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -14.399 5.555 -2.418 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -13.133 4.445 -2.993 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -13.710 4.343 -1.313 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -14.520 8.196 -0.046 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -13.930 8.295 -1.723 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -14.943 6.923 -1.216 1.00 0.00 H new ATOM 738 N TYR A 46 -9.915 5.334 -3.407 1.00 0.00 N ATOM 739 CA TYR A 46 -9.314 4.760 -4.604 1.00 0.00 C ATOM 740 C TYR A 46 -8.265 3.722 -4.210 1.00 0.00 C ATOM 741 O TYR A 46 -8.222 2.623 -4.764 1.00 0.00 O ATOM 742 CB TYR A 46 -8.669 5.868 -5.449 1.00 0.00 C ATOM 743 CG TYR A 46 -8.885 5.588 -6.920 1.00 0.00 C ATOM 744 CD1 TYR A 46 -8.447 4.378 -7.474 1.00 0.00 C ATOM 745 CD2 TYR A 46 -9.522 6.537 -7.730 1.00 0.00 C ATOM 746 CE1 TYR A 46 -8.648 4.118 -8.836 1.00 0.00 C ATOM 747 CE2 TYR A 46 -9.723 6.277 -9.091 1.00 0.00 C ATOM 748 CZ TYR A 46 -9.285 5.067 -9.643 1.00 0.00 C ATOM 749 OH TYR A 46 -9.483 4.810 -10.985 1.00 0.00 O ATOM 0 H TYR A 46 -9.796 6.343 -3.311 1.00 0.00 H new ATOM 0 HA TYR A 46 -10.090 4.273 -5.195 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -9.100 6.834 -5.187 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -7.602 5.926 -5.234 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -7.955 3.646 -6.851 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -9.859 7.471 -7.304 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -8.311 3.185 -9.263 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -10.215 7.009 -9.714 1.00 0.00 H new ATOM 0 HH TYR A 46 -9.940 5.571 -11.400 1.00 0.00 H new ATOM 759 N GLU A 47 -7.427 4.082 -3.243 1.00 0.00 N ATOM 760 CA GLU A 47 -6.384 3.182 -2.769 1.00 0.00 C ATOM 761 C GLU A 47 -6.995 1.878 -2.268 1.00 0.00 C ATOM 762 O GLU A 47 -6.500 0.792 -2.572 1.00 0.00 O ATOM 763 CB GLU A 47 -5.600 3.851 -1.637 1.00 0.00 C ATOM 764 CG GLU A 47 -4.334 3.045 -1.340 1.00 0.00 C ATOM 765 CD GLU A 47 -3.289 3.296 -2.422 1.00 0.00 C ATOM 766 OE1 GLU A 47 -2.966 4.450 -2.650 1.00 0.00 O ATOM 767 OE2 GLU A 47 -2.829 2.331 -3.008 1.00 0.00 O ATOM 0 H GLU A 47 -7.450 4.988 -2.774 1.00 0.00 H new ATOM 0 HA GLU A 47 -5.710 2.960 -3.597 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -5.336 4.871 -1.918 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -6.219 3.917 -0.742 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -3.935 3.326 -0.365 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -4.572 1.982 -1.293 1.00 0.00 H new ATOM 774 N ARG A 48 -8.075 1.994 -1.503 1.00 0.00 N ATOM 775 CA ARG A 48 -8.749 0.819 -0.969 1.00 0.00 C ATOM 776 C ARG A 48 -9.263 -0.060 -2.103 1.00 0.00 C ATOM 777 O ARG A 48 -9.373 -1.276 -1.959 1.00 0.00 O ATOM 778 CB ARG A 48 -9.918 1.245 -0.079 1.00 0.00 C ATOM 779 CG ARG A 48 -10.692 0.007 0.381 1.00 0.00 C ATOM 780 CD ARG A 48 -11.673 0.397 1.489 1.00 0.00 C ATOM 781 NE ARG A 48 -12.675 -0.646 1.665 1.00 0.00 N ATOM 782 CZ ARG A 48 -13.379 -0.741 2.789 1.00 0.00 C ATOM 783 NH1 ARG A 48 -13.174 0.109 3.759 1.00 0.00 N ATOM 784 NH2 ARG A 48 -14.272 -1.682 2.924 1.00 0.00 N ATOM 0 H ARG A 48 -8.499 2.884 -1.241 1.00 0.00 H new ATOM 0 HA ARG A 48 -8.034 0.249 -0.376 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -9.548 1.797 0.785 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -10.579 1.917 -0.627 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -11.232 -0.430 -0.459 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -10.000 -0.753 0.745 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -11.134 0.555 2.423 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -12.159 1.340 1.239 1.00 0.00 H new ATOM 0 HE ARG A 48 -12.839 -1.315 0.913 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -12.475 0.844 3.654 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -13.713 0.038 4.622 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -14.431 -2.346 2.167 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -14.811 -1.753 3.787 1.00 0.00 H new ATOM 798 N ALA A 49 -9.577 0.566 -3.232 1.00 0.00 N ATOM 799 CA ALA A 49 -10.082 -0.168 -4.387 1.00 0.00 C ATOM 800 C ALA A 49 -8.980 -1.030 -4.994 1.00 0.00 C ATOM 801 O ALA A 49 -9.223 -2.164 -5.409 1.00 0.00 O ATOM 802 CB ALA A 49 -10.606 0.812 -5.439 1.00 0.00 C ATOM 0 H ALA A 49 -9.492 1.573 -3.372 1.00 0.00 H new ATOM 0 HA ALA A 49 -10.895 -0.815 -4.058 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -10.981 0.257 -6.299 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -11.412 1.408 -5.012 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -9.798 1.471 -5.757 1.00 0.00 H new ATOM 808 N ALA A 50 -7.770 -0.485 -5.044 1.00 0.00 N ATOM 809 CA ALA A 50 -6.638 -1.214 -5.603 1.00 0.00 C ATOM 810 C ALA A 50 -6.415 -2.521 -4.849 1.00 0.00 C ATOM 811 O ALA A 50 -6.306 -3.588 -5.454 1.00 0.00 O ATOM 812 CB ALA A 50 -5.376 -0.353 -5.522 1.00 0.00 C ATOM 0 H ALA A 50 -7.548 0.452 -4.707 1.00 0.00 H new ATOM 0 HA ALA A 50 -6.856 -1.445 -6.646 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -4.533 -0.903 -5.941 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -5.526 0.567 -6.087 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -5.168 -0.109 -4.480 1.00 0.00 H new ATOM 818 N LEU A 51 -6.356 -2.434 -3.524 1.00 0.00 N ATOM 819 CA LEU A 51 -6.151 -3.620 -2.699 1.00 0.00 C ATOM 820 C LEU A 51 -7.443 -4.424 -2.600 1.00 0.00 C ATOM 821 O LEU A 51 -7.452 -5.624 -2.875 1.00 0.00 O ATOM 822 CB LEU A 51 -5.691 -3.209 -1.296 1.00 0.00 C ATOM 823 CG LEU A 51 -5.055 -4.411 -0.582 1.00 0.00 C ATOM 824 CD1 LEU A 51 -3.563 -4.484 -0.919 1.00 0.00 C ATOM 825 CD2 LEU A 51 -5.221 -4.251 0.933 1.00 0.00 C ATOM 0 H LEU A 51 -6.446 -1.563 -3.002 1.00 0.00 H new ATOM 0 HA LEU A 51 -5.383 -4.239 -3.163 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -4.972 -2.393 -1.364 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -6.539 -2.839 -0.719 1.00 0.00 H new ATOM 0 HG LEU A 51 -5.547 -5.325 -0.913 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -3.116 -5.338 -0.410 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -3.438 -4.597 -1.996 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -3.071 -3.568 -0.591 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -4.770 -5.104 1.441 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -4.730 -3.334 1.258 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -6.282 -4.202 1.180 1.00 0.00 H new ATOM 837 N PHE A 52 -8.537 -3.767 -2.227 1.00 0.00 N ATOM 838 CA PHE A 52 -9.815 -4.462 -2.127 1.00 0.00 C ATOM 839 C PHE A 52 -10.010 -5.345 -3.354 1.00 0.00 C ATOM 840 O PHE A 52 -10.487 -6.477 -3.257 1.00 0.00 O ATOM 841 CB PHE A 52 -10.961 -3.452 -2.029 1.00 0.00 C ATOM 842 CG PHE A 52 -12.281 -4.186 -2.016 1.00 0.00 C ATOM 843 CD1 PHE A 52 -12.671 -4.903 -0.878 1.00 0.00 C ATOM 844 CD2 PHE A 52 -13.115 -4.150 -3.139 1.00 0.00 C ATOM 845 CE1 PHE A 52 -13.895 -5.582 -0.863 1.00 0.00 C ATOM 846 CE2 PHE A 52 -14.339 -4.829 -3.125 1.00 0.00 C ATOM 847 CZ PHE A 52 -14.728 -5.546 -1.987 1.00 0.00 C ATOM 0 H PHE A 52 -8.566 -2.775 -1.993 1.00 0.00 H new ATOM 0 HA PHE A 52 -9.815 -5.080 -1.229 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -10.856 -2.854 -1.124 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -10.925 -2.762 -2.872 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -12.027 -4.932 -0.011 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -12.814 -3.598 -4.017 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -14.196 -6.133 0.015 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -14.983 -4.800 -3.992 1.00 0.00 H new ATOM 0 HZ PHE A 52 -15.671 -6.072 -1.977 1.00 0.00 H new ATOM 857 N GLY A 53 -9.616 -4.817 -4.510 1.00 0.00 N ATOM 858 CA GLY A 53 -9.728 -5.557 -5.759 1.00 0.00 C ATOM 859 C GLY A 53 -8.797 -6.762 -5.742 1.00 0.00 C ATOM 860 O GLY A 53 -9.166 -7.851 -6.184 1.00 0.00 O ATOM 0 H GLY A 53 -9.218 -3.883 -4.605 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -10.757 -5.885 -5.904 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -9.479 -4.908 -6.598 1.00 0.00 H new ATOM 864 N VAL A 54 -7.591 -6.565 -5.212 1.00 0.00 N ATOM 865 CA VAL A 54 -6.624 -7.653 -5.127 1.00 0.00 C ATOM 866 C VAL A 54 -7.165 -8.735 -4.203 1.00 0.00 C ATOM 867 O VAL A 54 -6.715 -9.882 -4.216 1.00 0.00 O ATOM 868 CB VAL A 54 -5.281 -7.134 -4.598 1.00 0.00 C ATOM 869 CG1 VAL A 54 -4.388 -8.315 -4.207 1.00 0.00 C ATOM 870 CG2 VAL A 54 -4.586 -6.314 -5.688 1.00 0.00 C ATOM 0 H VAL A 54 -7.265 -5.673 -4.840 1.00 0.00 H new ATOM 0 HA VAL A 54 -6.465 -8.069 -6.122 1.00 0.00 H new ATOM 0 HB VAL A 54 -5.457 -6.508 -3.723 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -3.435 -7.942 -3.832 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -4.879 -8.901 -3.430 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -4.213 -8.944 -5.080 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -3.632 -5.945 -5.313 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -4.414 -6.942 -6.562 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -5.217 -5.470 -5.967 1.00 0.00 H new ATOM 880 N LEU A 55 -8.153 -8.335 -3.409 1.00 0.00 N ATOM 881 CA LEU A 55 -8.789 -9.248 -2.473 1.00 0.00 C ATOM 882 C LEU A 55 -9.702 -10.202 -3.236 1.00 0.00 C ATOM 883 O LEU A 55 -9.692 -11.411 -3.004 1.00 0.00 O ATOM 884 CB LEU A 55 -9.605 -8.453 -1.443 1.00 0.00 C ATOM 885 CG LEU A 55 -9.643 -9.194 -0.097 1.00 0.00 C ATOM 886 CD1 LEU A 55 -10.122 -10.633 -0.310 1.00 0.00 C ATOM 887 CD2 LEU A 55 -8.245 -9.203 0.541 1.00 0.00 C ATOM 0 H LEU A 55 -8.528 -7.387 -3.397 1.00 0.00 H new ATOM 0 HA LEU A 55 -8.024 -9.822 -1.950 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -9.166 -7.464 -1.308 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -10.620 -8.304 -1.811 1.00 0.00 H new ATOM 0 HG LEU A 55 -10.334 -8.679 0.570 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -10.147 -11.154 0.647 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -11.122 -10.623 -0.744 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -9.438 -11.148 -0.985 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -8.283 -9.730 1.494 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -7.544 -9.707 -0.125 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -7.914 -8.178 0.707 1.00 0.00 H new ATOM 899 N GLY A 56 -10.479 -9.644 -4.157 1.00 0.00 N ATOM 900 CA GLY A 56 -11.387 -10.451 -4.963 1.00 0.00 C ATOM 901 C GLY A 56 -10.599 -11.385 -5.873 1.00 0.00 C ATOM 902 O GLY A 56 -11.031 -12.498 -6.168 1.00 0.00 O ATOM 0 H GLY A 56 -10.499 -8.645 -4.363 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -12.042 -11.032 -4.313 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -12.026 -9.802 -5.562 1.00 0.00 H new ATOM 906 N ALA A 57 -9.433 -10.917 -6.309 1.00 0.00 N ATOM 907 CA ALA A 57 -8.578 -11.711 -7.181 1.00 0.00 C ATOM 908 C ALA A 57 -7.936 -12.851 -6.399 1.00 0.00 C ATOM 909 O ALA A 57 -7.823 -13.972 -6.895 1.00 0.00 O ATOM 910 CB ALA A 57 -7.489 -10.826 -7.791 1.00 0.00 C ATOM 0 H ALA A 57 -9.061 -9.997 -6.073 1.00 0.00 H new ATOM 0 HA ALA A 57 -9.189 -12.132 -7.979 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -6.854 -11.427 -8.442 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -7.952 -10.028 -8.372 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -6.885 -10.392 -6.995 1.00 0.00 H new ATOM 916 N ALA A 58 -7.523 -12.558 -5.171 1.00 0.00 N ATOM 917 CA ALA A 58 -6.901 -13.568 -4.326 1.00 0.00 C ATOM 918 C ALA A 58 -7.864 -14.727 -4.098 1.00 0.00 C ATOM 919 O ALA A 58 -7.446 -15.876 -3.948 1.00 0.00 O ATOM 920 CB ALA A 58 -6.500 -12.955 -2.982 1.00 0.00 C ATOM 0 H ALA A 58 -7.607 -11.637 -4.742 1.00 0.00 H new ATOM 0 HA ALA A 58 -6.008 -13.942 -4.827 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -6.036 -13.719 -2.358 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -5.792 -12.143 -3.149 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -7.386 -12.566 -2.481 1.00 0.00 H new ATOM 926 N LEU A 59 -9.156 -14.417 -4.078 1.00 0.00 N ATOM 927 CA LEU A 59 -10.174 -15.441 -3.874 1.00 0.00 C ATOM 928 C LEU A 59 -10.398 -16.225 -5.166 1.00 0.00 C ATOM 929 O LEU A 59 -10.757 -17.402 -5.137 1.00 0.00 O ATOM 930 CB LEU A 59 -11.492 -14.786 -3.422 1.00 0.00 C ATOM 931 CG LEU A 59 -11.747 -15.083 -1.939 1.00 0.00 C ATOM 932 CD1 LEU A 59 -12.777 -14.091 -1.392 1.00 0.00 C ATOM 933 CD2 LEU A 59 -12.284 -16.511 -1.782 1.00 0.00 C ATOM 0 H LEU A 59 -9.521 -13.472 -4.200 1.00 0.00 H new ATOM 0 HA LEU A 59 -9.833 -16.128 -3.100 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -11.445 -13.709 -3.582 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -12.319 -15.162 -4.024 1.00 0.00 H new ATOM 0 HG LEU A 59 -10.813 -14.985 -1.386 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -12.960 -14.300 -0.338 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -12.397 -13.075 -1.500 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -13.709 -14.190 -1.948 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -12.464 -16.718 -0.727 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -13.217 -16.612 -2.336 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -11.553 -17.220 -2.171 1.00 0.00 H new ATOM 945 N ILE A 60 -10.184 -15.560 -6.297 1.00 0.00 N ATOM 946 CA ILE A 60 -10.362 -16.199 -7.596 1.00 0.00 C ATOM 947 C ILE A 60 -9.154 -17.071 -7.935 1.00 0.00 C ATOM 948 O ILE A 60 -9.301 -18.166 -8.477 1.00 0.00 O ATOM 949 CB ILE A 60 -10.552 -15.132 -8.678 1.00 0.00 C ATOM 950 CG1 ILE A 60 -11.909 -14.450 -8.487 1.00 0.00 C ATOM 951 CG2 ILE A 60 -10.503 -15.783 -10.063 1.00 0.00 C ATOM 952 CD1 ILE A 60 -11.962 -13.165 -9.319 1.00 0.00 C ATOM 0 H ILE A 60 -9.889 -14.585 -6.341 1.00 0.00 H new ATOM 0 HA ILE A 60 -11.248 -16.833 -7.554 1.00 0.00 H new ATOM 0 HB ILE A 60 -9.754 -14.393 -8.598 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -12.711 -15.124 -8.789 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -12.066 -14.219 -7.433 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -10.639 -15.019 -10.829 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -9.538 -16.269 -10.202 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -11.298 -16.524 -10.145 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -12.929 -12.682 -9.181 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -11.170 -12.490 -8.996 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -11.825 -13.408 -10.373 1.00 0.00 H new ATOM 964 N GLY A 61 -7.964 -16.578 -7.612 1.00 0.00 N ATOM 965 CA GLY A 61 -6.739 -17.321 -7.888 1.00 0.00 C ATOM 966 C GLY A 61 -6.657 -18.574 -7.022 1.00 0.00 C ATOM 967 O GLY A 61 -6.122 -19.599 -7.446 1.00 0.00 O ATOM 0 H GLY A 61 -7.821 -15.674 -7.162 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -6.707 -17.599 -8.941 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -5.873 -16.686 -7.699 1.00 0.00 H new ATOM 971 N ALA A 62 -7.191 -18.485 -5.808 1.00 0.00 N ATOM 972 CA ALA A 62 -7.172 -19.617 -4.889 1.00 0.00 C ATOM 973 C ALA A 62 -8.056 -20.746 -5.408 1.00 0.00 C ATOM 974 O ALA A 62 -8.307 -21.723 -4.702 1.00 0.00 O ATOM 975 CB ALA A 62 -7.661 -19.176 -3.507 1.00 0.00 C ATOM 0 H ALA A 62 -7.640 -17.646 -5.440 1.00 0.00 H new ATOM 0 HA ALA A 62 -6.147 -19.981 -4.813 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -7.644 -20.027 -2.826 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -7.009 -18.391 -3.123 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -8.679 -18.795 -3.586 1.00 0.00 H new ATOM 981 N ILE A 63 -8.523 -20.610 -6.644 1.00 0.00 N ATOM 982 CA ILE A 63 -9.374 -21.631 -7.242 1.00 0.00 C ATOM 983 C ILE A 63 -8.530 -22.811 -7.719 1.00 0.00 C ATOM 984 O ILE A 63 -8.776 -23.955 -7.335 1.00 0.00 O ATOM 985 CB ILE A 63 -10.160 -21.039 -8.415 1.00 0.00 C ATOM 986 CG1 ILE A 63 -11.251 -20.111 -7.874 1.00 0.00 C ATOM 987 CG2 ILE A 63 -10.807 -22.167 -9.226 1.00 0.00 C ATOM 988 CD1 ILE A 63 -11.899 -19.346 -9.030 1.00 0.00 C ATOM 0 H ILE A 63 -8.329 -19.810 -7.247 1.00 0.00 H new ATOM 0 HA ILE A 63 -10.077 -21.986 -6.488 1.00 0.00 H new ATOM 0 HB ILE A 63 -9.483 -20.476 -9.058 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -12.005 -20.692 -7.342 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -10.823 -19.411 -7.157 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -11.365 -21.742 -10.060 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -10.032 -22.830 -9.609 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -11.485 -22.732 -8.586 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -12.675 -18.687 -8.641 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -11.142 -18.752 -9.543 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -12.342 -20.053 -9.731 1.00 0.00 H new ATOM 1000 N ALA A 64 -7.534 -22.529 -8.555 1.00 0.00 N ATOM 1001 CA ALA A 64 -6.663 -23.578 -9.073 1.00 0.00 C ATOM 1002 C ALA A 64 -5.444 -22.963 -9.760 1.00 0.00 C ATOM 1003 O ALA A 64 -5.360 -22.933 -10.988 1.00 0.00 O ATOM 1004 CB ALA A 64 -7.429 -24.450 -10.069 1.00 0.00 C ATOM 0 H ALA A 64 -7.312 -21.590 -8.886 1.00 0.00 H new ATOM 0 HA ALA A 64 -6.327 -24.195 -8.239 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -6.771 -25.231 -10.451 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -8.283 -24.908 -9.570 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -7.780 -23.834 -10.897 1.00 0.00 H new ATOM 1010 N PRO A 65 -4.510 -22.472 -8.987 1.00 0.00 N ATOM 1011 CA PRO A 65 -3.265 -21.836 -9.518 1.00 0.00 C ATOM 1012 C PRO A 65 -2.417 -22.807 -10.339 1.00 0.00 C ATOM 1013 O PRO A 65 -1.251 -22.536 -10.625 1.00 0.00 O ATOM 1014 CB PRO A 65 -2.505 -21.382 -8.261 1.00 0.00 C ATOM 1015 CG PRO A 65 -3.498 -21.420 -7.143 1.00 0.00 C ATOM 1016 CD PRO A 65 -4.539 -22.470 -7.520 1.00 0.00 C ATOM 0 HA PRO A 65 -3.497 -21.017 -10.198 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -1.661 -22.041 -8.056 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -2.101 -20.378 -8.390 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -3.012 -21.677 -6.202 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -3.964 -20.444 -7.005 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -4.287 -23.449 -7.113 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -5.527 -22.211 -7.139 1.00 0.00 H new ATOM 1024 N LYS A 66 -3.008 -23.938 -10.715 1.00 0.00 N ATOM 1025 CA LYS A 66 -2.298 -24.944 -11.503 1.00 0.00 C ATOM 1026 C LYS A 66 -2.855 -24.989 -12.919 1.00 0.00 C ATOM 1027 O LYS A 66 -2.352 -25.716 -13.775 1.00 0.00 O ATOM 1028 CB LYS A 66 -2.445 -26.321 -10.851 1.00 0.00 C ATOM 1029 CG LYS A 66 -3.928 -26.614 -10.605 1.00 0.00 C ATOM 1030 CD LYS A 66 -4.092 -28.027 -10.026 1.00 0.00 C ATOM 1031 CE LYS A 66 -3.942 -27.982 -8.502 1.00 0.00 C ATOM 1032 NZ LYS A 66 -3.916 -29.373 -7.966 1.00 0.00 N ATOM 0 H LYS A 66 -3.972 -24.181 -10.489 1.00 0.00 H new ATOM 0 HA LYS A 66 -1.242 -24.675 -11.542 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -2.014 -27.088 -11.495 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -1.897 -26.350 -9.909 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -4.344 -25.879 -9.916 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -4.485 -26.527 -11.538 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -5.070 -28.428 -10.293 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -3.345 -28.695 -10.455 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -3.025 -27.459 -8.231 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -4.769 -27.426 -8.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -3.814 -29.345 -6.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -4.803 -29.857 -8.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -3.113 -29.889 -8.379 1.00 0.00 H new ATOM 1046 N THR A 67 -3.894 -24.195 -13.156 1.00 0.00 N ATOM 1047 CA THR A 67 -4.523 -24.125 -14.469 1.00 0.00 C ATOM 1048 C THR A 67 -4.326 -22.731 -15.060 1.00 0.00 C ATOM 1049 O THR A 67 -4.034 -21.782 -14.332 1.00 0.00 O ATOM 1050 CB THR A 67 -6.022 -24.436 -14.337 1.00 0.00 C ATOM 1051 OG1 THR A 67 -6.436 -24.181 -13.002 1.00 0.00 O ATOM 1052 CG2 THR A 67 -6.279 -25.907 -14.676 1.00 0.00 C ATOM 0 H THR A 67 -4.319 -23.590 -12.454 1.00 0.00 H new ATOM 0 HA THR A 67 -4.064 -24.858 -15.132 1.00 0.00 H new ATOM 0 HB THR A 67 -6.584 -23.806 -15.026 1.00 0.00 H new ATOM 0 HG1 THR A 67 -5.984 -23.378 -12.667 1.00 0.00 H new ATOM 0 HG21 THR A 67 -7.343 -26.122 -14.581 1.00 0.00 H new ATOM 0 HG22 THR A 67 -5.959 -26.106 -15.699 1.00 0.00 H new ATOM 0 HG23 THR A 67 -5.718 -26.542 -13.990 1.00 0.00 H new ATOM 1060 N PRO A 68 -4.478 -22.589 -16.350 1.00 0.00 N ATOM 1061 CA PRO A 68 -4.316 -21.276 -17.035 1.00 0.00 C ATOM 1062 C PRO A 68 -4.900 -20.120 -16.220 1.00 0.00 C ATOM 1063 O PRO A 68 -4.608 -18.955 -16.485 1.00 0.00 O ATOM 1064 CB PRO A 68 -5.082 -21.473 -18.342 1.00 0.00 C ATOM 1065 CG PRO A 68 -4.964 -22.932 -18.648 1.00 0.00 C ATOM 1066 CD PRO A 68 -4.818 -23.660 -17.304 1.00 0.00 C ATOM 0 HA PRO A 68 -3.270 -21.007 -17.179 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -6.125 -21.176 -18.236 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -4.658 -20.867 -19.143 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -5.844 -23.286 -19.185 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -4.102 -23.124 -19.287 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -5.741 -24.166 -17.023 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -4.038 -24.420 -17.345 1.00 0.00 H new ATOM 1074 N LEU A 69 -5.722 -20.454 -15.229 1.00 0.00 N ATOM 1075 CA LEU A 69 -6.338 -19.437 -14.382 1.00 0.00 C ATOM 1076 C LEU A 69 -5.319 -18.366 -13.995 1.00 0.00 C ATOM 1077 O LEU A 69 -5.659 -17.190 -13.878 1.00 0.00 O ATOM 1078 CB LEU A 69 -6.917 -20.091 -13.118 1.00 0.00 C ATOM 1079 CG LEU A 69 -8.426 -20.309 -13.286 1.00 0.00 C ATOM 1080 CD1 LEU A 69 -8.683 -21.258 -14.460 1.00 0.00 C ATOM 1081 CD2 LEU A 69 -8.996 -20.920 -12.003 1.00 0.00 C ATOM 0 H LEU A 69 -5.976 -21.414 -14.994 1.00 0.00 H new ATOM 0 HA LEU A 69 -7.143 -18.961 -14.942 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.422 -21.044 -12.932 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -6.727 -19.458 -12.251 1.00 0.00 H new ATOM 0 HG LEU A 69 -8.910 -19.353 -13.483 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -9.756 -21.411 -14.576 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -8.277 -20.824 -15.374 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -8.199 -22.215 -14.267 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -10.068 -21.076 -12.120 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.509 -21.876 -11.808 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -8.816 -20.244 -11.167 1.00 0.00 H new ATOM 1093 N ARG A 70 -4.072 -18.774 -13.796 1.00 0.00 N ATOM 1094 CA ARG A 70 -3.024 -17.826 -13.425 1.00 0.00 C ATOM 1095 C ARG A 70 -3.180 -16.519 -14.211 1.00 0.00 C ATOM 1096 O ARG A 70 -3.458 -15.478 -13.618 1.00 0.00 O ATOM 1097 CB ARG A 70 -1.643 -18.441 -13.706 1.00 0.00 C ATOM 1098 CG ARG A 70 -0.867 -18.611 -12.396 1.00 0.00 C ATOM 1099 CD ARG A 70 0.564 -19.055 -12.707 1.00 0.00 C ATOM 1100 NE ARG A 70 0.575 -19.956 -13.855 1.00 0.00 N ATOM 1101 CZ ARG A 70 0.386 -21.263 -13.708 1.00 0.00 C ATOM 1102 NH1 ARG A 70 0.181 -21.763 -12.521 1.00 0.00 N ATOM 1103 NH2 ARG A 70 0.406 -22.046 -14.752 1.00 0.00 N ATOM 0 H ARG A 70 -3.762 -19.742 -13.883 1.00 0.00 H new ATOM 0 HA ARG A 70 -3.113 -17.606 -12.361 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -1.759 -19.407 -14.197 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -1.084 -17.802 -14.389 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -0.856 -17.672 -11.843 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -1.359 -19.349 -11.762 1.00 0.00 H new ATOM 0 HD2 ARG A 70 1.186 -18.184 -12.913 1.00 0.00 H new ATOM 0 HD3 ARG A 70 0.994 -19.555 -11.839 1.00 0.00 H new ATOM 0 HE ARG A 70 0.731 -19.575 -14.788 1.00 0.00 H new ATOM 0 HH11 ARG A 70 0.166 -21.151 -11.705 1.00 0.00 H new ATOM 0 HH12 ARG A 70 0.036 -22.766 -12.408 1.00 0.00 H new ATOM 0 HH21 ARG A 70 0.567 -21.655 -15.680 1.00 0.00 H new ATOM 0 HH22 ARG A 70 0.261 -23.049 -14.640 1.00 0.00 H new ATOM 1117 N TYR A 71 -3.008 -16.555 -15.528 1.00 0.00 N ATOM 1118 CA TYR A 71 -3.146 -15.337 -16.325 1.00 0.00 C ATOM 1119 C TYR A 71 -4.536 -14.727 -16.140 1.00 0.00 C ATOM 1120 O TYR A 71 -4.753 -13.572 -16.501 1.00 0.00 O ATOM 1121 CB TYR A 71 -2.917 -15.656 -17.809 1.00 0.00 C ATOM 1122 CG TYR A 71 -1.436 -15.616 -18.116 1.00 0.00 C ATOM 1123 CD1 TYR A 71 -0.578 -16.563 -17.544 1.00 0.00 C ATOM 1124 CD2 TYR A 71 -0.923 -14.635 -18.974 1.00 0.00 C ATOM 1125 CE1 TYR A 71 0.792 -16.528 -17.828 1.00 0.00 C ATOM 1126 CE2 TYR A 71 0.446 -14.602 -19.259 1.00 0.00 C ATOM 1127 CZ TYR A 71 1.304 -15.548 -18.686 1.00 0.00 C ATOM 1128 OH TYR A 71 2.655 -15.515 -18.968 1.00 0.00 O ATOM 0 H TYR A 71 -2.777 -17.395 -16.059 1.00 0.00 H new ATOM 0 HA TYR A 71 -2.400 -14.617 -15.988 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -3.321 -16.640 -18.046 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -3.447 -14.935 -18.432 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -0.973 -17.321 -16.884 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -1.584 -13.904 -19.415 1.00 0.00 H new ATOM 0 HE1 TYR A 71 1.454 -17.257 -17.385 1.00 0.00 H new ATOM 0 HE2 TYR A 71 0.841 -13.846 -19.922 1.00 0.00 H new ATOM 0 HH TYR A 71 2.843 -14.774 -19.581 1.00 0.00 H new ATOM 1138 N VAL A 72 -5.479 -15.493 -15.602 1.00 0.00 N ATOM 1139 CA VAL A 72 -6.835 -14.974 -15.416 1.00 0.00 C ATOM 1140 C VAL A 72 -6.951 -14.139 -14.142 1.00 0.00 C ATOM 1141 O VAL A 72 -7.509 -13.044 -14.173 1.00 0.00 O ATOM 1142 CB VAL A 72 -7.847 -16.123 -15.376 1.00 0.00 C ATOM 1143 CG1 VAL A 72 -9.265 -15.553 -15.408 1.00 0.00 C ATOM 1144 CG2 VAL A 72 -7.637 -17.027 -16.594 1.00 0.00 C ATOM 0 H VAL A 72 -5.338 -16.455 -15.292 1.00 0.00 H new ATOM 0 HA VAL A 72 -7.055 -14.327 -16.265 1.00 0.00 H new ATOM 0 HB VAL A 72 -7.706 -16.701 -14.462 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -9.986 -16.370 -15.380 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -9.416 -14.905 -14.545 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -9.405 -14.977 -16.323 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -8.356 -17.846 -16.568 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -7.780 -16.448 -17.506 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -6.625 -17.432 -16.576 1.00 0.00 H new ATOM 1154 N ALA A 73 -6.422 -14.630 -13.028 1.00 0.00 N ATOM 1155 CA ALA A 73 -6.484 -13.877 -11.777 1.00 0.00 C ATOM 1156 C ALA A 73 -5.456 -12.742 -11.796 1.00 0.00 C ATOM 1157 O ALA A 73 -5.684 -11.659 -11.245 1.00 0.00 O ATOM 1158 CB ALA A 73 -6.211 -14.811 -10.591 1.00 0.00 C ATOM 0 H ALA A 73 -5.951 -15.533 -12.962 1.00 0.00 H new ATOM 0 HA ALA A 73 -7.481 -13.449 -11.670 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -6.259 -14.243 -9.662 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -6.960 -15.603 -10.571 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -5.220 -15.252 -10.696 1.00 0.00 H new ATOM 1164 N MET A 74 -4.325 -12.998 -12.441 1.00 0.00 N ATOM 1165 CA MET A 74 -3.270 -11.998 -12.535 1.00 0.00 C ATOM 1166 C MET A 74 -3.788 -10.745 -13.236 1.00 0.00 C ATOM 1167 O MET A 74 -3.103 -9.723 -13.283 1.00 0.00 O ATOM 1168 CB MET A 74 -2.076 -12.566 -13.309 1.00 0.00 C ATOM 1169 CG MET A 74 -1.204 -13.403 -12.370 1.00 0.00 C ATOM 1170 SD MET A 74 -2.249 -14.535 -11.421 1.00 0.00 S ATOM 1171 CE MET A 74 -0.996 -15.048 -10.221 1.00 0.00 C ATOM 0 H MET A 74 -4.116 -13.883 -12.904 1.00 0.00 H new ATOM 0 HA MET A 74 -2.951 -11.733 -11.527 1.00 0.00 H new ATOM 0 HB2 MET A 74 -2.427 -13.180 -14.139 1.00 0.00 H new ATOM 0 HB3 MET A 74 -1.489 -11.754 -13.739 1.00 0.00 H new ATOM 0 HG2 MET A 74 -0.469 -13.966 -12.945 1.00 0.00 H new ATOM 0 HG3 MET A 74 -0.649 -12.751 -11.695 1.00 0.00 H new ATOM 0 HE1 MET A 74 -1.432 -15.762 -9.523 1.00 0.00 H new ATOM 0 HE2 MET A 74 -0.161 -15.515 -10.744 1.00 0.00 H new ATOM 0 HE3 MET A 74 -0.639 -14.176 -9.673 1.00 0.00 H new ATOM 1181 N VAL A 75 -4.997 -10.831 -13.783 1.00 0.00 N ATOM 1182 CA VAL A 75 -5.587 -9.694 -14.482 1.00 0.00 C ATOM 1183 C VAL A 75 -5.710 -8.496 -13.549 1.00 0.00 C ATOM 1184 O VAL A 75 -5.416 -7.358 -13.919 1.00 0.00 O ATOM 1185 CB VAL A 75 -6.969 -10.061 -15.028 1.00 0.00 C ATOM 1186 CG1 VAL A 75 -6.841 -11.239 -15.999 1.00 0.00 C ATOM 1187 CG2 VAL A 75 -7.895 -10.443 -13.867 1.00 0.00 C ATOM 0 H VAL A 75 -5.582 -11.666 -13.757 1.00 0.00 H new ATOM 0 HA VAL A 75 -4.932 -9.431 -15.313 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.390 -9.205 -15.556 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -7.826 -11.499 -16.387 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -6.187 -10.960 -16.825 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -6.419 -12.097 -15.476 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -8.879 -10.704 -14.257 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -7.477 -11.297 -13.334 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -7.988 -9.599 -13.183 1.00 0.00 H new ATOM 1197 N ILE A 76 -6.146 -8.783 -12.324 1.00 0.00 N ATOM 1198 CA ILE A 76 -6.317 -7.751 -11.309 1.00 0.00 C ATOM 1199 C ILE A 76 -5.014 -7.541 -10.546 1.00 0.00 C ATOM 1200 O ILE A 76 -4.735 -6.438 -10.075 1.00 0.00 O ATOM 1201 CB ILE A 76 -7.439 -8.156 -10.341 1.00 0.00 C ATOM 1202 CG1 ILE A 76 -8.791 -7.690 -10.895 1.00 0.00 C ATOM 1203 CG2 ILE A 76 -7.210 -7.511 -8.969 1.00 0.00 C ATOM 1204 CD1 ILE A 76 -9.919 -8.468 -10.215 1.00 0.00 C ATOM 0 H ILE A 76 -6.387 -9.724 -12.012 1.00 0.00 H new ATOM 0 HA ILE A 76 -6.588 -6.815 -11.797 1.00 0.00 H new ATOM 0 HB ILE A 76 -7.437 -9.241 -10.235 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -8.917 -6.621 -10.723 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -8.827 -7.845 -11.973 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -8.011 -7.805 -8.291 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -6.253 -7.843 -8.566 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -7.203 -6.426 -9.074 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -10.879 -8.136 -10.610 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -9.795 -9.533 -10.410 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -9.887 -8.290 -9.140 1.00 0.00 H new ATOM 1216 N TRP A 77 -4.211 -8.596 -10.431 1.00 0.00 N ATOM 1217 CA TRP A 77 -2.937 -8.481 -9.726 1.00 0.00 C ATOM 1218 C TRP A 77 -2.026 -7.507 -10.463 1.00 0.00 C ATOM 1219 O TRP A 77 -1.515 -6.552 -9.877 1.00 0.00 O ATOM 1220 CB TRP A 77 -2.251 -9.848 -9.632 1.00 0.00 C ATOM 1221 CG TRP A 77 -1.261 -9.848 -8.506 1.00 0.00 C ATOM 1222 CD1 TRP A 77 -0.078 -9.186 -8.501 1.00 0.00 C ATOM 1223 CD2 TRP A 77 -1.350 -10.534 -7.224 1.00 0.00 C ATOM 1224 NE1 TRP A 77 0.571 -9.437 -7.300 1.00 0.00 N ATOM 1225 CE2 TRP A 77 -0.178 -10.258 -6.480 1.00 0.00 C ATOM 1226 CE3 TRP A 77 -2.324 -11.366 -6.643 1.00 0.00 C ATOM 1227 CZ2 TRP A 77 0.017 -10.789 -5.203 1.00 0.00 C ATOM 1228 CZ3 TRP A 77 -2.131 -11.900 -5.360 1.00 0.00 C ATOM 1229 CH2 TRP A 77 -0.963 -11.612 -4.641 1.00 0.00 C ATOM 0 H TRP A 77 -4.413 -9.522 -10.808 1.00 0.00 H new ATOM 0 HA TRP A 77 -3.130 -8.112 -8.719 1.00 0.00 H new ATOM 0 HB2 TRP A 77 -2.996 -10.628 -9.472 1.00 0.00 H new ATOM 0 HB3 TRP A 77 -1.747 -10.076 -10.571 1.00 0.00 H new ATOM 0 HD1 TRP A 77 0.298 -8.565 -9.301 1.00 0.00 H new ATOM 0 HE1 TRP A 77 1.487 -9.062 -7.054 1.00 0.00 H new ATOM 0 HE3 TRP A 77 -3.227 -11.596 -7.189 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 0.919 -10.565 -4.653 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 -2.887 -12.537 -4.924 1.00 0.00 H new ATOM 0 HH2 TRP A 77 -0.820 -12.026 -3.654 1.00 0.00 H new ATOM 1240 N LEU A 78 -1.829 -7.757 -11.753 1.00 0.00 N ATOM 1241 CA LEU A 78 -0.983 -6.904 -12.576 1.00 0.00 C ATOM 1242 C LEU A 78 -1.589 -5.509 -12.699 1.00 0.00 C ATOM 1243 O LEU A 78 -0.887 -4.504 -12.589 1.00 0.00 O ATOM 1244 CB LEU A 78 -0.821 -7.529 -13.970 1.00 0.00 C ATOM 1245 CG LEU A 78 0.569 -7.206 -14.536 1.00 0.00 C ATOM 1246 CD1 LEU A 78 1.598 -8.200 -13.988 1.00 0.00 C ATOM 1247 CD2 LEU A 78 0.534 -7.310 -16.062 1.00 0.00 C ATOM 0 H LEU A 78 -2.245 -8.544 -12.251 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.005 -6.816 -12.102 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -0.956 -8.609 -13.910 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -1.592 -7.148 -14.640 1.00 0.00 H new ATOM 0 HG LEU A 78 0.849 -6.195 -14.240 1.00 0.00 H new ATOM 0 HD11 LEU A 78 2.582 -7.965 -14.393 1.00 0.00 H new ATOM 0 HD12 LEU A 78 1.628 -8.131 -12.901 1.00 0.00 H new ATOM 0 HD13 LEU A 78 1.317 -9.212 -14.280 1.00 0.00 H new ATOM 0 HD21 LEU A 78 1.520 -7.081 -16.465 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.250 -8.322 -16.351 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.193 -6.602 -16.458 1.00 0.00 H new ATOM 1259 N TYR A 79 -2.898 -5.452 -12.928 1.00 0.00 N ATOM 1260 CA TYR A 79 -3.579 -4.170 -13.062 1.00 0.00 C ATOM 1261 C TYR A 79 -3.168 -3.227 -11.934 1.00 0.00 C ATOM 1262 O TYR A 79 -2.850 -2.062 -12.173 1.00 0.00 O ATOM 1263 CB TYR A 79 -5.094 -4.377 -13.030 1.00 0.00 C ATOM 1264 CG TYR A 79 -5.788 -3.041 -13.149 1.00 0.00 C ATOM 1265 CD1 TYR A 79 -6.058 -2.288 -12.001 1.00 0.00 C ATOM 1266 CD2 TYR A 79 -6.160 -2.556 -14.409 1.00 0.00 C ATOM 1267 CE1 TYR A 79 -6.701 -1.049 -12.112 1.00 0.00 C ATOM 1268 CE2 TYR A 79 -6.803 -1.318 -14.519 1.00 0.00 C ATOM 1269 CZ TYR A 79 -7.073 -0.564 -13.370 1.00 0.00 C ATOM 1270 OH TYR A 79 -7.708 0.657 -13.480 1.00 0.00 O ATOM 0 H TYR A 79 -3.502 -6.269 -13.024 1.00 0.00 H new ATOM 0 HA TYR A 79 -3.294 -3.725 -14.016 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -5.400 -5.031 -13.846 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -5.385 -4.868 -12.102 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -5.771 -2.662 -11.030 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -5.951 -3.137 -15.295 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -6.910 -0.468 -11.226 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -7.091 -0.944 -15.490 1.00 0.00 H new ATOM 0 HH TYR A 79 -7.896 0.844 -14.423 1.00 0.00 H new ATOM 1280 N SER A 80 -3.178 -3.739 -10.708 1.00 0.00 N ATOM 1281 CA SER A 80 -2.809 -2.932 -9.548 1.00 0.00 C ATOM 1282 C SER A 80 -1.292 -2.838 -9.410 1.00 0.00 C ATOM 1283 O SER A 80 -0.775 -1.931 -8.761 1.00 0.00 O ATOM 1284 CB SER A 80 -3.400 -3.544 -8.277 1.00 0.00 C ATOM 1285 OG SER A 80 -2.910 -4.869 -8.120 1.00 0.00 O ATOM 0 H SER A 80 -3.435 -4.702 -10.491 1.00 0.00 H new ATOM 0 HA SER A 80 -3.209 -1.928 -9.691 1.00 0.00 H new ATOM 0 HB2 SER A 80 -3.132 -2.940 -7.410 1.00 0.00 H new ATOM 0 HB3 SER A 80 -4.488 -3.551 -8.336 1.00 0.00 H new ATOM 0 HG SER A 80 -2.439 -5.142 -8.935 1.00 0.00 H new ATOM 1291 N ALA A 81 -0.581 -3.785 -10.005 1.00 0.00 N ATOM 1292 CA ALA A 81 0.872 -3.791 -9.917 1.00 0.00 C ATOM 1293 C ALA A 81 1.458 -2.509 -10.500 1.00 0.00 C ATOM 1294 O ALA A 81 2.117 -1.742 -9.797 1.00 0.00 O ATOM 1295 CB ALA A 81 1.439 -4.995 -10.670 1.00 0.00 C ATOM 0 H ALA A 81 -0.981 -4.551 -10.548 1.00 0.00 H new ATOM 0 HA ALA A 81 1.146 -3.855 -8.864 1.00 0.00 H new ATOM 0 HB1 ALA A 81 2.527 -4.990 -10.598 1.00 0.00 H new ATOM 0 HB2 ALA A 81 1.051 -5.914 -10.232 1.00 0.00 H new ATOM 0 HB3 ALA A 81 1.145 -4.940 -11.718 1.00 0.00 H new ATOM 1301 N PHE A 82 1.222 -2.291 -11.788 1.00 0.00 N ATOM 1302 CA PHE A 82 1.742 -1.106 -12.464 1.00 0.00 C ATOM 1303 C PHE A 82 0.971 0.151 -12.065 1.00 0.00 C ATOM 1304 O PHE A 82 1.570 1.200 -11.830 1.00 0.00 O ATOM 1305 CB PHE A 82 1.657 -1.294 -13.980 1.00 0.00 C ATOM 1306 CG PHE A 82 2.301 -0.116 -14.670 1.00 0.00 C ATOM 1307 CD1 PHE A 82 3.692 0.042 -14.632 1.00 0.00 C ATOM 1308 CD2 PHE A 82 1.509 0.820 -15.348 1.00 0.00 C ATOM 1309 CE1 PHE A 82 4.290 1.134 -15.272 1.00 0.00 C ATOM 1310 CE2 PHE A 82 2.107 1.912 -15.986 1.00 0.00 C ATOM 1311 CZ PHE A 82 3.498 2.069 -15.949 1.00 0.00 C ATOM 0 H PHE A 82 0.677 -2.915 -12.384 1.00 0.00 H new ATOM 0 HA PHE A 82 2.781 -0.979 -12.162 1.00 0.00 H new ATOM 0 HB2 PHE A 82 2.157 -2.218 -14.271 1.00 0.00 H new ATOM 0 HB3 PHE A 82 0.615 -1.385 -14.288 1.00 0.00 H new ATOM 0 HD1 PHE A 82 4.303 -0.679 -14.109 1.00 0.00 H new ATOM 0 HD2 PHE A 82 0.436 0.698 -15.378 1.00 0.00 H new ATOM 0 HE1 PHE A 82 5.363 1.255 -15.243 1.00 0.00 H new ATOM 0 HE2 PHE A 82 1.496 2.634 -16.507 1.00 0.00 H new ATOM 0 HZ PHE A 82 3.960 2.911 -16.443 1.00 0.00 H new ATOM 1321 N ARG A 83 -0.354 0.059 -12.018 1.00 0.00 N ATOM 1322 CA ARG A 83 -1.169 1.223 -11.680 1.00 0.00 C ATOM 1323 C ARG A 83 -1.119 1.545 -10.188 1.00 0.00 C ATOM 1324 O ARG A 83 -1.019 2.712 -9.812 1.00 0.00 O ATOM 1325 CB ARG A 83 -2.622 0.987 -12.097 1.00 0.00 C ATOM 1326 CG ARG A 83 -3.457 2.237 -11.787 1.00 0.00 C ATOM 1327 CD ARG A 83 -4.572 2.386 -12.825 1.00 0.00 C ATOM 1328 NE ARG A 83 -4.026 2.894 -14.079 1.00 0.00 N ATOM 1329 CZ ARG A 83 -3.578 4.142 -14.179 1.00 0.00 C ATOM 1330 NH1 ARG A 83 -3.631 4.940 -13.147 1.00 0.00 N ATOM 1331 NH2 ARG A 83 -3.087 4.570 -15.309 1.00 0.00 N ATOM 0 H ARG A 83 -0.881 -0.794 -12.206 1.00 0.00 H new ATOM 0 HA ARG A 83 -0.757 2.073 -12.223 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -2.673 0.758 -13.162 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -3.028 0.126 -11.566 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -3.886 2.161 -10.788 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -2.820 3.122 -11.794 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -5.054 1.423 -12.993 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -5.338 3.065 -12.452 1.00 0.00 H new ATOM 0 HE ARG A 83 -3.987 2.281 -14.893 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -4.016 4.606 -12.263 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -3.287 5.897 -13.224 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -3.047 3.947 -16.116 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -2.743 5.527 -15.386 1.00 0.00 H new ATOM 1345 N GLY A 84 -1.183 0.527 -9.336 1.00 0.00 N ATOM 1346 CA GLY A 84 -1.136 0.761 -7.896 1.00 0.00 C ATOM 1347 C GLY A 84 0.157 1.467 -7.503 1.00 0.00 C ATOM 1348 O GLY A 84 0.135 2.449 -6.762 1.00 0.00 O ATOM 0 H GLY A 84 -1.266 -0.452 -9.610 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -1.992 1.365 -7.593 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -1.212 -0.189 -7.366 1.00 0.00 H new ATOM 1352 N VAL A 85 1.285 0.954 -7.988 1.00 0.00 N ATOM 1353 CA VAL A 85 2.581 1.543 -7.657 1.00 0.00 C ATOM 1354 C VAL A 85 2.764 2.893 -8.346 1.00 0.00 C ATOM 1355 O VAL A 85 3.324 3.822 -7.765 1.00 0.00 O ATOM 1356 CB VAL A 85 3.714 0.597 -8.065 1.00 0.00 C ATOM 1357 CG1 VAL A 85 3.497 -0.774 -7.415 1.00 0.00 C ATOM 1358 CG2 VAL A 85 3.735 0.449 -9.590 1.00 0.00 C ATOM 0 H VAL A 85 1.330 0.142 -8.604 1.00 0.00 H new ATOM 0 HA VAL A 85 2.612 1.699 -6.579 1.00 0.00 H new ATOM 0 HB VAL A 85 4.667 1.007 -7.730 1.00 0.00 H new ATOM 0 HG11 VAL A 85 4.304 -1.446 -7.706 1.00 0.00 H new ATOM 0 HG12 VAL A 85 3.489 -0.665 -6.330 1.00 0.00 H new ATOM 0 HG13 VAL A 85 2.544 -1.187 -7.746 1.00 0.00 H new ATOM 0 HG21 VAL A 85 4.542 -0.224 -9.879 1.00 0.00 H new ATOM 0 HG22 VAL A 85 2.783 0.041 -9.929 1.00 0.00 H new ATOM 0 HG23 VAL A 85 3.895 1.425 -10.048 1.00 0.00 H new ATOM 1368 N GLN A 86 2.294 2.998 -9.585 1.00 0.00 N ATOM 1369 CA GLN A 86 2.421 4.244 -10.334 1.00 0.00 C ATOM 1370 C GLN A 86 1.460 5.297 -9.788 1.00 0.00 C ATOM 1371 O GLN A 86 1.784 6.484 -9.745 1.00 0.00 O ATOM 1372 CB GLN A 86 2.129 3.999 -11.816 1.00 0.00 C ATOM 1373 CG GLN A 86 2.457 5.258 -12.625 1.00 0.00 C ATOM 1374 CD GLN A 86 1.354 6.296 -12.451 1.00 0.00 C ATOM 1375 OE1 GLN A 86 0.170 5.968 -12.547 1.00 0.00 O ATOM 1376 NE2 GLN A 86 1.672 7.537 -12.199 1.00 0.00 N ATOM 0 H GLN A 86 1.826 2.244 -10.088 1.00 0.00 H new ATOM 0 HA GLN A 86 3.442 4.609 -10.224 1.00 0.00 H new ATOM 0 HB2 GLN A 86 2.721 3.158 -12.178 1.00 0.00 H new ATOM 0 HB3 GLN A 86 1.081 3.732 -11.950 1.00 0.00 H new ATOM 0 HG2 GLN A 86 3.411 5.672 -12.298 1.00 0.00 H new ATOM 0 HG3 GLN A 86 2.565 5.004 -13.680 1.00 0.00 H new ATOM 0 HE21 GLN A 86 2.653 7.806 -12.120 1.00 0.00 H new ATOM 0 HE22 GLN A 86 0.940 8.237 -12.081 1.00 0.00 H new ATOM 1385 N LEU A 87 0.277 4.855 -9.376 1.00 0.00 N ATOM 1386 CA LEU A 87 -0.723 5.771 -8.836 1.00 0.00 C ATOM 1387 C LEU A 87 -0.349 6.195 -7.419 1.00 0.00 C ATOM 1388 O LEU A 87 -0.353 7.382 -7.094 1.00 0.00 O ATOM 1389 CB LEU A 87 -2.098 5.093 -8.828 1.00 0.00 C ATOM 1390 CG LEU A 87 -3.128 5.999 -8.143 1.00 0.00 C ATOM 1391 CD1 LEU A 87 -3.152 7.372 -8.823 1.00 0.00 C ATOM 1392 CD2 LEU A 87 -4.512 5.354 -8.250 1.00 0.00 C ATOM 0 H LEU A 87 -0.012 3.877 -9.405 1.00 0.00 H new ATOM 0 HA LEU A 87 -0.760 6.658 -9.468 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -2.413 4.879 -9.849 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -2.038 4.138 -8.306 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.857 6.126 -7.095 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -3.886 8.009 -8.330 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.166 7.831 -8.750 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -3.421 7.253 -9.873 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -5.250 5.993 -7.765 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.775 5.229 -9.300 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.498 4.380 -7.761 1.00 0.00 H new ATOM 1404 N THR A 88 -0.029 5.218 -6.579 1.00 0.00 N ATOM 1405 CA THR A 88 0.340 5.505 -5.199 1.00 0.00 C ATOM 1406 C THR A 88 1.427 6.574 -5.146 1.00 0.00 C ATOM 1407 O THR A 88 1.314 7.548 -4.402 1.00 0.00 O ATOM 1408 CB THR A 88 0.831 4.228 -4.510 1.00 0.00 C ATOM 1409 OG1 THR A 88 1.718 3.536 -5.375 1.00 0.00 O ATOM 1410 CG2 THR A 88 -0.364 3.330 -4.177 1.00 0.00 C ATOM 0 H THR A 88 -0.017 4.229 -6.826 1.00 0.00 H new ATOM 0 HA THR A 88 -0.541 5.878 -4.676 1.00 0.00 H new ATOM 0 HB THR A 88 1.351 4.491 -3.589 1.00 0.00 H new ATOM 0 HG1 THR A 88 1.201 3.008 -6.019 1.00 0.00 H new ATOM 0 HG21 THR A 88 -0.012 2.422 -3.687 1.00 0.00 H new ATOM 0 HG22 THR A 88 -1.044 3.861 -3.511 1.00 0.00 H new ATOM 0 HG23 THR A 88 -0.888 3.066 -5.096 1.00 0.00 H new ATOM 1418 N TYR A 89 2.479 6.390 -5.940 1.00 0.00 N ATOM 1419 CA TYR A 89 3.572 7.355 -5.970 1.00 0.00 C ATOM 1420 C TYR A 89 3.019 8.769 -6.142 1.00 0.00 C ATOM 1421 O TYR A 89 3.508 9.717 -5.529 1.00 0.00 O ATOM 1422 CB TYR A 89 4.534 7.023 -7.123 1.00 0.00 C ATOM 1423 CG TYR A 89 5.852 6.529 -6.567 1.00 0.00 C ATOM 1424 CD1 TYR A 89 5.870 5.475 -5.647 1.00 0.00 C ATOM 1425 CD2 TYR A 89 7.053 7.125 -6.973 1.00 0.00 C ATOM 1426 CE1 TYR A 89 7.088 5.017 -5.131 1.00 0.00 C ATOM 1427 CE2 TYR A 89 8.271 6.667 -6.457 1.00 0.00 C ATOM 1428 CZ TYR A 89 8.289 5.613 -5.536 1.00 0.00 C ATOM 1429 OH TYR A 89 9.488 5.161 -5.027 1.00 0.00 O ATOM 0 H TYR A 89 2.597 5.591 -6.564 1.00 0.00 H new ATOM 0 HA TYR A 89 4.116 7.301 -5.027 1.00 0.00 H new ATOM 0 HB2 TYR A 89 4.094 6.263 -7.768 1.00 0.00 H new ATOM 0 HB3 TYR A 89 4.697 7.908 -7.738 1.00 0.00 H new ATOM 0 HD1 TYR A 89 4.944 5.015 -5.335 1.00 0.00 H new ATOM 0 HD2 TYR A 89 7.039 7.938 -7.684 1.00 0.00 H new ATOM 0 HE1 TYR A 89 7.102 4.204 -4.420 1.00 0.00 H new ATOM 0 HE2 TYR A 89 9.197 7.127 -6.769 1.00 0.00 H new ATOM 0 HH TYR A 89 10.224 5.681 -5.412 1.00 0.00 H new ATOM 1439 N GLU A 90 1.995 8.897 -6.980 1.00 0.00 N ATOM 1440 CA GLU A 90 1.381 10.197 -7.222 1.00 0.00 C ATOM 1441 C GLU A 90 0.853 10.786 -5.918 1.00 0.00 C ATOM 1442 O GLU A 90 1.003 11.979 -5.658 1.00 0.00 O ATOM 1443 CB GLU A 90 0.231 10.054 -8.222 1.00 0.00 C ATOM 1444 CG GLU A 90 -0.159 11.433 -8.758 1.00 0.00 C ATOM 1445 CD GLU A 90 0.894 11.927 -9.742 1.00 0.00 C ATOM 1446 OE1 GLU A 90 1.380 11.119 -10.517 1.00 0.00 O ATOM 1447 OE2 GLU A 90 1.201 13.108 -9.709 1.00 0.00 O ATOM 0 H GLU A 90 1.576 8.124 -7.498 1.00 0.00 H new ATOM 0 HA GLU A 90 2.137 10.866 -7.633 1.00 0.00 H new ATOM 0 HB2 GLU A 90 0.530 9.404 -9.045 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -0.627 9.584 -7.740 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -1.131 11.380 -9.249 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -0.257 12.139 -7.933 1.00 0.00 H new ATOM 1454 N HIS A 91 0.237 9.938 -5.102 1.00 0.00 N ATOM 1455 CA HIS A 91 -0.308 10.381 -3.825 1.00 0.00 C ATOM 1456 C HIS A 91 0.814 10.797 -2.878 1.00 0.00 C ATOM 1457 O HIS A 91 0.689 11.776 -2.143 1.00 0.00 O ATOM 1458 CB HIS A 91 -1.125 9.256 -3.186 1.00 0.00 C ATOM 1459 CG HIS A 91 -2.169 8.779 -4.158 1.00 0.00 C ATOM 1460 ND1 HIS A 91 -2.940 7.652 -3.920 1.00 0.00 N ATOM 1461 CD2 HIS A 91 -2.583 9.267 -5.373 1.00 0.00 C ATOM 1462 CE1 HIS A 91 -3.769 7.499 -4.969 1.00 0.00 C ATOM 1463 NE2 HIS A 91 -3.594 8.456 -5.884 1.00 0.00 N ATOM 0 H HIS A 91 0.103 8.946 -5.300 1.00 0.00 H new ATOM 0 HA HIS A 91 -0.953 11.241 -4.007 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -0.470 8.431 -2.905 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -1.600 9.611 -2.271 1.00 0.00 H new ATOM 0 HD1 HIS A 91 -2.888 7.049 -3.099 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -2.185 10.146 -5.859 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -4.489 6.699 -5.060 1.00 0.00 H new ATOM 1472 N THR A 92 1.913 10.047 -2.903 1.00 0.00 N ATOM 1473 CA THR A 92 3.051 10.352 -2.043 1.00 0.00 C ATOM 1474 C THR A 92 3.720 11.649 -2.484 1.00 0.00 C ATOM 1475 O THR A 92 4.210 12.418 -1.657 1.00 0.00 O ATOM 1476 CB THR A 92 4.069 9.210 -2.092 1.00 0.00 C ATOM 1477 OG1 THR A 92 4.428 8.956 -3.443 1.00 0.00 O ATOM 1478 CG2 THR A 92 3.459 7.950 -1.478 1.00 0.00 C ATOM 0 H THR A 92 2.039 9.232 -3.503 1.00 0.00 H new ATOM 0 HA THR A 92 2.688 10.469 -1.022 1.00 0.00 H new ATOM 0 HB THR A 92 4.957 9.491 -1.526 1.00 0.00 H new ATOM 0 HG1 THR A 92 3.873 9.503 -4.037 1.00 0.00 H new ATOM 0 HG21 THR A 92 4.186 7.139 -1.514 1.00 0.00 H new ATOM 0 HG22 THR A 92 3.186 8.146 -0.441 1.00 0.00 H new ATOM 0 HG23 THR A 92 2.569 7.665 -2.040 1.00 0.00 H new ATOM 1486 N MET A 93 3.735 11.887 -3.792 1.00 0.00 N ATOM 1487 CA MET A 93 4.345 13.096 -4.330 1.00 0.00 C ATOM 1488 C MET A 93 3.670 14.334 -3.752 1.00 0.00 C ATOM 1489 O MET A 93 4.336 15.292 -3.360 1.00 0.00 O ATOM 1490 CB MET A 93 4.222 13.109 -5.855 1.00 0.00 C ATOM 1491 CG MET A 93 5.129 14.198 -6.431 1.00 0.00 C ATOM 1492 SD MET A 93 4.892 14.297 -8.223 1.00 0.00 S ATOM 1493 CE MET A 93 5.247 16.063 -8.399 1.00 0.00 C ATOM 0 H MET A 93 3.335 11.264 -4.493 1.00 0.00 H new ATOM 0 HA MET A 93 5.399 13.106 -4.052 1.00 0.00 H new ATOM 0 HB2 MET A 93 4.500 12.137 -6.261 1.00 0.00 H new ATOM 0 HB3 MET A 93 3.187 13.291 -6.145 1.00 0.00 H new ATOM 0 HG2 MET A 93 4.900 15.159 -5.970 1.00 0.00 H new ATOM 0 HG3 MET A 93 6.172 13.976 -6.203 1.00 0.00 H new ATOM 0 HE1 MET A 93 5.158 16.349 -9.447 1.00 0.00 H new ATOM 0 HE2 MET A 93 4.537 16.638 -7.804 1.00 0.00 H new ATOM 0 HE3 MET A 93 6.260 16.267 -8.052 1.00 0.00 H new ATOM 1503 N LEU A 94 2.343 14.306 -3.699 1.00 0.00 N ATOM 1504 CA LEU A 94 1.584 15.428 -3.162 1.00 0.00 C ATOM 1505 C LEU A 94 1.985 15.687 -1.711 1.00 0.00 C ATOM 1506 O LEU A 94 2.277 16.820 -1.329 1.00 0.00 O ATOM 1507 CB LEU A 94 0.079 15.127 -3.248 1.00 0.00 C ATOM 1508 CG LEU A 94 -0.652 16.267 -3.967 1.00 0.00 C ATOM 1509 CD1 LEU A 94 -0.436 16.146 -5.478 1.00 0.00 C ATOM 1510 CD2 LEU A 94 -2.150 16.182 -3.664 1.00 0.00 C ATOM 0 H LEU A 94 1.774 13.523 -4.020 1.00 0.00 H new ATOM 0 HA LEU A 94 1.803 16.319 -3.750 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -0.081 14.190 -3.781 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -0.331 14.998 -2.246 1.00 0.00 H new ATOM 0 HG LEU A 94 -0.259 17.222 -3.619 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -0.957 16.958 -5.986 1.00 0.00 H new ATOM 0 HD12 LEU A 94 0.630 16.204 -5.699 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.827 15.190 -5.826 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -2.671 16.992 -4.175 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -2.538 15.225 -4.012 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -2.309 16.269 -2.589 1.00 0.00 H new ATOM 1522 N GLN A 95 1.999 14.625 -0.912 1.00 0.00 N ATOM 1523 CA GLN A 95 2.371 14.745 0.493 1.00 0.00 C ATOM 1524 C GLN A 95 3.695 15.492 0.625 1.00 0.00 C ATOM 1525 O GLN A 95 3.810 16.436 1.407 1.00 0.00 O ATOM 1526 CB GLN A 95 2.495 13.355 1.122 1.00 0.00 C ATOM 1527 CG GLN A 95 2.623 13.485 2.643 1.00 0.00 C ATOM 1528 CD GLN A 95 3.244 12.219 3.225 1.00 0.00 C ATOM 1529 OE1 GLN A 95 2.802 11.112 2.916 1.00 0.00 O ATOM 1530 NE2 GLN A 95 4.249 12.318 4.051 1.00 0.00 N ATOM 0 H GLN A 95 1.759 13.679 -1.210 1.00 0.00 H new ATOM 0 HA GLN A 95 1.595 15.305 1.014 1.00 0.00 H new ATOM 0 HB2 GLN A 95 1.622 12.753 0.871 1.00 0.00 H new ATOM 0 HB3 GLN A 95 3.365 12.839 0.717 1.00 0.00 H new ATOM 0 HG2 GLN A 95 3.239 14.349 2.892 1.00 0.00 H new ATOM 0 HG3 GLN A 95 1.641 13.655 3.086 1.00 0.00 H new ATOM 0 HE21 GLN A 95 4.612 13.237 4.304 1.00 0.00 H new ATOM 0 HE22 GLN A 95 4.672 11.477 4.443 1.00 0.00 H new ATOM 1539 N LEU A 96 4.688 15.067 -0.151 1.00 0.00 N ATOM 1540 CA LEU A 96 5.999 15.708 -0.118 1.00 0.00 C ATOM 1541 C LEU A 96 5.997 16.950 -1.005 1.00 0.00 C ATOM 1542 O LEU A 96 6.900 17.783 -0.928 1.00 0.00 O ATOM 1543 CB LEU A 96 7.078 14.731 -0.607 1.00 0.00 C ATOM 1544 CG LEU A 96 7.464 13.760 0.518 1.00 0.00 C ATOM 1545 CD1 LEU A 96 8.181 14.511 1.650 1.00 0.00 C ATOM 1546 CD2 LEU A 96 6.201 13.087 1.066 1.00 0.00 C ATOM 0 H LEU A 96 4.612 14.288 -0.805 1.00 0.00 H new ATOM 0 HA LEU A 96 6.218 15.999 0.909 1.00 0.00 H new ATOM 0 HB2 LEU A 96 6.710 14.173 -1.468 1.00 0.00 H new ATOM 0 HB3 LEU A 96 7.957 15.284 -0.937 1.00 0.00 H new ATOM 0 HG LEU A 96 8.139 13.004 0.117 1.00 0.00 H new ATOM 0 HD11 LEU A 96 8.448 13.809 2.440 1.00 0.00 H new ATOM 0 HD12 LEU A 96 9.084 14.980 1.260 1.00 0.00 H new ATOM 0 HD13 LEU A 96 7.520 15.278 2.054 1.00 0.00 H new ATOM 0 HD21 LEU A 96 6.474 12.397 1.865 1.00 0.00 H new ATOM 0 HD22 LEU A 96 5.525 13.847 1.458 1.00 0.00 H new ATOM 0 HD23 LEU A 96 5.705 12.538 0.266 1.00 0.00 H new ATOM 1558 N TYR A 97 4.974 17.065 -1.849 1.00 0.00 N ATOM 1559 CA TYR A 97 4.856 18.207 -2.751 1.00 0.00 C ATOM 1560 C TYR A 97 3.396 18.637 -2.876 1.00 0.00 C ATOM 1561 O TYR A 97 2.769 18.440 -3.917 1.00 0.00 O ATOM 1562 CB TYR A 97 5.402 17.837 -4.133 1.00 0.00 C ATOM 1563 CG TYR A 97 5.660 19.093 -4.930 1.00 0.00 C ATOM 1564 CD1 TYR A 97 6.795 19.869 -4.665 1.00 0.00 C ATOM 1565 CD2 TYR A 97 4.767 19.481 -5.934 1.00 0.00 C ATOM 1566 CE1 TYR A 97 7.035 21.033 -5.404 1.00 0.00 C ATOM 1567 CE2 TYR A 97 5.006 20.644 -6.673 1.00 0.00 C ATOM 1568 CZ TYR A 97 6.140 21.421 -6.408 1.00 0.00 C ATOM 1569 OH TYR A 97 6.377 22.569 -7.138 1.00 0.00 O ATOM 0 H TYR A 97 4.218 16.384 -1.927 1.00 0.00 H new ATOM 0 HA TYR A 97 5.435 19.035 -2.342 1.00 0.00 H new ATOM 0 HB2 TYR A 97 6.324 17.265 -4.029 1.00 0.00 H new ATOM 0 HB3 TYR A 97 4.689 17.201 -4.658 1.00 0.00 H new ATOM 0 HD1 TYR A 97 7.485 19.569 -3.890 1.00 0.00 H new ATOM 0 HD2 TYR A 97 3.892 18.882 -6.139 1.00 0.00 H new ATOM 0 HE1 TYR A 97 7.910 21.632 -5.200 1.00 0.00 H new ATOM 0 HE2 TYR A 97 4.316 20.943 -7.448 1.00 0.00 H new ATOM 0 HH TYR A 97 5.660 22.693 -7.795 1.00 0.00 H new ATOM 1579 N PRO A 98 2.850 19.209 -1.836 1.00 0.00 N ATOM 1580 CA PRO A 98 1.432 19.671 -1.820 1.00 0.00 C ATOM 1581 C PRO A 98 1.047 20.419 -3.096 1.00 0.00 C ATOM 1582 O PRO A 98 0.293 19.903 -3.922 1.00 0.00 O ATOM 1583 CB PRO A 98 1.371 20.590 -0.596 1.00 0.00 C ATOM 1584 CG PRO A 98 2.425 20.071 0.327 1.00 0.00 C ATOM 1585 CD PRO A 98 3.528 19.483 -0.557 1.00 0.00 C ATOM 0 HA PRO A 98 0.729 18.839 -1.770 1.00 0.00 H new ATOM 0 HB2 PRO A 98 1.562 21.627 -0.871 1.00 0.00 H new ATOM 0 HB3 PRO A 98 0.387 20.560 -0.128 1.00 0.00 H new ATOM 0 HG2 PRO A 98 2.817 20.870 0.956 1.00 0.00 H new ATOM 0 HG3 PRO A 98 2.017 19.312 0.994 1.00 0.00 H new ATOM 0 HD2 PRO A 98 4.353 20.183 -0.685 1.00 0.00 H new ATOM 0 HD3 PRO A 98 3.945 18.574 -0.123 1.00 0.00 H new ATOM 1593 N SER A 99 1.566 21.633 -3.251 1.00 0.00 N ATOM 1594 CA SER A 99 1.263 22.436 -4.432 1.00 0.00 C ATOM 1595 C SER A 99 -0.224 22.348 -4.771 1.00 0.00 C ATOM 1596 O SER A 99 -0.617 21.631 -5.691 1.00 0.00 O ATOM 1597 CB SER A 99 2.088 21.941 -5.620 1.00 0.00 C ATOM 1598 OG SER A 99 3.441 22.344 -5.451 1.00 0.00 O ATOM 0 H SER A 99 2.192 22.080 -2.581 1.00 0.00 H new ATOM 0 HA SER A 99 1.515 23.475 -4.220 1.00 0.00 H new ATOM 0 HB2 SER A 99 2.026 20.855 -5.694 1.00 0.00 H new ATOM 0 HB3 SER A 99 1.689 22.347 -6.549 1.00 0.00 H new ATOM 0 HG SER A 99 4.036 21.612 -5.717 1.00 0.00 H new ATOM 1604 N PRO A 100 -1.049 23.057 -4.047 1.00 0.00 N ATOM 1605 CA PRO A 100 -2.522 23.054 -4.274 1.00 0.00 C ATOM 1606 C PRO A 100 -2.920 23.915 -5.473 1.00 0.00 C ATOM 1607 O PRO A 100 -2.101 24.185 -6.350 1.00 0.00 O ATOM 1608 CB PRO A 100 -3.083 23.620 -2.967 1.00 0.00 C ATOM 1609 CG PRO A 100 -2.006 24.507 -2.430 1.00 0.00 C ATOM 1610 CD PRO A 100 -0.672 23.942 -2.931 1.00 0.00 C ATOM 0 HA PRO A 100 -2.906 22.061 -4.510 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -4.002 24.179 -3.142 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -3.324 22.823 -2.264 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -2.144 25.533 -2.773 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -2.031 24.529 -1.341 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -0.002 24.736 -3.261 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -0.152 23.393 -2.146 1.00 0.00 H new ATOM 1618 N PHE A 101 -4.180 24.337 -5.502 1.00 0.00 N ATOM 1619 CA PHE A 101 -4.677 25.163 -6.599 1.00 0.00 C ATOM 1620 C PHE A 101 -4.840 24.326 -7.864 1.00 0.00 C ATOM 1621 O PHE A 101 -4.244 23.257 -7.993 1.00 0.00 O ATOM 1622 CB PHE A 101 -3.711 26.324 -6.865 1.00 0.00 C ATOM 1623 CG PHE A 101 -4.449 27.456 -7.541 1.00 0.00 C ATOM 1624 CD1 PHE A 101 -5.080 28.440 -6.769 1.00 0.00 C ATOM 1625 CD2 PHE A 101 -4.503 27.520 -8.938 1.00 0.00 C ATOM 1626 CE1 PHE A 101 -5.763 29.488 -7.396 1.00 0.00 C ATOM 1627 CE2 PHE A 101 -5.187 28.569 -9.565 1.00 0.00 C ATOM 1628 CZ PHE A 101 -5.818 29.553 -8.793 1.00 0.00 C ATOM 0 H PHE A 101 -4.872 24.123 -4.784 1.00 0.00 H new ATOM 0 HA PHE A 101 -5.650 25.565 -6.316 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -3.276 26.670 -5.927 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -2.887 25.987 -7.494 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -5.039 28.390 -5.691 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -4.017 26.760 -9.533 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -6.248 30.248 -6.801 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -5.228 28.619 -10.643 1.00 0.00 H new ATOM 0 HZ PHE A 101 -6.347 30.362 -9.276 1.00 0.00 H new ATOM 1638 N ALA A 102 -5.653 24.819 -8.793 1.00 0.00 N ATOM 1639 CA ALA A 102 -5.890 24.108 -10.045 1.00 0.00 C ATOM 1640 C ALA A 102 -6.572 22.769 -9.783 1.00 0.00 C ATOM 1641 O ALA A 102 -6.623 21.906 -10.658 1.00 0.00 O ATOM 1642 CB ALA A 102 -4.565 23.870 -10.775 1.00 0.00 C ATOM 0 H ALA A 102 -6.156 25.702 -8.704 1.00 0.00 H new ATOM 0 HA ALA A 102 -6.542 24.721 -10.666 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -4.754 23.339 -11.708 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -4.092 24.828 -10.992 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -3.905 23.274 -10.145 1.00 0.00 H new ATOM 1648 N THR A 103 -7.095 22.603 -8.571 1.00 0.00 N ATOM 1649 CA THR A 103 -7.770 21.361 -8.209 1.00 0.00 C ATOM 1650 C THR A 103 -8.729 21.596 -7.044 1.00 0.00 C ATOM 1651 O THR A 103 -9.947 21.542 -7.210 1.00 0.00 O ATOM 1652 CB THR A 103 -6.732 20.295 -7.825 1.00 0.00 C ATOM 1653 OG1 THR A 103 -5.434 20.763 -8.163 1.00 0.00 O ATOM 1654 CG2 THR A 103 -7.014 18.994 -8.581 1.00 0.00 C ATOM 0 H THR A 103 -7.065 23.304 -7.831 1.00 0.00 H new ATOM 0 HA THR A 103 -8.343 21.011 -9.068 1.00 0.00 H new ATOM 0 HB THR A 103 -6.791 20.106 -6.753 1.00 0.00 H new ATOM 0 HG1 THR A 103 -4.768 20.087 -7.918 1.00 0.00 H new ATOM 0 HG21 THR A 103 -6.274 18.244 -8.303 1.00 0.00 H new ATOM 0 HG22 THR A 103 -8.010 18.633 -8.325 1.00 0.00 H new ATOM 0 HG23 THR A 103 -6.959 19.178 -9.654 1.00 0.00 H new ATOM 1662 N SER A 104 -8.170 21.856 -5.866 1.00 0.00 N ATOM 1663 CA SER A 104 -8.983 22.095 -4.680 1.00 0.00 C ATOM 1664 C SER A 104 -9.955 20.942 -4.456 1.00 0.00 C ATOM 1665 O SER A 104 -10.924 20.780 -5.199 1.00 0.00 O ATOM 1666 CB SER A 104 -9.763 23.401 -4.835 1.00 0.00 C ATOM 1667 OG SER A 104 -10.565 23.607 -3.680 1.00 0.00 O ATOM 0 H SER A 104 -7.164 21.906 -5.708 1.00 0.00 H new ATOM 0 HA SER A 104 -8.321 22.169 -3.818 1.00 0.00 H new ATOM 0 HB2 SER A 104 -9.075 24.236 -4.968 1.00 0.00 H new ATOM 0 HB3 SER A 104 -10.390 23.360 -5.725 1.00 0.00 H new ATOM 0 HG SER A 104 -11.066 24.444 -3.774 1.00 0.00 H new ATOM 1673 N ASP A 105 -9.690 20.144 -3.428 1.00 0.00 N ATOM 1674 CA ASP A 105 -10.548 19.007 -3.114 1.00 0.00 C ATOM 1675 C ASP A 105 -12.011 19.435 -3.061 1.00 0.00 C ATOM 1676 O ASP A 105 -12.352 20.434 -2.427 1.00 0.00 O ATOM 1677 CB ASP A 105 -10.142 18.403 -1.768 1.00 0.00 C ATOM 1678 CG ASP A 105 -8.780 17.729 -1.890 1.00 0.00 C ATOM 1679 OD1 ASP A 105 -7.798 18.442 -2.018 1.00 0.00 O ATOM 1680 OD2 ASP A 105 -8.738 16.511 -1.855 1.00 0.00 O ATOM 0 H ASP A 105 -8.894 20.262 -2.801 1.00 0.00 H new ATOM 0 HA ASP A 105 -10.429 18.260 -3.899 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -10.105 19.182 -1.007 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -10.889 17.677 -1.445 1.00 0.00 H new ATOM 1685 N PHE A 106 -12.869 18.673 -3.730 1.00 0.00 N ATOM 1686 CA PHE A 106 -14.294 18.982 -3.752 1.00 0.00 C ATOM 1687 C PHE A 106 -15.100 17.756 -4.174 1.00 0.00 C ATOM 1688 O PHE A 106 -15.512 17.638 -5.327 1.00 0.00 O ATOM 1689 CB PHE A 106 -14.564 20.140 -4.720 1.00 0.00 C ATOM 1690 CG PHE A 106 -15.849 20.837 -4.333 1.00 0.00 C ATOM 1691 CD1 PHE A 106 -17.084 20.276 -4.683 1.00 0.00 C ATOM 1692 CD2 PHE A 106 -15.804 22.044 -3.624 1.00 0.00 C ATOM 1693 CE1 PHE A 106 -18.272 20.923 -4.324 1.00 0.00 C ATOM 1694 CE2 PHE A 106 -16.993 22.689 -3.266 1.00 0.00 C ATOM 1695 CZ PHE A 106 -18.228 22.128 -3.616 1.00 0.00 C ATOM 0 H PHE A 106 -12.606 17.843 -4.261 1.00 0.00 H new ATOM 0 HA PHE A 106 -14.601 19.274 -2.748 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -13.734 20.847 -4.698 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -14.635 19.765 -5.741 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -17.119 19.345 -5.229 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -14.852 22.477 -3.354 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -19.224 20.491 -4.594 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -16.959 23.620 -2.720 1.00 0.00 H new ATOM 0 HZ PHE A 106 -19.146 22.626 -3.339 1.00 0.00 H new ATOM 1705 N MET A 107 -15.317 16.845 -3.232 1.00 0.00 N ATOM 1706 CA MET A 107 -16.073 15.631 -3.517 1.00 0.00 C ATOM 1707 C MET A 107 -15.377 14.815 -4.604 1.00 0.00 C ATOM 1708 O MET A 107 -14.150 14.823 -4.707 1.00 0.00 O ATOM 1709 CB MET A 107 -17.496 15.995 -3.962 1.00 0.00 C ATOM 1710 CG MET A 107 -18.481 14.922 -3.484 1.00 0.00 C ATOM 1711 SD MET A 107 -20.134 15.290 -4.128 1.00 0.00 S ATOM 1712 CE MET A 107 -20.797 16.075 -2.637 1.00 0.00 C ATOM 0 H MET A 107 -14.983 16.923 -2.271 1.00 0.00 H new ATOM 0 HA MET A 107 -16.126 15.029 -2.610 1.00 0.00 H new ATOM 0 HB2 MET A 107 -17.777 16.966 -3.555 1.00 0.00 H new ATOM 0 HB3 MET A 107 -17.536 16.081 -5.048 1.00 0.00 H new ATOM 0 HG2 MET A 107 -18.157 13.938 -3.824 1.00 0.00 H new ATOM 0 HG3 MET A 107 -18.502 14.892 -2.395 1.00 0.00 H new ATOM 0 HE1 MET A 107 -21.826 16.385 -2.816 1.00 0.00 H new ATOM 0 HE2 MET A 107 -20.770 15.366 -1.810 1.00 0.00 H new ATOM 0 HE3 MET A 107 -20.194 16.948 -2.386 1.00 0.00 H new ATOM 1722 N VAL A 108 -16.164 14.111 -5.412 1.00 0.00 N ATOM 1723 CA VAL A 108 -15.609 13.291 -6.484 1.00 0.00 C ATOM 1724 C VAL A 108 -16.604 13.158 -7.632 1.00 0.00 C ATOM 1725 O VAL A 108 -17.792 12.926 -7.410 1.00 0.00 O ATOM 1726 CB VAL A 108 -15.263 11.902 -5.949 1.00 0.00 C ATOM 1727 CG1 VAL A 108 -16.529 11.237 -5.403 1.00 0.00 C ATOM 1728 CG2 VAL A 108 -14.688 11.048 -7.082 1.00 0.00 C ATOM 0 H VAL A 108 -17.182 14.091 -5.346 1.00 0.00 H new ATOM 0 HA VAL A 108 -14.707 13.777 -6.855 1.00 0.00 H new ATOM 0 HB VAL A 108 -14.526 11.993 -5.151 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -16.284 10.246 -5.021 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -16.941 11.845 -4.597 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -17.265 11.146 -6.201 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -14.441 10.057 -6.701 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -15.426 10.957 -7.879 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -13.787 11.521 -7.473 1.00 0.00 H new ATOM 1738 N ARG A 109 -16.112 13.300 -8.861 1.00 0.00 N ATOM 1739 CA ARG A 109 -16.972 13.187 -10.035 1.00 0.00 C ATOM 1740 C ARG A 109 -16.840 11.801 -10.659 1.00 0.00 C ATOM 1741 O ARG A 109 -15.894 11.528 -11.397 1.00 0.00 O ATOM 1742 CB ARG A 109 -16.598 14.257 -11.066 1.00 0.00 C ATOM 1743 CG ARG A 109 -15.078 14.430 -11.101 1.00 0.00 C ATOM 1744 CD ARG A 109 -14.695 15.333 -12.276 1.00 0.00 C ATOM 1745 NE ARG A 109 -13.312 15.776 -12.144 1.00 0.00 N ATOM 1746 CZ ARG A 109 -12.301 14.986 -12.491 1.00 0.00 C ATOM 1747 NH1 ARG A 109 -12.538 13.791 -12.957 1.00 0.00 N ATOM 1748 NH2 ARG A 109 -11.073 15.405 -12.364 1.00 0.00 N ATOM 0 H ARG A 109 -15.132 13.492 -9.068 1.00 0.00 H new ATOM 0 HA ARG A 109 -18.006 13.336 -9.723 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -16.964 13.970 -12.052 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -17.076 15.203 -10.812 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -14.729 14.866 -10.165 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -14.593 13.459 -11.201 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -14.823 14.794 -13.215 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -15.359 16.197 -12.311 1.00 0.00 H new ATOM 0 HE ARG A 109 -13.117 16.708 -11.779 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -13.499 13.463 -13.055 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -11.762 13.184 -13.223 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -10.888 16.339 -11.998 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -10.297 14.799 -12.630 1.00 0.00 H new ATOM 1762 N PHE A 110 -17.798 10.929 -10.358 1.00 0.00 N ATOM 1763 CA PHE A 110 -17.785 9.572 -10.893 1.00 0.00 C ATOM 1764 C PHE A 110 -18.623 9.501 -12.170 1.00 0.00 C ATOM 1765 O PHE A 110 -19.525 10.313 -12.373 1.00 0.00 O ATOM 1766 CB PHE A 110 -18.339 8.590 -9.849 1.00 0.00 C ATOM 1767 CG PHE A 110 -19.223 9.334 -8.871 1.00 0.00 C ATOM 1768 CD1 PHE A 110 -20.389 9.963 -9.321 1.00 0.00 C ATOM 1769 CD2 PHE A 110 -18.875 9.392 -7.515 1.00 0.00 C ATOM 1770 CE1 PHE A 110 -21.207 10.652 -8.418 1.00 0.00 C ATOM 1771 CE2 PHE A 110 -19.693 10.082 -6.612 1.00 0.00 C ATOM 1772 CZ PHE A 110 -20.859 10.712 -7.062 1.00 0.00 C ATOM 0 H PHE A 110 -18.590 11.137 -9.749 1.00 0.00 H new ATOM 0 HA PHE A 110 -16.757 9.298 -11.129 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -18.908 7.802 -10.342 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -17.519 8.107 -9.318 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -20.658 9.917 -10.366 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -17.976 8.905 -7.166 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -22.107 11.137 -8.766 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -19.424 10.128 -5.567 1.00 0.00 H new ATOM 0 HZ PHE A 110 -21.490 11.244 -6.365 1.00 0.00 H new ATOM 1782 N PRO A 111 -18.345 8.550 -13.022 1.00 0.00 N ATOM 1783 CA PRO A 111 -19.095 8.375 -14.301 1.00 0.00 C ATOM 1784 C PRO A 111 -20.564 8.039 -14.052 1.00 0.00 C ATOM 1785 O PRO A 111 -20.927 7.562 -12.977 1.00 0.00 O ATOM 1786 CB PRO A 111 -18.369 7.219 -15.006 1.00 0.00 C ATOM 1787 CG PRO A 111 -17.624 6.499 -13.930 1.00 0.00 C ATOM 1788 CD PRO A 111 -17.289 7.540 -12.865 1.00 0.00 C ATOM 0 HA PRO A 111 -19.109 9.286 -14.899 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -19.077 6.556 -15.504 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -17.689 7.592 -15.772 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -18.229 5.695 -13.510 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -16.717 6.042 -14.325 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -17.295 7.106 -11.865 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -16.299 7.968 -13.021 1.00 0.00 H new ATOM 1796 N GLU A 112 -21.404 8.296 -15.050 1.00 0.00 N ATOM 1797 CA GLU A 112 -22.834 8.022 -14.927 1.00 0.00 C ATOM 1798 C GLU A 112 -23.195 6.718 -15.632 1.00 0.00 C ATOM 1799 O GLU A 112 -24.350 6.295 -15.623 1.00 0.00 O ATOM 1800 CB GLU A 112 -23.635 9.178 -15.536 1.00 0.00 C ATOM 1801 CG GLU A 112 -25.062 9.173 -14.981 1.00 0.00 C ATOM 1802 CD GLU A 112 -25.821 10.395 -15.487 1.00 0.00 C ATOM 1803 OE1 GLU A 112 -25.182 11.404 -15.734 1.00 0.00 O ATOM 1804 OE2 GLU A 112 -27.031 10.304 -15.620 1.00 0.00 O ATOM 0 H GLU A 112 -21.123 8.691 -15.948 1.00 0.00 H new ATOM 0 HA GLU A 112 -23.080 7.924 -13.870 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -23.150 10.127 -15.308 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -23.657 9.084 -16.622 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -25.577 8.262 -15.287 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -25.038 9.175 -13.891 1.00 0.00 H new ATOM 1811 N TRP A 113 -22.197 6.083 -16.243 1.00 0.00 N ATOM 1812 CA TRP A 113 -22.419 4.824 -16.951 1.00 0.00 C ATOM 1813 C TRP A 113 -21.901 3.649 -16.124 1.00 0.00 C ATOM 1814 O TRP A 113 -22.021 2.493 -16.531 1.00 0.00 O ATOM 1815 CB TRP A 113 -21.717 4.855 -18.317 1.00 0.00 C ATOM 1816 CG TRP A 113 -20.633 5.884 -18.305 1.00 0.00 C ATOM 1817 CD1 TRP A 113 -20.834 7.222 -18.267 1.00 0.00 C ATOM 1818 CD2 TRP A 113 -19.189 5.689 -18.332 1.00 0.00 C ATOM 1819 NE1 TRP A 113 -19.607 7.860 -18.267 1.00 0.00 N ATOM 1820 CE2 TRP A 113 -18.562 6.957 -18.307 1.00 0.00 C ATOM 1821 CE3 TRP A 113 -18.370 4.546 -18.375 1.00 0.00 C ATOM 1822 CZ2 TRP A 113 -17.173 7.088 -18.324 1.00 0.00 C ATOM 1823 CZ3 TRP A 113 -16.971 4.674 -18.392 1.00 0.00 C ATOM 1824 CH2 TRP A 113 -16.375 5.943 -18.367 1.00 0.00 C ATOM 0 H TRP A 113 -21.233 6.416 -16.262 1.00 0.00 H new ATOM 0 HA TRP A 113 -23.490 4.697 -17.105 1.00 0.00 H new ATOM 0 HB2 TRP A 113 -21.298 3.875 -18.543 1.00 0.00 H new ATOM 0 HB3 TRP A 113 -22.438 5.082 -19.102 1.00 0.00 H new ATOM 0 HD1 TRP A 113 -21.796 7.712 -18.241 1.00 0.00 H new ATOM 0 HE1 TRP A 113 -19.488 8.873 -18.241 1.00 0.00 H new ATOM 0 HE3 TRP A 113 -18.819 3.564 -18.395 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 -16.719 8.068 -18.304 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 -16.351 3.790 -18.425 1.00 0.00 H new ATOM 0 HH2 TRP A 113 -15.299 6.035 -18.381 1.00 0.00 H new ATOM 1835 N LEU A 114 -21.328 3.953 -14.962 1.00 0.00 N ATOM 1836 CA LEU A 114 -20.795 2.918 -14.079 1.00 0.00 C ATOM 1837 C LEU A 114 -21.513 2.962 -12.727 1.00 0.00 C ATOM 1838 O LEU A 114 -21.010 3.542 -11.765 1.00 0.00 O ATOM 1839 CB LEU A 114 -19.285 3.136 -13.884 1.00 0.00 C ATOM 1840 CG LEU A 114 -18.556 1.785 -13.835 1.00 0.00 C ATOM 1841 CD1 LEU A 114 -18.318 1.268 -15.257 1.00 0.00 C ATOM 1842 CD2 LEU A 114 -17.207 1.958 -13.131 1.00 0.00 C ATOM 0 H LEU A 114 -21.221 4.904 -14.610 1.00 0.00 H new ATOM 0 HA LEU A 114 -20.960 1.940 -14.530 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -18.889 3.742 -14.699 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -19.106 3.688 -12.961 1.00 0.00 H new ATOM 0 HG LEU A 114 -19.170 1.069 -13.288 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -17.801 0.310 -15.214 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -19.275 1.141 -15.763 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -17.709 1.985 -15.808 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -16.689 0.999 -13.096 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -16.600 2.678 -13.679 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -17.370 2.320 -12.116 1.00 0.00 H new ATOM 1854 N PRO A 115 -22.676 2.368 -12.643 1.00 0.00 N ATOM 1855 CA PRO A 115 -23.478 2.346 -11.383 1.00 0.00 C ATOM 1856 C PRO A 115 -22.673 1.824 -10.194 1.00 0.00 C ATOM 1857 O PRO A 115 -23.206 1.661 -9.100 1.00 0.00 O ATOM 1858 CB PRO A 115 -24.650 1.411 -11.706 1.00 0.00 C ATOM 1859 CG PRO A 115 -24.765 1.415 -13.194 1.00 0.00 C ATOM 1860 CD PRO A 115 -23.356 1.654 -13.736 1.00 0.00 C ATOM 0 HA PRO A 115 -23.798 3.346 -11.089 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -24.465 0.405 -11.329 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -25.571 1.761 -11.240 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -25.164 0.467 -13.555 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -25.447 2.196 -13.529 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -22.854 0.716 -13.974 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -23.374 2.247 -14.651 1.00 0.00 H new ATOM 1868 N LEU A 116 -21.392 1.565 -10.416 1.00 0.00 N ATOM 1869 CA LEU A 116 -20.530 1.062 -9.357 1.00 0.00 C ATOM 1870 C LEU A 116 -20.343 2.124 -8.280 1.00 0.00 C ATOM 1871 O LEU A 116 -20.161 1.811 -7.106 1.00 0.00 O ATOM 1872 CB LEU A 116 -19.167 0.664 -9.939 1.00 0.00 C ATOM 1873 CG LEU A 116 -19.209 -0.783 -10.457 1.00 0.00 C ATOM 1874 CD1 LEU A 116 -19.254 -1.768 -9.279 1.00 0.00 C ATOM 1875 CD2 LEU A 116 -20.448 -0.983 -11.340 1.00 0.00 C ATOM 0 H LEU A 116 -20.929 1.694 -11.316 1.00 0.00 H new ATOM 0 HA LEU A 116 -20.998 0.186 -8.909 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -18.899 1.340 -10.751 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -18.395 0.762 -9.175 1.00 0.00 H new ATOM 0 HG LEU A 116 -18.310 -0.971 -11.044 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -19.284 -2.789 -9.659 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -18.366 -1.637 -8.661 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -20.145 -1.578 -8.680 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -20.473 -2.010 -11.705 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -21.347 -0.783 -10.757 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -20.406 -0.298 -12.187 1.00 0.00 H new ATOM 1887 N ASP A 117 -20.397 3.387 -8.699 1.00 0.00 N ATOM 1888 CA ASP A 117 -20.243 4.506 -7.776 1.00 0.00 C ATOM 1889 C ASP A 117 -21.612 5.031 -7.352 1.00 0.00 C ATOM 1890 O ASP A 117 -21.832 5.353 -6.184 1.00 0.00 O ATOM 1891 CB ASP A 117 -19.442 5.629 -8.446 1.00 0.00 C ATOM 1892 CG ASP A 117 -18.497 5.043 -9.491 1.00 0.00 C ATOM 1893 OD1 ASP A 117 -17.398 4.664 -9.123 1.00 0.00 O ATOM 1894 OD2 ASP A 117 -18.888 4.982 -10.645 1.00 0.00 O ATOM 0 H ASP A 117 -20.546 3.659 -9.671 1.00 0.00 H new ATOM 0 HA ASP A 117 -19.707 4.161 -6.892 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -20.121 6.341 -8.916 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -18.873 6.178 -7.696 1.00 0.00 H new ATOM 1899 N LYS A 118 -22.527 5.117 -8.315 1.00 0.00 N ATOM 1900 CA LYS A 118 -23.872 5.609 -8.040 1.00 0.00 C ATOM 1901 C LYS A 118 -24.663 4.592 -7.222 1.00 0.00 C ATOM 1902 O LYS A 118 -25.336 4.950 -6.256 1.00 0.00 O ATOM 1903 CB LYS A 118 -24.605 5.887 -9.352 1.00 0.00 C ATOM 1904 CG LYS A 118 -25.882 6.681 -9.067 1.00 0.00 C ATOM 1905 CD LYS A 118 -26.616 6.971 -10.382 1.00 0.00 C ATOM 1906 CE LYS A 118 -27.452 5.754 -10.792 1.00 0.00 C ATOM 1907 NZ LYS A 118 -28.305 6.110 -11.960 1.00 0.00 N ATOM 0 H LYS A 118 -22.362 4.854 -9.287 1.00 0.00 H new ATOM 0 HA LYS A 118 -23.787 6.532 -7.466 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -23.960 6.447 -10.029 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -24.851 4.949 -9.849 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -26.529 6.118 -8.395 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -25.636 7.616 -8.563 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -27.260 7.843 -10.265 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -25.896 7.209 -11.165 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -26.799 4.919 -11.046 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -28.075 5.429 -9.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -28.873 5.285 -12.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -28.937 6.894 -11.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -27.701 6.400 -12.755 1.00 0.00 H new ATOM 1921 N TRP A 119 -24.579 3.326 -7.616 1.00 0.00 N ATOM 1922 CA TRP A 119 -25.295 2.271 -6.907 1.00 0.00 C ATOM 1923 C TRP A 119 -24.594 1.952 -5.591 1.00 0.00 C ATOM 1924 O TRP A 119 -25.166 1.303 -4.714 1.00 0.00 O ATOM 1925 CB TRP A 119 -25.375 1.008 -7.772 1.00 0.00 C ATOM 1926 CG TRP A 119 -26.545 0.179 -7.346 1.00 0.00 C ATOM 1927 CD1 TRP A 119 -26.486 -0.871 -6.496 1.00 0.00 C ATOM 1928 CD2 TRP A 119 -27.944 0.314 -7.733 1.00 0.00 C ATOM 1929 NE1 TRP A 119 -27.759 -1.389 -6.337 1.00 0.00 N ATOM 1930 CE2 TRP A 119 -28.691 -0.692 -7.079 1.00 0.00 C ATOM 1931 CE3 TRP A 119 -28.628 1.204 -8.580 1.00 0.00 C ATOM 1932 CZ2 TRP A 119 -30.069 -0.814 -7.259 1.00 0.00 C ATOM 1933 CZ3 TRP A 119 -30.016 1.086 -8.763 1.00 0.00 C ATOM 1934 CH2 TRP A 119 -30.735 0.079 -8.104 1.00 0.00 C ATOM 0 H TRP A 119 -24.029 3.007 -8.413 1.00 0.00 H new ATOM 0 HA TRP A 119 -26.306 2.620 -6.696 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -25.473 1.281 -8.823 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -24.455 0.432 -7.677 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -25.592 -1.244 -6.019 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -27.982 -2.188 -5.744 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -28.083 1.983 -9.093 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -30.617 -1.592 -6.749 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -30.532 1.775 -9.415 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -31.802 -0.007 -8.249 1.00 0.00 H new ATOM 1945 N VAL A 120 -23.353 2.413 -5.459 1.00 0.00 N ATOM 1946 CA VAL A 120 -22.585 2.168 -4.239 1.00 0.00 C ATOM 1947 C VAL A 120 -21.862 3.435 -3.784 1.00 0.00 C ATOM 1948 O VAL A 120 -20.635 3.516 -3.838 1.00 0.00 O ATOM 1949 CB VAL A 120 -21.565 1.050 -4.477 1.00 0.00 C ATOM 1950 CG1 VAL A 120 -21.201 0.393 -3.144 1.00 0.00 C ATOM 1951 CG2 VAL A 120 -22.173 0.001 -5.409 1.00 0.00 C ATOM 0 H VAL A 120 -22.861 2.952 -6.172 1.00 0.00 H new ATOM 0 HA VAL A 120 -23.280 1.866 -3.456 1.00 0.00 H new ATOM 0 HB VAL A 120 -20.667 1.469 -4.931 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -20.475 -0.402 -3.316 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -20.770 1.139 -2.476 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -22.098 -0.027 -2.688 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -21.450 -0.796 -5.581 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -23.070 -0.416 -4.952 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -22.433 0.466 -6.360 1.00 0.00 H new ATOM 1961 N PRO A 121 -22.599 4.414 -3.329 1.00 0.00 N ATOM 1962 CA PRO A 121 -22.022 5.696 -2.841 1.00 0.00 C ATOM 1963 C PRO A 121 -21.487 5.556 -1.419 1.00 0.00 C ATOM 1964 O PRO A 121 -20.664 6.351 -0.966 1.00 0.00 O ATOM 1965 CB PRO A 121 -23.210 6.659 -2.897 1.00 0.00 C ATOM 1966 CG PRO A 121 -24.421 5.801 -2.705 1.00 0.00 C ATOM 1967 CD PRO A 121 -24.068 4.403 -3.230 1.00 0.00 C ATOM 0 HA PRO A 121 -21.172 6.034 -3.434 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -23.138 7.418 -2.118 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -23.247 7.184 -3.852 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -24.700 5.758 -1.652 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -25.274 6.212 -3.245 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -24.416 3.624 -2.552 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -24.531 4.213 -4.198 1.00 0.00 H new ATOM 1975 N GLN A 122 -21.973 4.533 -0.727 1.00 0.00 N ATOM 1976 CA GLN A 122 -21.558 4.272 0.646 1.00 0.00 C ATOM 1977 C GLN A 122 -20.040 4.218 0.743 1.00 0.00 C ATOM 1978 O GLN A 122 -19.432 4.921 1.550 1.00 0.00 O ATOM 1979 CB GLN A 122 -22.145 2.942 1.126 1.00 0.00 C ATOM 1980 CG GLN A 122 -23.671 2.953 0.960 1.00 0.00 C ATOM 1981 CD GLN A 122 -24.194 1.525 0.835 1.00 0.00 C ATOM 1982 OE1 GLN A 122 -24.307 0.999 -0.274 1.00 0.00 O ATOM 1983 NE2 GLN A 122 -24.523 0.863 1.909 1.00 0.00 N ATOM 0 H GLN A 122 -22.656 3.870 -1.094 1.00 0.00 H new ATOM 0 HA GLN A 122 -21.926 5.082 1.276 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -21.715 2.118 0.557 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -21.886 2.776 2.172 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -24.134 3.445 1.815 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -23.944 3.528 0.075 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -24.429 1.300 2.826 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -24.874 -0.091 1.832 1.00 0.00 H new ATOM 1992 N VAL A 123 -19.432 3.373 -0.085 1.00 0.00 N ATOM 1993 CA VAL A 123 -17.980 3.223 -0.088 1.00 0.00 C ATOM 1994 C VAL A 123 -17.377 3.830 -1.351 1.00 0.00 C ATOM 1995 O VAL A 123 -16.660 3.159 -2.093 1.00 0.00 O ATOM 1996 CB VAL A 123 -17.610 1.741 -0.010 1.00 0.00 C ATOM 1997 CG1 VAL A 123 -16.134 1.601 0.369 1.00 0.00 C ATOM 1998 CG2 VAL A 123 -18.475 1.056 1.050 1.00 0.00 C ATOM 0 H VAL A 123 -19.920 2.784 -0.760 1.00 0.00 H new ATOM 0 HA VAL A 123 -17.580 3.747 0.780 1.00 0.00 H new ATOM 0 HB VAL A 123 -17.781 1.273 -0.979 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -15.871 0.545 0.424 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -15.517 2.089 -0.385 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -15.961 2.069 1.338 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -18.212 -0.000 1.107 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -18.303 1.525 2.019 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -19.527 1.155 0.781 1.00 0.00 H new ATOM 2008 N PHE A 124 -17.671 5.104 -1.586 1.00 0.00 N ATOM 2009 CA PHE A 124 -17.149 5.793 -2.760 1.00 0.00 C ATOM 2010 C PHE A 124 -17.153 7.304 -2.540 1.00 0.00 C ATOM 2011 O PHE A 124 -16.200 7.995 -2.899 1.00 0.00 O ATOM 2012 CB PHE A 124 -17.991 5.441 -3.993 1.00 0.00 C ATOM 2013 CG PHE A 124 -17.119 5.460 -5.228 1.00 0.00 C ATOM 2014 CD1 PHE A 124 -16.682 6.679 -5.758 1.00 0.00 C ATOM 2015 CD2 PHE A 124 -16.747 4.257 -5.840 1.00 0.00 C ATOM 2016 CE1 PHE A 124 -15.873 6.696 -6.901 1.00 0.00 C ATOM 2017 CE2 PHE A 124 -15.939 4.273 -6.982 1.00 0.00 C ATOM 2018 CZ PHE A 124 -15.502 5.492 -7.513 1.00 0.00 C ATOM 0 H PHE A 124 -18.263 5.677 -0.984 1.00 0.00 H new ATOM 0 HA PHE A 124 -16.122 5.468 -2.924 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -18.441 4.456 -3.869 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -18.809 6.153 -4.102 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -16.969 7.607 -5.286 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -17.084 3.316 -5.430 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -15.535 7.637 -7.310 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -15.652 3.345 -7.454 1.00 0.00 H new ATOM 0 HZ PHE A 124 -14.879 5.504 -8.395 1.00 0.00 H new ATOM 2028 N VAL A 125 -18.230 7.809 -1.945 1.00 0.00 N ATOM 2029 CA VAL A 125 -18.342 9.241 -1.683 1.00 0.00 C ATOM 2030 C VAL A 125 -17.157 9.726 -0.851 1.00 0.00 C ATOM 2031 O VAL A 125 -16.845 9.155 0.194 1.00 0.00 O ATOM 2032 CB VAL A 125 -19.648 9.534 -0.940 1.00 0.00 C ATOM 2033 CG1 VAL A 125 -19.684 11.006 -0.525 1.00 0.00 C ATOM 2034 CG2 VAL A 125 -20.833 9.237 -1.861 1.00 0.00 C ATOM 0 H VAL A 125 -19.030 7.255 -1.638 1.00 0.00 H new ATOM 0 HA VAL A 125 -18.342 9.770 -2.636 1.00 0.00 H new ATOM 0 HB VAL A 125 -19.708 8.906 -0.051 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -20.615 11.212 0.004 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -18.839 11.220 0.130 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -19.624 11.636 -1.413 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -21.764 9.445 -1.334 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -20.770 9.866 -2.749 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -20.810 8.188 -2.157 1.00 0.00 H new ATOM 2044 N ALA A 126 -16.499 10.782 -1.325 1.00 0.00 N ATOM 2045 CA ALA A 126 -15.347 11.337 -0.619 1.00 0.00 C ATOM 2046 C ALA A 126 -15.778 12.452 0.327 1.00 0.00 C ATOM 2047 O ALA A 126 -16.814 13.085 0.124 1.00 0.00 O ATOM 2048 CB ALA A 126 -14.337 11.888 -1.627 1.00 0.00 C ATOM 0 H ALA A 126 -16.742 11.267 -2.189 1.00 0.00 H new ATOM 0 HA ALA A 126 -14.887 10.540 -0.035 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -13.480 12.301 -1.095 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -14.004 11.085 -2.284 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -14.807 12.672 -2.221 1.00 0.00 H new ATOM 2054 N SER A 127 -14.976 12.688 1.360 1.00 0.00 N ATOM 2055 CA SER A 127 -15.279 13.730 2.333 1.00 0.00 C ATOM 2056 C SER A 127 -14.049 14.036 3.185 1.00 0.00 C ATOM 2057 O SER A 127 -13.742 13.310 4.131 1.00 0.00 O ATOM 2058 CB SER A 127 -16.430 13.284 3.234 1.00 0.00 C ATOM 2059 OG SER A 127 -17.580 13.034 2.436 1.00 0.00 O ATOM 0 H SER A 127 -14.115 12.174 1.544 1.00 0.00 H new ATOM 0 HA SER A 127 -15.570 14.633 1.796 1.00 0.00 H new ATOM 0 HB2 SER A 127 -16.151 12.384 3.782 1.00 0.00 H new ATOM 0 HB3 SER A 127 -16.647 14.054 3.974 1.00 0.00 H new ATOM 0 HG SER A 127 -17.545 13.588 1.629 1.00 0.00 H new ATOM 2065 N GLY A 128 -13.348 15.113 2.842 1.00 0.00 N ATOM 2066 CA GLY A 128 -12.150 15.509 3.580 1.00 0.00 C ATOM 2067 C GLY A 128 -11.066 16.010 2.630 1.00 0.00 C ATOM 2068 O GLY A 128 -11.300 16.154 1.430 1.00 0.00 O ATOM 0 H GLY A 128 -13.586 15.725 2.062 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -12.401 16.291 4.296 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -11.774 14.661 4.153 1.00 0.00 H new ATOM 2072 N ASP A 129 -9.879 16.271 3.173 1.00 0.00 N ATOM 2073 CA ASP A 129 -8.765 16.752 2.362 1.00 0.00 C ATOM 2074 C ASP A 129 -7.854 15.592 1.977 1.00 0.00 C ATOM 2075 O ASP A 129 -7.942 14.507 2.551 1.00 0.00 O ATOM 2076 CB ASP A 129 -7.963 17.796 3.141 1.00 0.00 C ATOM 2077 CG ASP A 129 -8.876 18.935 3.581 1.00 0.00 C ATOM 2078 OD1 ASP A 129 -9.010 19.885 2.828 1.00 0.00 O ATOM 2079 OD2 ASP A 129 -9.428 18.840 4.665 1.00 0.00 O ATOM 0 H ASP A 129 -9.665 16.158 4.164 1.00 0.00 H new ATOM 0 HA ASP A 129 -9.165 17.207 1.456 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -7.499 17.334 4.012 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -7.157 18.185 2.519 1.00 0.00 H new ATOM 2084 N CYS A 130 -6.983 15.828 0.999 1.00 0.00 N ATOM 2085 CA CYS A 130 -6.061 14.792 0.541 1.00 0.00 C ATOM 2086 C CYS A 130 -4.615 15.196 0.812 1.00 0.00 C ATOM 2087 O CYS A 130 -4.186 16.286 0.438 1.00 0.00 O ATOM 2088 CB CYS A 130 -6.258 14.550 -0.961 1.00 0.00 C ATOM 2089 SG CYS A 130 -7.400 13.166 -1.205 1.00 0.00 S ATOM 0 H CYS A 130 -6.896 16.720 0.512 1.00 0.00 H new ATOM 0 HA CYS A 130 -6.272 13.874 1.090 1.00 0.00 H new ATOM 0 HB2 CYS A 130 -6.652 15.448 -1.436 1.00 0.00 H new ATOM 0 HB3 CYS A 130 -5.300 14.333 -1.434 1.00 0.00 H new ATOM 2094 N ALA A 131 -3.882 14.297 1.474 1.00 0.00 N ATOM 2095 CA ALA A 131 -2.475 14.522 1.820 1.00 0.00 C ATOM 2096 C ALA A 131 -2.344 14.959 3.275 1.00 0.00 C ATOM 2097 O ALA A 131 -1.237 15.039 3.808 1.00 0.00 O ATOM 2098 CB ALA A 131 -1.836 15.573 0.907 1.00 0.00 C ATOM 0 H ALA A 131 -4.245 13.396 1.785 1.00 0.00 H new ATOM 0 HA ALA A 131 -1.949 13.578 1.679 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -0.793 15.716 1.191 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -1.888 15.235 -0.128 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -2.372 16.517 1.008 1.00 0.00 H new ATOM 2104 N GLU A 132 -3.476 15.230 3.918 1.00 0.00 N ATOM 2105 CA GLU A 132 -3.459 15.645 5.315 1.00 0.00 C ATOM 2106 C GLU A 132 -3.005 14.486 6.196 1.00 0.00 C ATOM 2107 O GLU A 132 -3.338 13.330 5.935 1.00 0.00 O ATOM 2108 CB GLU A 132 -4.855 16.101 5.744 1.00 0.00 C ATOM 2109 CG GLU A 132 -5.876 15.012 5.408 1.00 0.00 C ATOM 2110 CD GLU A 132 -7.272 15.457 5.831 1.00 0.00 C ATOM 2111 OE1 GLU A 132 -7.403 15.958 6.936 1.00 0.00 O ATOM 2112 OE2 GLU A 132 -8.189 15.291 5.045 1.00 0.00 O ATOM 0 H GLU A 132 -4.405 15.171 3.500 1.00 0.00 H new ATOM 0 HA GLU A 132 -2.762 16.476 5.427 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -4.868 16.308 6.814 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -5.118 17.029 5.236 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -5.860 14.805 4.338 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -5.611 14.085 5.916 1.00 0.00 H new ATOM 2119 N ARG A 133 -2.242 14.799 7.238 1.00 0.00 N ATOM 2120 CA ARG A 133 -1.746 13.771 8.149 1.00 0.00 C ATOM 2121 C ARG A 133 -2.801 13.448 9.204 1.00 0.00 C ATOM 2122 O ARG A 133 -3.325 14.344 9.867 1.00 0.00 O ATOM 2123 CB ARG A 133 -0.451 14.246 8.833 1.00 0.00 C ATOM 2124 CG ARG A 133 0.030 15.549 8.189 1.00 0.00 C ATOM 2125 CD ARG A 133 1.395 15.930 8.763 1.00 0.00 C ATOM 2126 NE ARG A 133 1.253 16.384 10.142 1.00 0.00 N ATOM 2127 CZ ARG A 133 2.316 16.557 10.922 1.00 0.00 C ATOM 2128 NH1 ARG A 133 3.512 16.321 10.457 1.00 0.00 N ATOM 2129 NH2 ARG A 133 2.162 16.962 12.153 1.00 0.00 N ATOM 0 H ARG A 133 -1.955 15.749 7.473 1.00 0.00 H new ATOM 0 HA ARG A 133 -1.533 12.870 7.574 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -0.627 14.400 9.898 1.00 0.00 H new ATOM 0 HB3 ARG A 133 0.320 13.480 8.744 1.00 0.00 H new ATOM 0 HG2 ARG A 133 0.099 15.428 7.108 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -0.690 16.346 8.375 1.00 0.00 H new ATOM 0 HD2 ARG A 133 2.067 15.073 8.722 1.00 0.00 H new ATOM 0 HD3 ARG A 133 1.845 16.717 8.158 1.00 0.00 H new ATOM 0 HE ARG A 133 0.322 16.572 10.514 1.00 0.00 H new ATOM 0 HH11 ARG A 133 3.632 16.004 9.495 1.00 0.00 H new ATOM 0 HH12 ARG A 133 4.327 16.454 11.055 1.00 0.00 H new ATOM 0 HH21 ARG A 133 1.227 17.146 12.516 1.00 0.00 H new ATOM 0 HH22 ARG A 133 2.977 17.095 12.752 1.00 0.00 H new ATOM 2143 N GLN A 134 -3.108 12.162 9.352 1.00 0.00 N ATOM 2144 CA GLN A 134 -4.106 11.728 10.326 1.00 0.00 C ATOM 2145 C GLN A 134 -3.593 10.548 11.151 1.00 0.00 C ATOM 2146 O GLN A 134 -4.063 10.313 12.264 1.00 0.00 O ATOM 2147 CB GLN A 134 -5.394 11.329 9.604 1.00 0.00 C ATOM 2148 CG GLN A 134 -5.853 12.481 8.708 1.00 0.00 C ATOM 2149 CD GLN A 134 -7.140 12.100 7.984 1.00 0.00 C ATOM 2150 OE1 GLN A 134 -7.119 11.811 6.788 1.00 0.00 O ATOM 2151 NE2 GLN A 134 -8.267 12.080 8.644 1.00 0.00 N ATOM 0 H GLN A 134 -2.683 11.407 8.814 1.00 0.00 H new ATOM 0 HA GLN A 134 -4.306 12.559 11.003 1.00 0.00 H new ATOM 0 HB2 GLN A 134 -5.226 10.433 9.006 1.00 0.00 H new ATOM 0 HB3 GLN A 134 -6.170 11.087 10.330 1.00 0.00 H new ATOM 0 HG2 GLN A 134 -6.015 13.376 9.308 1.00 0.00 H new ATOM 0 HG3 GLN A 134 -5.075 12.720 7.983 1.00 0.00 H new ATOM 0 HE21 GLN A 134 -8.282 12.320 9.635 1.00 0.00 H new ATOM 0 HE22 GLN A 134 -9.132 11.824 8.168 1.00 0.00 H new ATOM 2160 N TRP A 135 -2.630 9.808 10.605 1.00 0.00 N ATOM 2161 CA TRP A 135 -2.076 8.662 11.318 1.00 0.00 C ATOM 2162 C TRP A 135 -0.879 8.079 10.568 1.00 0.00 C ATOM 2163 O TRP A 135 -0.967 7.797 9.373 1.00 0.00 O ATOM 2164 CB TRP A 135 -3.157 7.582 11.491 1.00 0.00 C ATOM 2165 CG TRP A 135 -3.074 6.996 12.865 1.00 0.00 C ATOM 2166 CD1 TRP A 135 -3.938 7.257 13.873 1.00 0.00 C ATOM 2167 CD2 TRP A 135 -2.092 6.062 13.400 1.00 0.00 C ATOM 2168 NE1 TRP A 135 -3.550 6.543 14.992 1.00 0.00 N ATOM 2169 CE2 TRP A 135 -2.416 5.791 14.751 1.00 0.00 C ATOM 2170 CE3 TRP A 135 -0.962 5.429 12.850 1.00 0.00 C ATOM 2171 CZ2 TRP A 135 -1.648 4.923 15.527 1.00 0.00 C ATOM 2172 CZ3 TRP A 135 -0.186 4.555 13.631 1.00 0.00 C ATOM 2173 CH2 TRP A 135 -0.529 4.303 14.967 1.00 0.00 C ATOM 0 H TRP A 135 -2.223 9.978 9.685 1.00 0.00 H new ATOM 0 HA TRP A 135 -1.738 8.999 12.298 1.00 0.00 H new ATOM 0 HB2 TRP A 135 -4.145 8.014 11.329 1.00 0.00 H new ATOM 0 HB3 TRP A 135 -3.025 6.800 10.744 1.00 0.00 H new ATOM 0 HD1 TRP A 135 -4.792 7.916 13.813 1.00 0.00 H new ATOM 0 HE1 TRP A 135 -4.041 6.568 15.886 1.00 0.00 H new ATOM 0 HE3 TRP A 135 -0.689 5.616 11.822 1.00 0.00 H new ATOM 0 HZ2 TRP A 135 -1.917 4.731 16.555 1.00 0.00 H new ATOM 0 HZ3 TRP A 135 0.680 4.075 13.199 1.00 0.00 H new ATOM 0 HH2 TRP A 135 0.071 3.631 15.562 1.00 0.00 H new ATOM 2184 N ASP A 136 0.249 7.931 11.262 1.00 0.00 N ATOM 2185 CA ASP A 136 1.459 7.414 10.623 1.00 0.00 C ATOM 2186 C ASP A 136 2.174 6.381 11.493 1.00 0.00 C ATOM 2187 O ASP A 136 1.937 6.285 12.696 1.00 0.00 O ATOM 2188 CB ASP A 136 2.415 8.578 10.338 1.00 0.00 C ATOM 2189 CG ASP A 136 2.371 9.578 11.489 1.00 0.00 C ATOM 2190 OD1 ASP A 136 1.346 10.216 11.655 1.00 0.00 O ATOM 2191 OD2 ASP A 136 3.365 9.690 12.188 1.00 0.00 O ATOM 0 H ASP A 136 0.351 8.158 12.251 1.00 0.00 H new ATOM 0 HA ASP A 136 1.161 6.921 9.698 1.00 0.00 H new ATOM 0 HB2 ASP A 136 3.430 8.203 10.209 1.00 0.00 H new ATOM 0 HB3 ASP A 136 2.136 9.070 9.406 1.00 0.00 H new ATOM 2196 N PHE A 137 3.070 5.628 10.856 1.00 0.00 N ATOM 2197 CA PHE A 137 3.860 4.609 11.539 1.00 0.00 C ATOM 2198 C PHE A 137 5.344 4.916 11.351 1.00 0.00 C ATOM 2199 O PHE A 137 5.775 5.279 10.259 1.00 0.00 O ATOM 2200 CB PHE A 137 3.537 3.220 10.969 1.00 0.00 C ATOM 2201 CG PHE A 137 2.468 2.557 11.808 1.00 0.00 C ATOM 2202 CD1 PHE A 137 2.770 2.123 13.105 1.00 0.00 C ATOM 2203 CD2 PHE A 137 1.179 2.379 11.291 1.00 0.00 C ATOM 2204 CE1 PHE A 137 1.782 1.508 13.884 1.00 0.00 C ATOM 2205 CE2 PHE A 137 0.192 1.764 12.072 1.00 0.00 C ATOM 2206 CZ PHE A 137 0.494 1.330 13.368 1.00 0.00 C ATOM 0 H PHE A 137 3.267 5.708 9.858 1.00 0.00 H new ATOM 0 HA PHE A 137 3.617 4.615 12.602 1.00 0.00 H new ATOM 0 HB2 PHE A 137 3.198 3.310 9.937 1.00 0.00 H new ATOM 0 HB3 PHE A 137 4.436 2.604 10.956 1.00 0.00 H new ATOM 0 HD1 PHE A 137 3.764 2.263 13.504 1.00 0.00 H new ATOM 0 HD2 PHE A 137 0.946 2.715 10.292 1.00 0.00 H new ATOM 0 HE1 PHE A 137 2.015 1.171 14.883 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -0.802 1.625 11.674 1.00 0.00 H new ATOM 0 HZ PHE A 137 -0.268 0.857 13.970 1.00 0.00 H new ATOM 2216 N LEU A 138 6.121 4.762 12.414 1.00 0.00 N ATOM 2217 CA LEU A 138 7.555 5.026 12.342 1.00 0.00 C ATOM 2218 C LEU A 138 7.823 6.402 11.728 1.00 0.00 C ATOM 2219 O LEU A 138 8.947 6.693 11.315 1.00 0.00 O ATOM 2220 CB LEU A 138 8.242 3.937 11.500 1.00 0.00 C ATOM 2221 CG LEU A 138 9.558 3.506 12.166 1.00 0.00 C ATOM 2222 CD1 LEU A 138 9.268 2.484 13.269 1.00 0.00 C ATOM 2223 CD2 LEU A 138 10.475 2.871 11.116 1.00 0.00 C ATOM 0 H LEU A 138 5.789 4.459 13.329 1.00 0.00 H new ATOM 0 HA LEU A 138 7.961 5.014 13.354 1.00 0.00 H new ATOM 0 HB2 LEU A 138 7.581 3.077 11.394 1.00 0.00 H new ATOM 0 HB3 LEU A 138 8.440 4.313 10.496 1.00 0.00 H new ATOM 0 HG LEU A 138 10.045 4.379 12.600 1.00 0.00 H new ATOM 0 HD11 LEU A 138 10.203 2.181 13.739 1.00 0.00 H new ATOM 0 HD12 LEU A 138 8.614 2.932 14.017 1.00 0.00 H new ATOM 0 HD13 LEU A 138 8.779 1.611 12.837 1.00 0.00 H new ATOM 0 HD21 LEU A 138 11.409 2.565 11.586 1.00 0.00 H new ATOM 0 HD22 LEU A 138 9.984 2.000 10.683 1.00 0.00 H new ATOM 0 HD23 LEU A 138 10.685 3.596 10.330 1.00 0.00 H new ATOM 2235 N GLY A 139 6.799 7.249 11.685 1.00 0.00 N ATOM 2236 CA GLY A 139 6.956 8.597 11.136 1.00 0.00 C ATOM 2237 C GLY A 139 6.557 8.675 9.660 1.00 0.00 C ATOM 2238 O GLY A 139 6.851 9.666 8.991 1.00 0.00 O ATOM 0 H GLY A 139 5.860 7.032 12.019 1.00 0.00 H new ATOM 0 HA2 GLY A 139 6.347 9.294 11.712 1.00 0.00 H new ATOM 0 HA3 GLY A 139 7.993 8.913 11.247 1.00 0.00 H new ATOM 2242 N LEU A 140 5.883 7.643 9.157 1.00 0.00 N ATOM 2243 CA LEU A 140 5.448 7.628 7.757 1.00 0.00 C ATOM 2244 C LEU A 140 3.937 7.421 7.683 1.00 0.00 C ATOM 2245 O LEU A 140 3.358 6.703 8.493 1.00 0.00 O ATOM 2246 CB LEU A 140 6.160 6.507 6.997 1.00 0.00 C ATOM 2247 CG LEU A 140 7.672 6.614 7.216 1.00 0.00 C ATOM 2248 CD1 LEU A 140 8.362 5.389 6.614 1.00 0.00 C ATOM 2249 CD2 LEU A 140 8.205 7.881 6.537 1.00 0.00 C ATOM 0 H LEU A 140 5.627 6.812 9.690 1.00 0.00 H new ATOM 0 HA LEU A 140 5.702 8.585 7.300 1.00 0.00 H new ATOM 0 HB2 LEU A 140 5.801 5.537 7.340 1.00 0.00 H new ATOM 0 HB3 LEU A 140 5.931 6.573 5.933 1.00 0.00 H new ATOM 0 HG LEU A 140 7.878 6.662 8.285 1.00 0.00 H new ATOM 0 HD11 LEU A 140 9.438 5.465 6.769 1.00 0.00 H new ATOM 0 HD12 LEU A 140 7.988 4.486 7.097 1.00 0.00 H new ATOM 0 HD13 LEU A 140 8.152 5.342 5.545 1.00 0.00 H new ATOM 0 HD21 LEU A 140 9.281 7.953 6.695 1.00 0.00 H new ATOM 0 HD22 LEU A 140 7.998 7.836 5.468 1.00 0.00 H new ATOM 0 HD23 LEU A 140 7.716 8.756 6.965 1.00 0.00 H new ATOM 2261 N GLU A 141 3.307 8.055 6.700 1.00 0.00 N ATOM 2262 CA GLU A 141 1.863 7.933 6.529 1.00 0.00 C ATOM 2263 C GLU A 141 1.496 6.543 6.020 1.00 0.00 C ATOM 2264 O GLU A 141 2.278 5.896 5.323 1.00 0.00 O ATOM 2265 CB GLU A 141 1.362 8.994 5.545 1.00 0.00 C ATOM 2266 CG GLU A 141 2.108 10.311 5.784 1.00 0.00 C ATOM 2267 CD GLU A 141 1.306 11.477 5.214 1.00 0.00 C ATOM 2268 OE1 GLU A 141 0.470 11.235 4.361 1.00 0.00 O ATOM 2269 OE2 GLU A 141 1.542 12.596 5.641 1.00 0.00 O ATOM 0 H GLU A 141 3.768 8.654 6.015 1.00 0.00 H new ATOM 0 HA GLU A 141 1.387 8.085 7.498 1.00 0.00 H new ATOM 0 HB2 GLU A 141 1.518 8.657 4.520 1.00 0.00 H new ATOM 0 HB3 GLU A 141 0.290 9.144 5.671 1.00 0.00 H new ATOM 0 HG2 GLU A 141 2.270 10.458 6.852 1.00 0.00 H new ATOM 0 HG3 GLU A 141 3.091 10.272 5.315 1.00 0.00 H new ATOM 2276 N MET A 142 0.297 6.090 6.376 1.00 0.00 N ATOM 2277 CA MET A 142 -0.169 4.775 5.952 1.00 0.00 C ATOM 2278 C MET A 142 0.070 4.574 4.452 1.00 0.00 C ATOM 2279 O MET A 142 0.700 3.599 4.048 1.00 0.00 O ATOM 2280 CB MET A 142 -1.665 4.616 6.278 1.00 0.00 C ATOM 2281 CG MET A 142 -1.851 3.606 7.415 1.00 0.00 C ATOM 2282 SD MET A 142 -3.524 3.759 8.092 1.00 0.00 S ATOM 2283 CE MET A 142 -4.423 3.536 6.538 1.00 0.00 C ATOM 0 H MET A 142 -0.364 6.610 6.953 1.00 0.00 H new ATOM 0 HA MET A 142 0.395 4.016 6.494 1.00 0.00 H new ATOM 0 HB2 MET A 142 -2.087 5.579 6.564 1.00 0.00 H new ATOM 0 HB3 MET A 142 -2.205 4.282 5.392 1.00 0.00 H new ATOM 0 HG2 MET A 142 -1.688 2.593 7.046 1.00 0.00 H new ATOM 0 HG3 MET A 142 -1.113 3.783 8.197 1.00 0.00 H new ATOM 0 HE1 MET A 142 -5.451 3.242 6.751 1.00 0.00 H new ATOM 0 HE2 MET A 142 -4.422 4.472 5.980 1.00 0.00 H new ATOM 0 HE3 MET A 142 -3.939 2.760 5.946 1.00 0.00 H new ATOM 2293 N PRO A 143 -0.415 5.470 3.627 1.00 0.00 N ATOM 2294 CA PRO A 143 -0.242 5.373 2.150 1.00 0.00 C ATOM 2295 C PRO A 143 1.154 4.892 1.757 1.00 0.00 C ATOM 2296 O PRO A 143 1.310 4.123 0.808 1.00 0.00 O ATOM 2297 CB PRO A 143 -0.484 6.806 1.676 1.00 0.00 C ATOM 2298 CG PRO A 143 -1.434 7.391 2.670 1.00 0.00 C ATOM 2299 CD PRO A 143 -1.182 6.671 4.003 1.00 0.00 C ATOM 0 HA PRO A 143 -0.918 4.645 1.702 1.00 0.00 H new ATOM 0 HB2 PRO A 143 0.447 7.372 1.641 1.00 0.00 H new ATOM 0 HB3 PRO A 143 -0.906 6.823 0.671 1.00 0.00 H new ATOM 0 HG2 PRO A 143 -1.272 8.464 2.774 1.00 0.00 H new ATOM 0 HG3 PRO A 143 -2.466 7.254 2.346 1.00 0.00 H new ATOM 0 HD2 PRO A 143 -0.623 7.300 4.696 1.00 0.00 H new ATOM 0 HD3 PRO A 143 -2.118 6.408 4.496 1.00 0.00 H new ATOM 2307 N GLN A 144 2.163 5.341 2.496 1.00 0.00 N ATOM 2308 CA GLN A 144 3.535 4.941 2.211 1.00 0.00 C ATOM 2309 C GLN A 144 3.743 3.476 2.582 1.00 0.00 C ATOM 2310 O GLN A 144 4.297 2.698 1.804 1.00 0.00 O ATOM 2311 CB GLN A 144 4.514 5.816 2.995 1.00 0.00 C ATOM 2312 CG GLN A 144 4.489 7.238 2.432 1.00 0.00 C ATOM 2313 CD GLN A 144 5.525 8.101 3.145 1.00 0.00 C ATOM 2314 OE1 GLN A 144 6.595 7.615 3.511 1.00 0.00 O ATOM 2315 NE2 GLN A 144 5.270 9.362 3.364 1.00 0.00 N ATOM 0 H GLN A 144 2.058 5.975 3.288 1.00 0.00 H new ATOM 0 HA GLN A 144 3.720 5.068 1.144 1.00 0.00 H new ATOM 0 HB2 GLN A 144 4.244 5.827 4.051 1.00 0.00 H new ATOM 0 HB3 GLN A 144 5.521 5.404 2.928 1.00 0.00 H new ATOM 0 HG2 GLN A 144 4.695 7.218 1.362 1.00 0.00 H new ATOM 0 HG3 GLN A 144 3.496 7.670 2.557 1.00 0.00 H new ATOM 0 HE21 GLN A 144 4.383 9.763 3.060 1.00 0.00 H new ATOM 0 HE22 GLN A 144 5.958 9.946 3.839 1.00 0.00 H new ATOM 2324 N TRP A 145 3.289 3.100 3.772 1.00 0.00 N ATOM 2325 CA TRP A 145 3.433 1.722 4.216 1.00 0.00 C ATOM 2326 C TRP A 145 2.595 0.801 3.335 1.00 0.00 C ATOM 2327 O TRP A 145 3.117 -0.124 2.714 1.00 0.00 O ATOM 2328 CB TRP A 145 2.984 1.590 5.674 1.00 0.00 C ATOM 2329 CG TRP A 145 4.048 2.128 6.578 1.00 0.00 C ATOM 2330 CD1 TRP A 145 3.922 3.223 7.365 1.00 0.00 C ATOM 2331 CD2 TRP A 145 5.391 1.615 6.801 1.00 0.00 C ATOM 2332 NE1 TRP A 145 5.106 3.414 8.056 1.00 0.00 N ATOM 2333 CE2 TRP A 145 6.042 2.447 7.742 1.00 0.00 C ATOM 2334 CE3 TRP A 145 6.102 0.517 6.284 1.00 0.00 C ATOM 2335 CZ2 TRP A 145 7.352 2.200 8.154 1.00 0.00 C ATOM 2336 CZ3 TRP A 145 7.421 0.265 6.696 1.00 0.00 C ATOM 2337 CH2 TRP A 145 8.044 1.105 7.629 1.00 0.00 C ATOM 0 H TRP A 145 2.825 3.720 4.436 1.00 0.00 H new ATOM 0 HA TRP A 145 4.482 1.436 4.139 1.00 0.00 H new ATOM 0 HB2 TRP A 145 2.052 2.134 5.829 1.00 0.00 H new ATOM 0 HB3 TRP A 145 2.786 0.545 5.911 1.00 0.00 H new ATOM 0 HD1 TRP A 145 3.042 3.845 7.441 1.00 0.00 H new ATOM 0 HE1 TRP A 145 5.268 4.175 8.716 1.00 0.00 H new ATOM 0 HE3 TRP A 145 5.631 -0.137 5.565 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 7.828 2.850 8.873 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 7.958 -0.580 6.292 1.00 0.00 H new ATOM 0 HH2 TRP A 145 9.058 0.906 7.942 1.00 0.00 H new ATOM 2348 N LEU A 146 1.293 1.064 3.282 1.00 0.00 N ATOM 2349 CA LEU A 146 0.396 0.257 2.463 1.00 0.00 C ATOM 2350 C LEU A 146 1.046 -0.034 1.108 1.00 0.00 C ATOM 2351 O LEU A 146 0.889 -1.125 0.559 1.00 0.00 O ATOM 2352 CB LEU A 146 -0.932 1.005 2.261 1.00 0.00 C ATOM 2353 CG LEU A 146 -1.681 0.456 1.028 1.00 0.00 C ATOM 2354 CD1 LEU A 146 -3.192 0.531 1.269 1.00 0.00 C ATOM 2355 CD2 LEU A 146 -1.324 1.286 -0.217 1.00 0.00 C ATOM 0 H LEU A 146 0.839 1.822 3.791 1.00 0.00 H new ATOM 0 HA LEU A 146 0.200 -0.688 2.969 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -1.555 0.898 3.149 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -0.740 2.070 2.132 1.00 0.00 H new ATOM 0 HG LEU A 146 -1.386 -0.581 0.867 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -3.719 0.143 0.397 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -3.451 -0.065 2.144 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -3.483 1.568 1.437 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -1.857 0.892 -1.082 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -1.612 2.325 -0.056 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -0.250 1.230 -0.396 1.00 0.00 H new ATOM 2367 N LEU A 147 1.788 0.939 0.581 1.00 0.00 N ATOM 2368 CA LEU A 147 2.466 0.755 -0.701 1.00 0.00 C ATOM 2369 C LEU A 147 3.547 -0.310 -0.546 1.00 0.00 C ATOM 2370 O LEU A 147 3.807 -1.095 -1.458 1.00 0.00 O ATOM 2371 CB LEU A 147 3.088 2.075 -1.168 1.00 0.00 C ATOM 2372 CG LEU A 147 3.940 1.842 -2.420 1.00 0.00 C ATOM 2373 CD1 LEU A 147 3.098 1.160 -3.503 1.00 0.00 C ATOM 2374 CD2 LEU A 147 4.445 3.190 -2.944 1.00 0.00 C ATOM 0 H LEU A 147 1.934 1.851 1.015 1.00 0.00 H new ATOM 0 HA LEU A 147 1.742 0.433 -1.450 1.00 0.00 H new ATOM 0 HB2 LEU A 147 2.303 2.800 -1.383 1.00 0.00 H new ATOM 0 HB3 LEU A 147 3.703 2.497 -0.373 1.00 0.00 H new ATOM 0 HG LEU A 147 4.786 1.202 -2.167 1.00 0.00 H new ATOM 0 HD11 LEU A 147 3.709 0.997 -4.391 1.00 0.00 H new ATOM 0 HD12 LEU A 147 2.735 0.202 -3.132 1.00 0.00 H new ATOM 0 HD13 LEU A 147 2.250 1.795 -3.758 1.00 0.00 H new ATOM 0 HD21 LEU A 147 5.052 3.030 -3.835 1.00 0.00 H new ATOM 0 HD22 LEU A 147 3.595 3.825 -3.193 1.00 0.00 H new ATOM 0 HD23 LEU A 147 5.048 3.676 -2.177 1.00 0.00 H new ATOM 2386 N GLY A 148 4.159 -0.329 0.631 1.00 0.00 N ATOM 2387 CA GLY A 148 5.201 -1.307 0.914 1.00 0.00 C ATOM 2388 C GLY A 148 4.660 -2.722 0.728 1.00 0.00 C ATOM 2389 O GLY A 148 5.368 -3.619 0.265 1.00 0.00 O ATOM 0 H GLY A 148 3.955 0.313 1.397 1.00 0.00 H new ATOM 0 HA2 GLY A 148 6.052 -1.145 0.252 1.00 0.00 H new ATOM 0 HA3 GLY A 148 5.563 -1.179 1.934 1.00 0.00 H new ATOM 2393 N ILE A 149 3.393 -2.907 1.087 1.00 0.00 N ATOM 2394 CA ILE A 149 2.751 -4.210 0.956 1.00 0.00 C ATOM 2395 C ILE A 149 2.540 -4.548 -0.517 1.00 0.00 C ATOM 2396 O ILE A 149 2.805 -5.667 -0.952 1.00 0.00 O ATOM 2397 CB ILE A 149 1.400 -4.211 1.682 1.00 0.00 C ATOM 2398 CG1 ILE A 149 1.462 -3.286 2.904 1.00 0.00 C ATOM 2399 CG2 ILE A 149 1.058 -5.634 2.135 1.00 0.00 C ATOM 2400 CD1 ILE A 149 2.577 -3.737 3.853 1.00 0.00 C ATOM 0 H ILE A 149 2.794 -2.175 1.469 1.00 0.00 H new ATOM 0 HA ILE A 149 3.399 -4.962 1.406 1.00 0.00 H new ATOM 0 HB ILE A 149 0.630 -3.852 0.999 1.00 0.00 H new ATOM 0 HG12 ILE A 149 1.640 -2.260 2.584 1.00 0.00 H new ATOM 0 HG13 ILE A 149 0.505 -3.295 3.425 1.00 0.00 H new ATOM 0 HG21 ILE A 149 0.098 -5.631 2.650 1.00 0.00 H new ATOM 0 HG22 ILE A 149 1.001 -6.289 1.265 1.00 0.00 H new ATOM 0 HG23 ILE A 149 1.832 -5.996 2.812 1.00 0.00 H new ATOM 0 HD11 ILE A 149 2.611 -3.073 4.716 1.00 0.00 H new ATOM 0 HD12 ILE A 149 2.381 -4.756 4.187 1.00 0.00 H new ATOM 0 HD13 ILE A 149 3.534 -3.704 3.332 1.00 0.00 H new ATOM 2412 N PHE A 150 2.061 -3.571 -1.282 1.00 0.00 N ATOM 2413 CA PHE A 150 1.824 -3.785 -2.702 1.00 0.00 C ATOM 2414 C PHE A 150 3.089 -4.314 -3.367 1.00 0.00 C ATOM 2415 O PHE A 150 3.038 -5.251 -4.162 1.00 0.00 O ATOM 2416 CB PHE A 150 1.384 -2.473 -3.370 1.00 0.00 C ATOM 2417 CG PHE A 150 -0.038 -2.611 -3.869 1.00 0.00 C ATOM 2418 CD1 PHE A 150 -0.354 -3.601 -4.806 1.00 0.00 C ATOM 2419 CD2 PHE A 150 -1.037 -1.753 -3.392 1.00 0.00 C ATOM 2420 CE1 PHE A 150 -1.670 -3.735 -5.266 1.00 0.00 C ATOM 2421 CE2 PHE A 150 -2.352 -1.887 -3.852 1.00 0.00 C ATOM 2422 CZ PHE A 150 -2.669 -2.879 -4.789 1.00 0.00 C ATOM 0 H PHE A 150 1.832 -2.635 -0.946 1.00 0.00 H new ATOM 0 HA PHE A 150 1.029 -4.521 -2.820 1.00 0.00 H new ATOM 0 HB2 PHE A 150 1.452 -1.650 -2.659 1.00 0.00 H new ATOM 0 HB3 PHE A 150 2.050 -2.234 -4.199 1.00 0.00 H new ATOM 0 HD1 PHE A 150 0.417 -4.262 -5.174 1.00 0.00 H new ATOM 0 HD2 PHE A 150 -0.793 -0.988 -2.670 1.00 0.00 H new ATOM 0 HE1 PHE A 150 -1.914 -4.499 -5.989 1.00 0.00 H new ATOM 0 HE2 PHE A 150 -3.123 -1.225 -3.485 1.00 0.00 H new ATOM 0 HZ PHE A 150 -3.684 -2.983 -5.143 1.00 0.00 H new ATOM 2432 N ILE A 151 4.224 -3.713 -3.028 1.00 0.00 N ATOM 2433 CA ILE A 151 5.495 -4.141 -3.595 1.00 0.00 C ATOM 2434 C ILE A 151 5.703 -5.627 -3.331 1.00 0.00 C ATOM 2435 O ILE A 151 6.068 -6.382 -4.231 1.00 0.00 O ATOM 2436 CB ILE A 151 6.643 -3.334 -2.984 1.00 0.00 C ATOM 2437 CG1 ILE A 151 6.527 -1.874 -3.428 1.00 0.00 C ATOM 2438 CG2 ILE A 151 7.981 -3.907 -3.457 1.00 0.00 C ATOM 2439 CD1 ILE A 151 7.542 -1.019 -2.665 1.00 0.00 C ATOM 0 H ILE A 151 4.289 -2.936 -2.370 1.00 0.00 H new ATOM 0 HA ILE A 151 5.480 -3.969 -4.671 1.00 0.00 H new ATOM 0 HB ILE A 151 6.590 -3.391 -1.897 1.00 0.00 H new ATOM 0 HG12 ILE A 151 6.704 -1.795 -4.501 1.00 0.00 H new ATOM 0 HG13 ILE A 151 5.517 -1.507 -3.244 1.00 0.00 H new ATOM 0 HG21 ILE A 151 8.798 -3.331 -3.021 1.00 0.00 H new ATOM 0 HG22 ILE A 151 8.063 -4.948 -3.143 1.00 0.00 H new ATOM 0 HG23 ILE A 151 8.037 -3.851 -4.544 1.00 0.00 H new ATOM 0 HD11 ILE A 151 7.456 0.020 -2.984 1.00 0.00 H new ATOM 0 HD12 ILE A 151 7.344 -1.087 -1.595 1.00 0.00 H new ATOM 0 HD13 ILE A 151 8.550 -1.380 -2.871 1.00 0.00 H new ATOM 2451 N ALA A 152 5.455 -6.041 -2.094 1.00 0.00 N ATOM 2452 CA ALA A 152 5.609 -7.445 -1.727 1.00 0.00 C ATOM 2453 C ALA A 152 4.712 -8.321 -2.599 1.00 0.00 C ATOM 2454 O ALA A 152 5.168 -9.309 -3.174 1.00 0.00 O ATOM 2455 CB ALA A 152 5.250 -7.646 -0.253 1.00 0.00 C ATOM 0 H ALA A 152 5.149 -5.432 -1.335 1.00 0.00 H new ATOM 0 HA ALA A 152 6.648 -7.733 -1.885 1.00 0.00 H new ATOM 0 HB1 ALA A 152 5.368 -8.697 0.010 1.00 0.00 H new ATOM 0 HB2 ALA A 152 5.910 -7.040 0.368 1.00 0.00 H new ATOM 0 HB3 ALA A 152 4.216 -7.344 -0.086 1.00 0.00 H new ATOM 2461 N TYR A 153 3.438 -7.955 -2.691 1.00 0.00 N ATOM 2462 CA TYR A 153 2.487 -8.722 -3.493 1.00 0.00 C ATOM 2463 C TYR A 153 2.896 -8.729 -4.965 1.00 0.00 C ATOM 2464 O TYR A 153 2.908 -9.775 -5.612 1.00 0.00 O ATOM 2465 CB TYR A 153 1.082 -8.117 -3.351 1.00 0.00 C ATOM 2466 CG TYR A 153 0.380 -8.727 -2.158 1.00 0.00 C ATOM 2467 CD1 TYR A 153 1.019 -8.769 -0.913 1.00 0.00 C ATOM 2468 CD2 TYR A 153 -0.914 -9.247 -2.299 1.00 0.00 C ATOM 2469 CE1 TYR A 153 0.366 -9.332 0.190 1.00 0.00 C ATOM 2470 CE2 TYR A 153 -1.566 -9.809 -1.195 1.00 0.00 C ATOM 2471 CZ TYR A 153 -0.926 -9.851 0.050 1.00 0.00 C ATOM 2472 OH TYR A 153 -1.569 -10.405 1.139 1.00 0.00 O ATOM 0 H TYR A 153 3.041 -7.139 -2.225 1.00 0.00 H new ATOM 0 HA TYR A 153 2.483 -9.750 -3.131 1.00 0.00 H new ATOM 0 HB2 TYR A 153 1.152 -7.036 -3.230 1.00 0.00 H new ATOM 0 HB3 TYR A 153 0.504 -8.299 -4.257 1.00 0.00 H new ATOM 0 HD1 TYR A 153 2.015 -8.367 -0.804 1.00 0.00 H new ATOM 0 HD2 TYR A 153 -1.408 -9.214 -3.259 1.00 0.00 H new ATOM 0 HE1 TYR A 153 0.860 -9.366 1.150 1.00 0.00 H new ATOM 0 HE2 TYR A 153 -2.563 -10.210 -1.303 1.00 0.00 H new ATOM 0 HH TYR A 153 -2.452 -10.732 0.866 1.00 0.00 H new ATOM 2482 N LEU A 154 3.229 -7.554 -5.485 1.00 0.00 N ATOM 2483 CA LEU A 154 3.636 -7.423 -6.881 1.00 0.00 C ATOM 2484 C LEU A 154 4.776 -8.387 -7.198 1.00 0.00 C ATOM 2485 O LEU A 154 4.909 -8.868 -8.325 1.00 0.00 O ATOM 2486 CB LEU A 154 4.085 -5.979 -7.140 1.00 0.00 C ATOM 2487 CG LEU A 154 4.532 -5.809 -8.600 1.00 0.00 C ATOM 2488 CD1 LEU A 154 4.457 -4.327 -8.985 1.00 0.00 C ATOM 2489 CD2 LEU A 154 5.980 -6.305 -8.783 1.00 0.00 C ATOM 0 H LEU A 154 3.226 -6.678 -4.963 1.00 0.00 H new ATOM 0 HA LEU A 154 2.791 -7.667 -7.525 1.00 0.00 H new ATOM 0 HB2 LEU A 154 3.267 -5.293 -6.922 1.00 0.00 H new ATOM 0 HB3 LEU A 154 4.905 -5.721 -6.470 1.00 0.00 H new ATOM 0 HG LEU A 154 3.873 -6.397 -9.239 1.00 0.00 H new ATOM 0 HD11 LEU A 154 4.774 -4.204 -10.021 1.00 0.00 H new ATOM 0 HD12 LEU A 154 3.432 -3.974 -8.875 1.00 0.00 H new ATOM 0 HD13 LEU A 154 5.112 -3.748 -8.334 1.00 0.00 H new ATOM 0 HD21 LEU A 154 6.280 -6.177 -9.823 1.00 0.00 H new ATOM 0 HD22 LEU A 154 6.646 -5.729 -8.140 1.00 0.00 H new ATOM 0 HD23 LEU A 154 6.040 -7.360 -8.515 1.00 0.00 H new ATOM 2501 N ILE A 155 5.595 -8.659 -6.192 1.00 0.00 N ATOM 2502 CA ILE A 155 6.735 -9.557 -6.360 1.00 0.00 C ATOM 2503 C ILE A 155 6.297 -11.019 -6.308 1.00 0.00 C ATOM 2504 O ILE A 155 6.940 -11.888 -6.895 1.00 0.00 O ATOM 2505 CB ILE A 155 7.772 -9.289 -5.265 1.00 0.00 C ATOM 2506 CG1 ILE A 155 8.360 -7.885 -5.453 1.00 0.00 C ATOM 2507 CG2 ILE A 155 8.894 -10.326 -5.353 1.00 0.00 C ATOM 2508 CD1 ILE A 155 8.955 -7.394 -4.131 1.00 0.00 C ATOM 0 H ILE A 155 5.494 -8.274 -5.253 1.00 0.00 H new ATOM 0 HA ILE A 155 7.177 -9.367 -7.338 1.00 0.00 H new ATOM 0 HB ILE A 155 7.292 -9.358 -4.289 1.00 0.00 H new ATOM 0 HG12 ILE A 155 9.129 -7.903 -6.225 1.00 0.00 H new ATOM 0 HG13 ILE A 155 7.585 -7.198 -5.792 1.00 0.00 H new ATOM 0 HG21 ILE A 155 9.630 -10.133 -4.573 1.00 0.00 H new ATOM 0 HG22 ILE A 155 8.478 -11.325 -5.220 1.00 0.00 H new ATOM 0 HG23 ILE A 155 9.374 -10.260 -6.329 1.00 0.00 H new ATOM 0 HD11 ILE A 155 9.372 -6.396 -4.268 1.00 0.00 H new ATOM 0 HD12 ILE A 155 8.174 -7.360 -3.371 1.00 0.00 H new ATOM 0 HD13 ILE A 155 9.743 -8.076 -3.811 1.00 0.00 H new ATOM 2520 N VAL A 156 5.208 -11.286 -5.598 1.00 0.00 N ATOM 2521 CA VAL A 156 4.706 -12.650 -5.477 1.00 0.00 C ATOM 2522 C VAL A 156 4.018 -13.094 -6.766 1.00 0.00 C ATOM 2523 O VAL A 156 3.983 -14.281 -7.081 1.00 0.00 O ATOM 2524 CB VAL A 156 3.718 -12.742 -4.311 1.00 0.00 C ATOM 2525 CG1 VAL A 156 3.041 -14.114 -4.313 1.00 0.00 C ATOM 2526 CG2 VAL A 156 4.470 -12.554 -2.992 1.00 0.00 C ATOM 0 H VAL A 156 4.659 -10.584 -5.101 1.00 0.00 H new ATOM 0 HA VAL A 156 5.554 -13.309 -5.290 1.00 0.00 H new ATOM 0 HB VAL A 156 2.962 -11.965 -4.419 1.00 0.00 H new ATOM 0 HG11 VAL A 156 2.339 -14.175 -3.481 1.00 0.00 H new ATOM 0 HG12 VAL A 156 2.505 -14.254 -5.252 1.00 0.00 H new ATOM 0 HG13 VAL A 156 3.796 -14.893 -4.207 1.00 0.00 H new ATOM 0 HG21 VAL A 156 3.768 -12.619 -2.161 1.00 0.00 H new ATOM 0 HG22 VAL A 156 5.226 -13.332 -2.890 1.00 0.00 H new ATOM 0 HG23 VAL A 156 4.952 -11.576 -2.984 1.00 0.00 H new ATOM 2536 N ALA A 157 3.460 -12.136 -7.501 1.00 0.00 N ATOM 2537 CA ALA A 157 2.763 -12.454 -8.746 1.00 0.00 C ATOM 2538 C ALA A 157 3.738 -12.648 -9.909 1.00 0.00 C ATOM 2539 O ALA A 157 3.538 -13.524 -10.750 1.00 0.00 O ATOM 2540 CB ALA A 157 1.774 -11.337 -9.085 1.00 0.00 C ATOM 0 H ALA A 157 3.475 -11.145 -7.261 1.00 0.00 H new ATOM 0 HA ALA A 157 2.228 -13.392 -8.597 1.00 0.00 H new ATOM 0 HB1 ALA A 157 1.257 -11.578 -10.014 1.00 0.00 H new ATOM 0 HB2 ALA A 157 1.046 -11.238 -8.279 1.00 0.00 H new ATOM 0 HB3 ALA A 157 2.313 -10.397 -9.204 1.00 0.00 H new ATOM 2546 N VAL A 158 4.776 -11.821 -9.970 1.00 0.00 N ATOM 2547 CA VAL A 158 5.747 -11.920 -11.059 1.00 0.00 C ATOM 2548 C VAL A 158 6.632 -13.159 -10.912 1.00 0.00 C ATOM 2549 O VAL A 158 7.078 -13.729 -11.908 1.00 0.00 O ATOM 2550 CB VAL A 158 6.625 -10.668 -11.102 1.00 0.00 C ATOM 2551 CG1 VAL A 158 5.748 -9.436 -11.341 1.00 0.00 C ATOM 2552 CG2 VAL A 158 7.372 -10.520 -9.773 1.00 0.00 C ATOM 0 H VAL A 158 4.967 -11.085 -9.291 1.00 0.00 H new ATOM 0 HA VAL A 158 5.187 -12.007 -11.990 1.00 0.00 H new ATOM 0 HB VAL A 158 7.348 -10.759 -11.913 1.00 0.00 H new ATOM 0 HG11 VAL A 158 6.374 -8.544 -11.372 1.00 0.00 H new ATOM 0 HG12 VAL A 158 5.222 -9.543 -12.290 1.00 0.00 H new ATOM 0 HG13 VAL A 158 5.023 -9.343 -10.532 1.00 0.00 H new ATOM 0 HG21 VAL A 158 7.997 -9.628 -9.804 1.00 0.00 H new ATOM 0 HG22 VAL A 158 6.652 -10.430 -8.959 1.00 0.00 H new ATOM 0 HG23 VAL A 158 7.999 -11.397 -9.608 1.00 0.00 H new ATOM 2562 N LEU A 159 6.895 -13.566 -9.674 1.00 0.00 N ATOM 2563 CA LEU A 159 7.742 -14.733 -9.433 1.00 0.00 C ATOM 2564 C LEU A 159 6.970 -16.033 -9.648 1.00 0.00 C ATOM 2565 O LEU A 159 7.488 -16.981 -10.238 1.00 0.00 O ATOM 2566 CB LEU A 159 8.288 -14.702 -8.003 1.00 0.00 C ATOM 2567 CG LEU A 159 9.270 -13.537 -7.840 1.00 0.00 C ATOM 2568 CD1 LEU A 159 9.684 -13.429 -6.370 1.00 0.00 C ATOM 2569 CD2 LEU A 159 10.517 -13.774 -8.704 1.00 0.00 C ATOM 0 H LEU A 159 6.540 -13.113 -8.832 1.00 0.00 H new ATOM 0 HA LEU A 159 8.567 -14.696 -10.145 1.00 0.00 H new ATOM 0 HB2 LEU A 159 7.467 -14.598 -7.294 1.00 0.00 H new ATOM 0 HB3 LEU A 159 8.788 -15.644 -7.776 1.00 0.00 H new ATOM 0 HG LEU A 159 8.787 -12.613 -8.159 1.00 0.00 H new ATOM 0 HD11 LEU A 159 10.383 -12.601 -6.249 1.00 0.00 H new ATOM 0 HD12 LEU A 159 8.801 -13.252 -5.756 1.00 0.00 H new ATOM 0 HD13 LEU A 159 10.163 -14.357 -6.058 1.00 0.00 H new ATOM 0 HD21 LEU A 159 11.209 -12.941 -8.581 1.00 0.00 H new ATOM 0 HD22 LEU A 159 11.004 -14.698 -8.394 1.00 0.00 H new ATOM 0 HD23 LEU A 159 10.225 -13.852 -9.751 1.00 0.00 H new ATOM 2581 N VAL A 160 5.737 -16.078 -9.157 1.00 0.00 N ATOM 2582 CA VAL A 160 4.917 -17.278 -9.294 1.00 0.00 C ATOM 2583 C VAL A 160 4.471 -17.467 -10.739 1.00 0.00 C ATOM 2584 O VAL A 160 4.166 -18.583 -11.162 1.00 0.00 O ATOM 2585 CB VAL A 160 3.688 -17.184 -8.387 1.00 0.00 C ATOM 2586 CG1 VAL A 160 4.136 -17.013 -6.931 1.00 0.00 C ATOM 2587 CG2 VAL A 160 2.833 -15.984 -8.810 1.00 0.00 C ATOM 0 H VAL A 160 5.286 -15.307 -8.665 1.00 0.00 H new ATOM 0 HA VAL A 160 5.520 -18.136 -8.998 1.00 0.00 H new ATOM 0 HB VAL A 160 3.099 -18.097 -8.476 1.00 0.00 H new ATOM 0 HG11 VAL A 160 3.260 -16.946 -6.286 1.00 0.00 H new ATOM 0 HG12 VAL A 160 4.741 -17.869 -6.633 1.00 0.00 H new ATOM 0 HG13 VAL A 160 4.726 -16.102 -6.837 1.00 0.00 H new ATOM 0 HG21 VAL A 160 1.957 -15.916 -8.165 1.00 0.00 H new ATOM 0 HG22 VAL A 160 3.420 -15.070 -8.722 1.00 0.00 H new ATOM 0 HG23 VAL A 160 2.513 -16.112 -9.844 1.00 0.00 H new ATOM 2597 N VAL A 161 4.454 -16.377 -11.499 1.00 0.00 N ATOM 2598 CA VAL A 161 4.067 -16.452 -12.902 1.00 0.00 C ATOM 2599 C VAL A 161 5.231 -17.009 -13.713 1.00 0.00 C ATOM 2600 O VAL A 161 5.073 -17.948 -14.493 1.00 0.00 O ATOM 2601 CB VAL A 161 3.679 -15.060 -13.416 1.00 0.00 C ATOM 2602 CG1 VAL A 161 3.687 -15.051 -14.948 1.00 0.00 C ATOM 2603 CG2 VAL A 161 2.277 -14.702 -12.912 1.00 0.00 C ATOM 0 H VAL A 161 4.700 -15.443 -11.172 1.00 0.00 H new ATOM 0 HA VAL A 161 3.205 -17.111 -13.008 1.00 0.00 H new ATOM 0 HB VAL A 161 4.398 -14.328 -13.048 1.00 0.00 H new ATOM 0 HG11 VAL A 161 3.411 -14.060 -15.307 1.00 0.00 H new ATOM 0 HG12 VAL A 161 4.685 -15.303 -15.308 1.00 0.00 H new ATOM 0 HG13 VAL A 161 2.971 -15.784 -15.320 1.00 0.00 H new ATOM 0 HG21 VAL A 161 2.001 -13.713 -13.277 1.00 0.00 H new ATOM 0 HG22 VAL A 161 1.560 -15.437 -13.278 1.00 0.00 H new ATOM 0 HG23 VAL A 161 2.271 -14.701 -11.822 1.00 0.00 H new ATOM 2613 N ILE A 162 6.403 -16.410 -13.519 1.00 0.00 N ATOM 2614 CA ILE A 162 7.603 -16.836 -14.230 1.00 0.00 C ATOM 2615 C ILE A 162 7.993 -18.256 -13.833 1.00 0.00 C ATOM 2616 O ILE A 162 8.788 -18.904 -14.515 1.00 0.00 O ATOM 2617 CB ILE A 162 8.759 -15.882 -13.915 1.00 0.00 C ATOM 2618 CG1 ILE A 162 8.417 -14.481 -14.430 1.00 0.00 C ATOM 2619 CG2 ILE A 162 10.034 -16.380 -14.598 1.00 0.00 C ATOM 2620 CD1 ILE A 162 9.350 -13.457 -13.781 1.00 0.00 C ATOM 0 H ILE A 162 6.546 -15.630 -12.877 1.00 0.00 H new ATOM 0 HA ILE A 162 7.393 -16.818 -15.299 1.00 0.00 H new ATOM 0 HB ILE A 162 8.917 -15.845 -12.837 1.00 0.00 H new ATOM 0 HG12 ILE A 162 8.519 -14.446 -15.515 1.00 0.00 H new ATOM 0 HG13 ILE A 162 7.379 -14.241 -14.200 1.00 0.00 H new ATOM 0 HG21 ILE A 162 10.856 -15.701 -14.373 1.00 0.00 H new ATOM 0 HG22 ILE A 162 10.277 -17.377 -14.232 1.00 0.00 H new ATOM 0 HG23 ILE A 162 9.878 -16.417 -15.676 1.00 0.00 H new ATOM 0 HD11 ILE A 162 9.107 -12.460 -14.147 1.00 0.00 H new ATOM 0 HD12 ILE A 162 9.226 -13.486 -12.699 1.00 0.00 H new ATOM 0 HD13 ILE A 162 10.383 -13.695 -14.034 1.00 0.00 H new ATOM 2632 N SER A 163 7.430 -18.736 -12.730 1.00 0.00 N ATOM 2633 CA SER A 163 7.729 -20.083 -12.257 1.00 0.00 C ATOM 2634 C SER A 163 7.508 -21.102 -13.370 1.00 0.00 C ATOM 2635 O SER A 163 7.813 -22.285 -13.212 1.00 0.00 O ATOM 2636 CB SER A 163 6.838 -20.427 -11.063 1.00 0.00 C ATOM 2637 OG SER A 163 5.487 -20.521 -11.498 1.00 0.00 O ATOM 0 H SER A 163 6.769 -18.218 -12.151 1.00 0.00 H new ATOM 0 HA SER A 163 8.775 -20.117 -11.951 1.00 0.00 H new ATOM 0 HB2 SER A 163 7.155 -21.370 -10.617 1.00 0.00 H new ATOM 0 HB3 SER A 163 6.932 -19.662 -10.292 1.00 0.00 H new ATOM 0 HG SER A 163 4.967 -19.786 -11.111 1.00 0.00 H new ATOM 2643 N GLN A 164 6.976 -20.635 -14.496 1.00 0.00 N ATOM 2644 CA GLN A 164 6.716 -21.511 -15.635 1.00 0.00 C ATOM 2645 C GLN A 164 6.974 -20.770 -16.946 1.00 0.00 C ATOM 2646 O GLN A 164 6.045 -20.249 -17.563 1.00 0.00 O ATOM 2647 CB GLN A 164 5.263 -21.987 -15.600 1.00 0.00 C ATOM 2648 CG GLN A 164 5.066 -23.100 -16.632 1.00 0.00 C ATOM 2649 CD GLN A 164 3.617 -23.571 -16.614 1.00 0.00 C ATOM 2650 OE1 GLN A 164 2.752 -22.951 -15.860 1.00 0.00 O flip ATOM 2651 NE2 GLN A 164 3.265 -24.525 -17.305 1.00 0.00 N flip ATOM 0 H GLN A 164 6.717 -19.660 -14.644 1.00 0.00 H new ATOM 0 HA GLN A 164 7.385 -22.369 -15.574 1.00 0.00 H new ATOM 0 HB2 GLN A 164 5.012 -22.352 -14.604 1.00 0.00 H new ATOM 0 HB3 GLN A 164 4.591 -21.155 -15.813 1.00 0.00 H new ATOM 0 HG2 GLN A 164 5.328 -22.737 -17.626 1.00 0.00 H new ATOM 0 HG3 GLN A 164 5.732 -23.934 -16.412 1.00 0.00 H new ATOM 0 HE21 GLN A 164 3.945 -25.007 -17.893 1.00 0.00 H new ATOM 0 HE22 GLN A 164 2.293 -24.834 -17.290 1.00 0.00 H new ATOM 2660 N PRO A 165 8.208 -20.710 -17.378 1.00 0.00 N ATOM 2661 CA PRO A 165 8.578 -20.010 -18.639 1.00 0.00 C ATOM 2662 C PRO A 165 8.237 -20.838 -19.877 1.00 0.00 C ATOM 2663 O PRO A 165 8.843 -20.669 -20.935 1.00 0.00 O ATOM 2664 CB PRO A 165 10.089 -19.808 -18.505 1.00 0.00 C ATOM 2665 CG PRO A 165 10.562 -20.917 -17.620 1.00 0.00 C ATOM 2666 CD PRO A 165 9.384 -21.301 -16.714 1.00 0.00 C ATOM 0 HA PRO A 165 8.031 -19.076 -18.771 1.00 0.00 H new ATOM 0 HB2 PRO A 165 10.578 -19.846 -19.478 1.00 0.00 H new ATOM 0 HB3 PRO A 165 10.318 -18.835 -18.071 1.00 0.00 H new ATOM 0 HG2 PRO A 165 10.887 -21.772 -18.213 1.00 0.00 H new ATOM 0 HG3 PRO A 165 11.418 -20.598 -17.025 1.00 0.00 H new ATOM 0 HD2 PRO A 165 9.288 -22.383 -16.623 1.00 0.00 H new ATOM 0 HD3 PRO A 165 9.512 -20.907 -15.706 1.00 0.00 H new ATOM 2674 N PHE A 166 7.261 -21.729 -19.735 1.00 0.00 N ATOM 2675 CA PHE A 166 6.841 -22.576 -20.846 1.00 0.00 C ATOM 2676 C PHE A 166 8.049 -23.128 -21.598 1.00 0.00 C ATOM 2677 O PHE A 166 7.923 -23.610 -22.723 1.00 0.00 O ATOM 2678 CB PHE A 166 5.968 -21.774 -21.811 1.00 0.00 C ATOM 2679 CG PHE A 166 4.813 -21.162 -21.055 1.00 0.00 C ATOM 2680 CD1 PHE A 166 4.997 -19.974 -20.338 1.00 0.00 C ATOM 2681 CD2 PHE A 166 3.558 -21.781 -21.073 1.00 0.00 C ATOM 2682 CE1 PHE A 166 3.927 -19.405 -19.637 1.00 0.00 C ATOM 2683 CE2 PHE A 166 2.488 -21.212 -20.373 1.00 0.00 C ATOM 2684 CZ PHE A 166 2.671 -20.025 -19.655 1.00 0.00 C ATOM 0 H PHE A 166 6.748 -21.883 -18.867 1.00 0.00 H new ATOM 0 HA PHE A 166 6.270 -23.411 -20.439 1.00 0.00 H new ATOM 0 HB2 PHE A 166 6.559 -20.992 -22.289 1.00 0.00 H new ATOM 0 HB3 PHE A 166 5.595 -22.422 -22.604 1.00 0.00 H new ATOM 0 HD1 PHE A 166 5.965 -19.496 -20.326 1.00 0.00 H new ATOM 0 HD2 PHE A 166 3.415 -22.697 -21.627 1.00 0.00 H new ATOM 0 HE1 PHE A 166 4.070 -18.489 -19.083 1.00 0.00 H new ATOM 0 HE2 PHE A 166 1.520 -21.690 -20.387 1.00 0.00 H new ATOM 0 HZ PHE A 166 1.844 -19.587 -19.115 1.00 0.00 H new ATOM 2694 N LYS A 167 9.220 -23.056 -20.972 1.00 0.00 N ATOM 2695 CA LYS A 167 10.441 -23.554 -21.599 1.00 0.00 C ATOM 2696 C LYS A 167 10.666 -25.020 -21.243 1.00 0.00 C ATOM 2697 O LYS A 167 10.535 -25.415 -20.085 1.00 0.00 O ATOM 2698 CB LYS A 167 11.643 -22.726 -21.139 1.00 0.00 C ATOM 2699 CG LYS A 167 12.859 -23.076 -22.000 1.00 0.00 C ATOM 2700 CD LYS A 167 14.077 -22.285 -21.515 1.00 0.00 C ATOM 2701 CE LYS A 167 15.334 -22.808 -22.212 1.00 0.00 C ATOM 2702 NZ LYS A 167 16.517 -22.022 -21.760 1.00 0.00 N ATOM 0 H LYS A 167 9.350 -22.662 -20.040 1.00 0.00 H new ATOM 0 HA LYS A 167 10.332 -23.465 -22.680 1.00 0.00 H new ATOM 0 HB2 LYS A 167 11.419 -21.662 -21.221 1.00 0.00 H new ATOM 0 HB3 LYS A 167 11.857 -22.927 -20.089 1.00 0.00 H new ATOM 0 HG2 LYS A 167 13.061 -24.146 -21.944 1.00 0.00 H new ATOM 0 HG3 LYS A 167 12.656 -22.845 -23.046 1.00 0.00 H new ATOM 0 HD2 LYS A 167 13.944 -21.224 -21.729 1.00 0.00 H new ATOM 0 HD3 LYS A 167 14.180 -22.382 -20.434 1.00 0.00 H new ATOM 0 HE2 LYS A 167 15.477 -23.864 -21.983 1.00 0.00 H new ATOM 0 HE3 LYS A 167 15.223 -22.728 -23.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 167 17.372 -22.378 -22.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 167 16.380 -21.019 -22.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 167 16.626 -22.120 -20.730 1.00 0.00 H new ATOM 2716 N ALA A 168 11.005 -25.822 -22.248 1.00 0.00 N ATOM 2717 CA ALA A 168 11.246 -27.244 -22.029 1.00 0.00 C ATOM 2718 C ALA A 168 12.104 -27.456 -20.786 1.00 0.00 C ATOM 2719 O ALA A 168 12.879 -26.582 -20.398 1.00 0.00 O ATOM 2720 CB ALA A 168 11.948 -27.848 -23.247 1.00 0.00 C ATOM 0 H ALA A 168 11.118 -25.515 -23.214 1.00 0.00 H new ATOM 0 HA ALA A 168 10.286 -27.739 -21.882 1.00 0.00 H new ATOM 0 HB1 ALA A 168 12.124 -28.910 -23.076 1.00 0.00 H new ATOM 0 HB2 ALA A 168 11.320 -27.722 -24.129 1.00 0.00 H new ATOM 0 HB3 ALA A 168 12.901 -27.343 -23.405 1.00 0.00 H new ATOM 2726 N LYS A 169 11.960 -28.625 -20.166 1.00 0.00 N ATOM 2727 CA LYS A 169 12.728 -28.945 -18.964 1.00 0.00 C ATOM 2728 C LYS A 169 13.202 -30.395 -19.011 1.00 0.00 C ATOM 2729 O LYS A 169 13.498 -30.996 -17.978 1.00 0.00 O ATOM 2730 CB LYS A 169 11.863 -28.715 -17.717 1.00 0.00 C ATOM 2731 CG LYS A 169 12.712 -28.094 -16.603 1.00 0.00 C ATOM 2732 CD LYS A 169 11.897 -28.034 -15.308 1.00 0.00 C ATOM 2733 CE LYS A 169 12.497 -26.981 -14.372 1.00 0.00 C ATOM 2734 NZ LYS A 169 13.983 -27.011 -14.477 1.00 0.00 N ATOM 0 H LYS A 169 11.324 -29.361 -20.472 1.00 0.00 H new ATOM 0 HA LYS A 169 13.601 -28.293 -18.918 1.00 0.00 H new ATOM 0 HB2 LYS A 169 11.028 -28.058 -17.959 1.00 0.00 H new ATOM 0 HB3 LYS A 169 11.438 -29.660 -17.379 1.00 0.00 H new ATOM 0 HG2 LYS A 169 13.615 -28.684 -16.449 1.00 0.00 H new ATOM 0 HG3 LYS A 169 13.031 -27.092 -16.891 1.00 0.00 H new ATOM 0 HD2 LYS A 169 10.859 -27.788 -15.531 1.00 0.00 H new ATOM 0 HD3 LYS A 169 11.896 -29.009 -14.821 1.00 0.00 H new ATOM 0 HE2 LYS A 169 12.123 -25.991 -14.634 1.00 0.00 H new ATOM 0 HE3 LYS A 169 12.190 -27.176 -13.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 169 14.400 -26.581 -13.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 169 14.305 -27.996 -14.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 169 14.283 -26.476 -15.317 1.00 0.00 H new ATOM 2748 N LYS A 170 13.270 -30.946 -20.217 1.00 0.00 N ATOM 2749 CA LYS A 170 13.710 -32.324 -20.396 1.00 0.00 C ATOM 2750 C LYS A 170 15.224 -32.431 -20.217 1.00 0.00 C ATOM 2751 O LYS A 170 15.759 -32.064 -19.171 1.00 0.00 O ATOM 2752 CB LYS A 170 13.310 -32.813 -21.792 1.00 0.00 C ATOM 2753 CG LYS A 170 13.416 -34.341 -21.861 1.00 0.00 C ATOM 2754 CD LYS A 170 13.559 -34.784 -23.320 1.00 0.00 C ATOM 2755 CE LYS A 170 12.283 -34.438 -24.091 1.00 0.00 C ATOM 2756 NZ LYS A 170 12.399 -34.934 -25.491 1.00 0.00 N ATOM 0 H LYS A 170 13.027 -30.462 -21.082 1.00 0.00 H new ATOM 0 HA LYS A 170 13.230 -32.948 -19.643 1.00 0.00 H new ATOM 0 HB2 LYS A 170 12.291 -32.500 -22.018 1.00 0.00 H new ATOM 0 HB3 LYS A 170 13.956 -32.361 -22.544 1.00 0.00 H new ATOM 0 HG2 LYS A 170 14.274 -34.682 -21.282 1.00 0.00 H new ATOM 0 HG3 LYS A 170 12.531 -34.797 -21.418 1.00 0.00 H new ATOM 0 HD2 LYS A 170 14.417 -34.291 -23.777 1.00 0.00 H new ATOM 0 HD3 LYS A 170 13.745 -35.857 -23.368 1.00 0.00 H new ATOM 0 HE2 LYS A 170 11.418 -34.889 -23.605 1.00 0.00 H new ATOM 0 HE3 LYS A 170 12.124 -33.360 -24.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 170 11.532 -34.699 -26.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 170 13.215 -34.484 -25.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 170 12.531 -35.966 -25.484 1.00 0.00 H new ATOM 2770 N ARG A 171 15.909 -32.932 -21.241 1.00 0.00 N ATOM 2771 CA ARG A 171 17.359 -33.077 -21.180 1.00 0.00 C ATOM 2772 C ARG A 171 17.764 -33.919 -19.973 1.00 0.00 C ATOM 2773 O ARG A 171 16.979 -34.726 -19.478 1.00 0.00 O ATOM 2774 CB ARG A 171 18.019 -31.699 -21.089 1.00 0.00 C ATOM 2775 CG ARG A 171 17.503 -30.809 -22.222 1.00 0.00 C ATOM 2776 CD ARG A 171 18.400 -29.576 -22.355 1.00 0.00 C ATOM 2777 NE ARG A 171 19.609 -29.910 -23.101 1.00 0.00 N ATOM 2778 CZ ARG A 171 20.669 -29.109 -23.085 1.00 0.00 C ATOM 2779 NH1 ARG A 171 20.645 -28.006 -22.388 1.00 0.00 N ATOM 2780 NH2 ARG A 171 21.737 -29.426 -23.765 1.00 0.00 N ATOM 0 H ARG A 171 15.487 -33.242 -22.116 1.00 0.00 H new ATOM 0 HA ARG A 171 17.693 -33.580 -22.087 1.00 0.00 H new ATOM 0 HB2 ARG A 171 17.799 -31.242 -20.124 1.00 0.00 H new ATOM 0 HB3 ARG A 171 19.102 -31.798 -21.155 1.00 0.00 H new ATOM 0 HG2 ARG A 171 17.492 -31.366 -23.159 1.00 0.00 H new ATOM 0 HG3 ARG A 171 16.476 -30.504 -22.020 1.00 0.00 H new ATOM 0 HD2 ARG A 171 17.860 -28.777 -22.863 1.00 0.00 H new ATOM 0 HD3 ARG A 171 18.666 -29.202 -21.366 1.00 0.00 H new ATOM 0 HE ARG A 171 19.641 -30.773 -23.644 1.00 0.00 H new ATOM 0 HH11 ARG A 171 19.812 -27.758 -21.855 1.00 0.00 H new ATOM 0 HH12 ARG A 171 21.459 -27.392 -22.377 1.00 0.00 H new ATOM 0 HH21 ARG A 171 21.758 -30.289 -24.309 1.00 0.00 H new ATOM 0 HH22 ARG A 171 22.551 -28.811 -23.753 1.00 0.00 H new ATOM 2794 N ASP A 172 18.993 -33.722 -19.507 1.00 0.00 N ATOM 2795 CA ASP A 172 19.494 -34.468 -18.357 1.00 0.00 C ATOM 2796 C ASP A 172 20.597 -33.688 -17.650 1.00 0.00 C ATOM 2797 O ASP A 172 21.783 -33.937 -17.867 1.00 0.00 O ATOM 2798 CB ASP A 172 20.037 -35.825 -18.809 1.00 0.00 C ATOM 2799 CG ASP A 172 20.242 -36.732 -17.600 1.00 0.00 C ATOM 2800 OD1 ASP A 172 19.290 -37.386 -17.207 1.00 0.00 O ATOM 2801 OD2 ASP A 172 21.348 -36.759 -17.086 1.00 0.00 O ATOM 0 H ASP A 172 19.657 -33.057 -19.904 1.00 0.00 H new ATOM 0 HA ASP A 172 18.669 -34.620 -17.661 1.00 0.00 H new ATOM 0 HB2 ASP A 172 19.342 -36.289 -19.509 1.00 0.00 H new ATOM 0 HB3 ASP A 172 20.981 -35.691 -19.338 1.00 0.00 H new ATOM 2806 N LEU A 173 20.198 -32.743 -16.804 1.00 0.00 N ATOM 2807 CA LEU A 173 21.162 -31.933 -16.070 1.00 0.00 C ATOM 2808 C LEU A 173 21.761 -32.728 -14.915 1.00 0.00 C ATOM 2809 O LEU A 173 22.562 -32.208 -14.139 1.00 0.00 O ATOM 2810 CB LEU A 173 20.480 -30.673 -15.526 1.00 0.00 C ATOM 2811 CG LEU A 173 20.198 -29.696 -16.677 1.00 0.00 C ATOM 2812 CD1 LEU A 173 18.979 -28.836 -16.333 1.00 0.00 C ATOM 2813 CD2 LEU A 173 21.412 -28.785 -16.891 1.00 0.00 C ATOM 0 H LEU A 173 19.221 -32.521 -16.611 1.00 0.00 H new ATOM 0 HA LEU A 173 21.962 -31.647 -16.753 1.00 0.00 H new ATOM 0 HB2 LEU A 173 19.549 -30.939 -15.026 1.00 0.00 H new ATOM 0 HB3 LEU A 173 21.117 -30.197 -14.780 1.00 0.00 H new ATOM 0 HG LEU A 173 20.002 -30.263 -17.587 1.00 0.00 H new ATOM 0 HD11 LEU A 173 18.780 -28.143 -17.151 1.00 0.00 H new ATOM 0 HD12 LEU A 173 18.111 -29.478 -16.182 1.00 0.00 H new ATOM 0 HD13 LEU A 173 19.176 -28.273 -15.421 1.00 0.00 H new ATOM 0 HD21 LEU A 173 21.208 -28.093 -17.708 1.00 0.00 H new ATOM 0 HD22 LEU A 173 21.609 -28.221 -15.979 1.00 0.00 H new ATOM 0 HD23 LEU A 173 22.283 -29.392 -17.138 1.00 0.00 H new ATOM 2825 N PHE A 174 21.365 -33.993 -14.807 1.00 0.00 N ATOM 2826 CA PHE A 174 21.867 -34.854 -13.742 1.00 0.00 C ATOM 2827 C PHE A 174 21.556 -34.257 -12.373 1.00 0.00 C ATOM 2828 O PHE A 174 22.002 -33.156 -12.050 1.00 0.00 O ATOM 2829 CB PHE A 174 23.378 -35.041 -13.889 1.00 0.00 C ATOM 2830 CG PHE A 174 23.695 -35.506 -15.290 1.00 0.00 C ATOM 2831 CD1 PHE A 174 23.695 -36.873 -15.590 1.00 0.00 C ATOM 2832 CD2 PHE A 174 23.990 -34.570 -16.288 1.00 0.00 C ATOM 2833 CE1 PHE A 174 23.989 -37.305 -16.889 1.00 0.00 C ATOM 2834 CE2 PHE A 174 24.284 -35.002 -17.588 1.00 0.00 C ATOM 2835 CZ PHE A 174 24.283 -36.369 -17.888 1.00 0.00 C ATOM 0 H PHE A 174 20.703 -34.442 -15.439 1.00 0.00 H new ATOM 0 HA PHE A 174 21.372 -35.822 -13.822 1.00 0.00 H new ATOM 0 HB2 PHE A 174 23.893 -34.103 -13.681 1.00 0.00 H new ATOM 0 HB3 PHE A 174 23.737 -35.770 -13.163 1.00 0.00 H new ATOM 0 HD1 PHE A 174 23.468 -37.595 -14.819 1.00 0.00 H new ATOM 0 HD2 PHE A 174 23.991 -33.515 -16.056 1.00 0.00 H new ATOM 0 HE1 PHE A 174 23.989 -38.360 -17.120 1.00 0.00 H new ATOM 0 HE2 PHE A 174 24.511 -34.280 -18.358 1.00 0.00 H new ATOM 0 HZ PHE A 174 24.509 -36.702 -18.890 1.00 0.00 H new ATOM 2845 N GLY A 175 20.790 -34.991 -11.574 1.00 0.00 N ATOM 2846 CA GLY A 175 20.426 -34.524 -10.241 1.00 0.00 C ATOM 2847 C GLY A 175 21.591 -34.686 -9.271 1.00 0.00 C ATOM 2848 O GLY A 175 22.754 -34.680 -9.676 1.00 0.00 O ATOM 0 H GLY A 175 20.411 -35.905 -11.823 1.00 0.00 H new ATOM 0 HA2 GLY A 175 20.129 -33.476 -10.287 1.00 0.00 H new ATOM 0 HA3 GLY A 175 19.564 -35.084 -9.878 1.00 0.00 H new ATOM 2852 N ARG A 176 21.273 -34.831 -7.988 1.00 0.00 N ATOM 2853 CA ARG A 176 22.301 -34.994 -6.964 1.00 0.00 C ATOM 2854 C ARG A 176 21.807 -35.912 -5.850 1.00 0.00 C ATOM 2855 O ARG A 176 21.173 -36.934 -6.111 1.00 0.00 O ATOM 2856 CB ARG A 176 22.675 -33.631 -6.378 1.00 0.00 C ATOM 2857 CG ARG A 176 22.849 -32.618 -7.512 1.00 0.00 C ATOM 2858 CD ARG A 176 23.406 -31.311 -6.946 1.00 0.00 C ATOM 2859 NE ARG A 176 23.397 -30.274 -7.972 1.00 0.00 N ATOM 2860 CZ ARG A 176 24.265 -30.294 -8.977 1.00 0.00 C ATOM 2861 NH1 ARG A 176 25.145 -31.253 -9.060 1.00 0.00 N ATOM 2862 NH2 ARG A 176 24.237 -29.355 -9.883 1.00 0.00 N ATOM 0 H ARG A 176 20.317 -34.839 -7.633 1.00 0.00 H new ATOM 0 HA ARG A 176 23.180 -35.444 -7.426 1.00 0.00 H new ATOM 0 HB2 ARG A 176 21.899 -33.294 -5.691 1.00 0.00 H new ATOM 0 HB3 ARG A 176 23.598 -33.711 -5.803 1.00 0.00 H new ATOM 0 HG2 ARG A 176 23.524 -33.016 -8.269 1.00 0.00 H new ATOM 0 HG3 ARG A 176 21.892 -32.436 -8.002 1.00 0.00 H new ATOM 0 HD2 ARG A 176 22.809 -30.993 -6.091 1.00 0.00 H new ATOM 0 HD3 ARG A 176 24.423 -31.467 -6.585 1.00 0.00 H new ATOM 0 HE ARG A 176 22.712 -29.520 -7.917 1.00 0.00 H new ATOM 0 HH11 ARG A 176 25.167 -31.988 -8.353 1.00 0.00 H new ATOM 0 HH12 ARG A 176 25.812 -31.268 -9.832 1.00 0.00 H new ATOM 0 HH21 ARG A 176 23.548 -28.605 -9.819 1.00 0.00 H new ATOM 0 HH22 ARG A 176 24.904 -29.371 -10.655 1.00 0.00 H new ATOM 2876 N GLY A 177 22.103 -35.540 -4.608 1.00 0.00 N ATOM 2877 CA GLY A 177 21.684 -36.339 -3.462 1.00 0.00 C ATOM 2878 C GLY A 177 22.277 -35.790 -2.169 1.00 0.00 C ATOM 2879 O GLY A 177 22.041 -34.638 -1.807 1.00 0.00 O ATOM 0 H GLY A 177 22.627 -34.698 -4.371 1.00 0.00 H new ATOM 0 HA2 GLY A 177 20.596 -36.343 -3.395 1.00 0.00 H new ATOM 0 HA3 GLY A 177 21.999 -37.373 -3.600 1.00 0.00 H new ATOM 2883 N HIS A 178 23.047 -36.623 -1.475 1.00 0.00 N ATOM 2884 CA HIS A 178 23.668 -36.210 -0.222 1.00 0.00 C ATOM 2885 C HIS A 178 24.894 -37.067 0.075 1.00 0.00 C ATOM 2886 O HIS A 178 24.890 -38.275 -0.161 1.00 0.00 O ATOM 2887 CB HIS A 178 22.665 -36.337 0.925 1.00 0.00 C ATOM 2888 CG HIS A 178 21.604 -35.279 0.784 1.00 0.00 C ATOM 2889 ND1 HIS A 178 20.339 -35.563 0.294 1.00 0.00 N ATOM 2890 CD2 HIS A 178 21.605 -33.936 1.065 1.00 0.00 C ATOM 2891 CE1 HIS A 178 19.637 -34.414 0.294 1.00 0.00 C ATOM 2892 NE2 HIS A 178 20.362 -33.392 0.755 1.00 0.00 N ATOM 0 H HIS A 178 23.254 -37.581 -1.757 1.00 0.00 H new ATOM 0 HA HIS A 178 23.979 -35.170 -0.318 1.00 0.00 H new ATOM 0 HB2 HIS A 178 22.210 -37.327 0.916 1.00 0.00 H new ATOM 0 HB3 HIS A 178 23.175 -36.230 1.882 1.00 0.00 H new ATOM 0 HD2 HIS A 178 22.443 -33.385 1.466 1.00 0.00 H new ATOM 0 HE1 HIS A 178 18.613 -34.329 -0.038 1.00 0.00 H new ATOM 0 HE2 HIS A 178 20.068 -32.421 0.858 1.00 0.00 H new ATOM 2901 N HIS A 179 25.942 -36.434 0.595 1.00 0.00 N ATOM 2902 CA HIS A 179 27.174 -37.147 0.922 1.00 0.00 C ATOM 2903 C HIS A 179 27.278 -37.373 2.428 1.00 0.00 C ATOM 2904 O HIS A 179 28.175 -36.844 3.084 1.00 0.00 O ATOM 2905 CB HIS A 179 28.383 -36.343 0.443 1.00 0.00 C ATOM 2906 CG HIS A 179 28.385 -36.290 -1.060 1.00 0.00 C ATOM 2907 ND1 HIS A 179 27.278 -35.882 -1.788 1.00 0.00 N ATOM 2908 CD2 HIS A 179 29.353 -36.591 -1.987 1.00 0.00 C ATOM 2909 CE1 HIS A 179 27.602 -35.948 -3.092 1.00 0.00 C ATOM 2910 NE2 HIS A 179 28.855 -36.375 -3.269 1.00 0.00 N ATOM 0 H HIS A 179 25.964 -35.435 0.798 1.00 0.00 H new ATOM 0 HA HIS A 179 27.157 -38.114 0.420 1.00 0.00 H new ATOM 0 HB2 HIS A 179 28.348 -35.334 0.853 1.00 0.00 H new ATOM 0 HB3 HIS A 179 29.304 -36.802 0.803 1.00 0.00 H new ATOM 0 HD2 HIS A 179 30.348 -36.942 -1.757 1.00 0.00 H new ATOM 0 HE1 HIS A 179 26.931 -35.688 -3.897 1.00 0.00 H new ATOM 0 HE2 HIS A 179 29.343 -36.513 -4.154 1.00 0.00 H new ATOM 2919 N HIS A 180 26.355 -38.163 2.969 1.00 0.00 N ATOM 2920 CA HIS A 180 26.351 -38.453 4.399 1.00 0.00 C ATOM 2921 C HIS A 180 27.219 -39.670 4.703 1.00 0.00 C ATOM 2922 O HIS A 180 26.941 -40.775 4.239 1.00 0.00 O ATOM 2923 CB HIS A 180 24.920 -38.714 4.873 1.00 0.00 C ATOM 2924 CG HIS A 180 24.406 -39.983 4.248 1.00 0.00 C ATOM 2925 ND1 HIS A 180 24.795 -40.393 2.983 1.00 0.00 N ATOM 2926 CD2 HIS A 180 23.533 -40.940 4.702 1.00 0.00 C ATOM 2927 CE1 HIS A 180 24.164 -41.552 2.721 1.00 0.00 C ATOM 2928 NE2 HIS A 180 23.382 -41.931 3.735 1.00 0.00 N ATOM 0 H HIS A 180 25.605 -38.611 2.443 1.00 0.00 H new ATOM 0 HA HIS A 180 26.758 -37.591 4.927 1.00 0.00 H new ATOM 0 HB2 HIS A 180 24.895 -38.796 5.960 1.00 0.00 H new ATOM 0 HB3 HIS A 180 24.277 -37.876 4.601 1.00 0.00 H new ATOM 0 HD2 HIS A 180 23.039 -40.927 5.662 1.00 0.00 H new ATOM 0 HE1 HIS A 180 24.276 -42.108 1.802 1.00 0.00 H new ATOM 0 HE2 HIS A 180 22.799 -42.766 3.790 1.00 0.00 H new ATOM 2937 N HIS A 181 28.272 -39.459 5.488 1.00 0.00 N ATOM 2938 CA HIS A 181 29.178 -40.546 5.853 1.00 0.00 C ATOM 2939 C HIS A 181 28.885 -41.031 7.269 1.00 0.00 C ATOM 2940 O HIS A 181 27.920 -41.759 7.500 1.00 0.00 O ATOM 2941 CB HIS A 181 30.629 -40.067 5.761 1.00 0.00 C ATOM 2942 CG HIS A 181 30.741 -38.688 6.349 1.00 0.00 C ATOM 2943 ND1 HIS A 181 29.916 -38.250 7.373 1.00 0.00 N ATOM 2944 CD2 HIS A 181 31.575 -37.636 6.064 1.00 0.00 C ATOM 2945 CE1 HIS A 181 30.269 -36.985 7.665 1.00 0.00 C ATOM 2946 NE2 HIS A 181 31.276 -36.563 6.896 1.00 0.00 N ATOM 0 H HIS A 181 28.519 -38.551 5.882 1.00 0.00 H new ATOM 0 HA HIS A 181 29.026 -41.374 5.160 1.00 0.00 H new ATOM 0 HB2 HIS A 181 31.285 -40.755 6.294 1.00 0.00 H new ATOM 0 HB3 HIS A 181 30.955 -40.058 4.721 1.00 0.00 H new ATOM 0 HD2 HIS A 181 32.346 -37.641 5.308 1.00 0.00 H new ATOM 0 HE1 HIS A 181 29.796 -36.384 8.428 1.00 0.00 H new ATOM 0 HE2 HIS A 181 31.729 -35.649 6.915 1.00 0.00 H new ATOM 2955 N HIS A 182 29.725 -40.621 8.215 1.00 0.00 N ATOM 2956 CA HIS A 182 29.551 -41.018 9.610 1.00 0.00 C ATOM 2957 C HIS A 182 28.970 -39.867 10.426 1.00 0.00 C ATOM 2958 O HIS A 182 29.425 -38.727 10.318 1.00 0.00 O ATOM 2959 CB HIS A 182 30.897 -41.437 10.204 1.00 0.00 C ATOM 2960 CG HIS A 182 31.323 -42.750 9.610 1.00 0.00 C ATOM 2961 ND1 HIS A 182 30.453 -43.550 8.885 1.00 0.00 N ATOM 2962 CD2 HIS A 182 32.523 -43.418 9.624 1.00 0.00 C ATOM 2963 CE1 HIS A 182 31.137 -44.643 8.497 1.00 0.00 C ATOM 2964 NE2 HIS A 182 32.404 -44.612 8.922 1.00 0.00 N ATOM 0 H HIS A 182 30.529 -40.017 8.043 1.00 0.00 H new ATOM 0 HA HIS A 182 28.859 -41.860 9.646 1.00 0.00 H new ATOM 0 HB2 HIS A 182 31.649 -40.674 10.002 1.00 0.00 H new ATOM 0 HB3 HIS A 182 30.816 -41.526 11.287 1.00 0.00 H new ATOM 0 HD2 HIS A 182 33.423 -43.068 10.107 1.00 0.00 H new ATOM 0 HE1 HIS A 182 30.713 -45.447 7.913 1.00 0.00 H new ATOM 0 HE2 HIS A 182 33.128 -45.313 8.765 1.00 0.00 H new ATOM 2973 N HIS A 183 27.967 -40.172 11.241 1.00 0.00 N ATOM 2974 CA HIS A 183 27.332 -39.154 12.071 1.00 0.00 C ATOM 2975 C HIS A 183 28.167 -38.885 13.320 1.00 0.00 C ATOM 2976 O HIS A 183 29.236 -38.317 13.182 1.00 0.00 O ATOM 2977 CB HIS A 183 25.931 -39.613 12.481 1.00 0.00 C ATOM 2978 CG HIS A 183 25.996 -41.024 12.998 1.00 0.00 C ATOM 2979 ND1 HIS A 183 27.067 -41.489 13.744 1.00 0.00 N ATOM 2980 CD2 HIS A 183 25.130 -42.083 12.883 1.00 0.00 C ATOM 2981 CE1 HIS A 183 26.820 -42.777 14.048 1.00 0.00 C ATOM 2982 NE2 HIS A 183 25.652 -43.189 13.548 1.00 0.00 N ATOM 2983 OXT HIS A 183 27.724 -39.253 14.395 1.00 0.00 O ATOM 0 H HIS A 183 27.578 -41.109 11.345 1.00 0.00 H new ATOM 0 HA HIS A 183 27.257 -38.234 11.492 1.00 0.00 H new ATOM 0 HB2 HIS A 183 25.530 -38.951 13.249 1.00 0.00 H new ATOM 0 HB3 HIS A 183 25.255 -39.558 11.628 1.00 0.00 H new ATOM 0 HD1 HIS A 183 27.892 -40.953 14.014 1.00 0.00 H new ATOM 0 HD2 HIS A 183 24.187 -42.061 12.357 1.00 0.00 H new ATOM 0 HE1 HIS A 183 27.485 -43.401 14.626 1.00 0.00 H new TER 2992 HIS A 183 HETATM 2993 C1 UQ2 A 201 -8.373 5.116 5.698 1.00 20.00 C HETATM 2994 C2 UQ2 A 201 -8.167 6.092 6.785 1.00 20.00 C HETATM 2995 C3 UQ2 A 201 -7.078 6.880 6.786 1.00 20.00 C HETATM 2996 C4 UQ2 A 201 -6.087 6.771 5.699 1.00 20.00 C HETATM 2997 C5 UQ2 A 201 -6.286 5.795 4.606 1.00 20.00 C HETATM 2998 C6 UQ2 A 201 -7.385 4.999 4.605 1.00 20.00 C HETATM 2999 CM2 UQ2 A 201 -8.633 5.340 8.856 1.00 20.00 C HETATM 3000 CM3 UQ2 A 201 -7.848 8.836 7.605 1.00 20.00 C HETATM 3001 CM5 UQ2 A 201 -5.255 5.700 3.507 1.00 20.00 C HETATM 3002 C7 UQ2 A 201 -7.620 3.985 3.507 1.00 20.00 C HETATM 3003 C8 UQ2 A 201 -7.615 2.601 4.111 1.00 20.00 C HETATM 3004 C9 UQ2 A 201 -7.059 1.588 3.481 1.00 20.00 C HETATM 3005 C10 UQ2 A 201 -6.410 1.786 2.132 1.00 20.00 C HETATM 3006 C11 UQ2 A 201 -7.074 0.220 4.118 1.00 20.00 C HETATM 3007 C12 UQ2 A 201 -6.217 0.233 5.388 1.00 20.00 C HETATM 3008 C13 UQ2 A 201 -4.775 -0.007 5.027 1.00 20.00 C HETATM 3009 C14 UQ2 A 201 -3.855 -0.041 5.962 1.00 20.00 C HETATM 3010 C15 UQ2 A 201 -2.413 -0.281 5.594 1.00 20.00 C HETATM 3011 C16 UQ2 A 201 -4.237 0.156 7.409 1.00 20.00 C HETATM 3012 O1 UQ2 A 201 -9.359 4.405 5.701 1.00 20.00 O HETATM 3013 O2 UQ2 A 201 -9.079 6.193 7.790 1.00 20.00 O HETATM 3014 O3 UQ2 A 201 -6.891 7.781 7.789 1.00 20.00 O HETATM 3015 O4 UQ2 A 201 -5.103 7.484 5.702 1.00 20.00 O HETATM 0 H5M3 UQ2 A 201 -5.174 6.662 3.000 1.00 20.00 H new HETATM 0 H5M2 UQ2 A 201 -4.289 5.433 3.936 1.00 20.00 H new HETATM 0 H5M1 UQ2 A 201 -5.557 4.936 2.790 1.00 20.00 H new HETATM 0 H3M3 UQ2 A 201 -7.688 9.307 6.635 1.00 20.00 H new HETATM 0 H3M2 UQ2 A 201 -8.856 8.424 7.646 1.00 20.00 H new HETATM 0 H3M1 UQ2 A 201 -7.727 9.579 8.394 1.00 20.00 H new HETATM 0 H2M3 UQ2 A 201 -8.570 4.313 8.498 1.00 20.00 H new HETATM 0 H2M2 UQ2 A 201 -7.650 5.666 9.196 1.00 20.00 H new HETATM 0 H2M1 UQ2 A 201 -9.340 5.393 9.684 1.00 20.00 H new HETATM 0 H163 UQ2 A 201 -4.700 1.135 7.533 1.00 20.00 H new HETATM 0 H162 UQ2 A 201 -4.942 -0.619 7.708 1.00 20.00 H new HETATM 0 H161 UQ2 A 201 -3.345 0.095 8.032 1.00 20.00 H new HETATM 0 H153 UQ2 A 201 -2.320 -1.248 5.099 1.00 20.00 H new HETATM 0 H152 UQ2 A 201 -2.074 0.506 4.920 1.00 20.00 H new HETATM 0 H151 UQ2 A 201 -1.801 -0.275 6.496 1.00 20.00 H new HETATM 0 H122 UQ2 A 201 -6.320 1.191 5.899 1.00 20.00 H new HETATM 0 H121 UQ2 A 201 -6.562 -0.536 6.080 1.00 20.00 H new HETATM 0 H112 UQ2 A 201 -8.097 -0.068 4.361 1.00 20.00 H new HETATM 0 H111 UQ2 A 201 -6.692 -0.522 3.417 1.00 20.00 H new HETATM 0 H103 UQ2 A 201 -7.151 2.155 1.423 1.00 20.00 H new HETATM 0 H102 UQ2 A 201 -5.600 2.510 2.221 1.00 20.00 H new HETATM 0 H101 UQ2 A 201 -6.010 0.836 1.778 1.00 20.00 H new HETATM 0 H8 UQ2 A 201 -8.079 2.438 5.084 1.00 20.00 H new HETATM 0 H72 UQ2 A 201 -8.573 4.178 3.013 1.00 20.00 H new HETATM 0 H71 UQ2 A 201 -6.844 4.067 2.746 1.00 20.00 H new HETATM 0 H13 UQ2 A 201 -4.494 -0.153 3.984 1.00 20.00 H new