USER MOD reduce.3.24.130724 H: found=0, std=0, add=1535, rem=0, adj=31 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 181 HIS : no HD1:sc= -3.63! C(o=-5.1!,f=-9!) USER MOD Set 1.2: A 182 HIS : no HD1:sc= -1.51 K(o=-5.1,f=-11!) USER MOD Set 2.1: A 6 ASN :FLIP amide:sc= -0.375 F(o=-5.4,f=-0.85) USER MOD Set 2.2: A 10 GLN :FLIP amide:sc= -0.475 F(o=-3.1!,f=-0.85) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 154:sc= 0.661 (180deg=-1.77!) USER MOD Single : A 7 GLN : amide:sc= -0.299 X(o=-0.3,f=-0.13) USER MOD Single : A 9 SER OG : rot 180:sc=-0.00688 USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 21 THR OG1 : rot 84:sc= 1.18 USER MOD Single : A 28 THR OG1 : rot -83:sc= 0.386 USER MOD Single : A 33 GLN :FLIP amide:sc= -0.268 F(o=-1.1,f=-0.27) USER MOD Single : A 34 HIS : no HE2:sc= -1.28! C(o=-1.3!,f=-5.1!) USER MOD Single : A 36 MET CE :methyl 178:sc= 0 (180deg=-0.00377) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0.0172 USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ -106:sc= -0.458 (180deg=-1.65!) USER MOD Single : A 67 THR OG1 : rot 180:sc= -0.628 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 MET CE :methyl 180:sc=-0.00148 (180deg=-0.00148) USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 9:sc= 0.588 USER MOD Single : A 86 GLN : amide:sc= 0 X(o=0,f=-0.008) USER MOD Single : A 88 THR OG1 : rot 111:sc= -1.13 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 HIS : no HD1:sc= -5.95! C(o=-5.9!,f=-5.7!) USER MOD Single : A 92 THR OG1 : rot -41:sc= 0.181 USER MOD Single : A 93 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN :FLIP amide:sc= -2.38! C(o=-3.2!,f=-2.4!) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 57:sc= -0.708 USER MOD Single : A 103 THR OG1 : rot 180:sc= -0.0733 USER MOD Single : A 104 SER OG : rot -13:sc= 0.58 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= -0.0215 X(o=-0.021,f=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 134 GLN : amide:sc= -3.1 K(o=-3.1,f=-4.7!) USER MOD Single : A 142 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 144 GLN : amide:sc= -0.4 X(o=-0.4,f=-0.87) USER MOD Single : A 153 TYR OH : rot 166:sc= 0.32 USER MOD Single : A 163 SER OG : rot 103:sc= 0.848 USER MOD Single : A 164 GLN : amide:sc= -4.9! C(o=-4.9!,f=-7.1!) USER MOD Single : A 167 LYS NZ :NH3+ -179:sc= -7.05! (180deg=-7.15!) USER MOD Single : A 169 LYS NZ :NH3+ 164:sc=-0.00551 (180deg=-0.222) USER MOD Single : A 170 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.183) USER MOD Single : A 178 HIS : no HD1:sc= -0.134 X(o=-0.13,f=0) USER MOD Single : A 179 HIS : no HD1:sc= 0 X(o=0,f=-0.035) USER MOD Single : A 180 HIS : no HD1:sc= -2.65! C(o=-2.7!,f=-4.5!) USER MOD Single : A 183 HIS :FLIP no HD1:sc= -1.47! C(o=-2.3!,f=-1.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 14.449 -23.780 -0.668 1.00 0.00 N ATOM 2 CA MET A 1 14.162 -22.344 -0.389 1.00 0.00 C ATOM 3 C MET A 1 13.112 -21.838 -1.375 1.00 0.00 C ATOM 4 O MET A 1 11.914 -21.890 -1.101 1.00 0.00 O ATOM 5 CB MET A 1 15.455 -21.530 -0.528 1.00 0.00 C ATOM 6 CG MET A 1 16.378 -22.197 -1.552 1.00 0.00 C ATOM 7 SD MET A 1 17.307 -23.527 -0.750 1.00 0.00 S ATOM 8 CE MET A 1 18.680 -22.514 -0.146 1.00 0.00 C ATOM 0 H1 MET A 1 15.410 -24.011 -0.345 1.00 0.00 H new ATOM 0 H2 MET A 1 13.762 -24.376 -0.164 1.00 0.00 H new ATOM 0 H3 MET A 1 14.376 -23.956 -1.690 1.00 0.00 H new ATOM 0 HA MET A 1 13.780 -22.233 0.626 1.00 0.00 H new ATOM 0 HB2 MET A 1 15.223 -20.512 -0.842 1.00 0.00 H new ATOM 0 HB3 MET A 1 15.957 -21.460 0.437 1.00 0.00 H new ATOM 0 HG2 MET A 1 15.792 -22.596 -2.380 1.00 0.00 H new ATOM 0 HG3 MET A 1 17.064 -21.462 -1.972 1.00 0.00 H new ATOM 0 HE1 MET A 1 19.389 -23.145 0.391 1.00 0.00 H new ATOM 0 HE2 MET A 1 19.182 -22.041 -0.990 1.00 0.00 H new ATOM 0 HE3 MET A 1 18.297 -21.745 0.525 1.00 0.00 H new ATOM 20 N LEU A 2 13.570 -21.354 -2.526 1.00 0.00 N ATOM 21 CA LEU A 2 12.656 -20.848 -3.545 1.00 0.00 C ATOM 22 C LEU A 2 11.750 -21.969 -4.041 1.00 0.00 C ATOM 23 O LEU A 2 10.527 -21.827 -4.071 1.00 0.00 O ATOM 24 CB LEU A 2 13.450 -20.268 -4.721 1.00 0.00 C ATOM 25 CG LEU A 2 12.531 -19.399 -5.591 1.00 0.00 C ATOM 26 CD1 LEU A 2 12.467 -17.977 -5.023 1.00 0.00 C ATOM 27 CD2 LEU A 2 13.084 -19.345 -7.019 1.00 0.00 C ATOM 0 H LEU A 2 14.558 -21.302 -2.775 1.00 0.00 H new ATOM 0 HA LEU A 2 12.042 -20.062 -3.105 1.00 0.00 H new ATOM 0 HB2 LEU A 2 14.284 -19.673 -4.350 1.00 0.00 H new ATOM 0 HB3 LEU A 2 13.875 -21.075 -5.318 1.00 0.00 H new ATOM 0 HG LEU A 2 11.531 -19.832 -5.597 1.00 0.00 H new ATOM 0 HD11 LEU A 2 11.813 -17.366 -5.645 1.00 0.00 H new ATOM 0 HD12 LEU A 2 12.075 -18.009 -4.006 1.00 0.00 H new ATOM 0 HD13 LEU A 2 13.467 -17.544 -5.013 1.00 0.00 H new ATOM 0 HD21 LEU A 2 12.433 -18.728 -7.638 1.00 0.00 H new ATOM 0 HD22 LEU A 2 14.085 -18.915 -7.005 1.00 0.00 H new ATOM 0 HD23 LEU A 2 13.128 -20.353 -7.431 1.00 0.00 H new ATOM 39 N ARG A 3 12.360 -23.087 -4.423 1.00 0.00 N ATOM 40 CA ARG A 3 11.598 -24.230 -4.908 1.00 0.00 C ATOM 41 C ARG A 3 10.441 -24.528 -3.961 1.00 0.00 C ATOM 42 O ARG A 3 9.363 -24.940 -4.391 1.00 0.00 O ATOM 43 CB ARG A 3 12.506 -25.456 -5.018 1.00 0.00 C ATOM 44 CG ARG A 3 13.193 -25.710 -3.674 1.00 0.00 C ATOM 45 CD ARG A 3 14.283 -26.768 -3.852 1.00 0.00 C ATOM 46 NE ARG A 3 15.072 -26.890 -2.631 1.00 0.00 N ATOM 47 CZ ARG A 3 16.315 -27.361 -2.660 1.00 0.00 C ATOM 48 NH1 ARG A 3 16.850 -27.720 -3.795 1.00 0.00 N ATOM 49 NH2 ARG A 3 16.999 -27.465 -1.554 1.00 0.00 N ATOM 0 H ARG A 3 13.371 -23.224 -4.406 1.00 0.00 H new ATOM 0 HA ARG A 3 11.198 -23.993 -5.894 1.00 0.00 H new ATOM 0 HB2 ARG A 3 11.922 -26.329 -5.309 1.00 0.00 H new ATOM 0 HB3 ARG A 3 13.253 -25.299 -5.796 1.00 0.00 H new ATOM 0 HG2 ARG A 3 13.627 -24.785 -3.295 1.00 0.00 H new ATOM 0 HG3 ARG A 3 12.463 -26.045 -2.937 1.00 0.00 H new ATOM 0 HD2 ARG A 3 13.831 -27.729 -4.099 1.00 0.00 H new ATOM 0 HD3 ARG A 3 14.930 -26.497 -4.686 1.00 0.00 H new ATOM 0 HE ARG A 3 14.663 -26.609 -1.740 1.00 0.00 H new ATOM 0 HH11 ARG A 3 16.315 -27.639 -4.659 1.00 0.00 H new ATOM 0 HH12 ARG A 3 17.804 -28.081 -3.818 1.00 0.00 H new ATOM 0 HH21 ARG A 3 16.580 -27.185 -0.667 1.00 0.00 H new ATOM 0 HH22 ARG A 3 17.953 -27.826 -1.576 1.00 0.00 H new ATOM 63 N PHE A 4 10.673 -24.309 -2.671 1.00 0.00 N ATOM 64 CA PHE A 4 9.643 -24.547 -1.668 1.00 0.00 C ATOM 65 C PHE A 4 8.542 -23.500 -1.793 1.00 0.00 C ATOM 66 O PHE A 4 7.359 -23.804 -1.637 1.00 0.00 O ATOM 67 CB PHE A 4 10.255 -24.489 -0.265 1.00 0.00 C ATOM 68 CG PHE A 4 9.331 -25.165 0.720 1.00 0.00 C ATOM 69 CD1 PHE A 4 9.236 -26.562 0.745 1.00 0.00 C ATOM 70 CD2 PHE A 4 8.571 -24.396 1.610 1.00 0.00 C ATOM 71 CE1 PHE A 4 8.381 -27.190 1.659 1.00 0.00 C ATOM 72 CE2 PHE A 4 7.715 -25.024 2.523 1.00 0.00 C ATOM 73 CZ PHE A 4 7.620 -26.420 2.549 1.00 0.00 C ATOM 0 H PHE A 4 11.559 -23.969 -2.298 1.00 0.00 H new ATOM 0 HA PHE A 4 9.215 -25.536 -1.830 1.00 0.00 H new ATOM 0 HB2 PHE A 4 11.228 -24.980 -0.261 1.00 0.00 H new ATOM 0 HB3 PHE A 4 10.420 -23.452 0.028 1.00 0.00 H new ATOM 0 HD1 PHE A 4 9.822 -27.155 0.059 1.00 0.00 H new ATOM 0 HD2 PHE A 4 8.645 -23.319 1.592 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.308 -28.267 1.678 1.00 0.00 H new ATOM 0 HE2 PHE A 4 7.128 -24.430 3.208 1.00 0.00 H new ATOM 0 HZ PHE A 4 6.961 -26.904 3.254 1.00 0.00 H new ATOM 83 N LEU A 5 8.943 -22.265 -2.082 1.00 0.00 N ATOM 84 CA LEU A 5 7.988 -21.175 -2.234 1.00 0.00 C ATOM 85 C LEU A 5 6.880 -21.576 -3.202 1.00 0.00 C ATOM 86 O LEU A 5 5.708 -21.273 -2.981 1.00 0.00 O ATOM 87 CB LEU A 5 8.704 -19.925 -2.756 1.00 0.00 C ATOM 88 CG LEU A 5 7.833 -18.683 -2.516 1.00 0.00 C ATOM 89 CD1 LEU A 5 8.062 -18.149 -1.098 1.00 0.00 C ATOM 90 CD2 LEU A 5 8.207 -17.595 -3.529 1.00 0.00 C ATOM 0 H LEU A 5 9.918 -21.996 -2.215 1.00 0.00 H new ATOM 0 HA LEU A 5 7.546 -20.957 -1.262 1.00 0.00 H new ATOM 0 HB2 LEU A 5 9.664 -19.809 -2.253 1.00 0.00 H new ATOM 0 HB3 LEU A 5 8.913 -20.033 -3.820 1.00 0.00 H new ATOM 0 HG LEU A 5 6.784 -18.955 -2.634 1.00 0.00 H new ATOM 0 HD11 LEU A 5 7.441 -17.268 -0.936 1.00 0.00 H new ATOM 0 HD12 LEU A 5 7.797 -18.918 -0.372 1.00 0.00 H new ATOM 0 HD13 LEU A 5 9.111 -17.880 -0.975 1.00 0.00 H new ATOM 0 HD21 LEU A 5 7.590 -16.713 -3.360 1.00 0.00 H new ATOM 0 HD22 LEU A 5 9.258 -17.331 -3.408 1.00 0.00 H new ATOM 0 HD23 LEU A 5 8.040 -17.966 -4.540 1.00 0.00 H new ATOM 102 N ASN A 6 7.262 -22.266 -4.272 1.00 0.00 N ATOM 103 CA ASN A 6 6.291 -22.713 -5.265 1.00 0.00 C ATOM 104 C ASN A 6 5.362 -23.755 -4.654 1.00 0.00 C ATOM 105 O ASN A 6 4.206 -23.886 -5.053 1.00 0.00 O ATOM 106 CB ASN A 6 7.013 -23.313 -6.473 1.00 0.00 C ATOM 107 CG ASN A 6 5.999 -23.713 -7.539 1.00 0.00 C ATOM 108 OD1 ASN A 6 5.984 -24.940 -7.984 1.00 0.00 O flip ATOM 109 ND2 ASN A 6 5.199 -22.887 -7.977 1.00 0.00 N flip ATOM 0 H ASN A 6 8.228 -22.526 -4.473 1.00 0.00 H new ATOM 0 HA ASN A 6 5.703 -21.855 -5.590 1.00 0.00 H new ATOM 0 HB2 ASN A 6 7.718 -22.589 -6.883 1.00 0.00 H new ATOM 0 HB3 ASN A 6 7.593 -24.183 -6.166 1.00 0.00 H new ATOM 0 HD21 ASN A 6 5.213 -21.929 -7.628 1.00 0.00 H new ATOM 0 HD22 ASN A 6 4.522 -23.161 -8.689 1.00 0.00 H new ATOM 116 N GLN A 7 5.885 -24.495 -3.683 1.00 0.00 N ATOM 117 CA GLN A 7 5.105 -25.530 -3.018 1.00 0.00 C ATOM 118 C GLN A 7 4.100 -24.906 -2.056 1.00 0.00 C ATOM 119 O GLN A 7 2.916 -25.241 -2.076 1.00 0.00 O ATOM 120 CB GLN A 7 6.033 -26.472 -2.248 1.00 0.00 C ATOM 121 CG GLN A 7 5.273 -27.746 -1.874 1.00 0.00 C ATOM 122 CD GLN A 7 5.066 -28.612 -3.112 1.00 0.00 C ATOM 123 OE1 GLN A 7 3.942 -29.022 -3.403 1.00 0.00 O ATOM 124 NE2 GLN A 7 6.089 -28.916 -3.863 1.00 0.00 N ATOM 0 H GLN A 7 6.841 -24.398 -3.341 1.00 0.00 H new ATOM 0 HA GLN A 7 4.564 -26.095 -3.777 1.00 0.00 H new ATOM 0 HB2 GLN A 7 6.903 -26.720 -2.857 1.00 0.00 H new ATOM 0 HB3 GLN A 7 6.403 -25.980 -1.349 1.00 0.00 H new ATOM 0 HG2 GLN A 7 5.829 -28.303 -1.119 1.00 0.00 H new ATOM 0 HG3 GLN A 7 4.309 -27.489 -1.435 1.00 0.00 H new ATOM 0 HE21 GLN A 7 7.019 -28.575 -3.620 1.00 0.00 H new ATOM 0 HE22 GLN A 7 5.958 -29.494 -4.693 1.00 0.00 H new ATOM 133 N ALA A 8 4.584 -24.002 -1.213 1.00 0.00 N ATOM 134 CA ALA A 8 3.721 -23.339 -0.243 1.00 0.00 C ATOM 135 C ALA A 8 2.698 -22.450 -0.946 1.00 0.00 C ATOM 136 O ALA A 8 1.565 -22.309 -0.486 1.00 0.00 O ATOM 137 CB ALA A 8 4.566 -22.492 0.711 1.00 0.00 C ATOM 0 H ALA A 8 5.562 -23.713 -1.181 1.00 0.00 H new ATOM 0 HA ALA A 8 3.188 -24.104 0.322 1.00 0.00 H new ATOM 0 HB1 ALA A 8 3.915 -21.999 1.433 1.00 0.00 H new ATOM 0 HB2 ALA A 8 5.273 -23.133 1.238 1.00 0.00 H new ATOM 0 HB3 ALA A 8 5.113 -21.740 0.142 1.00 0.00 H new ATOM 143 N SER A 9 3.103 -21.850 -2.060 1.00 0.00 N ATOM 144 CA SER A 9 2.209 -20.973 -2.805 1.00 0.00 C ATOM 145 C SER A 9 1.182 -21.787 -3.581 1.00 0.00 C ATOM 146 O SER A 9 0.039 -21.365 -3.743 1.00 0.00 O ATOM 147 CB SER A 9 3.013 -20.107 -3.774 1.00 0.00 C ATOM 148 OG SER A 9 3.447 -20.906 -4.867 1.00 0.00 O ATOM 0 H SER A 9 4.034 -21.953 -2.463 1.00 0.00 H new ATOM 0 HA SER A 9 1.686 -20.333 -2.094 1.00 0.00 H new ATOM 0 HB2 SER A 9 2.402 -19.279 -4.134 1.00 0.00 H new ATOM 0 HB3 SER A 9 3.872 -19.671 -3.264 1.00 0.00 H new ATOM 0 HG SER A 9 3.962 -20.354 -5.492 1.00 0.00 H new ATOM 154 N GLN A 10 1.593 -22.958 -4.052 1.00 0.00 N ATOM 155 CA GLN A 10 0.689 -23.819 -4.801 1.00 0.00 C ATOM 156 C GLN A 10 -0.299 -24.495 -3.855 1.00 0.00 C ATOM 157 O GLN A 10 -0.975 -25.455 -4.225 1.00 0.00 O ATOM 158 CB GLN A 10 1.485 -24.882 -5.564 1.00 0.00 C ATOM 159 CG GLN A 10 2.058 -24.272 -6.847 1.00 0.00 C ATOM 160 CD GLN A 10 3.057 -25.232 -7.484 1.00 0.00 C ATOM 161 OE1 GLN A 10 3.800 -25.989 -6.724 1.00 0.00 O flip ATOM 162 NE2 GLN A 10 3.164 -25.294 -8.708 1.00 0.00 N flip ATOM 0 H GLN A 10 2.535 -23.329 -3.930 1.00 0.00 H new ATOM 0 HA GLN A 10 0.136 -23.207 -5.514 1.00 0.00 H new ATOM 0 HB2 GLN A 10 2.292 -25.265 -4.939 1.00 0.00 H new ATOM 0 HB3 GLN A 10 0.842 -25.728 -5.807 1.00 0.00 H new ATOM 0 HG2 GLN A 10 1.252 -24.056 -7.548 1.00 0.00 H new ATOM 0 HG3 GLN A 10 2.546 -23.324 -6.621 1.00 0.00 H new ATOM 0 HE21 GLN A 10 2.583 -24.702 -9.301 1.00 0.00 H new ATOM 0 HE22 GLN A 10 3.834 -25.937 -9.129 1.00 0.00 H new ATOM 171 N GLY A 11 -0.381 -23.974 -2.631 1.00 0.00 N ATOM 172 CA GLY A 11 -1.295 -24.518 -1.628 1.00 0.00 C ATOM 173 C GLY A 11 -2.455 -23.558 -1.389 1.00 0.00 C ATOM 174 O GLY A 11 -2.314 -22.338 -1.519 1.00 0.00 O ATOM 0 H GLY A 11 0.172 -23.179 -2.311 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -1.676 -25.484 -1.960 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -0.759 -24.691 -0.694 1.00 0.00 H new ATOM 178 N ARG A 12 -3.603 -24.124 -1.027 1.00 0.00 N ATOM 179 CA ARG A 12 -4.791 -23.325 -0.760 1.00 0.00 C ATOM 180 C ARG A 12 -4.596 -22.488 0.497 1.00 0.00 C ATOM 181 O ARG A 12 -5.281 -21.485 0.697 1.00 0.00 O ATOM 182 CB ARG A 12 -6.005 -24.240 -0.585 1.00 0.00 C ATOM 183 CG ARG A 12 -7.287 -23.411 -0.668 1.00 0.00 C ATOM 184 CD ARG A 12 -8.495 -24.303 -0.377 1.00 0.00 C ATOM 185 NE ARG A 12 -8.772 -25.167 -1.522 1.00 0.00 N ATOM 186 CZ ARG A 12 -8.217 -26.370 -1.634 1.00 0.00 C ATOM 187 NH1 ARG A 12 -7.408 -26.807 -0.707 1.00 0.00 N ATOM 188 NH2 ARG A 12 -8.483 -27.116 -2.671 1.00 0.00 N ATOM 0 H ARG A 12 -3.734 -25.129 -0.913 1.00 0.00 H new ATOM 0 HA ARG A 12 -4.959 -22.658 -1.605 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -6.007 -25.010 -1.356 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -5.952 -24.752 0.376 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -7.248 -22.590 0.048 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -7.381 -22.966 -1.659 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -8.303 -24.910 0.508 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -9.367 -23.687 -0.158 1.00 0.00 H new ATOM 0 HE ARG A 12 -9.405 -24.840 -2.252 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -7.201 -26.225 0.105 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -6.983 -27.730 -0.795 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -9.116 -26.776 -3.395 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -8.058 -28.039 -2.758 1.00 0.00 H new ATOM 202 N GLY A 13 -3.656 -22.901 1.341 1.00 0.00 N ATOM 203 CA GLY A 13 -3.378 -22.179 2.574 1.00 0.00 C ATOM 204 C GLY A 13 -2.754 -20.825 2.273 1.00 0.00 C ATOM 205 O GLY A 13 -3.085 -19.822 2.904 1.00 0.00 O ATOM 0 H GLY A 13 -3.077 -23.728 1.194 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -4.301 -22.043 3.138 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -2.705 -22.764 3.201 1.00 0.00 H new ATOM 209 N ALA A 14 -1.849 -20.805 1.298 1.00 0.00 N ATOM 210 CA ALA A 14 -1.183 -19.567 0.915 1.00 0.00 C ATOM 211 C ALA A 14 -2.188 -18.585 0.325 1.00 0.00 C ATOM 212 O ALA A 14 -2.263 -17.433 0.752 1.00 0.00 O ATOM 213 CB ALA A 14 -0.085 -19.859 -0.110 1.00 0.00 C ATOM 0 H ALA A 14 -1.563 -21.625 0.764 1.00 0.00 H new ATOM 0 HA ALA A 14 -0.736 -19.123 1.805 1.00 0.00 H new ATOM 0 HB1 ALA A 14 0.408 -18.928 -0.391 1.00 0.00 H new ATOM 0 HB2 ALA A 14 0.647 -20.540 0.325 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -0.526 -20.317 -0.995 1.00 0.00 H new ATOM 219 N TRP A 15 -2.962 -19.047 -0.654 1.00 0.00 N ATOM 220 CA TRP A 15 -3.959 -18.188 -1.283 1.00 0.00 C ATOM 221 C TRP A 15 -4.881 -17.582 -0.227 1.00 0.00 C ATOM 222 O TRP A 15 -5.213 -16.399 -0.285 1.00 0.00 O ATOM 223 CB TRP A 15 -4.789 -18.986 -2.292 1.00 0.00 C ATOM 224 CG TRP A 15 -3.884 -19.739 -3.217 1.00 0.00 C ATOM 225 CD1 TRP A 15 -2.624 -19.371 -3.552 1.00 0.00 C ATOM 226 CD2 TRP A 15 -4.148 -20.981 -3.935 1.00 0.00 C ATOM 227 NE1 TRP A 15 -2.101 -20.306 -4.426 1.00 0.00 N ATOM 228 CE2 TRP A 15 -3.001 -21.318 -4.692 1.00 0.00 C ATOM 229 CE3 TRP A 15 -5.261 -21.838 -4.002 1.00 0.00 C ATOM 230 CZ2 TRP A 15 -2.959 -22.465 -5.485 1.00 0.00 C ATOM 231 CZ3 TRP A 15 -5.221 -22.994 -4.799 1.00 0.00 C ATOM 232 CH2 TRP A 15 -4.074 -23.306 -5.539 1.00 0.00 C ATOM 0 H TRP A 15 -2.919 -19.997 -1.024 1.00 0.00 H new ATOM 0 HA TRP A 15 -3.439 -17.385 -1.805 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -5.446 -19.680 -1.767 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -5.428 -18.313 -2.863 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -2.111 -18.490 -3.194 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -1.164 -20.254 -4.826 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -6.152 -21.606 -3.437 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -2.071 -22.701 -6.053 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -6.081 -23.646 -4.841 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -4.051 -24.196 -6.151 1.00 0.00 H new ATOM 243 N LEU A 16 -5.290 -18.402 0.737 1.00 0.00 N ATOM 244 CA LEU A 16 -6.173 -17.934 1.801 1.00 0.00 C ATOM 245 C LEU A 16 -5.411 -17.029 2.765 1.00 0.00 C ATOM 246 O LEU A 16 -5.984 -16.115 3.358 1.00 0.00 O ATOM 247 CB LEU A 16 -6.751 -19.130 2.563 1.00 0.00 C ATOM 248 CG LEU A 16 -7.933 -18.674 3.433 1.00 0.00 C ATOM 249 CD1 LEU A 16 -9.220 -18.662 2.601 1.00 0.00 C ATOM 250 CD2 LEU A 16 -8.105 -19.642 4.609 1.00 0.00 C ATOM 0 H LEU A 16 -5.027 -19.385 0.804 1.00 0.00 H new ATOM 0 HA LEU A 16 -6.987 -17.364 1.353 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -7.080 -19.896 1.860 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -5.980 -19.581 3.188 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.733 -17.669 3.806 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -10.053 -18.338 3.224 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -9.105 -17.975 1.763 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -9.418 -19.665 2.223 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -8.943 -19.319 5.226 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -8.299 -20.645 4.229 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -7.195 -19.651 5.209 1.00 0.00 H new ATOM 262 N LEU A 17 -4.116 -17.292 2.920 1.00 0.00 N ATOM 263 CA LEU A 17 -3.285 -16.496 3.817 1.00 0.00 C ATOM 264 C LEU A 17 -3.106 -15.082 3.269 1.00 0.00 C ATOM 265 O LEU A 17 -2.997 -14.121 4.032 1.00 0.00 O ATOM 266 CB LEU A 17 -1.915 -17.162 3.989 1.00 0.00 C ATOM 267 CG LEU A 17 -1.128 -16.469 5.111 1.00 0.00 C ATOM 268 CD1 LEU A 17 -1.539 -17.043 6.470 1.00 0.00 C ATOM 269 CD2 LEU A 17 0.370 -16.700 4.899 1.00 0.00 C ATOM 0 H LEU A 17 -3.623 -18.045 2.440 1.00 0.00 H new ATOM 0 HA LEU A 17 -3.781 -16.435 4.786 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -2.043 -18.219 4.223 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -1.356 -17.108 3.055 1.00 0.00 H new ATOM 0 HG LEU A 17 -1.344 -15.401 5.091 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -0.976 -16.546 7.260 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -2.605 -16.880 6.626 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -1.328 -18.112 6.492 1.00 0.00 H new ATOM 0 HD21 LEU A 17 0.930 -16.209 5.695 1.00 0.00 H new ATOM 0 HD22 LEU A 17 0.579 -17.770 4.915 1.00 0.00 H new ATOM 0 HD23 LEU A 17 0.669 -16.286 3.936 1.00 0.00 H new ATOM 281 N MET A 18 -3.079 -14.962 1.945 1.00 0.00 N ATOM 282 CA MET A 18 -2.913 -13.659 1.311 1.00 0.00 C ATOM 283 C MET A 18 -4.207 -12.859 1.401 1.00 0.00 C ATOM 284 O MET A 18 -4.180 -11.634 1.520 1.00 0.00 O ATOM 285 CB MET A 18 -2.521 -13.839 -0.158 1.00 0.00 C ATOM 286 CG MET A 18 -1.124 -14.456 -0.241 1.00 0.00 C ATOM 287 SD MET A 18 -0.783 -14.946 -1.950 1.00 0.00 S ATOM 288 CE MET A 18 0.777 -15.807 -1.633 1.00 0.00 C ATOM 0 H MET A 18 -3.169 -15.743 1.296 1.00 0.00 H new ATOM 0 HA MET A 18 -2.124 -13.116 1.831 1.00 0.00 H new ATOM 0 HB2 MET A 18 -3.244 -14.480 -0.662 1.00 0.00 H new ATOM 0 HB3 MET A 18 -2.536 -12.877 -0.670 1.00 0.00 H new ATOM 0 HG2 MET A 18 -0.377 -13.739 0.099 1.00 0.00 H new ATOM 0 HG3 MET A 18 -1.057 -15.322 0.417 1.00 0.00 H new ATOM 0 HE1 MET A 18 1.173 -16.198 -2.570 1.00 0.00 H new ATOM 0 HE2 MET A 18 1.495 -15.111 -1.198 1.00 0.00 H new ATOM 0 HE3 MET A 18 0.604 -16.630 -0.940 1.00 0.00 H new ATOM 298 N ALA A 19 -5.338 -13.553 1.337 1.00 0.00 N ATOM 299 CA ALA A 19 -6.633 -12.889 1.405 1.00 0.00 C ATOM 300 C ALA A 19 -6.852 -12.274 2.782 1.00 0.00 C ATOM 301 O ALA A 19 -7.180 -11.094 2.898 1.00 0.00 O ATOM 302 CB ALA A 19 -7.750 -13.892 1.110 1.00 0.00 C ATOM 0 H ALA A 19 -5.384 -14.567 1.239 1.00 0.00 H new ATOM 0 HA ALA A 19 -6.650 -12.094 0.659 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -8.715 -13.388 1.163 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -7.612 -14.307 0.112 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -7.720 -14.696 1.845 1.00 0.00 H new ATOM 308 N PHE A 20 -6.674 -13.080 3.824 1.00 0.00 N ATOM 309 CA PHE A 20 -6.861 -12.607 5.190 1.00 0.00 C ATOM 310 C PHE A 20 -6.016 -11.361 5.450 1.00 0.00 C ATOM 311 O PHE A 20 -6.526 -10.345 5.918 1.00 0.00 O ATOM 312 CB PHE A 20 -6.474 -13.716 6.182 1.00 0.00 C ATOM 313 CG PHE A 20 -7.721 -14.339 6.767 1.00 0.00 C ATOM 314 CD1 PHE A 20 -8.370 -15.376 6.088 1.00 0.00 C ATOM 315 CD2 PHE A 20 -8.225 -13.878 7.988 1.00 0.00 C ATOM 316 CE1 PHE A 20 -9.525 -15.953 6.631 1.00 0.00 C ATOM 317 CE2 PHE A 20 -9.380 -14.453 8.530 1.00 0.00 C ATOM 318 CZ PHE A 20 -10.031 -15.491 7.852 1.00 0.00 C ATOM 0 H PHE A 20 -6.402 -14.060 3.749 1.00 0.00 H new ATOM 0 HA PHE A 20 -7.911 -12.348 5.327 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -5.879 -14.477 5.677 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -5.854 -13.304 6.979 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -7.980 -15.731 5.145 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -7.723 -13.078 8.512 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -10.025 -16.754 6.108 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -9.770 -14.096 9.472 1.00 0.00 H new ATOM 0 HZ PHE A 20 -10.922 -15.935 8.270 1.00 0.00 H new ATOM 328 N THR A 21 -4.725 -11.448 5.150 1.00 0.00 N ATOM 329 CA THR A 21 -3.828 -10.318 5.366 1.00 0.00 C ATOM 330 C THR A 21 -4.452 -9.027 4.845 1.00 0.00 C ATOM 331 O THR A 21 -4.697 -8.093 5.610 1.00 0.00 O ATOM 332 CB THR A 21 -2.495 -10.566 4.656 1.00 0.00 C ATOM 333 OG1 THR A 21 -1.958 -11.806 5.091 1.00 0.00 O ATOM 334 CG2 THR A 21 -1.519 -9.438 4.990 1.00 0.00 C ATOM 0 H THR A 21 -4.279 -12.279 4.761 1.00 0.00 H new ATOM 0 HA THR A 21 -3.656 -10.216 6.438 1.00 0.00 H new ATOM 0 HB THR A 21 -2.654 -10.595 3.578 1.00 0.00 H new ATOM 0 HG1 THR A 21 -2.352 -12.535 4.568 1.00 0.00 H new ATOM 0 HG21 THR A 21 -0.570 -9.616 4.484 1.00 0.00 H new ATOM 0 HG22 THR A 21 -1.935 -8.487 4.658 1.00 0.00 H new ATOM 0 HG23 THR A 21 -1.355 -9.406 6.067 1.00 0.00 H new ATOM 342 N ALA A 22 -4.708 -8.983 3.543 1.00 0.00 N ATOM 343 CA ALA A 22 -5.303 -7.800 2.933 1.00 0.00 C ATOM 344 C ALA A 22 -6.550 -7.372 3.699 1.00 0.00 C ATOM 345 O ALA A 22 -6.882 -6.189 3.750 1.00 0.00 O ATOM 346 CB ALA A 22 -5.672 -8.092 1.478 1.00 0.00 C ATOM 0 H ALA A 22 -4.515 -9.746 2.894 1.00 0.00 H new ATOM 0 HA ALA A 22 -4.573 -6.991 2.967 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.116 -7.203 1.030 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -4.775 -8.369 0.924 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -6.388 -8.913 1.442 1.00 0.00 H new ATOM 352 N LEU A 23 -7.236 -8.343 4.294 1.00 0.00 N ATOM 353 CA LEU A 23 -8.446 -8.053 5.056 1.00 0.00 C ATOM 354 C LEU A 23 -8.088 -7.445 6.410 1.00 0.00 C ATOM 355 O LEU A 23 -8.743 -6.512 6.876 1.00 0.00 O ATOM 356 CB LEU A 23 -9.258 -9.346 5.257 1.00 0.00 C ATOM 357 CG LEU A 23 -10.581 -9.268 4.485 1.00 0.00 C ATOM 358 CD1 LEU A 23 -11.159 -10.676 4.319 1.00 0.00 C ATOM 359 CD2 LEU A 23 -11.577 -8.402 5.260 1.00 0.00 C ATOM 0 H LEU A 23 -6.978 -9.329 4.264 1.00 0.00 H new ATOM 0 HA LEU A 23 -9.048 -7.334 4.500 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -8.679 -10.204 4.915 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -9.456 -9.498 6.318 1.00 0.00 H new ATOM 0 HG LEU A 23 -10.401 -8.828 3.504 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -12.099 -10.621 3.770 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -10.453 -11.297 3.767 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -11.337 -11.114 5.301 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -12.517 -8.348 4.710 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -11.756 -8.842 6.241 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -11.169 -7.399 5.382 1.00 0.00 H new ATOM 371 N ALA A 24 -7.047 -7.983 7.037 1.00 0.00 N ATOM 372 CA ALA A 24 -6.610 -7.488 8.337 1.00 0.00 C ATOM 373 C ALA A 24 -6.455 -5.972 8.312 1.00 0.00 C ATOM 374 O ALA A 24 -6.824 -5.285 9.265 1.00 0.00 O ATOM 375 CB ALA A 24 -5.277 -8.133 8.721 1.00 0.00 C ATOM 0 H ALA A 24 -6.494 -8.757 6.669 1.00 0.00 H new ATOM 0 HA ALA A 24 -7.367 -7.751 9.076 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -4.958 -7.758 9.693 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -5.398 -9.215 8.772 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -4.524 -7.886 7.972 1.00 0.00 H new ATOM 381 N LEU A 25 -5.906 -5.454 7.218 1.00 0.00 N ATOM 382 CA LEU A 25 -5.709 -4.016 7.083 1.00 0.00 C ATOM 383 C LEU A 25 -7.050 -3.302 6.939 1.00 0.00 C ATOM 384 O LEU A 25 -7.235 -2.200 7.457 1.00 0.00 O ATOM 385 CB LEU A 25 -4.831 -3.719 5.862 1.00 0.00 C ATOM 386 CG LEU A 25 -3.359 -3.931 6.222 1.00 0.00 C ATOM 387 CD1 LEU A 25 -3.174 -5.327 6.818 1.00 0.00 C ATOM 388 CD2 LEU A 25 -2.503 -3.797 4.961 1.00 0.00 C ATOM 0 H LEU A 25 -5.592 -6.004 6.418 1.00 0.00 H new ATOM 0 HA LEU A 25 -5.212 -3.650 7.982 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -5.110 -4.370 5.034 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -4.990 -2.694 5.528 1.00 0.00 H new ATOM 0 HG LEU A 25 -3.052 -3.182 6.952 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -2.125 -5.477 7.074 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -3.784 -5.423 7.716 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -3.481 -6.077 6.089 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -1.454 -3.948 5.216 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -2.810 -4.546 4.231 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -2.634 -2.802 4.536 1.00 0.00 H new ATOM 400 N GLU A 26 -7.981 -3.937 6.236 1.00 0.00 N ATOM 401 CA GLU A 26 -9.301 -3.350 6.032 1.00 0.00 C ATOM 402 C GLU A 26 -10.049 -3.234 7.357 1.00 0.00 C ATOM 403 O GLU A 26 -10.591 -2.179 7.682 1.00 0.00 O ATOM 404 CB GLU A 26 -10.113 -4.209 5.060 1.00 0.00 C ATOM 405 CG GLU A 26 -9.413 -4.242 3.700 1.00 0.00 C ATOM 406 CD GLU A 26 -9.981 -5.372 2.848 1.00 0.00 C ATOM 407 OE1 GLU A 26 -11.183 -5.577 2.895 1.00 0.00 O ATOM 408 OE2 GLU A 26 -9.206 -6.018 2.162 1.00 0.00 O ATOM 0 H GLU A 26 -7.849 -4.850 5.801 1.00 0.00 H new ATOM 0 HA GLU A 26 -9.171 -2.352 5.613 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.217 -5.221 5.452 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -11.119 -3.804 4.953 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -9.547 -3.288 3.190 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -8.341 -4.382 3.837 1.00 0.00 H new ATOM 415 N LEU A 27 -10.079 -4.325 8.114 1.00 0.00 N ATOM 416 CA LEU A 27 -10.769 -4.332 9.400 1.00 0.00 C ATOM 417 C LEU A 27 -10.141 -3.322 10.354 1.00 0.00 C ATOM 418 O LEU A 27 -10.836 -2.498 10.951 1.00 0.00 O ATOM 419 CB LEU A 27 -10.711 -5.733 10.018 1.00 0.00 C ATOM 420 CG LEU A 27 -11.380 -5.725 11.405 1.00 0.00 C ATOM 421 CD1 LEU A 27 -12.223 -6.990 11.579 1.00 0.00 C ATOM 422 CD2 LEU A 27 -10.308 -5.685 12.501 1.00 0.00 C ATOM 0 H LEU A 27 -9.638 -5.210 7.863 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.810 -4.053 9.233 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -11.214 -6.448 9.367 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -9.674 -6.058 10.107 1.00 0.00 H new ATOM 0 HG LEU A 27 -12.017 -4.844 11.484 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -12.695 -6.981 12.562 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -12.992 -7.024 10.808 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -11.583 -7.868 11.492 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -10.788 -5.680 13.480 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -9.668 -6.563 12.416 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -9.705 -4.784 12.388 1.00 0.00 H new ATOM 434 N THR A 28 -8.821 -3.394 10.499 1.00 0.00 N ATOM 435 CA THR A 28 -8.108 -2.485 11.389 1.00 0.00 C ATOM 436 C THR A 28 -8.434 -1.031 11.063 1.00 0.00 C ATOM 437 O THR A 28 -8.635 -0.217 11.963 1.00 0.00 O ATOM 438 CB THR A 28 -6.598 -2.710 11.267 1.00 0.00 C ATOM 439 OG1 THR A 28 -6.238 -2.754 9.894 1.00 0.00 O ATOM 440 CG2 THR A 28 -6.220 -4.031 11.938 1.00 0.00 C ATOM 0 H THR A 28 -8.227 -4.068 10.015 1.00 0.00 H new ATOM 0 HA THR A 28 -8.428 -2.692 12.410 1.00 0.00 H new ATOM 0 HB THR A 28 -6.068 -1.893 11.757 1.00 0.00 H new ATOM 0 HG1 THR A 28 -6.394 -3.656 9.544 1.00 0.00 H new ATOM 0 HG21 THR A 28 -5.145 -4.189 11.850 1.00 0.00 H new ATOM 0 HG22 THR A 28 -6.497 -3.996 12.992 1.00 0.00 H new ATOM 0 HG23 THR A 28 -6.748 -4.851 11.451 1.00 0.00 H new ATOM 448 N ALA A 29 -8.480 -0.708 9.774 1.00 0.00 N ATOM 449 CA ALA A 29 -8.775 0.657 9.353 1.00 0.00 C ATOM 450 C ALA A 29 -10.250 0.988 9.562 1.00 0.00 C ATOM 451 O ALA A 29 -10.598 2.127 9.883 1.00 0.00 O ATOM 452 CB ALA A 29 -8.414 0.838 7.877 1.00 0.00 C ATOM 0 H ALA A 29 -8.319 -1.365 9.011 1.00 0.00 H new ATOM 0 HA ALA A 29 -8.178 1.336 9.962 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -8.637 1.860 7.570 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -7.351 0.641 7.735 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.996 0.142 7.272 1.00 0.00 H new ATOM 458 N LEU A 30 -11.115 -0.004 9.381 1.00 0.00 N ATOM 459 CA LEU A 30 -12.548 0.193 9.552 1.00 0.00 C ATOM 460 C LEU A 30 -12.866 0.577 10.994 1.00 0.00 C ATOM 461 O LEU A 30 -13.920 1.151 11.272 1.00 0.00 O ATOM 462 CB LEU A 30 -13.297 -1.096 9.171 1.00 0.00 C ATOM 463 CG LEU A 30 -14.146 -0.875 7.909 1.00 0.00 C ATOM 464 CD1 LEU A 30 -15.240 0.165 8.186 1.00 0.00 C ATOM 465 CD2 LEU A 30 -13.250 -0.397 6.753 1.00 0.00 C ATOM 0 H LEU A 30 -10.848 -0.952 9.116 1.00 0.00 H new ATOM 0 HA LEU A 30 -12.872 1.004 8.900 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -12.582 -1.901 8.999 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -13.937 -1.409 9.996 1.00 0.00 H new ATOM 0 HG LEU A 30 -14.617 -1.818 7.630 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -15.836 0.315 7.286 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -15.883 -0.189 8.992 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -14.779 1.109 8.477 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -13.858 -0.242 5.862 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -12.767 0.540 7.030 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -12.489 -1.150 6.547 1.00 0.00 H new ATOM 477 N TRP A 31 -11.953 0.261 11.908 1.00 0.00 N ATOM 478 CA TRP A 31 -12.154 0.581 13.316 1.00 0.00 C ATOM 479 C TRP A 31 -11.704 2.011 13.599 1.00 0.00 C ATOM 480 O TRP A 31 -12.367 2.750 14.326 1.00 0.00 O ATOM 481 CB TRP A 31 -11.363 -0.401 14.194 1.00 0.00 C ATOM 482 CG TRP A 31 -12.233 -0.910 15.300 1.00 0.00 C ATOM 483 CD1 TRP A 31 -11.936 -0.845 16.618 1.00 0.00 C ATOM 484 CD2 TRP A 31 -13.534 -1.560 15.205 1.00 0.00 C ATOM 485 NE1 TRP A 31 -12.972 -1.414 17.338 1.00 0.00 N ATOM 486 CE2 TRP A 31 -13.979 -1.870 16.511 1.00 0.00 C ATOM 487 CE3 TRP A 31 -14.361 -1.909 14.121 1.00 0.00 C ATOM 488 CZ2 TRP A 31 -15.203 -2.502 16.735 1.00 0.00 C ATOM 489 CZ3 TRP A 31 -15.593 -2.545 14.344 1.00 0.00 C ATOM 490 CH2 TRP A 31 -16.013 -2.840 15.649 1.00 0.00 C ATOM 0 H TRP A 31 -11.074 -0.213 11.701 1.00 0.00 H new ATOM 0 HA TRP A 31 -13.215 0.493 13.550 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -11.003 -1.234 13.590 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -10.485 0.094 14.609 1.00 0.00 H new ATOM 0 HD1 TRP A 31 -11.038 -0.419 17.039 1.00 0.00 H new ATOM 0 HE1 TRP A 31 -12.989 -1.487 18.355 1.00 0.00 H new ATOM 0 HE3 TRP A 31 -14.046 -1.686 13.112 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 -15.522 -2.728 17.742 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 -16.221 -2.808 13.506 1.00 0.00 H new ATOM 0 HH2 TRP A 31 -16.962 -3.328 15.814 1.00 0.00 H new ATOM 501 N PHE A 32 -10.574 2.394 13.014 1.00 0.00 N ATOM 502 CA PHE A 32 -10.048 3.738 13.208 1.00 0.00 C ATOM 503 C PHE A 32 -11.137 4.770 12.929 1.00 0.00 C ATOM 504 O PHE A 32 -11.297 5.735 13.674 1.00 0.00 O ATOM 505 CB PHE A 32 -8.855 3.976 12.272 1.00 0.00 C ATOM 506 CG PHE A 32 -7.586 3.453 12.909 1.00 0.00 C ATOM 507 CD1 PHE A 32 -7.560 2.173 13.480 1.00 0.00 C ATOM 508 CD2 PHE A 32 -6.432 4.247 12.926 1.00 0.00 C ATOM 509 CE1 PHE A 32 -6.383 1.691 14.067 1.00 0.00 C ATOM 510 CE2 PHE A 32 -5.256 3.763 13.512 1.00 0.00 C ATOM 511 CZ PHE A 32 -5.232 2.485 14.082 1.00 0.00 C ATOM 0 H PHE A 32 -10.010 1.798 12.407 1.00 0.00 H new ATOM 0 HA PHE A 32 -9.716 3.840 14.241 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -9.025 3.477 11.318 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -8.754 5.041 12.061 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -8.448 1.558 13.467 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -6.449 5.233 12.487 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -6.364 0.705 14.508 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -4.367 4.376 13.524 1.00 0.00 H new ATOM 0 HZ PHE A 32 -4.325 2.112 14.533 1.00 0.00 H new ATOM 521 N GLN A 33 -11.885 4.558 11.851 1.00 0.00 N ATOM 522 CA GLN A 33 -12.956 5.478 11.486 1.00 0.00 C ATOM 523 C GLN A 33 -14.185 5.257 12.365 1.00 0.00 C ATOM 524 O GLN A 33 -14.836 6.212 12.786 1.00 0.00 O ATOM 525 CB GLN A 33 -13.338 5.280 10.015 1.00 0.00 C ATOM 526 CG GLN A 33 -14.583 6.111 9.692 1.00 0.00 C ATOM 527 CD GLN A 33 -14.738 6.255 8.181 1.00 0.00 C ATOM 528 OE1 GLN A 33 -14.157 5.395 7.390 1.00 0.00 O flip ATOM 529 NE2 GLN A 33 -15.408 7.174 7.710 1.00 0.00 N flip ATOM 0 H GLN A 33 -11.771 3.765 11.220 1.00 0.00 H new ATOM 0 HA GLN A 33 -12.596 6.496 11.637 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -12.511 5.579 9.371 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -13.531 4.226 9.817 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -15.468 5.633 10.113 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -14.503 7.095 10.153 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -15.861 7.845 8.331 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -15.510 7.265 6.699 1.00 0.00 H new ATOM 538 N HIS A 34 -14.498 3.996 12.638 1.00 0.00 N ATOM 539 CA HIS A 34 -15.656 3.673 13.465 1.00 0.00 C ATOM 540 C HIS A 34 -15.403 4.051 14.922 1.00 0.00 C ATOM 541 O HIS A 34 -16.337 4.144 15.718 1.00 0.00 O ATOM 542 CB HIS A 34 -15.968 2.177 13.369 1.00 0.00 C ATOM 543 CG HIS A 34 -17.318 1.906 13.974 1.00 0.00 C ATOM 544 ND1 HIS A 34 -18.068 2.900 14.582 1.00 0.00 N ATOM 545 CD2 HIS A 34 -18.067 0.758 14.075 1.00 0.00 C ATOM 546 CE1 HIS A 34 -19.211 2.339 15.018 1.00 0.00 C ATOM 547 NE2 HIS A 34 -19.261 1.035 14.735 1.00 0.00 N ATOM 0 H HIS A 34 -13.973 3.188 12.303 1.00 0.00 H new ATOM 0 HA HIS A 34 -16.508 4.246 13.098 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -15.954 1.858 12.327 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -15.202 1.601 13.889 1.00 0.00 H new ATOM 0 HD1 HIS A 34 -17.802 3.880 14.681 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -17.774 -0.211 13.700 1.00 0.00 H new ATOM 0 HE1 HIS A 34 -19.992 2.878 15.534 1.00 0.00 H new ATOM 556 N VAL A 35 -14.134 4.266 15.268 1.00 0.00 N ATOM 557 CA VAL A 35 -13.772 4.629 16.637 1.00 0.00 C ATOM 558 C VAL A 35 -13.317 6.085 16.720 1.00 0.00 C ATOM 559 O VAL A 35 -13.785 6.840 17.573 1.00 0.00 O ATOM 560 CB VAL A 35 -12.654 3.710 17.137 1.00 0.00 C ATOM 561 CG1 VAL A 35 -12.128 4.219 18.482 1.00 0.00 C ATOM 562 CG2 VAL A 35 -13.202 2.292 17.309 1.00 0.00 C ATOM 0 H VAL A 35 -13.345 4.196 14.625 1.00 0.00 H new ATOM 0 HA VAL A 35 -14.655 4.511 17.265 1.00 0.00 H new ATOM 0 HB VAL A 35 -11.841 3.704 16.412 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -11.333 3.562 18.834 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -11.737 5.229 18.361 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -12.939 4.229 19.210 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -12.408 1.636 17.665 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -14.016 2.302 18.033 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -13.573 1.927 16.351 1.00 0.00 H new ATOM 572 N MET A 36 -12.395 6.471 15.843 1.00 0.00 N ATOM 573 CA MET A 36 -11.878 7.839 15.847 1.00 0.00 C ATOM 574 C MET A 36 -12.696 8.744 14.928 1.00 0.00 C ATOM 575 O MET A 36 -12.265 9.848 14.594 1.00 0.00 O ATOM 576 CB MET A 36 -10.414 7.845 15.402 1.00 0.00 C ATOM 577 CG MET A 36 -9.675 6.683 16.069 1.00 0.00 C ATOM 578 SD MET A 36 -7.889 6.937 15.920 1.00 0.00 S ATOM 579 CE MET A 36 -7.388 5.244 16.317 1.00 0.00 C ATOM 0 H MET A 36 -11.993 5.865 15.128 1.00 0.00 H new ATOM 0 HA MET A 36 -11.955 8.224 16.864 1.00 0.00 H new ATOM 0 HB2 MET A 36 -10.352 7.755 14.317 1.00 0.00 H new ATOM 0 HB3 MET A 36 -9.945 8.791 15.671 1.00 0.00 H new ATOM 0 HG2 MET A 36 -9.957 6.614 17.120 1.00 0.00 H new ATOM 0 HG3 MET A 36 -9.959 5.741 15.601 1.00 0.00 H new ATOM 0 HE1 MET A 36 -6.303 5.160 16.249 1.00 0.00 H new ATOM 0 HE2 MET A 36 -7.708 4.998 17.329 1.00 0.00 H new ATOM 0 HE3 MET A 36 -7.850 4.553 15.612 1.00 0.00 H new ATOM 589 N LEU A 37 -13.876 8.278 14.525 1.00 0.00 N ATOM 590 CA LEU A 37 -14.736 9.070 13.648 1.00 0.00 C ATOM 591 C LEU A 37 -13.903 9.759 12.568 1.00 0.00 C ATOM 592 O LEU A 37 -14.173 10.900 12.192 1.00 0.00 O ATOM 593 CB LEU A 37 -15.490 10.123 14.476 1.00 0.00 C ATOM 594 CG LEU A 37 -16.917 10.300 13.934 1.00 0.00 C ATOM 595 CD1 LEU A 37 -17.836 9.238 14.543 1.00 0.00 C ATOM 596 CD2 LEU A 37 -17.436 11.691 14.311 1.00 0.00 C ATOM 0 H LEU A 37 -14.255 7.368 14.787 1.00 0.00 H new ATOM 0 HA LEU A 37 -15.454 8.407 13.166 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -15.525 9.817 15.522 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -14.959 11.074 14.440 1.00 0.00 H new ATOM 0 HG LEU A 37 -16.906 10.192 12.849 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -18.847 9.367 14.156 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -17.470 8.246 14.279 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -17.846 9.344 15.628 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -18.448 11.818 13.927 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -17.444 11.795 15.396 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -16.786 12.451 13.878 1.00 0.00 H new ATOM 608 N LEU A 38 -12.888 9.054 12.081 1.00 0.00 N ATOM 609 CA LEU A 38 -12.017 9.606 11.048 1.00 0.00 C ATOM 610 C LEU A 38 -12.807 9.869 9.767 1.00 0.00 C ATOM 611 O LEU A 38 -13.847 9.254 9.531 1.00 0.00 O ATOM 612 CB LEU A 38 -10.862 8.631 10.769 1.00 0.00 C ATOM 613 CG LEU A 38 -9.537 9.396 10.631 1.00 0.00 C ATOM 614 CD1 LEU A 38 -9.169 10.069 11.963 1.00 0.00 C ATOM 615 CD2 LEU A 38 -8.431 8.413 10.234 1.00 0.00 C ATOM 0 H LEU A 38 -12.649 8.109 12.380 1.00 0.00 H new ATOM 0 HA LEU A 38 -11.609 10.553 11.400 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -10.787 7.905 11.578 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -11.063 8.071 9.856 1.00 0.00 H new ATOM 0 HG LEU A 38 -9.645 10.165 9.867 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -8.228 10.608 11.851 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -9.956 10.768 12.247 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -9.062 9.309 12.737 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -7.487 8.949 10.134 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -8.333 7.646 11.002 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -8.685 7.944 9.283 1.00 0.00 H new ATOM 627 N LYS A 39 -12.312 10.796 8.949 1.00 0.00 N ATOM 628 CA LYS A 39 -12.984 11.146 7.699 1.00 0.00 C ATOM 629 C LYS A 39 -12.072 10.891 6.497 1.00 0.00 C ATOM 630 O LYS A 39 -11.314 11.770 6.088 1.00 0.00 O ATOM 631 CB LYS A 39 -13.381 12.622 7.729 1.00 0.00 C ATOM 632 CG LYS A 39 -14.006 12.955 9.087 1.00 0.00 C ATOM 633 CD LYS A 39 -14.666 14.339 9.030 1.00 0.00 C ATOM 634 CE LYS A 39 -16.113 14.204 8.545 1.00 0.00 C ATOM 635 NZ LYS A 39 -16.608 15.533 8.086 1.00 0.00 N ATOM 0 H LYS A 39 -11.453 11.316 9.128 1.00 0.00 H new ATOM 0 HA LYS A 39 -13.872 10.522 7.599 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -12.506 13.249 7.556 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -14.089 12.835 6.928 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -14.746 12.200 9.352 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -13.241 12.938 9.864 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -14.645 14.803 10.016 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -14.107 14.991 8.359 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -16.169 13.482 7.731 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -16.744 13.827 9.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -17.590 15.443 7.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -16.568 16.210 8.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -16.011 15.875 7.306 1.00 0.00 H new ATOM 649 N PRO A 40 -12.135 9.714 5.927 1.00 0.00 N ATOM 650 CA PRO A 40 -11.298 9.347 4.743 1.00 0.00 C ATOM 651 C PRO A 40 -11.399 10.383 3.625 1.00 0.00 C ATOM 652 O PRO A 40 -12.441 11.011 3.439 1.00 0.00 O ATOM 653 CB PRO A 40 -11.868 7.995 4.298 1.00 0.00 C ATOM 654 CG PRO A 40 -12.501 7.417 5.521 1.00 0.00 C ATOM 655 CD PRO A 40 -13.006 8.603 6.343 1.00 0.00 C ATOM 0 HA PRO A 40 -10.237 9.303 4.988 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -12.598 8.119 3.498 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -11.083 7.343 3.915 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -13.321 6.750 5.256 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -11.782 6.828 6.090 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -14.054 8.817 6.135 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -12.926 8.411 7.413 1.00 0.00 H new ATOM 663 N CYS A 41 -10.306 10.557 2.885 1.00 0.00 N ATOM 664 CA CYS A 41 -10.282 11.522 1.788 1.00 0.00 C ATOM 665 C CYS A 41 -10.504 10.825 0.449 1.00 0.00 C ATOM 666 O CYS A 41 -10.794 9.630 0.399 1.00 0.00 O ATOM 667 CB CYS A 41 -8.939 12.255 1.769 1.00 0.00 C ATOM 668 SG CYS A 41 -9.108 13.800 0.842 1.00 0.00 S ATOM 0 H CYS A 41 -9.433 10.048 3.023 1.00 0.00 H new ATOM 0 HA CYS A 41 -11.087 12.240 1.945 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -8.612 12.464 2.788 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -8.176 11.626 1.312 1.00 0.00 H new ATOM 673 N VAL A 42 -10.364 11.582 -0.634 1.00 0.00 N ATOM 674 CA VAL A 42 -10.552 11.033 -1.972 1.00 0.00 C ATOM 675 C VAL A 42 -9.455 10.024 -2.298 1.00 0.00 C ATOM 676 O VAL A 42 -9.727 8.934 -2.803 1.00 0.00 O ATOM 677 CB VAL A 42 -10.530 12.159 -3.007 1.00 0.00 C ATOM 678 CG1 VAL A 42 -11.047 11.632 -4.347 1.00 0.00 C ATOM 679 CG2 VAL A 42 -11.425 13.307 -2.534 1.00 0.00 C ATOM 0 H VAL A 42 -10.122 12.573 -0.612 1.00 0.00 H new ATOM 0 HA VAL A 42 -11.517 10.528 -2.002 1.00 0.00 H new ATOM 0 HB VAL A 42 -9.508 12.519 -3.127 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -11.031 12.435 -5.084 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -10.411 10.815 -4.687 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -12.068 11.270 -4.226 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -11.409 14.109 -3.272 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -12.446 12.946 -2.413 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -11.058 13.685 -1.580 1.00 0.00 H new ATOM 689 N LEU A 43 -8.213 10.403 -2.017 1.00 0.00 N ATOM 690 CA LEU A 43 -7.073 9.536 -2.295 1.00 0.00 C ATOM 691 C LEU A 43 -7.108 8.282 -1.426 1.00 0.00 C ATOM 692 O LEU A 43 -6.923 7.168 -1.918 1.00 0.00 O ATOM 693 CB LEU A 43 -5.765 10.299 -2.044 1.00 0.00 C ATOM 694 CG LEU A 43 -5.338 11.055 -3.313 1.00 0.00 C ATOM 695 CD1 LEU A 43 -4.867 10.066 -4.389 1.00 0.00 C ATOM 696 CD2 LEU A 43 -6.519 11.875 -3.849 1.00 0.00 C ATOM 0 H LEU A 43 -7.970 11.301 -1.599 1.00 0.00 H new ATOM 0 HA LEU A 43 -7.127 9.231 -3.340 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.898 11.001 -1.221 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.981 9.603 -1.746 1.00 0.00 H new ATOM 0 HG LEU A 43 -4.514 11.724 -3.063 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -4.568 10.615 -5.282 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -4.018 9.495 -4.012 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -5.680 9.384 -4.638 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -6.213 12.409 -4.748 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -7.347 11.207 -4.088 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -6.838 12.592 -3.092 1.00 0.00 H new ATOM 708 N SER A 44 -7.347 8.472 -0.132 1.00 0.00 N ATOM 709 CA SER A 44 -7.404 7.351 0.799 1.00 0.00 C ATOM 710 C SER A 44 -8.311 6.252 0.259 1.00 0.00 C ATOM 711 O SER A 44 -7.949 5.076 0.266 1.00 0.00 O ATOM 712 CB SER A 44 -7.926 7.824 2.156 1.00 0.00 C ATOM 713 OG SER A 44 -7.257 9.023 2.526 1.00 0.00 O ATOM 0 H SER A 44 -7.503 9.386 0.293 1.00 0.00 H new ATOM 0 HA SER A 44 -6.397 6.951 0.917 1.00 0.00 H new ATOM 0 HB2 SER A 44 -9.001 7.995 2.105 1.00 0.00 H new ATOM 0 HB3 SER A 44 -7.761 7.055 2.910 1.00 0.00 H new ATOM 0 HG SER A 44 -7.591 9.329 3.395 1.00 0.00 H new ATOM 719 N ILE A 45 -9.492 6.643 -0.208 1.00 0.00 N ATOM 720 CA ILE A 45 -10.440 5.680 -0.751 1.00 0.00 C ATOM 721 C ILE A 45 -9.867 5.024 -2.002 1.00 0.00 C ATOM 722 O ILE A 45 -10.021 3.822 -2.213 1.00 0.00 O ATOM 723 CB ILE A 45 -11.759 6.375 -1.090 1.00 0.00 C ATOM 724 CG1 ILE A 45 -12.399 6.905 0.196 1.00 0.00 C ATOM 725 CG2 ILE A 45 -12.706 5.373 -1.755 1.00 0.00 C ATOM 726 CD1 ILE A 45 -13.582 7.812 -0.153 1.00 0.00 C ATOM 0 H ILE A 45 -9.813 7.611 -0.221 1.00 0.00 H new ATOM 0 HA ILE A 45 -10.624 4.911 -0.000 1.00 0.00 H new ATOM 0 HB ILE A 45 -11.570 7.204 -1.772 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -12.736 6.074 0.815 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -11.663 7.459 0.779 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -13.647 5.867 -1.997 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -12.250 4.993 -2.669 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -12.896 4.544 -1.073 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -14.035 8.188 0.764 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -13.232 8.651 -0.755 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -14.322 7.244 -0.717 1.00 0.00 H new ATOM 738 N TYR A 46 -9.199 5.823 -2.825 1.00 0.00 N ATOM 739 CA TYR A 46 -8.601 5.300 -4.045 1.00 0.00 C ATOM 740 C TYR A 46 -7.683 4.130 -3.708 1.00 0.00 C ATOM 741 O TYR A 46 -7.770 3.061 -4.312 1.00 0.00 O ATOM 742 CB TYR A 46 -7.804 6.401 -4.753 1.00 0.00 C ATOM 743 CG TYR A 46 -7.741 6.111 -6.237 1.00 0.00 C ATOM 744 CD1 TYR A 46 -6.956 5.053 -6.711 1.00 0.00 C ATOM 745 CD2 TYR A 46 -8.469 6.900 -7.136 1.00 0.00 C ATOM 746 CE1 TYR A 46 -6.898 4.785 -8.084 1.00 0.00 C ATOM 747 CE2 TYR A 46 -8.412 6.631 -8.508 1.00 0.00 C ATOM 748 CZ TYR A 46 -7.626 5.574 -8.983 1.00 0.00 C ATOM 749 OH TYR A 46 -7.569 5.309 -10.336 1.00 0.00 O ATOM 0 H TYR A 46 -9.059 6.822 -2.673 1.00 0.00 H new ATOM 0 HA TYR A 46 -9.393 4.954 -4.710 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -8.273 7.370 -4.582 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -6.797 6.457 -4.340 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -6.395 4.444 -6.018 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -9.074 7.716 -6.770 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -6.292 3.970 -8.450 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -8.975 7.239 -9.201 1.00 0.00 H new ATOM 0 HH TYR A 46 -8.133 5.949 -10.819 1.00 0.00 H new ATOM 759 N GLU A 47 -6.803 4.343 -2.733 1.00 0.00 N ATOM 760 CA GLU A 47 -5.872 3.301 -2.317 1.00 0.00 C ATOM 761 C GLU A 47 -6.632 2.063 -1.850 1.00 0.00 C ATOM 762 O GLU A 47 -6.234 0.934 -2.138 1.00 0.00 O ATOM 763 CB GLU A 47 -4.982 3.814 -1.183 1.00 0.00 C ATOM 764 CG GLU A 47 -4.036 4.889 -1.723 1.00 0.00 C ATOM 765 CD GLU A 47 -3.109 5.371 -0.613 1.00 0.00 C ATOM 766 OE1 GLU A 47 -3.591 5.569 0.490 1.00 0.00 O ATOM 767 OE2 GLU A 47 -1.931 5.537 -0.883 1.00 0.00 O ATOM 0 H GLU A 47 -6.716 5.221 -2.221 1.00 0.00 H new ATOM 0 HA GLU A 47 -5.250 3.033 -3.171 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -5.596 4.224 -0.382 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -4.409 2.991 -0.756 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -3.450 4.488 -2.549 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -4.611 5.727 -2.118 1.00 0.00 H new ATOM 774 N ARG A 48 -7.731 2.282 -1.134 1.00 0.00 N ATOM 775 CA ARG A 48 -8.541 1.174 -0.639 1.00 0.00 C ATOM 776 C ARG A 48 -9.027 0.318 -1.804 1.00 0.00 C ATOM 777 O ARG A 48 -9.072 -0.907 -1.709 1.00 0.00 O ATOM 778 CB ARG A 48 -9.743 1.714 0.142 1.00 0.00 C ATOM 779 CG ARG A 48 -10.559 0.552 0.718 1.00 0.00 C ATOM 780 CD ARG A 48 -9.714 -0.241 1.720 1.00 0.00 C ATOM 781 NE ARG A 48 -10.567 -0.807 2.758 1.00 0.00 N ATOM 782 CZ ARG A 48 -11.485 -1.724 2.470 1.00 0.00 C ATOM 783 NH1 ARG A 48 -11.627 -2.144 1.243 1.00 0.00 N ATOM 784 NH2 ARG A 48 -12.242 -2.208 3.417 1.00 0.00 N ATOM 0 H ARG A 48 -8.079 3.208 -0.885 1.00 0.00 H new ATOM 0 HA ARG A 48 -7.930 0.560 0.022 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -9.401 2.364 0.948 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -10.370 2.320 -0.512 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -11.454 0.934 1.208 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -10.892 -0.103 -0.087 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -9.178 -1.038 1.205 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -8.964 0.409 2.170 1.00 0.00 H new ATOM 0 HE ARG A 48 -10.457 -0.494 3.722 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -11.033 -1.769 0.504 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -12.332 -2.848 1.023 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -12.129 -1.882 4.377 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -12.947 -2.912 3.197 1.00 0.00 H new ATOM 798 N ALA A 49 -9.388 0.975 -2.901 1.00 0.00 N ATOM 799 CA ALA A 49 -9.871 0.268 -4.081 1.00 0.00 C ATOM 800 C ALA A 49 -8.771 -0.614 -4.663 1.00 0.00 C ATOM 801 O ALA A 49 -9.028 -1.735 -5.102 1.00 0.00 O ATOM 802 CB ALA A 49 -10.336 1.271 -5.137 1.00 0.00 C ATOM 0 H ALA A 49 -9.356 1.990 -2.998 1.00 0.00 H new ATOM 0 HA ALA A 49 -10.710 -0.363 -3.786 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -10.695 0.734 -6.015 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -11.142 1.881 -4.729 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -9.502 1.914 -5.420 1.00 0.00 H new ATOM 808 N ALA A 50 -7.545 -0.101 -4.662 1.00 0.00 N ATOM 809 CA ALA A 50 -6.413 -0.853 -5.192 1.00 0.00 C ATOM 810 C ALA A 50 -6.272 -2.187 -4.467 1.00 0.00 C ATOM 811 O ALA A 50 -6.106 -3.233 -5.096 1.00 0.00 O ATOM 812 CB ALA A 50 -5.125 -0.043 -5.031 1.00 0.00 C ATOM 0 H ALA A 50 -7.311 0.825 -4.303 1.00 0.00 H new ATOM 0 HA ALA A 50 -6.590 -1.044 -6.250 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -4.285 -0.612 -5.429 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -5.216 0.897 -5.574 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -4.955 0.164 -3.974 1.00 0.00 H new ATOM 818 N LEU A 51 -6.341 -2.145 -3.140 1.00 0.00 N ATOM 819 CA LEU A 51 -6.220 -3.358 -2.342 1.00 0.00 C ATOM 820 C LEU A 51 -7.517 -4.159 -2.395 1.00 0.00 C ATOM 821 O LEU A 51 -7.498 -5.356 -2.683 1.00 0.00 O ATOM 822 CB LEU A 51 -5.900 -2.997 -0.889 1.00 0.00 C ATOM 823 CG LEU A 51 -5.559 -4.266 -0.099 1.00 0.00 C ATOM 824 CD1 LEU A 51 -4.197 -4.818 -0.548 1.00 0.00 C ATOM 825 CD2 LEU A 51 -5.506 -3.931 1.394 1.00 0.00 C ATOM 0 H LEU A 51 -6.479 -1.291 -2.599 1.00 0.00 H new ATOM 0 HA LEU A 51 -5.412 -3.964 -2.751 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -5.062 -2.300 -0.854 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -6.753 -2.493 -0.434 1.00 0.00 H new ATOM 0 HG LEU A 51 -6.325 -5.019 -0.283 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -3.965 -5.719 0.019 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -4.234 -5.058 -1.611 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -3.425 -4.069 -0.372 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -5.264 -4.830 1.960 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -4.741 -3.174 1.570 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -6.475 -3.550 1.716 1.00 0.00 H new ATOM 837 N PHE A 52 -8.644 -3.506 -2.136 1.00 0.00 N ATOM 838 CA PHE A 52 -9.927 -4.196 -2.185 1.00 0.00 C ATOM 839 C PHE A 52 -9.980 -5.081 -3.426 1.00 0.00 C ATOM 840 O PHE A 52 -10.425 -6.228 -3.371 1.00 0.00 O ATOM 841 CB PHE A 52 -11.072 -3.181 -2.223 1.00 0.00 C ATOM 842 CG PHE A 52 -12.390 -3.910 -2.344 1.00 0.00 C ATOM 843 CD1 PHE A 52 -12.866 -4.676 -1.272 1.00 0.00 C ATOM 844 CD2 PHE A 52 -13.138 -3.818 -3.525 1.00 0.00 C ATOM 845 CE1 PHE A 52 -14.087 -5.350 -1.381 1.00 0.00 C ATOM 846 CE2 PHE A 52 -14.360 -4.493 -3.633 1.00 0.00 C ATOM 847 CZ PHE A 52 -14.835 -5.259 -2.561 1.00 0.00 C ATOM 0 H PHE A 52 -8.696 -2.517 -1.894 1.00 0.00 H new ATOM 0 HA PHE A 52 -10.035 -4.813 -1.293 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -11.063 -2.573 -1.319 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -10.942 -2.502 -3.065 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -12.290 -4.746 -0.361 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -12.772 -3.227 -4.352 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -14.453 -5.941 -0.554 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -14.937 -4.423 -4.543 1.00 0.00 H new ATOM 0 HZ PHE A 52 -15.778 -5.779 -2.645 1.00 0.00 H new ATOM 857 N GLY A 53 -9.507 -4.537 -4.543 1.00 0.00 N ATOM 858 CA GLY A 53 -9.486 -5.280 -5.796 1.00 0.00 C ATOM 859 C GLY A 53 -8.536 -6.468 -5.695 1.00 0.00 C ATOM 860 O GLY A 53 -8.843 -7.562 -6.167 1.00 0.00 O ATOM 0 H GLY A 53 -9.135 -3.589 -4.605 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -10.490 -5.629 -6.036 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -9.174 -4.625 -6.609 1.00 0.00 H new ATOM 864 N VAL A 54 -7.381 -6.247 -5.070 1.00 0.00 N ATOM 865 CA VAL A 54 -6.400 -7.313 -4.906 1.00 0.00 C ATOM 866 C VAL A 54 -7.007 -8.458 -4.101 1.00 0.00 C ATOM 867 O VAL A 54 -6.503 -9.580 -4.104 1.00 0.00 O ATOM 868 CB VAL A 54 -5.149 -6.782 -4.198 1.00 0.00 C ATOM 869 CG1 VAL A 54 -4.264 -7.952 -3.762 1.00 0.00 C ATOM 870 CG2 VAL A 54 -4.363 -5.886 -5.159 1.00 0.00 C ATOM 0 H VAL A 54 -7.105 -5.349 -4.673 1.00 0.00 H new ATOM 0 HA VAL A 54 -6.114 -7.681 -5.892 1.00 0.00 H new ATOM 0 HB VAL A 54 -5.449 -6.209 -3.321 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -3.376 -7.569 -3.259 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -4.820 -8.594 -3.078 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -3.965 -8.528 -4.638 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -3.473 -5.507 -4.657 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -4.068 -6.463 -6.035 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.988 -5.049 -5.470 1.00 0.00 H new ATOM 880 N LEU A 55 -8.104 -8.145 -3.416 1.00 0.00 N ATOM 881 CA LEU A 55 -8.796 -9.139 -2.606 1.00 0.00 C ATOM 882 C LEU A 55 -9.704 -9.990 -3.486 1.00 0.00 C ATOM 883 O LEU A 55 -9.777 -11.209 -3.325 1.00 0.00 O ATOM 884 CB LEU A 55 -9.630 -8.445 -1.522 1.00 0.00 C ATOM 885 CG LEU A 55 -9.970 -9.443 -0.404 1.00 0.00 C ATOM 886 CD1 LEU A 55 -8.816 -9.521 0.600 1.00 0.00 C ATOM 887 CD2 LEU A 55 -11.236 -8.979 0.322 1.00 0.00 C ATOM 0 H LEU A 55 -8.529 -7.218 -3.406 1.00 0.00 H new ATOM 0 HA LEU A 55 -8.055 -9.782 -2.130 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -9.077 -7.600 -1.111 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -10.547 -8.046 -1.956 1.00 0.00 H new ATOM 0 HG LEU A 55 -10.132 -10.427 -0.843 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -9.067 -10.231 1.388 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.911 -9.851 0.089 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -8.648 -8.537 1.038 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -11.480 -9.685 1.116 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -11.067 -7.992 0.753 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -12.064 -8.929 -0.386 1.00 0.00 H new ATOM 899 N GLY A 56 -10.385 -9.338 -4.422 1.00 0.00 N ATOM 900 CA GLY A 56 -11.278 -10.046 -5.332 1.00 0.00 C ATOM 901 C GLY A 56 -10.481 -10.952 -6.261 1.00 0.00 C ATOM 902 O GLY A 56 -10.957 -12.007 -6.681 1.00 0.00 O ATOM 0 H GLY A 56 -10.337 -8.330 -4.570 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -11.993 -10.638 -4.762 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -11.853 -9.329 -5.918 1.00 0.00 H new ATOM 906 N ALA A 57 -9.258 -10.533 -6.569 1.00 0.00 N ATOM 907 CA ALA A 57 -8.393 -11.315 -7.442 1.00 0.00 C ATOM 908 C ALA A 57 -7.816 -12.503 -6.682 1.00 0.00 C ATOM 909 O ALA A 57 -7.630 -13.583 -7.242 1.00 0.00 O ATOM 910 CB ALA A 57 -7.253 -10.441 -7.969 1.00 0.00 C ATOM 0 H ALA A 57 -8.847 -9.663 -6.230 1.00 0.00 H new ATOM 0 HA ALA A 57 -8.984 -11.681 -8.282 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -6.611 -11.034 -8.621 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -7.666 -9.604 -8.531 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -6.668 -10.062 -7.131 1.00 0.00 H new ATOM 916 N ALA A 58 -7.539 -12.294 -5.398 1.00 0.00 N ATOM 917 CA ALA A 58 -6.986 -13.354 -4.562 1.00 0.00 C ATOM 918 C ALA A 58 -7.978 -14.505 -4.439 1.00 0.00 C ATOM 919 O ALA A 58 -7.595 -15.674 -4.485 1.00 0.00 O ATOM 920 CB ALA A 58 -6.661 -12.805 -3.172 1.00 0.00 C ATOM 0 H ALA A 58 -7.687 -11.407 -4.917 1.00 0.00 H new ATOM 0 HA ALA A 58 -6.072 -13.724 -5.028 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -6.249 -13.602 -2.553 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -5.932 -12.000 -3.260 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -7.571 -12.421 -2.710 1.00 0.00 H new ATOM 926 N LEU A 59 -9.254 -14.168 -4.286 1.00 0.00 N ATOM 927 CA LEU A 59 -10.291 -15.187 -4.164 1.00 0.00 C ATOM 928 C LEU A 59 -10.399 -15.982 -5.461 1.00 0.00 C ATOM 929 O LEU A 59 -10.528 -17.207 -5.444 1.00 0.00 O ATOM 930 CB LEU A 59 -11.641 -14.526 -3.840 1.00 0.00 C ATOM 931 CG LEU A 59 -12.008 -14.752 -2.365 1.00 0.00 C ATOM 932 CD1 LEU A 59 -12.279 -16.244 -2.113 1.00 0.00 C ATOM 933 CD2 LEU A 59 -10.856 -14.273 -1.467 1.00 0.00 C ATOM 0 H LEU A 59 -9.593 -13.207 -4.244 1.00 0.00 H new ATOM 0 HA LEU A 59 -10.025 -15.866 -3.354 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -11.589 -13.457 -4.049 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -12.419 -14.939 -4.482 1.00 0.00 H new ATOM 0 HG LEU A 59 -12.908 -14.184 -2.130 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -12.538 -16.395 -1.065 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -13.105 -16.575 -2.742 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -11.386 -16.822 -2.353 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -11.118 -14.434 -0.421 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -9.952 -14.834 -1.705 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -10.679 -13.211 -1.637 1.00 0.00 H new ATOM 945 N ILE A 60 -10.343 -15.276 -6.586 1.00 0.00 N ATOM 946 CA ILE A 60 -10.432 -15.924 -7.889 1.00 0.00 C ATOM 947 C ILE A 60 -9.210 -16.803 -8.134 1.00 0.00 C ATOM 948 O ILE A 60 -9.319 -17.892 -8.696 1.00 0.00 O ATOM 949 CB ILE A 60 -10.532 -14.865 -8.989 1.00 0.00 C ATOM 950 CG1 ILE A 60 -11.837 -14.081 -8.826 1.00 0.00 C ATOM 951 CG2 ILE A 60 -10.518 -15.546 -10.359 1.00 0.00 C ATOM 952 CD1 ILE A 60 -11.780 -12.811 -9.676 1.00 0.00 C ATOM 0 H ILE A 60 -10.237 -14.262 -6.622 1.00 0.00 H new ATOM 0 HA ILE A 60 -11.324 -16.551 -7.905 1.00 0.00 H new ATOM 0 HB ILE A 60 -9.684 -14.184 -8.913 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -12.684 -14.697 -9.130 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -11.990 -13.823 -7.778 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -10.589 -14.791 -11.142 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -9.590 -16.105 -10.478 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -11.365 -16.228 -10.435 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -12.709 -12.253 -9.560 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -10.943 -12.193 -9.351 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -11.647 -13.080 -10.724 1.00 0.00 H new ATOM 964 N GLY A 61 -8.046 -16.320 -7.710 1.00 0.00 N ATOM 965 CA GLY A 61 -6.808 -17.068 -7.892 1.00 0.00 C ATOM 966 C GLY A 61 -6.762 -18.287 -6.977 1.00 0.00 C ATOM 967 O GLY A 61 -6.020 -19.235 -7.229 1.00 0.00 O ATOM 0 H GLY A 61 -7.935 -15.421 -7.242 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -6.721 -17.386 -8.931 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -5.955 -16.422 -7.684 1.00 0.00 H new ATOM 971 N ALA A 62 -7.558 -18.255 -5.912 1.00 0.00 N ATOM 972 CA ALA A 62 -7.597 -19.364 -4.966 1.00 0.00 C ATOM 973 C ALA A 62 -8.540 -20.459 -5.458 1.00 0.00 C ATOM 974 O ALA A 62 -8.765 -21.452 -4.766 1.00 0.00 O ATOM 975 CB ALA A 62 -8.063 -18.862 -3.597 1.00 0.00 C ATOM 0 H ALA A 62 -8.180 -17.479 -5.684 1.00 0.00 H new ATOM 0 HA ALA A 62 -6.593 -19.780 -4.880 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -8.090 -19.695 -2.894 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -7.371 -18.102 -3.233 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -9.060 -18.431 -3.688 1.00 0.00 H new ATOM 981 N ILE A 63 -9.090 -20.271 -6.653 1.00 0.00 N ATOM 982 CA ILE A 63 -10.012 -21.249 -7.222 1.00 0.00 C ATOM 983 C ILE A 63 -9.252 -22.396 -7.880 1.00 0.00 C ATOM 984 O ILE A 63 -9.547 -23.566 -7.635 1.00 0.00 O ATOM 985 CB ILE A 63 -10.919 -20.576 -8.254 1.00 0.00 C ATOM 986 CG1 ILE A 63 -11.828 -19.568 -7.546 1.00 0.00 C ATOM 987 CG2 ILE A 63 -11.779 -21.636 -8.949 1.00 0.00 C ATOM 988 CD1 ILE A 63 -12.602 -18.756 -8.585 1.00 0.00 C ATOM 0 H ILE A 63 -8.916 -19.457 -7.243 1.00 0.00 H new ATOM 0 HA ILE A 63 -10.619 -21.654 -6.412 1.00 0.00 H new ATOM 0 HB ILE A 63 -10.308 -20.062 -8.996 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -12.522 -20.089 -6.887 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -11.233 -18.903 -6.920 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -12.425 -21.156 -9.684 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -11.133 -22.357 -9.450 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -12.392 -22.150 -8.209 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -13.248 -18.039 -8.079 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -11.900 -18.222 -9.226 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -13.210 -19.427 -9.192 1.00 0.00 H new ATOM 1000 N ALA A 64 -8.276 -22.059 -8.718 1.00 0.00 N ATOM 1001 CA ALA A 64 -7.487 -23.076 -9.404 1.00 0.00 C ATOM 1002 C ALA A 64 -6.453 -22.419 -10.318 1.00 0.00 C ATOM 1003 O ALA A 64 -6.634 -22.361 -11.534 1.00 0.00 O ATOM 1004 CB ALA A 64 -8.407 -23.977 -10.234 1.00 0.00 C ATOM 0 H ALA A 64 -8.014 -21.098 -8.937 1.00 0.00 H new ATOM 0 HA ALA A 64 -6.968 -23.677 -8.657 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -7.811 -24.734 -10.744 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -9.128 -24.464 -9.578 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -8.937 -23.375 -10.972 1.00 0.00 H new ATOM 1010 N PRO A 65 -5.385 -21.921 -9.752 1.00 0.00 N ATOM 1011 CA PRO A 65 -4.303 -21.247 -10.520 1.00 0.00 C ATOM 1012 C PRO A 65 -3.323 -22.242 -11.136 1.00 0.00 C ATOM 1013 O PRO A 65 -2.188 -21.891 -11.464 1.00 0.00 O ATOM 1014 CB PRO A 65 -3.621 -20.380 -9.462 1.00 0.00 C ATOM 1015 CG PRO A 65 -3.802 -21.121 -8.175 1.00 0.00 C ATOM 1016 CD PRO A 65 -5.089 -21.947 -8.311 1.00 0.00 C ATOM 0 HA PRO A 65 -4.684 -20.680 -11.369 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -2.565 -20.238 -9.690 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -4.073 -19.389 -9.413 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -2.947 -21.768 -7.979 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -3.875 -20.427 -7.337 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -4.948 -22.966 -7.952 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -5.903 -21.514 -7.729 1.00 0.00 H new ATOM 1024 N LYS A 66 -3.771 -23.484 -11.296 1.00 0.00 N ATOM 1025 CA LYS A 66 -2.931 -24.524 -11.882 1.00 0.00 C ATOM 1026 C LYS A 66 -3.238 -24.664 -13.368 1.00 0.00 C ATOM 1027 O LYS A 66 -2.541 -25.369 -14.098 1.00 0.00 O ATOM 1028 CB LYS A 66 -3.178 -25.861 -11.175 1.00 0.00 C ATOM 1029 CG LYS A 66 -1.972 -26.780 -11.383 1.00 0.00 C ATOM 1030 CD LYS A 66 -2.282 -28.174 -10.828 1.00 0.00 C ATOM 1031 CE LYS A 66 -3.398 -28.835 -11.649 1.00 0.00 C ATOM 1032 NZ LYS A 66 -4.702 -28.646 -10.953 1.00 0.00 N ATOM 0 H LYS A 66 -4.706 -23.794 -11.030 1.00 0.00 H new ATOM 0 HA LYS A 66 -1.885 -24.243 -11.757 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -3.343 -25.696 -10.110 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -4.079 -26.331 -11.569 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -1.732 -26.846 -12.444 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -1.097 -26.366 -10.883 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -1.385 -28.792 -10.856 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -2.585 -28.099 -9.784 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -3.439 -28.397 -12.647 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -3.191 -29.898 -11.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -4.998 -29.544 -10.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -4.599 -27.922 -10.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -5.421 -28.340 -11.639 1.00 0.00 H new ATOM 1046 N THR A 67 -4.289 -23.976 -13.804 1.00 0.00 N ATOM 1047 CA THR A 67 -4.700 -24.007 -15.205 1.00 0.00 C ATOM 1048 C THR A 67 -4.411 -22.654 -15.852 1.00 0.00 C ATOM 1049 O THR A 67 -3.939 -21.734 -15.185 1.00 0.00 O ATOM 1050 CB THR A 67 -6.199 -24.331 -15.297 1.00 0.00 C ATOM 1051 OG1 THR A 67 -6.919 -23.154 -15.643 1.00 0.00 O ATOM 1052 CG2 THR A 67 -6.703 -24.856 -13.949 1.00 0.00 C ATOM 0 H THR A 67 -4.872 -23.390 -13.207 1.00 0.00 H new ATOM 0 HA THR A 67 -4.140 -24.779 -15.733 1.00 0.00 H new ATOM 0 HB THR A 67 -6.353 -25.093 -16.061 1.00 0.00 H new ATOM 0 HG1 THR A 67 -7.875 -23.361 -15.703 1.00 0.00 H new ATOM 0 HG21 THR A 67 -7.766 -25.084 -14.022 1.00 0.00 H new ATOM 0 HG22 THR A 67 -6.156 -25.760 -13.683 1.00 0.00 H new ATOM 0 HG23 THR A 67 -6.546 -24.098 -13.182 1.00 0.00 H new ATOM 1060 N PRO A 68 -4.678 -22.510 -17.125 1.00 0.00 N ATOM 1061 CA PRO A 68 -4.430 -21.228 -17.852 1.00 0.00 C ATOM 1062 C PRO A 68 -5.030 -20.025 -17.126 1.00 0.00 C ATOM 1063 O PRO A 68 -4.907 -18.888 -17.583 1.00 0.00 O ATOM 1064 CB PRO A 68 -5.101 -21.448 -19.213 1.00 0.00 C ATOM 1065 CG PRO A 68 -5.097 -22.928 -19.408 1.00 0.00 C ATOM 1066 CD PRO A 68 -5.240 -23.540 -18.016 1.00 0.00 C ATOM 0 HA PRO A 68 -3.367 -21.000 -17.931 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -6.116 -21.051 -19.222 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -4.554 -20.943 -20.009 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -5.917 -23.238 -20.056 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -4.173 -23.256 -19.885 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -6.282 -23.752 -17.776 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -4.696 -24.481 -17.934 1.00 0.00 H new ATOM 1074 N LEU A 69 -5.677 -20.281 -15.991 1.00 0.00 N ATOM 1075 CA LEU A 69 -6.287 -19.210 -15.212 1.00 0.00 C ATOM 1076 C LEU A 69 -5.224 -18.228 -14.725 1.00 0.00 C ATOM 1077 O LEU A 69 -5.504 -17.048 -14.521 1.00 0.00 O ATOM 1078 CB LEU A 69 -7.033 -19.799 -14.009 1.00 0.00 C ATOM 1079 CG LEU A 69 -8.357 -20.424 -14.470 1.00 0.00 C ATOM 1080 CD1 LEU A 69 -8.792 -21.498 -13.469 1.00 0.00 C ATOM 1081 CD2 LEU A 69 -9.443 -19.345 -14.552 1.00 0.00 C ATOM 0 H LEU A 69 -5.791 -21.214 -15.594 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.991 -18.677 -15.850 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.416 -20.553 -13.521 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -7.226 -19.019 -13.272 1.00 0.00 H new ATOM 0 HG LEU A 69 -8.215 -20.871 -15.454 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -9.732 -21.941 -13.797 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -8.027 -22.272 -13.410 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -8.927 -21.046 -12.486 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -10.380 -19.796 -14.880 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -9.582 -18.893 -13.570 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.141 -18.578 -15.265 1.00 0.00 H new ATOM 1093 N ARG A 70 -4.005 -18.721 -14.538 1.00 0.00 N ATOM 1094 CA ARG A 70 -2.913 -17.869 -14.073 1.00 0.00 C ATOM 1095 C ARG A 70 -2.953 -16.512 -14.777 1.00 0.00 C ATOM 1096 O ARG A 70 -3.185 -15.492 -14.129 1.00 0.00 O ATOM 1097 CB ARG A 70 -1.561 -18.551 -14.335 1.00 0.00 C ATOM 1098 CG ARG A 70 -1.760 -20.068 -14.460 1.00 0.00 C ATOM 1099 CD ARG A 70 -0.432 -20.788 -14.207 1.00 0.00 C ATOM 1100 NE ARG A 70 -0.207 -20.941 -12.773 1.00 0.00 N ATOM 1101 CZ ARG A 70 0.540 -21.931 -12.293 1.00 0.00 C ATOM 1102 NH1 ARG A 70 1.093 -22.788 -13.108 1.00 0.00 N ATOM 1103 NH2 ARG A 70 0.721 -22.046 -11.006 1.00 0.00 N ATOM 0 H ARG A 70 -3.748 -19.695 -14.699 1.00 0.00 H new ATOM 0 HA ARG A 70 -3.033 -17.711 -13.001 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -1.115 -18.157 -15.248 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -0.869 -18.331 -13.522 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -2.509 -20.406 -13.744 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -2.134 -20.314 -15.454 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -0.443 -21.766 -14.687 1.00 0.00 H new ATOM 0 HD3 ARG A 70 0.387 -20.223 -14.653 1.00 0.00 H new ATOM 0 HE ARG A 70 -0.631 -20.276 -12.126 1.00 0.00 H new ATOM 0 HH11 ARG A 70 0.952 -22.699 -14.114 1.00 0.00 H new ATOM 0 HH12 ARG A 70 1.666 -23.547 -12.738 1.00 0.00 H new ATOM 0 HH21 ARG A 70 0.290 -21.377 -10.369 1.00 0.00 H new ATOM 0 HH22 ARG A 70 1.294 -22.805 -10.637 1.00 0.00 H new ATOM 1117 N TYR A 71 -2.748 -16.481 -16.091 1.00 0.00 N ATOM 1118 CA TYR A 71 -2.796 -15.209 -16.809 1.00 0.00 C ATOM 1119 C TYR A 71 -4.134 -14.521 -16.549 1.00 0.00 C ATOM 1120 O TYR A 71 -4.187 -13.299 -16.424 1.00 0.00 O ATOM 1121 CB TYR A 71 -2.621 -15.446 -18.313 1.00 0.00 C ATOM 1122 CG TYR A 71 -1.154 -15.615 -18.630 1.00 0.00 C ATOM 1123 CD1 TYR A 71 -0.341 -14.488 -18.800 1.00 0.00 C ATOM 1124 CD2 TYR A 71 -0.607 -16.897 -18.753 1.00 0.00 C ATOM 1125 CE1 TYR A 71 1.019 -14.645 -19.093 1.00 0.00 C ATOM 1126 CE2 TYR A 71 0.753 -17.054 -19.046 1.00 0.00 C ATOM 1127 CZ TYR A 71 1.565 -15.927 -19.216 1.00 0.00 C ATOM 1128 OH TYR A 71 2.907 -16.080 -19.503 1.00 0.00 O ATOM 0 H TYR A 71 -2.552 -17.298 -16.669 1.00 0.00 H new ATOM 0 HA TYR A 71 -1.986 -14.571 -16.454 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -3.174 -16.334 -18.619 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -3.031 -14.606 -18.874 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -0.763 -13.498 -18.705 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -1.234 -17.766 -18.622 1.00 0.00 H new ATOM 0 HE1 TYR A 71 1.647 -13.776 -19.224 1.00 0.00 H new ATOM 0 HE2 TYR A 71 1.175 -18.044 -19.141 1.00 0.00 H new ATOM 0 HH TYR A 71 3.124 -17.034 -19.553 1.00 0.00 H new ATOM 1138 N VAL A 72 -5.215 -15.288 -16.494 1.00 0.00 N ATOM 1139 CA VAL A 72 -6.536 -14.704 -16.283 1.00 0.00 C ATOM 1140 C VAL A 72 -6.594 -13.904 -14.986 1.00 0.00 C ATOM 1141 O VAL A 72 -6.948 -12.727 -15.005 1.00 0.00 O ATOM 1142 CB VAL A 72 -7.603 -15.800 -16.261 1.00 0.00 C ATOM 1143 CG1 VAL A 72 -8.991 -15.157 -16.289 1.00 0.00 C ATOM 1144 CG2 VAL A 72 -7.437 -16.695 -17.493 1.00 0.00 C ATOM 0 H VAL A 72 -5.206 -16.303 -16.591 1.00 0.00 H new ATOM 0 HA VAL A 72 -6.731 -14.023 -17.112 1.00 0.00 H new ATOM 0 HB VAL A 72 -7.493 -16.397 -15.356 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -9.753 -15.936 -16.273 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -9.112 -14.514 -15.417 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -9.098 -14.562 -17.196 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -8.196 -17.477 -17.480 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -7.550 -16.095 -18.396 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -6.447 -17.151 -17.481 1.00 0.00 H new ATOM 1154 N ALA A 73 -6.244 -14.517 -13.865 1.00 0.00 N ATOM 1155 CA ALA A 73 -6.262 -13.807 -12.589 1.00 0.00 C ATOM 1156 C ALA A 73 -5.159 -12.748 -12.555 1.00 0.00 C ATOM 1157 O ALA A 73 -5.315 -11.681 -11.954 1.00 0.00 O ATOM 1158 CB ALA A 73 -6.062 -14.795 -11.438 1.00 0.00 C ATOM 0 H ALA A 73 -5.947 -15.491 -13.809 1.00 0.00 H new ATOM 0 HA ALA A 73 -7.229 -13.315 -12.478 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -6.077 -14.257 -10.490 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -6.864 -15.533 -11.449 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -5.103 -15.299 -11.554 1.00 0.00 H new ATOM 1164 N MET A 74 -4.041 -13.051 -13.208 1.00 0.00 N ATOM 1165 CA MET A 74 -2.918 -12.123 -13.249 1.00 0.00 C ATOM 1166 C MET A 74 -3.298 -10.846 -13.993 1.00 0.00 C ATOM 1167 O MET A 74 -2.713 -9.789 -13.764 1.00 0.00 O ATOM 1168 CB MET A 74 -1.723 -12.780 -13.943 1.00 0.00 C ATOM 1169 CG MET A 74 -0.449 -11.989 -13.636 1.00 0.00 C ATOM 1170 SD MET A 74 0.800 -12.346 -14.896 1.00 0.00 S ATOM 1171 CE MET A 74 2.139 -11.368 -14.172 1.00 0.00 C ATOM 0 H MET A 74 -3.890 -13.925 -13.712 1.00 0.00 H new ATOM 0 HA MET A 74 -2.650 -11.866 -12.224 1.00 0.00 H new ATOM 0 HB2 MET A 74 -1.614 -13.810 -13.603 1.00 0.00 H new ATOM 0 HB3 MET A 74 -1.890 -12.816 -15.020 1.00 0.00 H new ATOM 0 HG2 MET A 74 -0.667 -10.921 -13.617 1.00 0.00 H new ATOM 0 HG3 MET A 74 -0.072 -12.255 -12.649 1.00 0.00 H new ATOM 0 HE1 MET A 74 3.027 -11.446 -14.800 1.00 0.00 H new ATOM 0 HE2 MET A 74 1.832 -10.324 -14.105 1.00 0.00 H new ATOM 0 HE3 MET A 74 2.366 -11.744 -13.174 1.00 0.00 H new ATOM 1181 N VAL A 75 -4.276 -10.950 -14.889 1.00 0.00 N ATOM 1182 CA VAL A 75 -4.708 -9.789 -15.658 1.00 0.00 C ATOM 1183 C VAL A 75 -5.040 -8.622 -14.733 1.00 0.00 C ATOM 1184 O VAL A 75 -4.838 -7.456 -15.072 1.00 0.00 O ATOM 1185 CB VAL A 75 -5.927 -10.141 -16.523 1.00 0.00 C ATOM 1186 CG1 VAL A 75 -6.558 -8.854 -17.069 1.00 0.00 C ATOM 1187 CG2 VAL A 75 -5.490 -11.034 -17.697 1.00 0.00 C ATOM 0 H VAL A 75 -4.777 -11.813 -15.098 1.00 0.00 H new ATOM 0 HA VAL A 75 -3.888 -9.490 -16.312 1.00 0.00 H new ATOM 0 HB VAL A 75 -6.657 -10.675 -15.914 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -7.423 -9.105 -17.683 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -6.873 -8.223 -16.238 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.827 -8.319 -17.674 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -6.358 -11.282 -18.308 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -4.757 -10.503 -18.305 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -5.045 -11.951 -17.311 1.00 0.00 H new ATOM 1197 N ILE A 76 -5.546 -8.970 -13.549 1.00 0.00 N ATOM 1198 CA ILE A 76 -5.910 -7.975 -12.547 1.00 0.00 C ATOM 1199 C ILE A 76 -4.711 -7.663 -11.659 1.00 0.00 C ATOM 1200 O ILE A 76 -4.559 -6.541 -11.178 1.00 0.00 O ATOM 1201 CB ILE A 76 -7.067 -8.493 -11.682 1.00 0.00 C ATOM 1202 CG1 ILE A 76 -8.359 -8.524 -12.507 1.00 0.00 C ATOM 1203 CG2 ILE A 76 -7.263 -7.567 -10.477 1.00 0.00 C ATOM 1204 CD1 ILE A 76 -8.324 -9.697 -13.490 1.00 0.00 C ATOM 0 H ILE A 76 -5.712 -9.935 -13.263 1.00 0.00 H new ATOM 0 HA ILE A 76 -6.225 -7.066 -13.059 1.00 0.00 H new ATOM 0 HB ILE A 76 -6.830 -9.500 -11.338 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -9.220 -8.618 -11.846 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -8.476 -7.586 -13.051 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -8.085 -7.937 -9.864 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -6.349 -7.544 -9.883 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -7.494 -6.560 -10.825 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -9.246 -9.712 -14.072 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -7.473 -9.584 -14.161 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -8.229 -10.632 -12.938 1.00 0.00 H new ATOM 1216 N TRP A 77 -3.854 -8.661 -11.451 1.00 0.00 N ATOM 1217 CA TRP A 77 -2.667 -8.467 -10.626 1.00 0.00 C ATOM 1218 C TRP A 77 -1.722 -7.481 -11.304 1.00 0.00 C ATOM 1219 O TRP A 77 -1.254 -6.529 -10.682 1.00 0.00 O ATOM 1220 CB TRP A 77 -1.955 -9.808 -10.406 1.00 0.00 C ATOM 1221 CG TRP A 77 -1.124 -9.754 -9.159 1.00 0.00 C ATOM 1222 CD1 TRP A 77 0.044 -9.080 -9.024 1.00 0.00 C ATOM 1223 CD2 TRP A 77 -1.377 -10.393 -7.873 1.00 0.00 C ATOM 1224 NE1 TRP A 77 0.527 -9.274 -7.738 1.00 0.00 N ATOM 1225 CE2 TRP A 77 -0.316 -10.073 -6.991 1.00 0.00 C ATOM 1226 CE3 TRP A 77 -2.413 -11.214 -7.393 1.00 0.00 C ATOM 1227 CZ2 TRP A 77 -0.287 -10.550 -5.680 1.00 0.00 C ATOM 1228 CZ3 TRP A 77 -2.386 -11.695 -6.074 1.00 0.00 C ATOM 1229 CH2 TRP A 77 -1.325 -11.364 -5.219 1.00 0.00 C ATOM 0 H TRP A 77 -3.958 -9.599 -11.837 1.00 0.00 H new ATOM 0 HA TRP A 77 -2.968 -8.065 -9.659 1.00 0.00 H new ATOM 0 HB2 TRP A 77 -2.689 -10.610 -10.328 1.00 0.00 H new ATOM 0 HB3 TRP A 77 -1.323 -10.037 -11.264 1.00 0.00 H new ATOM 0 HD1 TRP A 77 0.521 -8.489 -9.792 1.00 0.00 H new ATOM 0 HE1 TRP A 77 1.398 -8.875 -7.387 1.00 0.00 H new ATOM 0 HE3 TRP A 77 -3.235 -11.476 -8.043 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 0.533 -10.292 -5.026 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 -3.188 -12.324 -5.716 1.00 0.00 H new ATOM 0 HH2 TRP A 77 -1.310 -11.738 -4.206 1.00 0.00 H new ATOM 1240 N LEU A 78 -1.452 -7.712 -12.586 1.00 0.00 N ATOM 1241 CA LEU A 78 -0.571 -6.834 -13.345 1.00 0.00 C ATOM 1242 C LEU A 78 -1.229 -5.471 -13.545 1.00 0.00 C ATOM 1243 O LEU A 78 -0.588 -4.433 -13.395 1.00 0.00 O ATOM 1244 CB LEU A 78 -0.254 -7.457 -14.707 1.00 0.00 C ATOM 1245 CG LEU A 78 0.849 -6.651 -15.407 1.00 0.00 C ATOM 1246 CD1 LEU A 78 2.214 -6.984 -14.792 1.00 0.00 C ATOM 1247 CD2 LEU A 78 0.865 -7.002 -16.897 1.00 0.00 C ATOM 0 H LEU A 78 -1.829 -8.496 -13.118 1.00 0.00 H new ATOM 0 HA LEU A 78 0.356 -6.703 -12.786 1.00 0.00 H new ATOM 0 HB2 LEU A 78 0.066 -8.491 -14.578 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -1.151 -7.475 -15.326 1.00 0.00 H new ATOM 0 HG LEU A 78 0.650 -5.587 -15.280 1.00 0.00 H new ATOM 0 HD11 LEU A 78 2.990 -6.407 -15.295 1.00 0.00 H new ATOM 0 HD12 LEU A 78 2.206 -6.734 -13.731 1.00 0.00 H new ATOM 0 HD13 LEU A 78 2.417 -8.048 -14.912 1.00 0.00 H new ATOM 0 HD21 LEU A 78 1.647 -6.431 -17.397 1.00 0.00 H new ATOM 0 HD22 LEU A 78 1.060 -8.068 -17.018 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.101 -6.758 -17.339 1.00 0.00 H new ATOM 1259 N TYR A 79 -2.514 -5.482 -13.883 1.00 0.00 N ATOM 1260 CA TYR A 79 -3.242 -4.237 -14.094 1.00 0.00 C ATOM 1261 C TYR A 79 -2.962 -3.261 -12.956 1.00 0.00 C ATOM 1262 O TYR A 79 -2.688 -2.082 -13.186 1.00 0.00 O ATOM 1263 CB TYR A 79 -4.745 -4.516 -14.175 1.00 0.00 C ATOM 1264 CG TYR A 79 -5.497 -3.210 -14.276 1.00 0.00 C ATOM 1265 CD1 TYR A 79 -5.918 -2.553 -13.115 1.00 0.00 C ATOM 1266 CD2 TYR A 79 -5.772 -2.658 -15.533 1.00 0.00 C ATOM 1267 CE1 TYR A 79 -6.616 -1.342 -13.209 1.00 0.00 C ATOM 1268 CE2 TYR A 79 -6.470 -1.448 -15.627 1.00 0.00 C ATOM 1269 CZ TYR A 79 -6.892 -0.790 -14.466 1.00 0.00 C ATOM 1270 OH TYR A 79 -7.580 0.402 -14.559 1.00 0.00 O ATOM 0 H TYR A 79 -3.067 -6.329 -14.015 1.00 0.00 H new ATOM 0 HA TYR A 79 -2.908 -3.793 -15.032 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -4.963 -5.141 -15.041 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -5.071 -5.068 -13.293 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -5.705 -2.979 -12.146 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -5.446 -3.165 -16.429 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -6.941 -0.835 -12.313 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -6.683 -1.022 -16.596 1.00 0.00 H new ATOM 0 HH TYR A 79 -7.687 0.645 -15.502 1.00 0.00 H new ATOM 1280 N SER A 80 -3.031 -3.762 -11.726 1.00 0.00 N ATOM 1281 CA SER A 80 -2.785 -2.931 -10.554 1.00 0.00 C ATOM 1282 C SER A 80 -1.287 -2.745 -10.328 1.00 0.00 C ATOM 1283 O SER A 80 -0.868 -1.806 -9.654 1.00 0.00 O ATOM 1284 CB SER A 80 -3.414 -3.576 -9.320 1.00 0.00 C ATOM 1285 OG SER A 80 -2.992 -4.930 -9.230 1.00 0.00 O ATOM 0 H SER A 80 -3.254 -4.735 -11.516 1.00 0.00 H new ATOM 0 HA SER A 80 -3.235 -1.953 -10.724 1.00 0.00 H new ATOM 0 HB2 SER A 80 -3.121 -3.032 -8.422 1.00 0.00 H new ATOM 0 HB3 SER A 80 -4.501 -3.525 -9.383 1.00 0.00 H new ATOM 0 HG SER A 80 -2.294 -5.100 -9.897 1.00 0.00 H new ATOM 1291 N ALA A 81 -0.483 -3.647 -10.875 1.00 0.00 N ATOM 1292 CA ALA A 81 0.962 -3.559 -10.694 1.00 0.00 C ATOM 1293 C ALA A 81 1.503 -2.242 -11.241 1.00 0.00 C ATOM 1294 O ALA A 81 2.087 -1.448 -10.503 1.00 0.00 O ATOM 1295 CB ALA A 81 1.659 -4.726 -11.394 1.00 0.00 C ATOM 0 H ALA A 81 -0.799 -4.436 -11.439 1.00 0.00 H new ATOM 0 HA ALA A 81 1.167 -3.604 -9.624 1.00 0.00 H new ATOM 0 HB1 ALA A 81 2.736 -4.646 -11.250 1.00 0.00 H new ATOM 0 HB2 ALA A 81 1.305 -5.667 -10.972 1.00 0.00 H new ATOM 0 HB3 ALA A 81 1.433 -4.698 -12.460 1.00 0.00 H new ATOM 1301 N PHE A 82 1.312 -2.021 -12.534 1.00 0.00 N ATOM 1302 CA PHE A 82 1.798 -0.797 -13.164 1.00 0.00 C ATOM 1303 C PHE A 82 0.904 0.392 -12.817 1.00 0.00 C ATOM 1304 O PHE A 82 1.395 1.456 -12.445 1.00 0.00 O ATOM 1305 CB PHE A 82 1.848 -0.978 -14.685 1.00 0.00 C ATOM 1306 CG PHE A 82 2.842 -0.006 -15.277 1.00 0.00 C ATOM 1307 CD1 PHE A 82 4.215 -0.214 -15.097 1.00 0.00 C ATOM 1308 CD2 PHE A 82 2.392 1.103 -16.005 1.00 0.00 C ATOM 1309 CE1 PHE A 82 5.137 0.685 -15.645 1.00 0.00 C ATOM 1310 CE2 PHE A 82 3.314 2.003 -16.551 1.00 0.00 C ATOM 1311 CZ PHE A 82 4.687 1.794 -16.371 1.00 0.00 C ATOM 0 H PHE A 82 0.830 -2.663 -13.163 1.00 0.00 H new ATOM 0 HA PHE A 82 2.800 -0.595 -12.786 1.00 0.00 H new ATOM 0 HB2 PHE A 82 2.133 -2.001 -14.931 1.00 0.00 H new ATOM 0 HB3 PHE A 82 0.860 -0.811 -15.114 1.00 0.00 H new ATOM 0 HD1 PHE A 82 4.563 -1.068 -14.535 1.00 0.00 H new ATOM 0 HD2 PHE A 82 1.333 1.263 -16.145 1.00 0.00 H new ATOM 0 HE1 PHE A 82 6.196 0.523 -15.508 1.00 0.00 H new ATOM 0 HE2 PHE A 82 2.967 2.859 -17.111 1.00 0.00 H new ATOM 0 HZ PHE A 82 5.399 2.489 -16.792 1.00 0.00 H new ATOM 1321 N ARG A 83 -0.405 0.216 -12.963 1.00 0.00 N ATOM 1322 CA ARG A 83 -1.348 1.296 -12.685 1.00 0.00 C ATOM 1323 C ARG A 83 -1.394 1.644 -11.198 1.00 0.00 C ATOM 1324 O ARG A 83 -1.398 2.820 -10.836 1.00 0.00 O ATOM 1325 CB ARG A 83 -2.750 0.895 -13.153 1.00 0.00 C ATOM 1326 CG ARG A 83 -2.688 0.391 -14.600 1.00 0.00 C ATOM 1327 CD ARG A 83 -2.298 1.540 -15.534 1.00 0.00 C ATOM 1328 NE ARG A 83 -2.681 1.227 -16.906 1.00 0.00 N ATOM 1329 CZ ARG A 83 -3.957 1.210 -17.278 1.00 0.00 C ATOM 1330 NH1 ARG A 83 -4.894 1.473 -16.409 1.00 0.00 N ATOM 1331 NH2 ARG A 83 -4.272 0.931 -18.514 1.00 0.00 N ATOM 0 H ARG A 83 -0.836 -0.656 -13.270 1.00 0.00 H new ATOM 0 HA ARG A 83 -1.007 2.177 -13.229 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -3.152 0.117 -12.504 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -3.425 1.748 -13.084 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -1.963 -0.418 -14.682 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -3.655 -0.017 -14.894 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -2.786 2.460 -15.214 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -1.223 1.714 -15.479 1.00 0.00 H new ATOM 0 HE ARG A 83 -1.956 1.017 -17.593 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -4.647 1.692 -15.444 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -5.873 1.460 -16.695 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -3.539 0.726 -19.193 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -5.251 0.918 -18.800 1.00 0.00 H new ATOM 1345 N GLY A 84 -1.426 0.634 -10.337 1.00 0.00 N ATOM 1346 CA GLY A 84 -1.467 0.885 -8.900 1.00 0.00 C ATOM 1347 C GLY A 84 -0.233 1.660 -8.448 1.00 0.00 C ATOM 1348 O GLY A 84 -0.342 2.636 -7.707 1.00 0.00 O ATOM 0 H GLY A 84 -1.424 -0.351 -10.601 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -2.367 1.448 -8.650 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -1.524 -0.062 -8.363 1.00 0.00 H new ATOM 1352 N VAL A 85 0.941 1.212 -8.882 1.00 0.00 N ATOM 1353 CA VAL A 85 2.187 1.866 -8.494 1.00 0.00 C ATOM 1354 C VAL A 85 2.376 3.185 -9.243 1.00 0.00 C ATOM 1355 O VAL A 85 2.958 4.131 -8.710 1.00 0.00 O ATOM 1356 CB VAL A 85 3.371 0.931 -8.765 1.00 0.00 C ATOM 1357 CG1 VAL A 85 4.686 1.710 -8.649 1.00 0.00 C ATOM 1358 CG2 VAL A 85 3.366 -0.208 -7.737 1.00 0.00 C ATOM 0 H VAL A 85 1.056 0.406 -9.497 1.00 0.00 H new ATOM 0 HA VAL A 85 2.138 2.089 -7.428 1.00 0.00 H new ATOM 0 HB VAL A 85 3.281 0.521 -9.771 1.00 0.00 H new ATOM 0 HG11 VAL A 85 5.524 1.040 -8.843 1.00 0.00 H new ATOM 0 HG12 VAL A 85 4.694 2.521 -9.377 1.00 0.00 H new ATOM 0 HG13 VAL A 85 4.777 2.123 -7.645 1.00 0.00 H new ATOM 0 HG21 VAL A 85 4.207 -0.874 -7.928 1.00 0.00 H new ATOM 0 HG22 VAL A 85 3.453 0.208 -6.733 1.00 0.00 H new ATOM 0 HG23 VAL A 85 2.434 -0.768 -7.819 1.00 0.00 H new ATOM 1368 N GLN A 86 1.886 3.244 -10.475 1.00 0.00 N ATOM 1369 CA GLN A 86 2.016 4.453 -11.282 1.00 0.00 C ATOM 1370 C GLN A 86 1.125 5.568 -10.741 1.00 0.00 C ATOM 1371 O GLN A 86 1.430 6.750 -10.899 1.00 0.00 O ATOM 1372 CB GLN A 86 1.638 4.152 -12.735 1.00 0.00 C ATOM 1373 CG GLN A 86 1.623 5.451 -13.544 1.00 0.00 C ATOM 1374 CD GLN A 86 1.609 5.135 -15.036 1.00 0.00 C ATOM 1375 OE1 GLN A 86 2.662 5.087 -15.672 1.00 0.00 O ATOM 1376 NE2 GLN A 86 0.470 4.913 -15.635 1.00 0.00 N ATOM 0 H GLN A 86 1.398 2.476 -10.936 1.00 0.00 H new ATOM 0 HA GLN A 86 3.053 4.785 -11.235 1.00 0.00 H new ATOM 0 HB2 GLN A 86 2.351 3.451 -13.168 1.00 0.00 H new ATOM 0 HB3 GLN A 86 0.658 3.676 -12.775 1.00 0.00 H new ATOM 0 HG2 GLN A 86 0.746 6.043 -13.281 1.00 0.00 H new ATOM 0 HG3 GLN A 86 2.499 6.052 -13.299 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -0.401 4.953 -15.106 1.00 0.00 H new ATOM 0 HE22 GLN A 86 0.451 4.699 -16.632 1.00 0.00 H new ATOM 1385 N LEU A 87 0.020 5.187 -10.105 1.00 0.00 N ATOM 1386 CA LEU A 87 -0.908 6.169 -9.552 1.00 0.00 C ATOM 1387 C LEU A 87 -0.500 6.565 -8.135 1.00 0.00 C ATOM 1388 O LEU A 87 -0.566 7.737 -7.765 1.00 0.00 O ATOM 1389 CB LEU A 87 -2.329 5.593 -9.534 1.00 0.00 C ATOM 1390 CG LEU A 87 -2.956 5.701 -10.932 1.00 0.00 C ATOM 1391 CD1 LEU A 87 -4.027 4.620 -11.099 1.00 0.00 C ATOM 1392 CD2 LEU A 87 -3.603 7.080 -11.106 1.00 0.00 C ATOM 0 H LEU A 87 -0.253 4.215 -9.961 1.00 0.00 H new ATOM 0 HA LEU A 87 -0.881 7.057 -10.183 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -2.304 4.550 -9.217 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -2.940 6.132 -8.810 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.177 5.567 -11.683 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -4.471 4.698 -12.091 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -3.573 3.636 -10.981 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.801 4.755 -10.344 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.046 7.151 -12.099 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.378 7.216 -10.352 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -2.845 7.855 -10.991 1.00 0.00 H new ATOM 1404 N THR A 88 -0.086 5.580 -7.344 1.00 0.00 N ATOM 1405 CA THR A 88 0.319 5.844 -5.968 1.00 0.00 C ATOM 1406 C THR A 88 1.351 6.964 -5.915 1.00 0.00 C ATOM 1407 O THR A 88 1.190 7.933 -5.174 1.00 0.00 O ATOM 1408 CB THR A 88 0.902 4.575 -5.340 1.00 0.00 C ATOM 1409 OG1 THR A 88 1.802 3.969 -6.253 1.00 0.00 O ATOM 1410 CG2 THR A 88 -0.229 3.598 -5.006 1.00 0.00 C ATOM 0 H THR A 88 -0.022 4.602 -7.628 1.00 0.00 H new ATOM 0 HA THR A 88 -0.562 6.154 -5.405 1.00 0.00 H new ATOM 0 HB THR A 88 1.433 4.834 -4.424 1.00 0.00 H new ATOM 0 HG1 THR A 88 2.718 4.051 -5.913 1.00 0.00 H new ATOM 0 HG21 THR A 88 0.189 2.696 -4.559 1.00 0.00 H new ATOM 0 HG22 THR A 88 -0.918 4.066 -4.302 1.00 0.00 H new ATOM 0 HG23 THR A 88 -0.765 3.336 -5.918 1.00 0.00 H new ATOM 1418 N TYR A 89 2.409 6.828 -6.709 1.00 0.00 N ATOM 1419 CA TYR A 89 3.454 7.844 -6.742 1.00 0.00 C ATOM 1420 C TYR A 89 2.840 9.222 -6.974 1.00 0.00 C ATOM 1421 O TYR A 89 3.149 10.177 -6.263 1.00 0.00 O ATOM 1422 CB TYR A 89 4.460 7.529 -7.857 1.00 0.00 C ATOM 1423 CG TYR A 89 5.538 6.610 -7.326 1.00 0.00 C ATOM 1424 CD1 TYR A 89 5.205 5.330 -6.872 1.00 0.00 C ATOM 1425 CD2 TYR A 89 6.871 7.041 -7.287 1.00 0.00 C ATOM 1426 CE1 TYR A 89 6.201 4.479 -6.379 1.00 0.00 C ATOM 1427 CE2 TYR A 89 7.867 6.189 -6.795 1.00 0.00 C ATOM 1428 CZ TYR A 89 7.532 4.909 -6.341 1.00 0.00 C ATOM 1429 OH TYR A 89 8.514 4.070 -5.855 1.00 0.00 O ATOM 0 H TYR A 89 2.564 6.034 -7.331 1.00 0.00 H new ATOM 0 HA TYR A 89 3.973 7.843 -5.783 1.00 0.00 H new ATOM 0 HB2 TYR A 89 3.950 7.059 -8.698 1.00 0.00 H new ATOM 0 HB3 TYR A 89 4.906 8.451 -8.229 1.00 0.00 H new ATOM 0 HD1 TYR A 89 4.178 4.998 -6.902 1.00 0.00 H new ATOM 0 HD2 TYR A 89 7.130 8.030 -7.636 1.00 0.00 H new ATOM 0 HE1 TYR A 89 5.942 3.491 -6.028 1.00 0.00 H new ATOM 0 HE2 TYR A 89 8.895 6.520 -6.766 1.00 0.00 H new ATOM 0 HH TYR A 89 9.382 4.522 -5.899 1.00 0.00 H new ATOM 1439 N GLU A 90 1.963 9.314 -7.969 1.00 0.00 N ATOM 1440 CA GLU A 90 1.308 10.580 -8.276 1.00 0.00 C ATOM 1441 C GLU A 90 0.850 11.255 -6.985 1.00 0.00 C ATOM 1442 O GLU A 90 1.035 12.459 -6.799 1.00 0.00 O ATOM 1443 CB GLU A 90 0.104 10.333 -9.200 1.00 0.00 C ATOM 1444 CG GLU A 90 0.265 11.140 -10.493 1.00 0.00 C ATOM 1445 CD GLU A 90 1.472 10.635 -11.276 1.00 0.00 C ATOM 1446 OE1 GLU A 90 2.081 9.674 -10.835 1.00 0.00 O ATOM 1447 OE2 GLU A 90 1.772 11.218 -12.305 1.00 0.00 O ATOM 0 H GLU A 90 1.692 8.536 -8.570 1.00 0.00 H new ATOM 0 HA GLU A 90 2.016 11.235 -8.784 1.00 0.00 H new ATOM 0 HB2 GLU A 90 0.024 9.271 -9.431 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -0.818 10.619 -8.695 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -0.636 11.052 -11.101 1.00 0.00 H new ATOM 0 HG3 GLU A 90 0.390 12.197 -10.258 1.00 0.00 H new ATOM 1454 N HIS A 91 0.257 10.467 -6.093 1.00 0.00 N ATOM 1455 CA HIS A 91 -0.217 10.994 -4.820 1.00 0.00 C ATOM 1456 C HIS A 91 0.953 11.526 -3.998 1.00 0.00 C ATOM 1457 O HIS A 91 0.877 12.610 -3.421 1.00 0.00 O ATOM 1458 CB HIS A 91 -0.937 9.896 -4.032 1.00 0.00 C ATOM 1459 CG HIS A 91 -1.825 9.111 -4.957 1.00 0.00 C ATOM 1460 ND1 HIS A 91 -2.224 9.597 -6.192 1.00 0.00 N ATOM 1461 CD2 HIS A 91 -2.401 7.869 -4.840 1.00 0.00 C ATOM 1462 CE1 HIS A 91 -3.003 8.661 -6.765 1.00 0.00 C ATOM 1463 NE2 HIS A 91 -3.144 7.589 -5.982 1.00 0.00 N ATOM 0 H HIS A 91 0.095 9.469 -6.227 1.00 0.00 H new ATOM 0 HA HIS A 91 -0.912 11.809 -5.021 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -0.209 9.235 -3.562 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -1.529 10.338 -3.231 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -2.293 7.211 -3.991 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -3.458 8.764 -7.739 1.00 0.00 H new ATOM 0 HE2 HIS A 91 -3.682 6.745 -6.179 1.00 0.00 H new ATOM 1472 N THR A 92 2.036 10.756 -3.951 1.00 0.00 N ATOM 1473 CA THR A 92 3.218 11.162 -3.199 1.00 0.00 C ATOM 1474 C THR A 92 3.782 12.463 -3.760 1.00 0.00 C ATOM 1475 O THR A 92 4.076 13.396 -3.013 1.00 0.00 O ATOM 1476 CB THR A 92 4.286 10.067 -3.264 1.00 0.00 C ATOM 1477 OG1 THR A 92 4.802 9.990 -4.585 1.00 0.00 O ATOM 1478 CG2 THR A 92 3.668 8.724 -2.875 1.00 0.00 C ATOM 0 H THR A 92 2.120 9.854 -4.421 1.00 0.00 H new ATOM 0 HA THR A 92 2.929 11.320 -2.160 1.00 0.00 H new ATOM 0 HB THR A 92 5.094 10.305 -2.572 1.00 0.00 H new ATOM 0 HG1 THR A 92 4.068 10.073 -5.228 1.00 0.00 H new ATOM 0 HG21 THR A 92 4.430 7.946 -2.922 1.00 0.00 H new ATOM 0 HG22 THR A 92 3.274 8.785 -1.861 1.00 0.00 H new ATOM 0 HG23 THR A 92 2.859 8.482 -3.565 1.00 0.00 H new ATOM 1486 N MET A 93 3.926 12.518 -5.080 1.00 0.00 N ATOM 1487 CA MET A 93 4.453 13.712 -5.729 1.00 0.00 C ATOM 1488 C MET A 93 3.789 14.959 -5.159 1.00 0.00 C ATOM 1489 O MET A 93 4.459 15.944 -4.847 1.00 0.00 O ATOM 1490 CB MET A 93 4.201 13.641 -7.237 1.00 0.00 C ATOM 1491 CG MET A 93 4.969 14.762 -7.941 1.00 0.00 C ATOM 1492 SD MET A 93 6.743 14.408 -7.880 1.00 0.00 S ATOM 1493 CE MET A 93 7.301 15.900 -8.740 1.00 0.00 C ATOM 0 H MET A 93 3.688 11.757 -5.716 1.00 0.00 H new ATOM 0 HA MET A 93 5.526 13.764 -5.544 1.00 0.00 H new ATOM 0 HB2 MET A 93 4.517 12.672 -7.623 1.00 0.00 H new ATOM 0 HB3 MET A 93 3.134 13.733 -7.442 1.00 0.00 H new ATOM 0 HG2 MET A 93 4.640 14.848 -8.977 1.00 0.00 H new ATOM 0 HG3 MET A 93 4.761 15.718 -7.460 1.00 0.00 H new ATOM 0 HE1 MET A 93 8.388 15.891 -8.816 1.00 0.00 H new ATOM 0 HE2 MET A 93 6.867 15.928 -9.740 1.00 0.00 H new ATOM 0 HE3 MET A 93 6.984 16.781 -8.182 1.00 0.00 H new ATOM 1503 N LEU A 94 2.470 14.908 -5.020 1.00 0.00 N ATOM 1504 CA LEU A 94 1.724 16.038 -4.479 1.00 0.00 C ATOM 1505 C LEU A 94 2.116 16.279 -3.026 1.00 0.00 C ATOM 1506 O LEU A 94 2.322 17.419 -2.609 1.00 0.00 O ATOM 1507 CB LEU A 94 0.220 15.764 -4.570 1.00 0.00 C ATOM 1508 CG LEU A 94 -0.562 17.021 -4.173 1.00 0.00 C ATOM 1509 CD1 LEU A 94 -0.352 18.125 -5.218 1.00 0.00 C ATOM 1510 CD2 LEU A 94 -2.052 16.679 -4.081 1.00 0.00 C ATOM 0 H LEU A 94 1.898 14.102 -5.272 1.00 0.00 H new ATOM 0 HA LEU A 94 1.962 16.927 -5.063 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -0.044 15.466 -5.585 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -0.048 14.936 -3.914 1.00 0.00 H new ATOM 0 HG LEU A 94 -0.204 17.377 -3.207 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -0.912 19.013 -4.926 1.00 0.00 H new ATOM 0 HD12 LEU A 94 0.708 18.369 -5.281 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.703 17.778 -6.190 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -2.613 17.570 -3.799 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -2.403 16.320 -5.048 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -2.202 15.903 -3.330 1.00 0.00 H new ATOM 1522 N GLN A 95 2.222 15.198 -2.261 1.00 0.00 N ATOM 1523 CA GLN A 95 2.595 15.302 -0.856 1.00 0.00 C ATOM 1524 C GLN A 95 3.954 15.978 -0.717 1.00 0.00 C ATOM 1525 O GLN A 95 4.119 16.907 0.075 1.00 0.00 O ATOM 1526 CB GLN A 95 2.648 13.910 -0.224 1.00 0.00 C ATOM 1527 CG GLN A 95 2.689 14.040 1.299 1.00 0.00 C ATOM 1528 CD GLN A 95 2.648 12.658 1.943 1.00 0.00 C ATOM 1529 OE1 GLN A 95 2.261 11.631 1.236 1.00 0.00 O flip ATOM 1530 NE2 GLN A 95 2.979 12.510 3.118 1.00 0.00 N flip ATOM 0 H GLN A 95 2.056 14.246 -2.588 1.00 0.00 H new ATOM 0 HA GLN A 95 1.845 15.904 -0.342 1.00 0.00 H new ATOM 0 HB2 GLN A 95 1.777 13.329 -0.526 1.00 0.00 H new ATOM 0 HB3 GLN A 95 3.528 13.372 -0.577 1.00 0.00 H new ATOM 0 HG2 GLN A 95 3.595 14.565 1.603 1.00 0.00 H new ATOM 0 HG3 GLN A 95 1.844 14.636 1.644 1.00 0.00 H new ATOM 0 HE21 GLN A 95 3.281 13.314 3.668 1.00 0.00 H new ATOM 0 HE22 GLN A 95 2.952 11.583 3.543 1.00 0.00 H new ATOM 1539 N LEU A 96 4.925 15.511 -1.496 1.00 0.00 N ATOM 1540 CA LEU A 96 6.265 16.083 -1.456 1.00 0.00 C ATOM 1541 C LEU A 96 6.316 17.363 -2.284 1.00 0.00 C ATOM 1542 O LEU A 96 7.230 18.174 -2.137 1.00 0.00 O ATOM 1543 CB LEU A 96 7.284 15.074 -1.997 1.00 0.00 C ATOM 1544 CG LEU A 96 7.597 14.033 -0.920 1.00 0.00 C ATOM 1545 CD1 LEU A 96 6.307 13.330 -0.493 1.00 0.00 C ATOM 1546 CD2 LEU A 96 8.578 13.000 -1.480 1.00 0.00 C ATOM 0 H LEU A 96 4.810 14.744 -2.158 1.00 0.00 H new ATOM 0 HA LEU A 96 6.513 16.320 -0.421 1.00 0.00 H new ATOM 0 HB2 LEU A 96 6.889 14.584 -2.887 1.00 0.00 H new ATOM 0 HB3 LEU A 96 8.197 15.589 -2.296 1.00 0.00 H new ATOM 0 HG LEU A 96 8.041 14.529 -0.057 1.00 0.00 H new ATOM 0 HD11 LEU A 96 6.533 12.589 0.274 1.00 0.00 H new ATOM 0 HD12 LEU A 96 5.608 14.064 -0.093 1.00 0.00 H new ATOM 0 HD13 LEU A 96 5.860 12.835 -1.355 1.00 0.00 H new ATOM 0 HD21 LEU A 96 8.802 12.258 -0.714 1.00 0.00 H new ATOM 0 HD22 LEU A 96 8.133 12.507 -2.344 1.00 0.00 H new ATOM 0 HD23 LEU A 96 9.499 13.499 -1.782 1.00 0.00 H new ATOM 1558 N TYR A 97 5.321 17.538 -3.151 1.00 0.00 N ATOM 1559 CA TYR A 97 5.253 18.726 -3.999 1.00 0.00 C ATOM 1560 C TYR A 97 3.840 19.307 -3.989 1.00 0.00 C ATOM 1561 O TYR A 97 3.141 19.285 -5.002 1.00 0.00 O ATOM 1562 CB TYR A 97 5.659 18.367 -5.433 1.00 0.00 C ATOM 1563 CG TYR A 97 6.163 19.600 -6.145 1.00 0.00 C ATOM 1564 CD1 TYR A 97 7.473 20.046 -5.930 1.00 0.00 C ATOM 1565 CD2 TYR A 97 5.322 20.297 -7.021 1.00 0.00 C ATOM 1566 CE1 TYR A 97 7.941 21.188 -6.591 1.00 0.00 C ATOM 1567 CE2 TYR A 97 5.790 21.440 -7.680 1.00 0.00 C ATOM 1568 CZ TYR A 97 7.100 21.885 -7.465 1.00 0.00 C ATOM 1569 OH TYR A 97 7.562 23.011 -8.116 1.00 0.00 O ATOM 0 H TYR A 97 4.556 16.877 -3.285 1.00 0.00 H new ATOM 0 HA TYR A 97 5.942 19.475 -3.608 1.00 0.00 H new ATOM 0 HB2 TYR A 97 6.434 17.601 -5.420 1.00 0.00 H new ATOM 0 HB3 TYR A 97 4.806 17.949 -5.969 1.00 0.00 H new ATOM 0 HD1 TYR A 97 8.122 19.509 -5.254 1.00 0.00 H new ATOM 0 HD2 TYR A 97 4.312 19.953 -7.188 1.00 0.00 H new ATOM 0 HE1 TYR A 97 8.952 21.531 -6.426 1.00 0.00 H new ATOM 0 HE2 TYR A 97 5.141 21.979 -8.354 1.00 0.00 H new ATOM 0 HH TYR A 97 6.852 23.374 -8.686 1.00 0.00 H new ATOM 1579 N PRO A 98 3.414 19.818 -2.864 1.00 0.00 N ATOM 1580 CA PRO A 98 2.056 20.416 -2.707 1.00 0.00 C ATOM 1581 C PRO A 98 1.700 21.364 -3.850 1.00 0.00 C ATOM 1582 O PRO A 98 2.468 21.528 -4.798 1.00 0.00 O ATOM 1583 CB PRO A 98 2.146 21.171 -1.378 1.00 0.00 C ATOM 1584 CG PRO A 98 3.200 20.459 -0.594 1.00 0.00 C ATOM 1585 CD PRO A 98 4.186 19.880 -1.612 1.00 0.00 C ATOM 0 HA PRO A 98 1.273 19.657 -2.722 1.00 0.00 H new ATOM 0 HB2 PRO A 98 2.411 22.216 -1.536 1.00 0.00 H new ATOM 0 HB3 PRO A 98 1.191 21.161 -0.854 1.00 0.00 H new ATOM 0 HG2 PRO A 98 3.704 21.144 0.088 1.00 0.00 H new ATOM 0 HG3 PRO A 98 2.762 19.668 0.015 1.00 0.00 H new ATOM 0 HD2 PRO A 98 5.067 20.513 -1.718 1.00 0.00 H new ATOM 0 HD3 PRO A 98 4.537 18.893 -1.311 1.00 0.00 H new ATOM 1593 N SER A 99 0.529 21.984 -3.750 1.00 0.00 N ATOM 1594 CA SER A 99 0.076 22.914 -4.778 1.00 0.00 C ATOM 1595 C SER A 99 -1.193 23.631 -4.323 1.00 0.00 C ATOM 1596 O SER A 99 -2.267 23.433 -4.890 1.00 0.00 O ATOM 1597 CB SER A 99 -0.200 22.159 -6.078 1.00 0.00 C ATOM 1598 OG SER A 99 -1.076 21.072 -5.813 1.00 0.00 O ATOM 0 H SER A 99 -0.120 21.861 -2.973 1.00 0.00 H new ATOM 0 HA SER A 99 0.859 23.653 -4.948 1.00 0.00 H new ATOM 0 HB2 SER A 99 -0.645 22.829 -6.814 1.00 0.00 H new ATOM 0 HB3 SER A 99 0.734 21.793 -6.505 1.00 0.00 H new ATOM 0 HG SER A 99 -1.899 21.408 -5.400 1.00 0.00 H new ATOM 1604 N PRO A 100 -1.083 24.453 -3.314 1.00 0.00 N ATOM 1605 CA PRO A 100 -2.239 25.216 -2.764 1.00 0.00 C ATOM 1606 C PRO A 100 -3.093 25.842 -3.862 1.00 0.00 C ATOM 1607 O PRO A 100 -4.320 25.875 -3.765 1.00 0.00 O ATOM 1608 CB PRO A 100 -1.578 26.290 -1.896 1.00 0.00 C ATOM 1609 CG PRO A 100 -0.274 25.699 -1.467 1.00 0.00 C ATOM 1610 CD PRO A 100 0.163 24.745 -2.585 1.00 0.00 C ATOM 0 HA PRO A 100 -2.927 24.578 -2.209 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -1.427 27.212 -2.457 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -2.200 26.539 -1.036 1.00 0.00 H new ATOM 0 HG2 PRO A 100 0.471 26.478 -1.309 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -0.382 25.166 -0.523 1.00 0.00 H new ATOM 0 HD2 PRO A 100 0.907 25.206 -3.235 1.00 0.00 H new ATOM 0 HD3 PRO A 100 0.611 23.837 -2.182 1.00 0.00 H new ATOM 1618 N PHE A 101 -2.438 26.337 -4.907 1.00 0.00 N ATOM 1619 CA PHE A 101 -3.151 26.958 -6.016 1.00 0.00 C ATOM 1620 C PHE A 101 -4.243 26.026 -6.534 1.00 0.00 C ATOM 1621 O PHE A 101 -3.965 25.074 -7.263 1.00 0.00 O ATOM 1622 CB PHE A 101 -2.166 27.295 -7.146 1.00 0.00 C ATOM 1623 CG PHE A 101 -2.030 28.796 -7.277 1.00 0.00 C ATOM 1624 CD1 PHE A 101 -1.358 29.525 -6.289 1.00 0.00 C ATOM 1625 CD2 PHE A 101 -2.578 29.456 -8.383 1.00 0.00 C ATOM 1626 CE1 PHE A 101 -1.234 30.915 -6.408 1.00 0.00 C ATOM 1627 CE2 PHE A 101 -2.455 30.846 -8.502 1.00 0.00 C ATOM 1628 CZ PHE A 101 -1.782 31.575 -7.514 1.00 0.00 C ATOM 0 H PHE A 101 -1.423 26.321 -5.009 1.00 0.00 H new ATOM 0 HA PHE A 101 -3.618 27.878 -5.663 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -1.193 26.849 -6.938 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -2.517 26.869 -8.086 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -0.935 29.016 -5.435 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -3.096 28.893 -9.145 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -0.715 31.478 -5.646 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -2.879 31.355 -9.355 1.00 0.00 H new ATOM 0 HZ PHE A 101 -1.686 32.647 -7.605 1.00 0.00 H new ATOM 1638 N ALA A 102 -5.483 26.307 -6.151 1.00 0.00 N ATOM 1639 CA ALA A 102 -6.609 25.487 -6.583 1.00 0.00 C ATOM 1640 C ALA A 102 -6.722 25.496 -8.104 1.00 0.00 C ATOM 1641 O ALA A 102 -6.528 26.530 -8.745 1.00 0.00 O ATOM 1642 CB ALA A 102 -7.905 26.016 -5.968 1.00 0.00 C ATOM 0 H ALA A 102 -5.733 27.090 -5.547 1.00 0.00 H new ATOM 0 HA ALA A 102 -6.441 24.463 -6.248 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -8.742 25.399 -6.295 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -7.832 25.982 -4.881 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -8.066 27.045 -6.289 1.00 0.00 H new ATOM 1648 N THR A 103 -7.034 24.338 -8.678 1.00 0.00 N ATOM 1649 CA THR A 103 -7.168 24.223 -10.128 1.00 0.00 C ATOM 1650 C THR A 103 -8.311 23.278 -10.487 1.00 0.00 C ATOM 1651 O THR A 103 -9.259 23.667 -11.169 1.00 0.00 O ATOM 1652 CB THR A 103 -5.863 23.703 -10.733 1.00 0.00 C ATOM 1653 OG1 THR A 103 -5.457 22.529 -10.041 1.00 0.00 O ATOM 1654 CG2 THR A 103 -4.776 24.773 -10.608 1.00 0.00 C ATOM 0 H THR A 103 -7.198 23.471 -8.166 1.00 0.00 H new ATOM 0 HA THR A 103 -7.388 25.211 -10.534 1.00 0.00 H new ATOM 0 HB THR A 103 -6.019 23.470 -11.786 1.00 0.00 H new ATOM 0 HG1 THR A 103 -4.622 22.193 -10.428 1.00 0.00 H new ATOM 0 HG21 THR A 103 -3.847 24.400 -11.040 1.00 0.00 H new ATOM 0 HG22 THR A 103 -5.088 25.672 -11.139 1.00 0.00 H new ATOM 0 HG23 THR A 103 -4.618 25.010 -9.556 1.00 0.00 H new ATOM 1662 N SER A 104 -8.215 22.037 -10.023 1.00 0.00 N ATOM 1663 CA SER A 104 -9.248 21.047 -10.303 1.00 0.00 C ATOM 1664 C SER A 104 -9.081 19.826 -9.405 1.00 0.00 C ATOM 1665 O SER A 104 -7.973 19.319 -9.230 1.00 0.00 O ATOM 1666 CB SER A 104 -9.178 20.618 -11.769 1.00 0.00 C ATOM 1667 OG SER A 104 -9.440 21.740 -12.600 1.00 0.00 O ATOM 0 H SER A 104 -7.439 21.695 -9.456 1.00 0.00 H new ATOM 0 HA SER A 104 -10.219 21.499 -10.103 1.00 0.00 H new ATOM 0 HB2 SER A 104 -8.194 20.207 -11.993 1.00 0.00 H new ATOM 0 HB3 SER A 104 -9.904 19.829 -11.964 1.00 0.00 H new ATOM 0 HG SER A 104 -9.803 22.471 -12.058 1.00 0.00 H new ATOM 1673 N ASP A 105 -10.189 19.360 -8.836 1.00 0.00 N ATOM 1674 CA ASP A 105 -10.157 18.196 -7.956 1.00 0.00 C ATOM 1675 C ASP A 105 -11.420 17.358 -8.132 1.00 0.00 C ATOM 1676 O ASP A 105 -12.515 17.895 -8.298 1.00 0.00 O ATOM 1677 CB ASP A 105 -10.042 18.647 -6.499 1.00 0.00 C ATOM 1678 CG ASP A 105 -8.751 19.433 -6.296 1.00 0.00 C ATOM 1679 OD1 ASP A 105 -7.726 18.987 -6.782 1.00 0.00 O ATOM 1680 OD2 ASP A 105 -8.808 20.470 -5.656 1.00 0.00 O ATOM 0 H ASP A 105 -11.115 19.767 -8.967 1.00 0.00 H new ATOM 0 HA ASP A 105 -9.291 17.588 -8.218 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -10.899 19.265 -6.232 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -10.057 17.780 -5.839 1.00 0.00 H new ATOM 1685 N PHE A 106 -11.258 16.038 -8.097 1.00 0.00 N ATOM 1686 CA PHE A 106 -12.391 15.130 -8.255 1.00 0.00 C ATOM 1687 C PHE A 106 -13.037 14.836 -6.904 1.00 0.00 C ATOM 1688 O PHE A 106 -12.346 14.630 -5.906 1.00 0.00 O ATOM 1689 CB PHE A 106 -11.922 13.820 -8.893 1.00 0.00 C ATOM 1690 CG PHE A 106 -11.674 14.037 -10.367 1.00 0.00 C ATOM 1691 CD1 PHE A 106 -10.576 14.796 -10.789 1.00 0.00 C ATOM 1692 CD2 PHE A 106 -12.543 13.476 -11.313 1.00 0.00 C ATOM 1693 CE1 PHE A 106 -10.347 14.996 -12.156 1.00 0.00 C ATOM 1694 CE2 PHE A 106 -12.313 13.676 -12.679 1.00 0.00 C ATOM 1695 CZ PHE A 106 -11.216 14.436 -13.101 1.00 0.00 C ATOM 0 H PHE A 106 -10.359 15.575 -7.962 1.00 0.00 H new ATOM 0 HA PHE A 106 -13.128 15.608 -8.900 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -11.010 13.473 -8.407 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -12.674 13.044 -8.750 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -9.906 15.227 -10.060 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -13.390 12.890 -10.988 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -9.500 15.582 -12.482 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -12.982 13.244 -13.408 1.00 0.00 H new ATOM 0 HZ PHE A 106 -11.040 14.591 -14.155 1.00 0.00 H new ATOM 1705 N MET A 107 -14.366 14.815 -6.883 1.00 0.00 N ATOM 1706 CA MET A 107 -15.099 14.543 -5.651 1.00 0.00 C ATOM 1707 C MET A 107 -16.476 13.966 -5.967 1.00 0.00 C ATOM 1708 O MET A 107 -17.314 14.630 -6.577 1.00 0.00 O ATOM 1709 CB MET A 107 -15.258 15.830 -4.837 1.00 0.00 C ATOM 1710 CG MET A 107 -13.905 16.235 -4.246 1.00 0.00 C ATOM 1711 SD MET A 107 -14.154 17.517 -2.991 1.00 0.00 S ATOM 1712 CE MET A 107 -12.803 17.025 -1.891 1.00 0.00 C ATOM 0 H MET A 107 -14.954 14.982 -7.699 1.00 0.00 H new ATOM 0 HA MET A 107 -14.534 13.815 -5.068 1.00 0.00 H new ATOM 0 HB2 MET A 107 -15.642 16.628 -5.472 1.00 0.00 H new ATOM 0 HB3 MET A 107 -15.985 15.680 -4.039 1.00 0.00 H new ATOM 0 HG2 MET A 107 -13.415 15.368 -3.803 1.00 0.00 H new ATOM 0 HG3 MET A 107 -13.248 16.605 -5.033 1.00 0.00 H new ATOM 0 HE1 MET A 107 -12.771 17.695 -1.032 1.00 0.00 H new ATOM 0 HE2 MET A 107 -12.966 16.003 -1.549 1.00 0.00 H new ATOM 0 HE3 MET A 107 -11.857 17.081 -2.429 1.00 0.00 H new ATOM 1722 N VAL A 108 -16.700 12.723 -5.548 1.00 0.00 N ATOM 1723 CA VAL A 108 -17.978 12.059 -5.791 1.00 0.00 C ATOM 1724 C VAL A 108 -18.264 11.972 -7.287 1.00 0.00 C ATOM 1725 O VAL A 108 -19.281 11.416 -7.703 1.00 0.00 O ATOM 1726 CB VAL A 108 -19.106 12.823 -5.092 1.00 0.00 C ATOM 1727 CG1 VAL A 108 -20.410 12.023 -5.184 1.00 0.00 C ATOM 1728 CG2 VAL A 108 -18.741 13.031 -3.620 1.00 0.00 C ATOM 0 H VAL A 108 -16.018 12.158 -5.042 1.00 0.00 H new ATOM 0 HA VAL A 108 -17.923 11.048 -5.388 1.00 0.00 H new ATOM 0 HB VAL A 108 -19.242 13.789 -5.578 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -21.209 12.571 -4.685 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -20.672 11.873 -6.231 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -20.278 11.055 -4.701 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -19.542 13.575 -3.120 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -18.604 12.063 -3.139 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -17.816 13.604 -3.552 1.00 0.00 H new ATOM 1738 N ARG A 109 -17.361 12.522 -8.094 1.00 0.00 N ATOM 1739 CA ARG A 109 -17.530 12.495 -9.544 1.00 0.00 C ATOM 1740 C ARG A 109 -16.894 11.239 -10.132 1.00 0.00 C ATOM 1741 O ARG A 109 -15.682 11.179 -10.332 1.00 0.00 O ATOM 1742 CB ARG A 109 -16.886 13.740 -10.164 1.00 0.00 C ATOM 1743 CG ARG A 109 -17.827 14.944 -10.012 1.00 0.00 C ATOM 1744 CD ARG A 109 -18.778 15.011 -11.210 1.00 0.00 C ATOM 1745 NE ARG A 109 -19.948 15.820 -10.882 1.00 0.00 N ATOM 1746 CZ ARG A 109 -20.914 16.020 -11.772 1.00 0.00 C ATOM 1747 NH1 ARG A 109 -20.823 15.494 -12.963 1.00 0.00 N ATOM 1748 NH2 ARG A 109 -21.952 16.743 -11.456 1.00 0.00 N ATOM 0 H ARG A 109 -16.512 12.988 -7.773 1.00 0.00 H new ATOM 0 HA ARG A 109 -18.596 12.487 -9.771 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -15.933 13.948 -9.677 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -16.674 13.564 -11.219 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -18.397 14.857 -9.087 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -17.247 15.864 -9.944 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -18.262 15.438 -12.070 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -19.090 14.005 -11.492 1.00 0.00 H new ATOM 0 HE ARG A 109 -20.025 16.238 -9.955 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -20.010 14.929 -13.210 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -21.565 15.647 -13.646 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -22.022 17.155 -10.526 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -22.694 16.897 -12.139 1.00 0.00 H new ATOM 1762 N PHE A 110 -17.728 10.239 -10.409 1.00 0.00 N ATOM 1763 CA PHE A 110 -17.250 8.980 -10.976 1.00 0.00 C ATOM 1764 C PHE A 110 -18.098 8.601 -12.192 1.00 0.00 C ATOM 1765 O PHE A 110 -19.255 9.008 -12.298 1.00 0.00 O ATOM 1766 CB PHE A 110 -17.337 7.869 -9.915 1.00 0.00 C ATOM 1767 CG PHE A 110 -15.957 7.331 -9.604 1.00 0.00 C ATOM 1768 CD1 PHE A 110 -14.938 8.204 -9.205 1.00 0.00 C ATOM 1769 CD2 PHE A 110 -15.699 5.958 -9.711 1.00 0.00 C ATOM 1770 CE1 PHE A 110 -13.662 7.706 -8.915 1.00 0.00 C ATOM 1771 CE2 PHE A 110 -14.423 5.460 -9.420 1.00 0.00 C ATOM 1772 CZ PHE A 110 -13.405 6.335 -9.023 1.00 0.00 C ATOM 0 H PHE A 110 -18.735 10.276 -10.251 1.00 0.00 H new ATOM 0 HA PHE A 110 -16.213 9.100 -11.289 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -17.796 8.259 -9.007 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -17.977 7.063 -10.274 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -15.136 9.262 -9.121 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -16.485 5.283 -10.018 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -12.876 8.380 -8.608 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -14.224 4.402 -9.502 1.00 0.00 H new ATOM 0 HZ PHE A 110 -12.420 5.951 -8.800 1.00 0.00 H new ATOM 1782 N PRO A 111 -17.555 7.831 -13.100 1.00 0.00 N ATOM 1783 CA PRO A 111 -18.290 7.393 -14.317 1.00 0.00 C ATOM 1784 C PRO A 111 -19.747 7.055 -14.013 1.00 0.00 C ATOM 1785 O PRO A 111 -20.032 6.168 -13.209 1.00 0.00 O ATOM 1786 CB PRO A 111 -17.516 6.152 -14.763 1.00 0.00 C ATOM 1787 CG PRO A 111 -16.112 6.374 -14.297 1.00 0.00 C ATOM 1788 CD PRO A 111 -16.185 7.292 -13.069 1.00 0.00 C ATOM 0 HA PRO A 111 -18.338 8.170 -15.080 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -17.937 5.247 -14.325 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -17.557 6.031 -15.845 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -15.636 5.427 -14.042 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -15.512 6.831 -15.084 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -15.995 6.741 -12.148 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -15.443 8.088 -13.123 1.00 0.00 H new ATOM 1796 N GLU A 112 -20.665 7.767 -14.659 1.00 0.00 N ATOM 1797 CA GLU A 112 -22.088 7.528 -14.444 1.00 0.00 C ATOM 1798 C GLU A 112 -22.519 6.238 -15.132 1.00 0.00 C ATOM 1799 O GLU A 112 -23.675 5.825 -15.032 1.00 0.00 O ATOM 1800 CB GLU A 112 -22.905 8.700 -14.987 1.00 0.00 C ATOM 1801 CG GLU A 112 -22.620 9.949 -14.151 1.00 0.00 C ATOM 1802 CD GLU A 112 -23.561 11.077 -14.560 1.00 0.00 C ATOM 1803 OE1 GLU A 112 -24.763 10.870 -14.505 1.00 0.00 O ATOM 1804 OE2 GLU A 112 -23.067 12.132 -14.922 1.00 0.00 O ATOM 0 H GLU A 112 -20.453 8.506 -15.329 1.00 0.00 H new ATOM 0 HA GLU A 112 -22.266 7.433 -13.373 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -22.651 8.882 -16.031 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -23.968 8.462 -14.955 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -22.747 9.724 -13.092 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -21.585 10.260 -14.289 1.00 0.00 H new ATOM 1811 N TRP A 113 -21.581 5.605 -15.830 1.00 0.00 N ATOM 1812 CA TRP A 113 -21.866 4.357 -16.532 1.00 0.00 C ATOM 1813 C TRP A 113 -21.377 3.166 -15.712 1.00 0.00 C ATOM 1814 O TRP A 113 -21.482 2.018 -16.143 1.00 0.00 O ATOM 1815 CB TRP A 113 -21.183 4.357 -17.913 1.00 0.00 C ATOM 1816 CG TRP A 113 -20.289 5.551 -18.035 1.00 0.00 C ATOM 1817 CD1 TRP A 113 -20.707 6.838 -18.039 1.00 0.00 C ATOM 1818 CD2 TRP A 113 -18.838 5.592 -18.174 1.00 0.00 C ATOM 1819 NE1 TRP A 113 -19.606 7.666 -18.171 1.00 0.00 N ATOM 1820 CE2 TRP A 113 -18.431 6.944 -18.257 1.00 0.00 C ATOM 1821 CE3 TRP A 113 -17.846 4.597 -18.234 1.00 0.00 C ATOM 1822 CZ2 TRP A 113 -17.089 7.299 -18.394 1.00 0.00 C ATOM 1823 CZ3 TRP A 113 -16.492 4.949 -18.373 1.00 0.00 C ATOM 1824 CH2 TRP A 113 -16.115 6.297 -18.453 1.00 0.00 C ATOM 0 H TRP A 113 -20.620 5.934 -15.925 1.00 0.00 H new ATOM 0 HA TRP A 113 -22.944 4.273 -16.669 1.00 0.00 H new ATOM 0 HB2 TRP A 113 -20.604 3.443 -18.043 1.00 0.00 H new ATOM 0 HB3 TRP A 113 -21.936 4.372 -18.701 1.00 0.00 H new ATOM 0 HD1 TRP A 113 -21.733 7.166 -17.953 1.00 0.00 H new ATOM 0 HE1 TRP A 113 -19.656 8.684 -18.201 1.00 0.00 H new ATOM 0 HE3 TRP A 113 -18.126 3.556 -18.173 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 -16.804 8.339 -18.454 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 -15.738 4.177 -18.418 1.00 0.00 H new ATOM 0 HH2 TRP A 113 -15.073 6.561 -18.560 1.00 0.00 H new ATOM 1835 N LEU A 114 -20.841 3.451 -14.526 1.00 0.00 N ATOM 1836 CA LEU A 114 -20.336 2.402 -13.645 1.00 0.00 C ATOM 1837 C LEU A 114 -21.091 2.425 -12.317 1.00 0.00 C ATOM 1838 O LEU A 114 -20.647 3.043 -11.351 1.00 0.00 O ATOM 1839 CB LEU A 114 -18.838 2.620 -13.393 1.00 0.00 C ATOM 1840 CG LEU A 114 -18.180 1.300 -12.966 1.00 0.00 C ATOM 1841 CD1 LEU A 114 -17.780 0.496 -14.208 1.00 0.00 C ATOM 1842 CD2 LEU A 114 -16.928 1.594 -12.133 1.00 0.00 C ATOM 0 H LEU A 114 -20.746 4.396 -14.155 1.00 0.00 H new ATOM 0 HA LEU A 114 -20.487 1.433 -14.121 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -18.360 2.999 -14.297 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -18.697 3.374 -12.618 1.00 0.00 H new ATOM 0 HG LEU A 114 -18.889 0.725 -12.371 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -17.313 -0.440 -13.901 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -18.667 0.281 -14.803 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -17.074 1.075 -14.804 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -16.463 0.655 -11.831 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -16.223 2.173 -12.729 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -17.207 2.163 -11.246 1.00 0.00 H new ATOM 1854 N PRO A 115 -22.224 1.772 -12.259 1.00 0.00 N ATOM 1855 CA PRO A 115 -23.064 1.723 -11.025 1.00 0.00 C ATOM 1856 C PRO A 115 -22.298 1.192 -9.812 1.00 0.00 C ATOM 1857 O PRO A 115 -22.899 0.814 -8.810 1.00 0.00 O ATOM 1858 CB PRO A 115 -24.220 0.782 -11.395 1.00 0.00 C ATOM 1859 CG PRO A 115 -24.258 0.756 -12.889 1.00 0.00 C ATOM 1860 CD PRO A 115 -22.829 1.012 -13.363 1.00 0.00 C ATOM 0 HA PRO A 115 -23.397 2.718 -10.731 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -24.057 -0.217 -10.990 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -25.164 1.142 -10.986 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -24.621 -0.206 -13.251 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -24.937 1.518 -13.273 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -22.295 0.079 -13.546 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -22.812 1.578 -14.295 1.00 0.00 H new ATOM 1868 N LEU A 116 -20.973 1.166 -9.903 1.00 0.00 N ATOM 1869 CA LEU A 116 -20.150 0.681 -8.804 1.00 0.00 C ATOM 1870 C LEU A 116 -20.052 1.736 -7.712 1.00 0.00 C ATOM 1871 O LEU A 116 -19.941 1.416 -6.529 1.00 0.00 O ATOM 1872 CB LEU A 116 -18.747 0.334 -9.312 1.00 0.00 C ATOM 1873 CG LEU A 116 -17.994 -0.478 -8.249 1.00 0.00 C ATOM 1874 CD1 LEU A 116 -18.441 -1.943 -8.291 1.00 0.00 C ATOM 1875 CD2 LEU A 116 -16.488 -0.401 -8.523 1.00 0.00 C ATOM 0 H LEU A 116 -20.449 1.474 -10.722 1.00 0.00 H new ATOM 0 HA LEU A 116 -20.615 -0.214 -8.391 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -18.817 -0.238 -10.237 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -18.198 1.247 -9.542 1.00 0.00 H new ATOM 0 HG LEU A 116 -18.213 -0.065 -7.264 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -17.901 -2.510 -7.533 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -19.511 -2.003 -8.094 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -18.229 -2.360 -9.276 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -15.951 -0.977 -7.769 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -16.277 -0.810 -9.511 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -16.164 0.639 -8.484 1.00 0.00 H new ATOM 1887 N ASP A 117 -20.111 3.000 -8.125 1.00 0.00 N ATOM 1888 CA ASP A 117 -20.047 4.115 -7.187 1.00 0.00 C ATOM 1889 C ASP A 117 -21.452 4.615 -6.871 1.00 0.00 C ATOM 1890 O ASP A 117 -21.761 4.948 -5.727 1.00 0.00 O ATOM 1891 CB ASP A 117 -19.219 5.255 -7.784 1.00 0.00 C ATOM 1892 CG ASP A 117 -19.939 5.848 -8.989 1.00 0.00 C ATOM 1893 OD1 ASP A 117 -20.015 5.172 -10.001 1.00 0.00 O ATOM 1894 OD2 ASP A 117 -20.405 6.970 -8.882 1.00 0.00 O ATOM 0 H ASP A 117 -20.203 3.276 -9.103 1.00 0.00 H new ATOM 0 HA ASP A 117 -19.574 3.771 -6.267 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -19.054 6.027 -7.033 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -18.238 4.885 -8.082 1.00 0.00 H new ATOM 1899 N LYS A 118 -22.298 4.669 -7.898 1.00 0.00 N ATOM 1900 CA LYS A 118 -23.669 5.138 -7.722 1.00 0.00 C ATOM 1901 C LYS A 118 -24.495 4.125 -6.935 1.00 0.00 C ATOM 1902 O LYS A 118 -25.230 4.494 -6.019 1.00 0.00 O ATOM 1903 CB LYS A 118 -24.320 5.381 -9.085 1.00 0.00 C ATOM 1904 CG LYS A 118 -25.622 6.162 -8.895 1.00 0.00 C ATOM 1905 CD LYS A 118 -26.327 6.325 -10.244 1.00 0.00 C ATOM 1906 CE LYS A 118 -27.445 7.361 -10.115 1.00 0.00 C ATOM 1907 NZ LYS A 118 -28.037 7.625 -11.457 1.00 0.00 N ATOM 0 H LYS A 118 -22.061 4.396 -8.852 1.00 0.00 H new ATOM 0 HA LYS A 118 -23.638 6.072 -7.162 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -23.640 5.937 -9.731 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -24.522 4.430 -9.578 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -26.273 5.638 -8.195 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -25.411 7.140 -8.463 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -25.612 6.639 -11.004 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -26.738 5.369 -10.569 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -28.213 6.999 -9.432 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -27.052 8.285 -9.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -28.797 8.329 -11.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -27.301 7.988 -12.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -28.427 6.742 -11.844 1.00 0.00 H new ATOM 1921 N TRP A 119 -24.373 2.849 -7.292 1.00 0.00 N ATOM 1922 CA TRP A 119 -25.122 1.807 -6.599 1.00 0.00 C ATOM 1923 C TRP A 119 -24.489 1.512 -5.243 1.00 0.00 C ATOM 1924 O TRP A 119 -25.083 0.832 -4.406 1.00 0.00 O ATOM 1925 CB TRP A 119 -25.166 0.527 -7.442 1.00 0.00 C ATOM 1926 CG TRP A 119 -26.383 -0.268 -7.085 1.00 0.00 C ATOM 1927 CD1 TRP A 119 -27.643 0.016 -7.484 1.00 0.00 C ATOM 1928 CD2 TRP A 119 -26.475 -1.471 -6.266 1.00 0.00 C ATOM 1929 NE1 TRP A 119 -28.504 -0.933 -6.961 1.00 0.00 N ATOM 1930 CE2 TRP A 119 -27.830 -1.871 -6.203 1.00 0.00 C ATOM 1931 CE3 TRP A 119 -25.523 -2.245 -5.578 1.00 0.00 C ATOM 1932 CZ2 TRP A 119 -28.228 -2.998 -5.484 1.00 0.00 C ATOM 1933 CZ3 TRP A 119 -25.919 -3.380 -4.853 1.00 0.00 C ATOM 1934 CH2 TRP A 119 -27.269 -3.756 -4.805 1.00 0.00 C ATOM 0 H TRP A 119 -23.772 2.516 -8.046 1.00 0.00 H new ATOM 0 HA TRP A 119 -26.141 2.162 -6.445 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -25.182 0.778 -8.503 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -24.268 -0.066 -7.268 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -27.931 0.848 -8.109 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -29.512 -0.939 -7.116 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -24.481 -1.964 -5.608 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -29.269 -3.283 -5.452 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -25.179 -3.967 -4.329 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -27.568 -4.630 -4.245 1.00 0.00 H new ATOM 1945 N VAL A 120 -23.284 2.037 -5.027 1.00 0.00 N ATOM 1946 CA VAL A 120 -22.589 1.828 -3.758 1.00 0.00 C ATOM 1947 C VAL A 120 -21.810 3.078 -3.353 1.00 0.00 C ATOM 1948 O VAL A 120 -20.580 3.094 -3.393 1.00 0.00 O ATOM 1949 CB VAL A 120 -21.629 0.642 -3.867 1.00 0.00 C ATOM 1950 CG1 VAL A 120 -21.194 0.209 -2.465 1.00 0.00 C ATOM 1951 CG2 VAL A 120 -22.336 -0.524 -4.559 1.00 0.00 C ATOM 0 H VAL A 120 -22.774 2.603 -5.705 1.00 0.00 H new ATOM 0 HA VAL A 120 -23.338 1.618 -2.995 1.00 0.00 H new ATOM 0 HB VAL A 120 -20.754 0.935 -4.448 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -20.510 -0.636 -2.541 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -20.692 1.039 -1.967 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -22.070 -0.084 -1.887 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -21.652 -1.369 -4.637 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -23.210 -0.817 -3.977 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -22.650 -0.218 -5.557 1.00 0.00 H new ATOM 1961 N PRO A 121 -22.503 4.117 -2.960 1.00 0.00 N ATOM 1962 CA PRO A 121 -21.867 5.396 -2.531 1.00 0.00 C ATOM 1963 C PRO A 121 -21.306 5.302 -1.114 1.00 0.00 C ATOM 1964 O PRO A 121 -20.522 6.147 -0.683 1.00 0.00 O ATOM 1965 CB PRO A 121 -23.019 6.400 -2.603 1.00 0.00 C ATOM 1966 CG PRO A 121 -24.248 5.594 -2.338 1.00 0.00 C ATOM 1967 CD PRO A 121 -23.973 4.187 -2.879 1.00 0.00 C ATOM 0 HA PRO A 121 -21.015 5.672 -3.153 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -22.899 7.192 -1.864 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -23.064 6.880 -3.581 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -24.468 5.563 -1.271 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -25.115 6.036 -2.830 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -24.373 3.419 -2.217 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -24.434 4.038 -3.855 1.00 0.00 H new ATOM 1975 N GLN A 122 -21.725 4.267 -0.396 1.00 0.00 N ATOM 1976 CA GLN A 122 -21.275 4.064 0.976 1.00 0.00 C ATOM 1977 C GLN A 122 -19.755 3.974 1.040 1.00 0.00 C ATOM 1978 O GLN A 122 -19.113 4.694 1.806 1.00 0.00 O ATOM 1979 CB GLN A 122 -21.891 2.783 1.542 1.00 0.00 C ATOM 1980 CG GLN A 122 -23.405 2.963 1.678 1.00 0.00 C ATOM 1981 CD GLN A 122 -24.057 1.639 2.063 1.00 0.00 C ATOM 1982 OE1 GLN A 122 -24.738 1.556 3.085 1.00 0.00 O ATOM 1983 NE2 GLN A 122 -23.887 0.593 1.301 1.00 0.00 N ATOM 0 H GLN A 122 -22.373 3.558 -0.739 1.00 0.00 H new ATOM 0 HA GLN A 122 -21.598 4.917 1.572 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -21.671 1.940 0.886 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -21.452 2.554 2.513 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -23.623 3.718 2.433 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -23.822 3.323 0.738 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -23.322 0.665 0.455 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -24.319 -0.296 1.552 1.00 0.00 H new ATOM 1992 N VAL A 123 -19.182 3.084 0.236 1.00 0.00 N ATOM 1993 CA VAL A 123 -17.732 2.906 0.215 1.00 0.00 C ATOM 1994 C VAL A 123 -17.119 3.586 -1.006 1.00 0.00 C ATOM 1995 O VAL A 123 -16.392 2.965 -1.780 1.00 0.00 O ATOM 1996 CB VAL A 123 -17.390 1.414 0.188 1.00 0.00 C ATOM 1997 CG1 VAL A 123 -15.919 1.218 0.558 1.00 0.00 C ATOM 1998 CG2 VAL A 123 -18.272 0.670 1.195 1.00 0.00 C ATOM 0 H VAL A 123 -19.694 2.478 -0.406 1.00 0.00 H new ATOM 0 HA VAL A 123 -17.320 3.362 1.115 1.00 0.00 H new ATOM 0 HB VAL A 123 -17.567 1.020 -0.813 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -15.677 0.155 0.538 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -15.290 1.747 -0.158 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -15.740 1.612 1.558 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -18.029 -0.392 1.176 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -18.095 1.065 2.195 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -19.321 0.807 0.931 1.00 0.00 H new ATOM 2008 N PHE A 124 -17.420 4.872 -1.166 1.00 0.00 N ATOM 2009 CA PHE A 124 -16.898 5.642 -2.288 1.00 0.00 C ATOM 2010 C PHE A 124 -16.927 7.135 -1.965 1.00 0.00 C ATOM 2011 O PHE A 124 -16.000 7.871 -2.304 1.00 0.00 O ATOM 2012 CB PHE A 124 -17.729 5.364 -3.548 1.00 0.00 C ATOM 2013 CG PHE A 124 -17.512 6.473 -4.554 1.00 0.00 C ATOM 2014 CD1 PHE A 124 -16.278 6.599 -5.201 1.00 0.00 C ATOM 2015 CD2 PHE A 124 -18.544 7.377 -4.833 1.00 0.00 C ATOM 2016 CE1 PHE A 124 -16.075 7.629 -6.129 1.00 0.00 C ATOM 2017 CE2 PHE A 124 -18.341 8.407 -5.759 1.00 0.00 C ATOM 2018 CZ PHE A 124 -17.107 8.533 -6.407 1.00 0.00 C ATOM 0 H PHE A 124 -18.021 5.400 -0.534 1.00 0.00 H new ATOM 0 HA PHE A 124 -15.866 5.341 -2.468 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -17.442 4.406 -3.981 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -18.786 5.294 -3.291 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -15.482 5.902 -4.985 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -19.497 7.280 -4.334 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -15.123 7.725 -6.630 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -19.137 9.105 -5.973 1.00 0.00 H new ATOM 0 HZ PHE A 124 -16.951 9.328 -7.122 1.00 0.00 H new ATOM 2028 N VAL A 125 -17.997 7.573 -1.310 1.00 0.00 N ATOM 2029 CA VAL A 125 -18.136 8.979 -0.947 1.00 0.00 C ATOM 2030 C VAL A 125 -16.925 9.449 -0.144 1.00 0.00 C ATOM 2031 O VAL A 125 -16.590 8.870 0.888 1.00 0.00 O ATOM 2032 CB VAL A 125 -19.416 9.180 -0.129 1.00 0.00 C ATOM 2033 CG1 VAL A 125 -19.408 10.568 0.521 1.00 0.00 C ATOM 2034 CG2 VAL A 125 -20.632 9.062 -1.053 1.00 0.00 C ATOM 0 H VAL A 125 -18.775 6.980 -1.021 1.00 0.00 H new ATOM 0 HA VAL A 125 -18.196 9.570 -1.861 1.00 0.00 H new ATOM 0 HB VAL A 125 -19.467 8.419 0.649 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -20.321 10.704 1.101 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -18.544 10.657 1.179 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -19.354 11.332 -0.254 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -21.544 9.205 -0.474 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -20.573 9.823 -1.831 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -20.645 8.074 -1.513 1.00 0.00 H new ATOM 2044 N ALA A 126 -16.272 10.501 -0.632 1.00 0.00 N ATOM 2045 CA ALA A 126 -15.096 11.046 0.043 1.00 0.00 C ATOM 2046 C ALA A 126 -15.491 12.189 0.973 1.00 0.00 C ATOM 2047 O ALA A 126 -16.544 12.804 0.802 1.00 0.00 O ATOM 2048 CB ALA A 126 -14.094 11.555 -0.994 1.00 0.00 C ATOM 0 H ALA A 126 -16.535 10.991 -1.487 1.00 0.00 H new ATOM 0 HA ALA A 126 -14.640 10.253 0.636 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -13.219 11.960 -0.486 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -13.789 10.732 -1.640 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -14.558 12.336 -1.596 1.00 0.00 H new ATOM 2054 N SER A 127 -14.641 12.470 1.955 1.00 0.00 N ATOM 2055 CA SER A 127 -14.908 13.544 2.905 1.00 0.00 C ATOM 2056 C SER A 127 -13.697 13.773 3.808 1.00 0.00 C ATOM 2057 O SER A 127 -13.440 12.995 4.725 1.00 0.00 O ATOM 2058 CB SER A 127 -16.135 13.193 3.754 1.00 0.00 C ATOM 2059 OG SER A 127 -17.081 14.251 3.671 1.00 0.00 O ATOM 0 H SER A 127 -13.765 11.972 2.114 1.00 0.00 H new ATOM 0 HA SER A 127 -15.105 14.461 2.350 1.00 0.00 H new ATOM 0 HB2 SER A 127 -16.581 12.263 3.402 1.00 0.00 H new ATOM 0 HB3 SER A 127 -15.840 13.033 4.791 1.00 0.00 H new ATOM 0 HG SER A 127 -17.868 14.029 4.211 1.00 0.00 H new ATOM 2065 N GLY A 128 -12.957 14.847 3.541 1.00 0.00 N ATOM 2066 CA GLY A 128 -11.773 15.168 4.338 1.00 0.00 C ATOM 2067 C GLY A 128 -10.640 15.675 3.451 1.00 0.00 C ATOM 2068 O GLY A 128 -10.804 15.819 2.239 1.00 0.00 O ATOM 0 H GLY A 128 -13.153 15.505 2.786 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -12.024 15.924 5.081 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -11.445 14.282 4.883 1.00 0.00 H new ATOM 2072 N ASP A 129 -9.488 15.942 4.062 1.00 0.00 N ATOM 2073 CA ASP A 129 -8.331 16.428 3.317 1.00 0.00 C ATOM 2074 C ASP A 129 -7.494 15.256 2.817 1.00 0.00 C ATOM 2075 O ASP A 129 -7.308 14.267 3.526 1.00 0.00 O ATOM 2076 CB ASP A 129 -7.475 17.331 4.206 1.00 0.00 C ATOM 2077 CG ASP A 129 -6.261 17.828 3.427 1.00 0.00 C ATOM 2078 OD1 ASP A 129 -6.455 18.573 2.480 1.00 0.00 O ATOM 2079 OD2 ASP A 129 -5.156 17.458 3.789 1.00 0.00 O ATOM 0 H ASP A 129 -9.332 15.831 5.064 1.00 0.00 H new ATOM 0 HA ASP A 129 -8.685 17.001 2.460 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -8.066 18.178 4.555 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -7.151 16.783 5.091 1.00 0.00 H new ATOM 2084 N CYS A 130 -7.000 15.368 1.589 1.00 0.00 N ATOM 2085 CA CYS A 130 -6.194 14.305 0.997 1.00 0.00 C ATOM 2086 C CYS A 130 -4.709 14.523 1.272 1.00 0.00 C ATOM 2087 O CYS A 130 -4.194 15.630 1.117 1.00 0.00 O ATOM 2088 CB CYS A 130 -6.435 14.254 -0.514 1.00 0.00 C ATOM 2089 SG CYS A 130 -8.041 13.486 -0.845 1.00 0.00 S ATOM 0 H CYS A 130 -7.142 16.179 0.987 1.00 0.00 H new ATOM 0 HA CYS A 130 -6.491 13.359 1.450 1.00 0.00 H new ATOM 0 HB2 CYS A 130 -6.409 15.261 -0.931 1.00 0.00 H new ATOM 0 HB3 CYS A 130 -5.642 13.687 -1.000 1.00 0.00 H new ATOM 2094 N ALA A 131 -4.029 13.449 1.672 1.00 0.00 N ATOM 2095 CA ALA A 131 -2.597 13.505 1.962 1.00 0.00 C ATOM 2096 C ALA A 131 -2.345 13.933 3.406 1.00 0.00 C ATOM 2097 O ALA A 131 -1.197 14.013 3.844 1.00 0.00 O ATOM 2098 CB ALA A 131 -1.894 14.476 1.004 1.00 0.00 C ATOM 0 H ALA A 131 -4.448 12.528 1.803 1.00 0.00 H new ATOM 0 HA ALA A 131 -2.189 12.504 1.821 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -0.829 14.506 1.233 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -2.035 14.139 -0.023 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -2.318 15.473 1.120 1.00 0.00 H new ATOM 2104 N GLU A 132 -3.417 14.201 4.143 1.00 0.00 N ATOM 2105 CA GLU A 132 -3.282 14.613 5.537 1.00 0.00 C ATOM 2106 C GLU A 132 -2.756 13.459 6.383 1.00 0.00 C ATOM 2107 O GLU A 132 -2.963 12.292 6.051 1.00 0.00 O ATOM 2108 CB GLU A 132 -4.636 15.067 6.083 1.00 0.00 C ATOM 2109 CG GLU A 132 -4.432 15.806 7.407 1.00 0.00 C ATOM 2110 CD GLU A 132 -5.769 16.322 7.927 1.00 0.00 C ATOM 2111 OE1 GLU A 132 -6.566 15.507 8.364 1.00 0.00 O ATOM 2112 OE2 GLU A 132 -5.977 17.523 7.880 1.00 0.00 O ATOM 0 H GLU A 132 -4.378 14.142 3.805 1.00 0.00 H new ATOM 0 HA GLU A 132 -2.575 15.442 5.585 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -5.130 15.719 5.363 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -5.287 14.206 6.232 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -3.981 15.138 8.140 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -3.742 16.638 7.266 1.00 0.00 H new ATOM 2119 N ARG A 133 -2.079 13.787 7.480 1.00 0.00 N ATOM 2120 CA ARG A 133 -1.531 12.763 8.368 1.00 0.00 C ATOM 2121 C ARG A 133 -2.445 12.573 9.575 1.00 0.00 C ATOM 2122 O ARG A 133 -2.671 13.506 10.346 1.00 0.00 O ATOM 2123 CB ARG A 133 -0.122 13.163 8.839 1.00 0.00 C ATOM 2124 CG ARG A 133 0.320 14.448 8.135 1.00 0.00 C ATOM 2125 CD ARG A 133 1.743 14.811 8.570 1.00 0.00 C ATOM 2126 NE ARG A 133 1.974 16.240 8.399 1.00 0.00 N ATOM 2127 CZ ARG A 133 2.104 16.776 7.190 1.00 0.00 C ATOM 2128 NH1 ARG A 133 2.027 16.019 6.129 1.00 0.00 N ATOM 2129 NH2 ARG A 133 2.310 18.058 7.062 1.00 0.00 N ATOM 0 H ARG A 133 -1.897 14.746 7.775 1.00 0.00 H new ATOM 0 HA ARG A 133 -1.466 11.824 7.818 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -0.119 13.311 9.919 1.00 0.00 H new ATOM 0 HB3 ARG A 133 0.584 12.360 8.625 1.00 0.00 H new ATOM 0 HG2 ARG A 133 0.283 14.313 7.054 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -0.364 15.261 8.378 1.00 0.00 H new ATOM 0 HD2 ARG A 133 1.894 14.533 9.613 1.00 0.00 H new ATOM 0 HD3 ARG A 133 2.466 14.246 7.982 1.00 0.00 H new ATOM 0 HE ARG A 133 2.037 16.839 9.222 1.00 0.00 H new ATOM 0 HH11 ARG A 133 1.867 15.017 6.228 1.00 0.00 H new ATOM 0 HH12 ARG A 133 2.127 16.430 5.201 1.00 0.00 H new ATOM 0 HH21 ARG A 133 2.371 18.650 7.890 1.00 0.00 H new ATOM 0 HH22 ARG A 133 2.410 18.468 6.134 1.00 0.00 H new ATOM 2143 N GLN A 134 -2.971 11.361 9.729 1.00 0.00 N ATOM 2144 CA GLN A 134 -3.864 11.059 10.844 1.00 0.00 C ATOM 2145 C GLN A 134 -3.321 9.899 11.671 1.00 0.00 C ATOM 2146 O GLN A 134 -3.794 9.639 12.776 1.00 0.00 O ATOM 2147 CB GLN A 134 -5.254 10.704 10.310 1.00 0.00 C ATOM 2148 CG GLN A 134 -5.870 11.934 9.635 1.00 0.00 C ATOM 2149 CD GLN A 134 -6.936 11.504 8.633 1.00 0.00 C ATOM 2150 OE1 GLN A 134 -6.617 10.901 7.608 1.00 0.00 O ATOM 2151 NE2 GLN A 134 -8.189 11.782 8.868 1.00 0.00 N ATOM 0 H GLN A 134 -2.796 10.577 9.101 1.00 0.00 H new ATOM 0 HA GLN A 134 -3.931 11.940 11.483 1.00 0.00 H new ATOM 0 HB2 GLN A 134 -5.183 9.882 9.598 1.00 0.00 H new ATOM 0 HB3 GLN A 134 -5.893 10.365 11.125 1.00 0.00 H new ATOM 0 HG2 GLN A 134 -6.310 12.589 10.387 1.00 0.00 H new ATOM 0 HG3 GLN A 134 -5.094 12.507 9.128 1.00 0.00 H new ATOM 0 HE21 GLN A 134 -8.450 12.282 9.718 1.00 0.00 H new ATOM 0 HE22 GLN A 134 -8.908 11.500 8.202 1.00 0.00 H new ATOM 2160 N TRP A 135 -2.325 9.205 11.131 1.00 0.00 N ATOM 2161 CA TRP A 135 -1.730 8.076 11.838 1.00 0.00 C ATOM 2162 C TRP A 135 -0.506 7.552 11.090 1.00 0.00 C ATOM 2163 O TRP A 135 -0.572 7.293 9.889 1.00 0.00 O ATOM 2164 CB TRP A 135 -2.763 6.953 11.989 1.00 0.00 C ATOM 2165 CG TRP A 135 -2.435 6.123 13.189 1.00 0.00 C ATOM 2166 CD1 TRP A 135 -1.596 5.062 13.195 1.00 0.00 C ATOM 2167 CD2 TRP A 135 -2.926 6.264 14.554 1.00 0.00 C ATOM 2168 NE1 TRP A 135 -1.541 4.543 14.476 1.00 0.00 N ATOM 2169 CE2 TRP A 135 -2.343 5.249 15.349 1.00 0.00 C ATOM 2170 CE3 TRP A 135 -3.811 7.164 15.173 1.00 0.00 C ATOM 2171 CZ2 TRP A 135 -2.628 5.132 16.710 1.00 0.00 C ATOM 2172 CZ3 TRP A 135 -4.101 7.049 16.543 1.00 0.00 C ATOM 2173 CH2 TRP A 135 -3.510 6.035 17.309 1.00 0.00 C ATOM 0 H TRP A 135 -1.916 9.401 10.217 1.00 0.00 H new ATOM 0 HA TRP A 135 -1.415 8.416 12.824 1.00 0.00 H new ATOM 0 HB2 TRP A 135 -3.762 7.376 12.090 1.00 0.00 H new ATOM 0 HB3 TRP A 135 -2.770 6.330 11.095 1.00 0.00 H new ATOM 0 HD1 TRP A 135 -1.057 4.682 12.340 1.00 0.00 H new ATOM 0 HE1 TRP A 135 -0.976 3.737 14.743 1.00 0.00 H new ATOM 0 HE3 TRP A 135 -4.271 7.949 14.591 1.00 0.00 H new ATOM 0 HZ2 TRP A 135 -2.170 4.349 17.296 1.00 0.00 H new ATOM 0 HZ3 TRP A 135 -4.783 7.746 17.008 1.00 0.00 H new ATOM 0 HH2 TRP A 135 -3.736 5.952 18.362 1.00 0.00 H new ATOM 2184 N ASP A 136 0.617 7.427 11.793 1.00 0.00 N ATOM 2185 CA ASP A 136 1.848 6.967 11.155 1.00 0.00 C ATOM 2186 C ASP A 136 2.639 6.017 12.048 1.00 0.00 C ATOM 2187 O ASP A 136 2.460 5.987 13.267 1.00 0.00 O ATOM 2188 CB ASP A 136 2.723 8.176 10.816 1.00 0.00 C ATOM 2189 CG ASP A 136 2.788 9.120 12.012 1.00 0.00 C ATOM 2190 OD1 ASP A 136 3.324 8.716 13.032 1.00 0.00 O ATOM 2191 OD2 ASP A 136 2.302 10.232 11.892 1.00 0.00 O ATOM 0 H ASP A 136 0.701 7.634 12.788 1.00 0.00 H new ATOM 0 HA ASP A 136 1.569 6.424 10.252 1.00 0.00 H new ATOM 0 HB2 ASP A 136 3.726 7.846 10.547 1.00 0.00 H new ATOM 0 HB3 ASP A 136 2.317 8.699 9.950 1.00 0.00 H new ATOM 2196 N PHE A 137 3.535 5.260 11.419 1.00 0.00 N ATOM 2197 CA PHE A 137 4.392 4.315 12.129 1.00 0.00 C ATOM 2198 C PHE A 137 5.850 4.719 11.922 1.00 0.00 C ATOM 2199 O PHE A 137 6.249 5.073 10.814 1.00 0.00 O ATOM 2200 CB PHE A 137 4.155 2.893 11.601 1.00 0.00 C ATOM 2201 CG PHE A 137 4.240 1.902 12.740 1.00 0.00 C ATOM 2202 CD1 PHE A 137 5.453 1.710 13.412 1.00 0.00 C ATOM 2203 CD2 PHE A 137 3.105 1.177 13.127 1.00 0.00 C ATOM 2204 CE1 PHE A 137 5.533 0.795 14.468 1.00 0.00 C ATOM 2205 CE2 PHE A 137 3.184 0.261 14.182 1.00 0.00 C ATOM 2206 CZ PHE A 137 4.398 0.070 14.852 1.00 0.00 C ATOM 0 H PHE A 137 3.687 5.284 10.411 1.00 0.00 H new ATOM 0 HA PHE A 137 4.157 4.331 13.193 1.00 0.00 H new ATOM 0 HB2 PHE A 137 3.176 2.831 11.125 1.00 0.00 H new ATOM 0 HB3 PHE A 137 4.896 2.650 10.839 1.00 0.00 H new ATOM 0 HD1 PHE A 137 6.328 2.269 13.115 1.00 0.00 H new ATOM 0 HD2 PHE A 137 2.168 1.325 12.610 1.00 0.00 H new ATOM 0 HE1 PHE A 137 6.469 0.648 14.986 1.00 0.00 H new ATOM 0 HE2 PHE A 137 2.309 -0.298 14.479 1.00 0.00 H new ATOM 0 HZ PHE A 137 4.459 -0.637 15.666 1.00 0.00 H new ATOM 2216 N LEU A 138 6.643 4.665 12.984 1.00 0.00 N ATOM 2217 CA LEU A 138 8.051 5.036 12.881 1.00 0.00 C ATOM 2218 C LEU A 138 8.194 6.402 12.205 1.00 0.00 C ATOM 2219 O LEU A 138 9.276 6.765 11.747 1.00 0.00 O ATOM 2220 CB LEU A 138 8.816 3.973 12.077 1.00 0.00 C ATOM 2221 CG LEU A 138 9.447 2.947 13.030 1.00 0.00 C ATOM 2222 CD1 LEU A 138 9.669 1.625 12.290 1.00 0.00 C ATOM 2223 CD2 LEU A 138 10.794 3.474 13.536 1.00 0.00 C ATOM 0 H LEU A 138 6.343 4.373 13.914 1.00 0.00 H new ATOM 0 HA LEU A 138 8.470 5.096 13.885 1.00 0.00 H new ATOM 0 HB2 LEU A 138 8.139 3.471 11.386 1.00 0.00 H new ATOM 0 HB3 LEU A 138 9.591 4.448 11.476 1.00 0.00 H new ATOM 0 HG LEU A 138 8.777 2.785 13.875 1.00 0.00 H new ATOM 0 HD11 LEU A 138 10.117 0.899 12.969 1.00 0.00 H new ATOM 0 HD12 LEU A 138 8.713 1.244 11.931 1.00 0.00 H new ATOM 0 HD13 LEU A 138 10.335 1.789 11.443 1.00 0.00 H new ATOM 0 HD21 LEU A 138 11.240 2.744 14.212 1.00 0.00 H new ATOM 0 HD22 LEU A 138 11.461 3.640 12.690 1.00 0.00 H new ATOM 0 HD23 LEU A 138 10.641 4.414 14.067 1.00 0.00 H new ATOM 2235 N GLY A 139 7.100 7.158 12.156 1.00 0.00 N ATOM 2236 CA GLY A 139 7.123 8.486 11.542 1.00 0.00 C ATOM 2237 C GLY A 139 6.781 8.427 10.053 1.00 0.00 C ATOM 2238 O GLY A 139 7.115 9.340 9.298 1.00 0.00 O ATOM 0 H GLY A 139 6.193 6.878 12.530 1.00 0.00 H new ATOM 0 HA2 GLY A 139 6.412 9.135 12.053 1.00 0.00 H new ATOM 0 HA3 GLY A 139 8.110 8.930 11.671 1.00 0.00 H new ATOM 2242 N LEU A 140 6.107 7.355 9.639 1.00 0.00 N ATOM 2243 CA LEU A 140 5.716 7.190 8.236 1.00 0.00 C ATOM 2244 C LEU A 140 4.201 7.028 8.138 1.00 0.00 C ATOM 2245 O LEU A 140 3.596 6.273 8.899 1.00 0.00 O ATOM 2246 CB LEU A 140 6.412 5.956 7.640 1.00 0.00 C ATOM 2247 CG LEU A 140 7.659 6.372 6.842 1.00 0.00 C ATOM 2248 CD1 LEU A 140 7.249 7.167 5.592 1.00 0.00 C ATOM 2249 CD2 LEU A 140 8.578 7.227 7.726 1.00 0.00 C ATOM 0 H LEU A 140 5.821 6.590 10.250 1.00 0.00 H new ATOM 0 HA LEU A 140 6.019 8.074 7.675 1.00 0.00 H new ATOM 0 HB2 LEU A 140 6.696 5.271 8.439 1.00 0.00 H new ATOM 0 HB3 LEU A 140 5.720 5.419 6.991 1.00 0.00 H new ATOM 0 HG LEU A 140 8.193 5.475 6.528 1.00 0.00 H new ATOM 0 HD11 LEU A 140 8.141 7.456 5.036 1.00 0.00 H new ATOM 0 HD12 LEU A 140 6.612 6.548 4.960 1.00 0.00 H new ATOM 0 HD13 LEU A 140 6.703 8.062 5.892 1.00 0.00 H new ATOM 0 HD21 LEU A 140 9.460 7.520 7.157 1.00 0.00 H new ATOM 0 HD22 LEU A 140 8.043 8.119 8.051 1.00 0.00 H new ATOM 0 HD23 LEU A 140 8.884 6.650 8.598 1.00 0.00 H new ATOM 2261 N GLU A 141 3.596 7.741 7.194 1.00 0.00 N ATOM 2262 CA GLU A 141 2.151 7.671 7.002 1.00 0.00 C ATOM 2263 C GLU A 141 1.747 6.309 6.450 1.00 0.00 C ATOM 2264 O GLU A 141 2.503 5.676 5.714 1.00 0.00 O ATOM 2265 CB GLU A 141 1.700 8.776 6.041 1.00 0.00 C ATOM 2266 CG GLU A 141 2.568 10.018 6.246 1.00 0.00 C ATOM 2267 CD GLU A 141 1.947 11.213 5.531 1.00 0.00 C ATOM 2268 OE1 GLU A 141 1.569 11.059 4.382 1.00 0.00 O ATOM 2269 OE2 GLU A 141 1.859 12.264 6.144 1.00 0.00 O ATOM 0 H GLU A 141 4.080 8.370 6.553 1.00 0.00 H new ATOM 0 HA GLU A 141 1.666 7.811 7.968 1.00 0.00 H new ATOM 0 HB2 GLU A 141 1.779 8.430 5.010 1.00 0.00 H new ATOM 0 HB3 GLU A 141 0.652 9.019 6.216 1.00 0.00 H new ATOM 0 HG2 GLU A 141 2.666 10.231 7.310 1.00 0.00 H new ATOM 0 HG3 GLU A 141 3.572 9.837 5.863 1.00 0.00 H new ATOM 2276 N MET A 142 0.549 5.861 6.813 1.00 0.00 N ATOM 2277 CA MET A 142 0.056 4.570 6.347 1.00 0.00 C ATOM 2278 C MET A 142 0.225 4.441 4.831 1.00 0.00 C ATOM 2279 O MET A 142 0.791 3.460 4.349 1.00 0.00 O ATOM 2280 CB MET A 142 -1.423 4.401 6.733 1.00 0.00 C ATOM 2281 CG MET A 142 -1.569 3.269 7.755 1.00 0.00 C ATOM 2282 SD MET A 142 -0.582 3.651 9.224 1.00 0.00 S ATOM 2283 CE MET A 142 -0.449 1.962 9.857 1.00 0.00 C ATOM 0 H MET A 142 -0.093 6.368 7.423 1.00 0.00 H new ATOM 0 HA MET A 142 0.640 3.783 6.825 1.00 0.00 H new ATOM 0 HB2 MET A 142 -1.808 5.332 7.151 1.00 0.00 H new ATOM 0 HB3 MET A 142 -2.017 4.181 5.846 1.00 0.00 H new ATOM 0 HG2 MET A 142 -2.617 3.146 8.030 1.00 0.00 H new ATOM 0 HG3 MET A 142 -1.241 2.326 7.318 1.00 0.00 H new ATOM 0 HE1 MET A 142 0.133 1.964 10.779 1.00 0.00 H new ATOM 0 HE2 MET A 142 -1.446 1.569 10.058 1.00 0.00 H new ATOM 0 HE3 MET A 142 0.046 1.334 9.117 1.00 0.00 H new ATOM 2293 N PRO A 143 -0.247 5.402 4.077 1.00 0.00 N ATOM 2294 CA PRO A 143 -0.135 5.380 2.590 1.00 0.00 C ATOM 2295 C PRO A 143 1.254 4.946 2.124 1.00 0.00 C ATOM 2296 O PRO A 143 1.392 4.211 1.147 1.00 0.00 O ATOM 2297 CB PRO A 143 -0.425 6.827 2.189 1.00 0.00 C ATOM 2298 CG PRO A 143 -1.324 7.350 3.260 1.00 0.00 C ATOM 2299 CD PRO A 143 -0.938 6.617 4.549 1.00 0.00 C ATOM 0 HA PRO A 143 -0.818 4.663 2.134 1.00 0.00 H new ATOM 0 HB2 PRO A 143 0.493 7.411 2.124 1.00 0.00 H new ATOM 0 HB3 PRO A 143 -0.904 6.877 1.211 1.00 0.00 H new ATOM 0 HG2 PRO A 143 -1.204 8.427 3.376 1.00 0.00 H new ATOM 0 HG3 PRO A 143 -2.370 7.171 3.010 1.00 0.00 H new ATOM 0 HD2 PRO A 143 -0.288 7.228 5.176 1.00 0.00 H new ATOM 0 HD3 PRO A 143 -1.816 6.370 5.146 1.00 0.00 H new ATOM 2307 N GLN A 144 2.280 5.399 2.838 1.00 0.00 N ATOM 2308 CA GLN A 144 3.651 5.046 2.490 1.00 0.00 C ATOM 2309 C GLN A 144 3.907 3.573 2.791 1.00 0.00 C ATOM 2310 O GLN A 144 4.415 2.832 1.946 1.00 0.00 O ATOM 2311 CB GLN A 144 4.634 5.909 3.283 1.00 0.00 C ATOM 2312 CG GLN A 144 4.640 7.330 2.715 1.00 0.00 C ATOM 2313 CD GLN A 144 5.345 7.346 1.365 1.00 0.00 C ATOM 2314 OE1 GLN A 144 4.710 7.151 0.328 1.00 0.00 O ATOM 2315 NE2 GLN A 144 6.630 7.568 1.315 1.00 0.00 N ATOM 0 H GLN A 144 2.189 6.005 3.653 1.00 0.00 H new ATOM 0 HA GLN A 144 3.796 5.224 1.424 1.00 0.00 H new ATOM 0 HB2 GLN A 144 4.351 5.928 4.335 1.00 0.00 H new ATOM 0 HB3 GLN A 144 5.635 5.481 3.230 1.00 0.00 H new ATOM 0 HG2 GLN A 144 3.618 7.691 2.605 1.00 0.00 H new ATOM 0 HG3 GLN A 144 5.144 8.005 3.406 1.00 0.00 H new ATOM 0 HE21 GLN A 144 7.154 7.729 2.175 1.00 0.00 H new ATOM 0 HE22 GLN A 144 7.111 7.580 0.416 1.00 0.00 H new ATOM 2324 N TRP A 145 3.549 3.151 3.996 1.00 0.00 N ATOM 2325 CA TRP A 145 3.745 1.765 4.390 1.00 0.00 C ATOM 2326 C TRP A 145 2.956 0.837 3.471 1.00 0.00 C ATOM 2327 O TRP A 145 3.524 -0.053 2.840 1.00 0.00 O ATOM 2328 CB TRP A 145 3.289 1.561 5.839 1.00 0.00 C ATOM 2329 CG TRP A 145 4.312 2.123 6.776 1.00 0.00 C ATOM 2330 CD1 TRP A 145 4.100 3.148 7.633 1.00 0.00 C ATOM 2331 CD2 TRP A 145 5.697 1.709 6.967 1.00 0.00 C ATOM 2332 NE1 TRP A 145 5.266 3.389 8.338 1.00 0.00 N ATOM 2333 CE2 TRP A 145 6.278 2.528 7.963 1.00 0.00 C ATOM 2334 CE3 TRP A 145 6.496 0.711 6.379 1.00 0.00 C ATOM 2335 CZ2 TRP A 145 7.606 2.365 8.361 1.00 0.00 C ATOM 2336 CZ3 TRP A 145 7.833 0.544 6.778 1.00 0.00 C ATOM 2337 CH2 TRP A 145 8.386 1.369 7.766 1.00 0.00 C ATOM 0 H TRP A 145 3.125 3.743 4.711 1.00 0.00 H new ATOM 0 HA TRP A 145 4.806 1.528 4.309 1.00 0.00 H new ATOM 0 HB2 TRP A 145 2.328 2.049 6.000 1.00 0.00 H new ATOM 0 HB3 TRP A 145 3.144 0.499 6.038 1.00 0.00 H new ATOM 0 HD1 TRP A 145 3.173 3.689 7.748 1.00 0.00 H new ATOM 0 HE1 TRP A 145 5.366 4.114 9.048 1.00 0.00 H new ATOM 0 HE3 TRP A 145 6.079 0.070 5.617 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 8.028 3.004 9.123 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 8.438 -0.225 6.320 1.00 0.00 H new ATOM 0 HH2 TRP A 145 9.414 1.236 8.068 1.00 0.00 H new ATOM 2348 N LEU A 146 1.645 1.051 3.396 1.00 0.00 N ATOM 2349 CA LEU A 146 0.798 0.229 2.539 1.00 0.00 C ATOM 2350 C LEU A 146 1.476 0.004 1.187 1.00 0.00 C ATOM 2351 O LEU A 146 1.433 -1.097 0.642 1.00 0.00 O ATOM 2352 CB LEU A 146 -0.558 0.913 2.329 1.00 0.00 C ATOM 2353 CG LEU A 146 -1.471 0.020 1.480 1.00 0.00 C ATOM 2354 CD1 LEU A 146 -1.772 -1.284 2.228 1.00 0.00 C ATOM 2355 CD2 LEU A 146 -2.781 0.763 1.200 1.00 0.00 C ATOM 0 H LEU A 146 1.151 1.779 3.913 1.00 0.00 H new ATOM 0 HA LEU A 146 0.642 -0.735 3.024 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -1.026 1.114 3.293 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -0.417 1.875 1.837 1.00 0.00 H new ATOM 0 HG LEU A 146 -0.972 -0.217 0.540 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -2.421 -1.912 1.618 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -0.840 -1.812 2.428 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -2.270 -1.056 3.171 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -3.435 0.133 0.597 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -3.274 0.999 2.143 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -2.568 1.686 0.661 1.00 0.00 H new ATOM 2367 N LEU A 147 2.120 1.046 0.661 1.00 0.00 N ATOM 2368 CA LEU A 147 2.822 0.922 -0.617 1.00 0.00 C ATOM 2369 C LEU A 147 3.913 -0.136 -0.478 1.00 0.00 C ATOM 2370 O LEU A 147 4.200 -0.886 -1.411 1.00 0.00 O ATOM 2371 CB LEU A 147 3.440 2.272 -1.018 1.00 0.00 C ATOM 2372 CG LEU A 147 2.620 2.926 -2.144 1.00 0.00 C ATOM 2373 CD1 LEU A 147 2.823 2.158 -3.460 1.00 0.00 C ATOM 2374 CD2 LEU A 147 1.128 2.930 -1.770 1.00 0.00 C ATOM 0 H LEU A 147 2.171 1.970 1.090 1.00 0.00 H new ATOM 0 HA LEU A 147 2.118 0.625 -1.394 1.00 0.00 H new ATOM 0 HB2 LEU A 147 3.474 2.934 -0.153 1.00 0.00 H new ATOM 0 HB3 LEU A 147 4.468 2.124 -1.347 1.00 0.00 H new ATOM 0 HG LEU A 147 2.960 3.953 -2.276 1.00 0.00 H new ATOM 0 HD11 LEU A 147 2.238 2.629 -4.250 1.00 0.00 H new ATOM 0 HD12 LEU A 147 3.879 2.174 -3.731 1.00 0.00 H new ATOM 0 HD13 LEU A 147 2.496 1.126 -3.333 1.00 0.00 H new ATOM 0 HD21 LEU A 147 0.553 3.394 -2.571 1.00 0.00 H new ATOM 0 HD22 LEU A 147 0.786 1.905 -1.625 1.00 0.00 H new ATOM 0 HD23 LEU A 147 0.986 3.493 -0.848 1.00 0.00 H new ATOM 2386 N GLY A 148 4.499 -0.186 0.710 1.00 0.00 N ATOM 2387 CA GLY A 148 5.548 -1.163 0.977 1.00 0.00 C ATOM 2388 C GLY A 148 5.012 -2.575 0.766 1.00 0.00 C ATOM 2389 O GLY A 148 5.654 -3.416 0.130 1.00 0.00 O ATOM 0 H GLY A 148 4.272 0.427 1.493 1.00 0.00 H new ATOM 0 HA2 GLY A 148 6.398 -0.986 0.318 1.00 0.00 H new ATOM 0 HA3 GLY A 148 5.909 -1.051 1.999 1.00 0.00 H new ATOM 2393 N ILE A 149 3.819 -2.818 1.294 1.00 0.00 N ATOM 2394 CA ILE A 149 3.177 -4.118 1.158 1.00 0.00 C ATOM 2395 C ILE A 149 2.613 -4.280 -0.249 1.00 0.00 C ATOM 2396 O ILE A 149 2.609 -5.377 -0.807 1.00 0.00 O ATOM 2397 CB ILE A 149 2.051 -4.244 2.186 1.00 0.00 C ATOM 2398 CG1 ILE A 149 2.625 -4.067 3.598 1.00 0.00 C ATOM 2399 CG2 ILE A 149 1.398 -5.623 2.068 1.00 0.00 C ATOM 2400 CD1 ILE A 149 1.510 -3.640 4.554 1.00 0.00 C ATOM 0 H ILE A 149 3.277 -2.132 1.820 1.00 0.00 H new ATOM 0 HA ILE A 149 3.916 -4.900 1.333 1.00 0.00 H new ATOM 0 HB ILE A 149 1.303 -3.474 1.999 1.00 0.00 H new ATOM 0 HG12 ILE A 149 3.073 -5.000 3.939 1.00 0.00 H new ATOM 0 HG13 ILE A 149 3.417 -3.318 3.589 1.00 0.00 H new ATOM 0 HG21 ILE A 149 0.596 -5.710 2.801 1.00 0.00 H new ATOM 0 HG22 ILE A 149 0.988 -5.747 1.066 1.00 0.00 H new ATOM 0 HG23 ILE A 149 2.144 -6.396 2.253 1.00 0.00 H new ATOM 0 HD11 ILE A 149 1.919 -3.515 5.557 1.00 0.00 H new ATOM 0 HD12 ILE A 149 1.082 -2.696 4.216 1.00 0.00 H new ATOM 0 HD13 ILE A 149 0.733 -4.405 4.572 1.00 0.00 H new ATOM 2412 N PHE A 150 2.142 -3.174 -0.814 1.00 0.00 N ATOM 2413 CA PHE A 150 1.580 -3.190 -2.157 1.00 0.00 C ATOM 2414 C PHE A 150 2.580 -3.784 -3.143 1.00 0.00 C ATOM 2415 O PHE A 150 2.238 -4.644 -3.952 1.00 0.00 O ATOM 2416 CB PHE A 150 1.212 -1.765 -2.581 1.00 0.00 C ATOM 2417 CG PHE A 150 0.190 -1.810 -3.691 1.00 0.00 C ATOM 2418 CD1 PHE A 150 -1.149 -2.095 -3.396 1.00 0.00 C ATOM 2419 CD2 PHE A 150 0.577 -1.564 -5.013 1.00 0.00 C ATOM 2420 CE1 PHE A 150 -2.100 -2.132 -4.421 1.00 0.00 C ATOM 2421 CE2 PHE A 150 -0.374 -1.602 -6.040 1.00 0.00 C ATOM 2422 CZ PHE A 150 -1.712 -1.887 -5.744 1.00 0.00 C ATOM 0 H PHE A 150 2.139 -2.259 -0.364 1.00 0.00 H new ATOM 0 HA PHE A 150 0.682 -3.808 -2.156 1.00 0.00 H new ATOM 0 HB2 PHE A 150 0.813 -1.214 -1.729 1.00 0.00 H new ATOM 0 HB3 PHE A 150 2.103 -1.234 -2.916 1.00 0.00 H new ATOM 0 HD1 PHE A 150 -1.448 -2.286 -2.376 1.00 0.00 H new ATOM 0 HD2 PHE A 150 1.610 -1.345 -5.241 1.00 0.00 H new ATOM 0 HE1 PHE A 150 -3.133 -2.349 -4.192 1.00 0.00 H new ATOM 0 HE2 PHE A 150 -0.075 -1.411 -7.060 1.00 0.00 H new ATOM 0 HZ PHE A 150 -2.445 -1.918 -6.536 1.00 0.00 H new ATOM 2432 N ILE A 151 3.821 -3.311 -3.065 1.00 0.00 N ATOM 2433 CA ILE A 151 4.871 -3.791 -3.953 1.00 0.00 C ATOM 2434 C ILE A 151 5.156 -5.265 -3.694 1.00 0.00 C ATOM 2435 O ILE A 151 5.315 -6.049 -4.627 1.00 0.00 O ATOM 2436 CB ILE A 151 6.149 -2.975 -3.744 1.00 0.00 C ATOM 2437 CG1 ILE A 151 5.871 -1.504 -4.066 1.00 0.00 C ATOM 2438 CG2 ILE A 151 7.249 -3.497 -4.669 1.00 0.00 C ATOM 2439 CD1 ILE A 151 7.026 -0.640 -3.556 1.00 0.00 C ATOM 0 H ILE A 151 4.121 -2.599 -2.399 1.00 0.00 H new ATOM 0 HA ILE A 151 4.533 -3.673 -4.982 1.00 0.00 H new ATOM 0 HB ILE A 151 6.473 -3.069 -2.707 1.00 0.00 H new ATOM 0 HG12 ILE A 151 5.753 -1.373 -5.142 1.00 0.00 H new ATOM 0 HG13 ILE A 151 4.936 -1.190 -3.602 1.00 0.00 H new ATOM 0 HG21 ILE A 151 8.158 -2.914 -4.518 1.00 0.00 H new ATOM 0 HG22 ILE A 151 7.448 -4.545 -4.443 1.00 0.00 H new ATOM 0 HG23 ILE A 151 6.927 -3.405 -5.706 1.00 0.00 H new ATOM 0 HD11 ILE A 151 6.827 0.407 -3.786 1.00 0.00 H new ATOM 0 HD12 ILE A 151 7.123 -0.762 -2.477 1.00 0.00 H new ATOM 0 HD13 ILE A 151 7.952 -0.948 -4.041 1.00 0.00 H new ATOM 2451 N ALA A 152 5.214 -5.637 -2.422 1.00 0.00 N ATOM 2452 CA ALA A 152 5.475 -7.027 -2.063 1.00 0.00 C ATOM 2453 C ALA A 152 4.590 -7.964 -2.883 1.00 0.00 C ATOM 2454 O ALA A 152 5.061 -8.972 -3.409 1.00 0.00 O ATOM 2455 CB ALA A 152 5.206 -7.242 -0.573 1.00 0.00 C ATOM 0 H ALA A 152 5.086 -5.007 -1.630 1.00 0.00 H new ATOM 0 HA ALA A 152 6.520 -7.249 -2.277 1.00 0.00 H new ATOM 0 HB1 ALA A 152 5.403 -8.282 -0.314 1.00 0.00 H new ATOM 0 HB2 ALA A 152 5.857 -6.593 0.012 1.00 0.00 H new ATOM 0 HB3 ALA A 152 4.165 -7.005 -0.353 1.00 0.00 H new ATOM 2461 N TYR A 153 3.308 -7.631 -2.978 1.00 0.00 N ATOM 2462 CA TYR A 153 2.365 -8.457 -3.726 1.00 0.00 C ATOM 2463 C TYR A 153 2.727 -8.491 -5.211 1.00 0.00 C ATOM 2464 O TYR A 153 2.686 -9.546 -5.843 1.00 0.00 O ATOM 2465 CB TYR A 153 0.940 -7.913 -3.542 1.00 0.00 C ATOM 2466 CG TYR A 153 0.267 -8.630 -2.391 1.00 0.00 C ATOM 2467 CD1 TYR A 153 0.920 -8.736 -1.157 1.00 0.00 C ATOM 2468 CD2 TYR A 153 -1.004 -9.194 -2.561 1.00 0.00 C ATOM 2469 CE1 TYR A 153 0.301 -9.403 -0.092 1.00 0.00 C ATOM 2470 CE2 TYR A 153 -1.622 -9.862 -1.495 1.00 0.00 C ATOM 2471 CZ TYR A 153 -0.969 -9.965 -0.261 1.00 0.00 C ATOM 2472 OH TYR A 153 -1.576 -10.625 0.790 1.00 0.00 O ATOM 0 H TYR A 153 2.899 -6.801 -2.550 1.00 0.00 H new ATOM 0 HA TYR A 153 2.416 -9.476 -3.341 1.00 0.00 H new ATOM 0 HB2 TYR A 153 0.972 -6.841 -3.347 1.00 0.00 H new ATOM 0 HB3 TYR A 153 0.365 -8.054 -4.457 1.00 0.00 H new ATOM 0 HD1 TYR A 153 1.901 -8.304 -1.026 1.00 0.00 H new ATOM 0 HD2 TYR A 153 -1.507 -9.114 -3.513 1.00 0.00 H new ATOM 0 HE1 TYR A 153 0.804 -9.483 0.860 1.00 0.00 H new ATOM 0 HE2 TYR A 153 -2.602 -10.297 -1.626 1.00 0.00 H new ATOM 0 HH TYR A 153 -2.524 -10.764 0.585 1.00 0.00 H new ATOM 2482 N LEU A 154 3.081 -7.336 -5.763 1.00 0.00 N ATOM 2483 CA LEU A 154 3.446 -7.256 -7.176 1.00 0.00 C ATOM 2484 C LEU A 154 4.514 -8.293 -7.518 1.00 0.00 C ATOM 2485 O LEU A 154 4.551 -8.818 -8.632 1.00 0.00 O ATOM 2486 CB LEU A 154 3.972 -5.850 -7.496 1.00 0.00 C ATOM 2487 CG LEU A 154 2.840 -4.981 -8.060 1.00 0.00 C ATOM 2488 CD1 LEU A 154 1.619 -5.047 -7.132 1.00 0.00 C ATOM 2489 CD2 LEU A 154 3.325 -3.526 -8.186 1.00 0.00 C ATOM 0 H LEU A 154 3.124 -6.449 -5.261 1.00 0.00 H new ATOM 0 HA LEU A 154 2.558 -7.460 -7.775 1.00 0.00 H new ATOM 0 HB2 LEU A 154 4.379 -5.391 -6.595 1.00 0.00 H new ATOM 0 HB3 LEU A 154 4.787 -5.913 -8.217 1.00 0.00 H new ATOM 0 HG LEU A 154 2.555 -5.353 -9.044 1.00 0.00 H new ATOM 0 HD11 LEU A 154 0.819 -4.428 -7.538 1.00 0.00 H new ATOM 0 HD12 LEU A 154 1.276 -6.079 -7.055 1.00 0.00 H new ATOM 0 HD13 LEU A 154 1.894 -4.681 -6.143 1.00 0.00 H new ATOM 0 HD21 LEU A 154 2.521 -2.908 -8.587 1.00 0.00 H new ATOM 0 HD22 LEU A 154 3.615 -3.153 -7.204 1.00 0.00 H new ATOM 0 HD23 LEU A 154 4.183 -3.485 -8.857 1.00 0.00 H new ATOM 2501 N ILE A 155 5.385 -8.579 -6.557 1.00 0.00 N ATOM 2502 CA ILE A 155 6.458 -9.546 -6.770 1.00 0.00 C ATOM 2503 C ILE A 155 5.944 -10.971 -6.579 1.00 0.00 C ATOM 2504 O ILE A 155 6.471 -11.914 -7.169 1.00 0.00 O ATOM 2505 CB ILE A 155 7.613 -9.269 -5.793 1.00 0.00 C ATOM 2506 CG1 ILE A 155 8.544 -8.204 -6.386 1.00 0.00 C ATOM 2507 CG2 ILE A 155 8.413 -10.552 -5.543 1.00 0.00 C ATOM 2508 CD1 ILE A 155 7.777 -6.895 -6.574 1.00 0.00 C ATOM 0 H ILE A 155 5.371 -8.159 -5.628 1.00 0.00 H new ATOM 0 HA ILE A 155 6.820 -9.443 -7.793 1.00 0.00 H new ATOM 0 HB ILE A 155 7.198 -8.914 -4.850 1.00 0.00 H new ATOM 0 HG12 ILE A 155 9.397 -8.045 -5.726 1.00 0.00 H new ATOM 0 HG13 ILE A 155 8.940 -8.545 -7.343 1.00 0.00 H new ATOM 0 HG21 ILE A 155 9.228 -10.343 -4.850 1.00 0.00 H new ATOM 0 HG22 ILE A 155 7.758 -11.311 -5.115 1.00 0.00 H new ATOM 0 HG23 ILE A 155 8.822 -10.915 -6.486 1.00 0.00 H new ATOM 0 HD11 ILE A 155 8.442 -6.141 -6.995 1.00 0.00 H new ATOM 0 HD12 ILE A 155 6.939 -7.059 -7.251 1.00 0.00 H new ATOM 0 HD13 ILE A 155 7.403 -6.551 -5.610 1.00 0.00 H new ATOM 2520 N VAL A 156 4.917 -11.124 -5.755 1.00 0.00 N ATOM 2521 CA VAL A 156 4.351 -12.443 -5.502 1.00 0.00 C ATOM 2522 C VAL A 156 3.766 -13.021 -6.786 1.00 0.00 C ATOM 2523 O VAL A 156 3.791 -14.232 -7.000 1.00 0.00 O ATOM 2524 CB VAL A 156 3.264 -12.350 -4.428 1.00 0.00 C ATOM 2525 CG1 VAL A 156 2.517 -13.682 -4.332 1.00 0.00 C ATOM 2526 CG2 VAL A 156 3.911 -12.033 -3.077 1.00 0.00 C ATOM 0 H VAL A 156 4.462 -10.360 -5.255 1.00 0.00 H new ATOM 0 HA VAL A 156 5.144 -13.102 -5.149 1.00 0.00 H new ATOM 0 HB VAL A 156 2.561 -11.560 -4.694 1.00 0.00 H new ATOM 0 HG11 VAL A 156 1.744 -13.611 -3.566 1.00 0.00 H new ATOM 0 HG12 VAL A 156 2.056 -13.911 -5.293 1.00 0.00 H new ATOM 0 HG13 VAL A 156 3.218 -14.474 -4.068 1.00 0.00 H new ATOM 0 HG21 VAL A 156 3.139 -11.966 -2.311 1.00 0.00 H new ATOM 0 HG22 VAL A 156 4.614 -12.824 -2.816 1.00 0.00 H new ATOM 0 HG23 VAL A 156 4.441 -11.083 -3.142 1.00 0.00 H new ATOM 2536 N ALA A 157 3.234 -12.148 -7.634 1.00 0.00 N ATOM 2537 CA ALA A 157 2.639 -12.587 -8.893 1.00 0.00 C ATOM 2538 C ALA A 157 3.708 -12.836 -9.955 1.00 0.00 C ATOM 2539 O ALA A 157 3.713 -13.877 -10.610 1.00 0.00 O ATOM 2540 CB ALA A 157 1.661 -11.531 -9.401 1.00 0.00 C ATOM 0 H ALA A 157 3.202 -11.141 -7.476 1.00 0.00 H new ATOM 0 HA ALA A 157 2.112 -13.523 -8.706 1.00 0.00 H new ATOM 0 HB1 ALA A 157 1.221 -11.865 -10.341 1.00 0.00 H new ATOM 0 HB2 ALA A 157 0.872 -11.381 -8.664 1.00 0.00 H new ATOM 0 HB3 ALA A 157 2.191 -10.592 -9.562 1.00 0.00 H new ATOM 2546 N VAL A 158 4.597 -11.865 -10.134 1.00 0.00 N ATOM 2547 CA VAL A 158 5.653 -11.980 -11.139 1.00 0.00 C ATOM 2548 C VAL A 158 6.456 -13.267 -10.964 1.00 0.00 C ATOM 2549 O VAL A 158 6.874 -13.884 -11.945 1.00 0.00 O ATOM 2550 CB VAL A 158 6.590 -10.773 -11.047 1.00 0.00 C ATOM 2551 CG1 VAL A 158 7.697 -10.900 -12.096 1.00 0.00 C ATOM 2552 CG2 VAL A 158 5.794 -9.490 -11.302 1.00 0.00 C ATOM 0 H VAL A 158 4.610 -10.995 -9.602 1.00 0.00 H new ATOM 0 HA VAL A 158 5.180 -12.008 -12.120 1.00 0.00 H new ATOM 0 HB VAL A 158 7.035 -10.736 -10.053 1.00 0.00 H new ATOM 0 HG11 VAL A 158 8.363 -10.040 -12.028 1.00 0.00 H new ATOM 0 HG12 VAL A 158 8.265 -11.813 -11.917 1.00 0.00 H new ATOM 0 HG13 VAL A 158 7.253 -10.938 -13.091 1.00 0.00 H new ATOM 0 HG21 VAL A 158 6.460 -8.630 -11.237 1.00 0.00 H new ATOM 0 HG22 VAL A 158 5.349 -9.530 -12.296 1.00 0.00 H new ATOM 0 HG23 VAL A 158 5.006 -9.396 -10.555 1.00 0.00 H new ATOM 2562 N LEU A 159 6.683 -13.665 -9.717 1.00 0.00 N ATOM 2563 CA LEU A 159 7.454 -14.875 -9.442 1.00 0.00 C ATOM 2564 C LEU A 159 6.565 -16.118 -9.491 1.00 0.00 C ATOM 2565 O LEU A 159 7.014 -17.194 -9.887 1.00 0.00 O ATOM 2566 CB LEU A 159 8.110 -14.767 -8.059 1.00 0.00 C ATOM 2567 CG LEU A 159 9.419 -13.968 -8.153 1.00 0.00 C ATOM 2568 CD1 LEU A 159 10.494 -14.791 -8.881 1.00 0.00 C ATOM 2569 CD2 LEU A 159 9.173 -12.661 -8.916 1.00 0.00 C ATOM 0 H LEU A 159 6.349 -13.174 -8.887 1.00 0.00 H new ATOM 0 HA LEU A 159 8.222 -14.972 -10.209 1.00 0.00 H new ATOM 0 HB2 LEU A 159 7.428 -14.280 -7.362 1.00 0.00 H new ATOM 0 HB3 LEU A 159 8.311 -15.763 -7.665 1.00 0.00 H new ATOM 0 HG LEU A 159 9.766 -13.743 -7.144 1.00 0.00 H new ATOM 0 HD11 LEU A 159 11.416 -14.213 -8.941 1.00 0.00 H new ATOM 0 HD12 LEU A 159 10.679 -15.714 -8.332 1.00 0.00 H new ATOM 0 HD13 LEU A 159 10.150 -15.030 -9.887 1.00 0.00 H new ATOM 0 HD21 LEU A 159 10.103 -12.097 -8.981 1.00 0.00 H new ATOM 0 HD22 LEU A 159 8.815 -12.888 -9.920 1.00 0.00 H new ATOM 0 HD23 LEU A 159 8.425 -12.068 -8.390 1.00 0.00 H new ATOM 2581 N VAL A 160 5.311 -15.970 -9.079 1.00 0.00 N ATOM 2582 CA VAL A 160 4.385 -17.100 -9.072 1.00 0.00 C ATOM 2583 C VAL A 160 4.006 -17.520 -10.492 1.00 0.00 C ATOM 2584 O VAL A 160 3.712 -18.690 -10.741 1.00 0.00 O ATOM 2585 CB VAL A 160 3.122 -16.734 -8.281 1.00 0.00 C ATOM 2586 CG1 VAL A 160 1.988 -17.704 -8.630 1.00 0.00 C ATOM 2587 CG2 VAL A 160 3.419 -16.817 -6.779 1.00 0.00 C ATOM 0 H VAL A 160 4.914 -15.090 -8.749 1.00 0.00 H new ATOM 0 HA VAL A 160 4.885 -17.943 -8.594 1.00 0.00 H new ATOM 0 HB VAL A 160 2.819 -15.720 -8.540 1.00 0.00 H new ATOM 0 HG11 VAL A 160 1.095 -17.438 -8.065 1.00 0.00 H new ATOM 0 HG12 VAL A 160 1.773 -17.644 -9.697 1.00 0.00 H new ATOM 0 HG13 VAL A 160 2.288 -18.721 -8.377 1.00 0.00 H new ATOM 0 HG21 VAL A 160 2.523 -16.557 -6.216 1.00 0.00 H new ATOM 0 HG22 VAL A 160 3.726 -17.831 -6.524 1.00 0.00 H new ATOM 0 HG23 VAL A 160 4.220 -16.122 -6.527 1.00 0.00 H new ATOM 2597 N VAL A 161 4.012 -16.569 -11.421 1.00 0.00 N ATOM 2598 CA VAL A 161 3.663 -16.873 -12.806 1.00 0.00 C ATOM 2599 C VAL A 161 4.872 -17.433 -13.554 1.00 0.00 C ATOM 2600 O VAL A 161 4.767 -18.443 -14.251 1.00 0.00 O ATOM 2601 CB VAL A 161 3.146 -15.616 -13.513 1.00 0.00 C ATOM 2602 CG1 VAL A 161 1.915 -15.085 -12.773 1.00 0.00 C ATOM 2603 CG2 VAL A 161 4.238 -14.542 -13.527 1.00 0.00 C ATOM 0 H VAL A 161 4.251 -15.593 -11.245 1.00 0.00 H new ATOM 0 HA VAL A 161 2.875 -17.626 -12.803 1.00 0.00 H new ATOM 0 HB VAL A 161 2.876 -15.865 -14.539 1.00 0.00 H new ATOM 0 HG11 VAL A 161 1.546 -14.191 -13.275 1.00 0.00 H new ATOM 0 HG12 VAL A 161 1.136 -15.847 -12.770 1.00 0.00 H new ATOM 0 HG13 VAL A 161 2.186 -14.839 -11.746 1.00 0.00 H new ATOM 0 HG21 VAL A 161 3.865 -13.650 -14.031 1.00 0.00 H new ATOM 0 HG22 VAL A 161 4.515 -14.291 -12.503 1.00 0.00 H new ATOM 0 HG23 VAL A 161 5.113 -14.919 -14.057 1.00 0.00 H new ATOM 2613 N ILE A 162 6.018 -16.776 -13.401 1.00 0.00 N ATOM 2614 CA ILE A 162 7.240 -17.224 -14.066 1.00 0.00 C ATOM 2615 C ILE A 162 7.764 -18.506 -13.418 1.00 0.00 C ATOM 2616 O ILE A 162 8.690 -19.136 -13.931 1.00 0.00 O ATOM 2617 CB ILE A 162 8.305 -16.118 -13.991 1.00 0.00 C ATOM 2618 CG1 ILE A 162 8.031 -15.063 -15.074 1.00 0.00 C ATOM 2619 CG2 ILE A 162 9.703 -16.712 -14.211 1.00 0.00 C ATOM 2620 CD1 ILE A 162 8.574 -13.704 -14.625 1.00 0.00 C ATOM 0 H ILE A 162 6.127 -15.939 -12.828 1.00 0.00 H new ATOM 0 HA ILE A 162 7.015 -17.435 -15.111 1.00 0.00 H new ATOM 0 HB ILE A 162 8.261 -15.656 -13.005 1.00 0.00 H new ATOM 0 HG12 ILE A 162 8.501 -15.361 -16.011 1.00 0.00 H new ATOM 0 HG13 ILE A 162 6.960 -14.992 -15.263 1.00 0.00 H new ATOM 0 HG21 ILE A 162 10.448 -15.919 -14.156 1.00 0.00 H new ATOM 0 HG22 ILE A 162 9.907 -17.456 -13.441 1.00 0.00 H new ATOM 0 HG23 ILE A 162 9.748 -17.184 -15.193 1.00 0.00 H new ATOM 0 HD11 ILE A 162 8.377 -12.960 -15.397 1.00 0.00 H new ATOM 0 HD12 ILE A 162 8.084 -13.404 -13.699 1.00 0.00 H new ATOM 0 HD13 ILE A 162 9.649 -13.778 -14.459 1.00 0.00 H new ATOM 2632 N SER A 163 7.169 -18.888 -12.292 1.00 0.00 N ATOM 2633 CA SER A 163 7.591 -20.099 -11.592 1.00 0.00 C ATOM 2634 C SER A 163 7.074 -21.343 -12.310 1.00 0.00 C ATOM 2635 O SER A 163 7.316 -22.469 -11.875 1.00 0.00 O ATOM 2636 CB SER A 163 7.067 -20.082 -10.153 1.00 0.00 C ATOM 2637 OG SER A 163 7.931 -19.290 -9.348 1.00 0.00 O ATOM 0 H SER A 163 6.402 -18.384 -11.848 1.00 0.00 H new ATOM 0 HA SER A 163 8.681 -20.127 -11.581 1.00 0.00 H new ATOM 0 HB2 SER A 163 6.055 -19.678 -10.127 1.00 0.00 H new ATOM 0 HB3 SER A 163 7.015 -21.098 -9.761 1.00 0.00 H new ATOM 0 HG SER A 163 7.518 -18.416 -9.187 1.00 0.00 H new ATOM 2643 N GLN A 164 6.357 -21.131 -13.409 1.00 0.00 N ATOM 2644 CA GLN A 164 5.806 -22.242 -14.178 1.00 0.00 C ATOM 2645 C GLN A 164 6.924 -23.113 -14.756 1.00 0.00 C ATOM 2646 O GLN A 164 7.056 -24.282 -14.389 1.00 0.00 O ATOM 2647 CB GLN A 164 4.912 -21.703 -15.306 1.00 0.00 C ATOM 2648 CG GLN A 164 3.440 -21.733 -14.872 1.00 0.00 C ATOM 2649 CD GLN A 164 2.846 -23.117 -15.116 1.00 0.00 C ATOM 2650 OE1 GLN A 164 1.694 -23.233 -15.535 1.00 0.00 O ATOM 2651 NE2 GLN A 164 3.565 -24.179 -14.879 1.00 0.00 N ATOM 0 H GLN A 164 6.145 -20.207 -13.785 1.00 0.00 H new ATOM 0 HA GLN A 164 5.206 -22.861 -13.511 1.00 0.00 H new ATOM 0 HB2 GLN A 164 5.205 -20.683 -15.557 1.00 0.00 H new ATOM 0 HB3 GLN A 164 5.046 -22.304 -16.206 1.00 0.00 H new ATOM 0 HG2 GLN A 164 3.360 -21.476 -13.816 1.00 0.00 H new ATOM 0 HG3 GLN A 164 2.875 -20.984 -15.426 1.00 0.00 H new ATOM 0 HE21 GLN A 164 4.519 -24.082 -14.532 1.00 0.00 H new ATOM 0 HE22 GLN A 164 3.173 -25.107 -15.041 1.00 0.00 H new ATOM 2660 N PRO A 165 7.723 -22.579 -15.646 1.00 0.00 N ATOM 2661 CA PRO A 165 8.846 -23.338 -16.277 1.00 0.00 C ATOM 2662 C PRO A 165 9.834 -23.871 -15.241 1.00 0.00 C ATOM 2663 O PRO A 165 10.811 -24.534 -15.587 1.00 0.00 O ATOM 2664 CB PRO A 165 9.519 -22.313 -17.206 1.00 0.00 C ATOM 2665 CG PRO A 165 9.043 -20.975 -16.742 1.00 0.00 C ATOM 2666 CD PRO A 165 7.655 -21.201 -16.151 1.00 0.00 C ATOM 0 HA PRO A 165 8.490 -24.221 -16.808 1.00 0.00 H new ATOM 0 HB2 PRO A 165 10.605 -22.385 -17.147 1.00 0.00 H new ATOM 0 HB3 PRO A 165 9.244 -22.487 -18.246 1.00 0.00 H new ATOM 0 HG2 PRO A 165 9.720 -20.557 -15.997 1.00 0.00 H new ATOM 0 HG3 PRO A 165 9.004 -20.267 -17.570 1.00 0.00 H new ATOM 0 HD2 PRO A 165 7.437 -20.491 -15.354 1.00 0.00 H new ATOM 0 HD3 PRO A 165 6.874 -21.086 -16.903 1.00 0.00 H new ATOM 2674 N PHE A 166 9.570 -23.580 -13.970 1.00 0.00 N ATOM 2675 CA PHE A 166 10.445 -24.040 -12.896 1.00 0.00 C ATOM 2676 C PHE A 166 10.899 -25.473 -13.156 1.00 0.00 C ATOM 2677 O PHE A 166 10.090 -26.342 -13.481 1.00 0.00 O ATOM 2678 CB PHE A 166 9.710 -23.968 -11.554 1.00 0.00 C ATOM 2679 CG PHE A 166 10.543 -24.637 -10.487 1.00 0.00 C ATOM 2680 CD1 PHE A 166 11.626 -23.959 -9.916 1.00 0.00 C ATOM 2681 CD2 PHE A 166 10.235 -25.939 -10.072 1.00 0.00 C ATOM 2682 CE1 PHE A 166 12.400 -24.581 -8.928 1.00 0.00 C ATOM 2683 CE2 PHE A 166 11.008 -26.560 -9.085 1.00 0.00 C ATOM 2684 CZ PHE A 166 12.091 -25.881 -8.513 1.00 0.00 C ATOM 0 H PHE A 166 8.766 -23.034 -13.661 1.00 0.00 H new ATOM 0 HA PHE A 166 11.321 -23.393 -12.862 1.00 0.00 H new ATOM 0 HB2 PHE A 166 9.522 -22.928 -11.285 1.00 0.00 H new ATOM 0 HB3 PHE A 166 8.739 -24.457 -11.632 1.00 0.00 H new ATOM 0 HD1 PHE A 166 11.865 -22.956 -10.237 1.00 0.00 H new ATOM 0 HD2 PHE A 166 9.401 -26.463 -10.514 1.00 0.00 H new ATOM 0 HE1 PHE A 166 13.235 -24.057 -8.487 1.00 0.00 H new ATOM 0 HE2 PHE A 166 10.769 -27.563 -8.764 1.00 0.00 H new ATOM 0 HZ PHE A 166 12.688 -26.361 -7.751 1.00 0.00 H new ATOM 2694 N LYS A 167 12.200 -25.712 -13.016 1.00 0.00 N ATOM 2695 CA LYS A 167 12.751 -27.043 -13.243 1.00 0.00 C ATOM 2696 C LYS A 167 14.017 -27.249 -12.417 1.00 0.00 C ATOM 2697 O LYS A 167 15.018 -26.561 -12.616 1.00 0.00 O ATOM 2698 CB LYS A 167 13.075 -27.224 -14.727 1.00 0.00 C ATOM 2699 CG LYS A 167 13.327 -28.706 -15.021 1.00 0.00 C ATOM 2700 CD LYS A 167 14.056 -28.852 -16.363 1.00 0.00 C ATOM 2701 CE LYS A 167 15.569 -28.769 -16.144 1.00 0.00 C ATOM 2702 NZ LYS A 167 16.249 -28.531 -17.447 1.00 0.00 N ATOM 0 H LYS A 167 12.887 -25.007 -12.749 1.00 0.00 H new ATOM 0 HA LYS A 167 12.009 -27.780 -12.938 1.00 0.00 H new ATOM 0 HB2 LYS A 167 12.250 -26.857 -15.337 1.00 0.00 H new ATOM 0 HB3 LYS A 167 13.954 -26.636 -14.992 1.00 0.00 H new ATOM 0 HG2 LYS A 167 13.923 -29.148 -14.223 1.00 0.00 H new ATOM 0 HG3 LYS A 167 12.381 -29.247 -15.050 1.00 0.00 H new ATOM 0 HD2 LYS A 167 13.798 -29.805 -16.825 1.00 0.00 H new ATOM 0 HD3 LYS A 167 13.735 -28.068 -17.049 1.00 0.00 H new ATOM 0 HE2 LYS A 167 15.802 -27.963 -15.448 1.00 0.00 H new ATOM 0 HE3 LYS A 167 15.933 -29.693 -15.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 167 17.278 -28.492 -17.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 167 16.023 -29.305 -18.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 167 15.922 -27.629 -17.849 1.00 0.00 H new ATOM 2716 N ALA A 168 13.964 -28.201 -11.491 1.00 0.00 N ATOM 2717 CA ALA A 168 15.114 -28.490 -10.642 1.00 0.00 C ATOM 2718 C ALA A 168 14.969 -29.862 -9.991 1.00 0.00 C ATOM 2719 O ALA A 168 15.870 -30.696 -10.071 1.00 0.00 O ATOM 2720 CB ALA A 168 15.246 -27.420 -9.557 1.00 0.00 C ATOM 0 H ALA A 168 13.145 -28.781 -11.310 1.00 0.00 H new ATOM 0 HA ALA A 168 16.009 -28.488 -11.264 1.00 0.00 H new ATOM 0 HB1 ALA A 168 16.107 -27.644 -8.928 1.00 0.00 H new ATOM 0 HB2 ALA A 168 15.381 -26.444 -10.023 1.00 0.00 H new ATOM 0 HB3 ALA A 168 14.344 -27.408 -8.946 1.00 0.00 H new ATOM 2726 N LYS A 169 13.828 -30.090 -9.348 1.00 0.00 N ATOM 2727 CA LYS A 169 13.576 -31.365 -8.687 1.00 0.00 C ATOM 2728 C LYS A 169 13.370 -32.469 -9.721 1.00 0.00 C ATOM 2729 O LYS A 169 13.209 -32.196 -10.911 1.00 0.00 O ATOM 2730 CB LYS A 169 12.335 -31.255 -7.793 1.00 0.00 C ATOM 2731 CG LYS A 169 12.708 -30.589 -6.461 1.00 0.00 C ATOM 2732 CD LYS A 169 13.202 -31.649 -5.471 1.00 0.00 C ATOM 2733 CE LYS A 169 13.507 -30.988 -4.125 1.00 0.00 C ATOM 2734 NZ LYS A 169 12.229 -30.615 -3.455 1.00 0.00 N ATOM 0 H LYS A 169 13.068 -29.414 -9.271 1.00 0.00 H new ATOM 0 HA LYS A 169 14.441 -31.615 -8.073 1.00 0.00 H new ATOM 0 HB2 LYS A 169 11.563 -30.673 -8.297 1.00 0.00 H new ATOM 0 HB3 LYS A 169 11.919 -32.246 -7.610 1.00 0.00 H new ATOM 0 HG2 LYS A 169 13.483 -29.840 -6.623 1.00 0.00 H new ATOM 0 HG3 LYS A 169 11.843 -30.069 -6.049 1.00 0.00 H new ATOM 0 HD2 LYS A 169 12.446 -32.424 -5.345 1.00 0.00 H new ATOM 0 HD3 LYS A 169 14.096 -32.136 -5.860 1.00 0.00 H new ATOM 0 HE2 LYS A 169 14.076 -31.670 -3.493 1.00 0.00 H new ATOM 0 HE3 LYS A 169 14.124 -30.102 -4.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 169 12.408 -30.421 -2.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 169 11.836 -29.765 -3.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 169 11.550 -31.398 -3.541 1.00 0.00 H new ATOM 2748 N LYS A 170 13.378 -33.716 -9.259 1.00 0.00 N ATOM 2749 CA LYS A 170 13.192 -34.857 -10.152 1.00 0.00 C ATOM 2750 C LYS A 170 12.384 -35.952 -9.463 1.00 0.00 C ATOM 2751 O LYS A 170 12.702 -36.361 -8.346 1.00 0.00 O ATOM 2752 CB LYS A 170 14.552 -35.418 -10.573 1.00 0.00 C ATOM 2753 CG LYS A 170 15.463 -34.275 -11.023 1.00 0.00 C ATOM 2754 CD LYS A 170 16.738 -34.855 -11.640 1.00 0.00 C ATOM 2755 CE LYS A 170 17.779 -33.746 -11.806 1.00 0.00 C ATOM 2756 NZ LYS A 170 17.258 -32.711 -12.743 1.00 0.00 N ATOM 0 H LYS A 170 13.510 -33.962 -8.278 1.00 0.00 H new ATOM 0 HA LYS A 170 12.648 -34.518 -11.033 1.00 0.00 H new ATOM 0 HB2 LYS A 170 15.009 -35.954 -9.741 1.00 0.00 H new ATOM 0 HB3 LYS A 170 14.425 -36.136 -11.383 1.00 0.00 H new ATOM 0 HG2 LYS A 170 14.947 -33.648 -11.750 1.00 0.00 H new ATOM 0 HG3 LYS A 170 15.713 -33.639 -10.174 1.00 0.00 H new ATOM 0 HD2 LYS A 170 17.134 -35.647 -11.004 1.00 0.00 H new ATOM 0 HD3 LYS A 170 16.514 -35.305 -12.607 1.00 0.00 H new ATOM 0 HE2 LYS A 170 18.004 -33.296 -10.839 1.00 0.00 H new ATOM 0 HE3 LYS A 170 18.711 -34.162 -12.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 170 18.022 -32.049 -12.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 170 16.907 -33.170 -13.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 170 16.481 -32.190 -12.288 1.00 0.00 H new ATOM 2770 N ARG A 171 11.340 -36.426 -10.138 1.00 0.00 N ATOM 2771 CA ARG A 171 10.496 -37.477 -9.581 1.00 0.00 C ATOM 2772 C ARG A 171 11.144 -38.843 -9.786 1.00 0.00 C ATOM 2773 O ARG A 171 10.954 -39.759 -8.986 1.00 0.00 O ATOM 2774 CB ARG A 171 9.122 -37.454 -10.252 1.00 0.00 C ATOM 2775 CG ARG A 171 8.373 -36.184 -9.841 1.00 0.00 C ATOM 2776 CD ARG A 171 6.961 -36.209 -10.428 1.00 0.00 C ATOM 2777 NE ARG A 171 7.019 -36.198 -11.886 1.00 0.00 N ATOM 2778 CZ ARG A 171 7.176 -35.062 -12.559 1.00 0.00 C ATOM 2779 NH1 ARG A 171 7.284 -33.931 -11.917 1.00 0.00 N ATOM 2780 NH2 ARG A 171 7.224 -35.079 -13.863 1.00 0.00 N ATOM 0 H ARG A 171 11.060 -36.102 -11.064 1.00 0.00 H new ATOM 0 HA ARG A 171 10.379 -37.298 -8.512 1.00 0.00 H new ATOM 0 HB2 ARG A 171 9.234 -37.488 -11.336 1.00 0.00 H new ATOM 0 HB3 ARG A 171 8.550 -38.336 -9.963 1.00 0.00 H new ATOM 0 HG2 ARG A 171 8.325 -36.114 -8.754 1.00 0.00 H new ATOM 0 HG3 ARG A 171 8.909 -35.303 -10.194 1.00 0.00 H new ATOM 0 HD2 ARG A 171 6.433 -37.099 -10.085 1.00 0.00 H new ATOM 0 HD3 ARG A 171 6.397 -35.347 -10.073 1.00 0.00 H new ATOM 0 HE ARG A 171 6.938 -37.077 -12.398 1.00 0.00 H new ATOM 0 HH11 ARG A 171 7.248 -33.918 -10.898 1.00 0.00 H new ATOM 0 HH12 ARG A 171 7.404 -33.060 -12.434 1.00 0.00 H new ATOM 0 HH21 ARG A 171 7.141 -35.963 -14.365 1.00 0.00 H new ATOM 0 HH22 ARG A 171 7.344 -34.208 -14.380 1.00 0.00 H new ATOM 2794 N ASP A 172 11.913 -38.968 -10.863 1.00 0.00 N ATOM 2795 CA ASP A 172 12.591 -40.223 -11.169 1.00 0.00 C ATOM 2796 C ASP A 172 13.814 -39.962 -12.043 1.00 0.00 C ATOM 2797 O ASP A 172 14.669 -39.145 -11.701 1.00 0.00 O ATOM 2798 CB ASP A 172 11.633 -41.175 -11.888 1.00 0.00 C ATOM 2799 CG ASP A 172 10.334 -41.302 -11.099 1.00 0.00 C ATOM 2800 OD1 ASP A 172 10.357 -41.937 -10.057 1.00 0.00 O ATOM 2801 OD2 ASP A 172 9.335 -40.765 -11.548 1.00 0.00 O ATOM 0 H ASP A 172 12.082 -38.220 -11.535 1.00 0.00 H new ATOM 0 HA ASP A 172 12.915 -40.682 -10.235 1.00 0.00 H new ATOM 0 HB2 ASP A 172 11.424 -40.804 -12.891 1.00 0.00 H new ATOM 0 HB3 ASP A 172 12.097 -42.155 -12.000 1.00 0.00 H new ATOM 2806 N LEU A 173 13.890 -40.655 -13.175 1.00 0.00 N ATOM 2807 CA LEU A 173 15.013 -40.482 -14.088 1.00 0.00 C ATOM 2808 C LEU A 173 14.908 -39.135 -14.800 1.00 0.00 C ATOM 2809 O LEU A 173 15.775 -38.274 -14.650 1.00 0.00 O ATOM 2810 CB LEU A 173 15.037 -41.619 -15.123 1.00 0.00 C ATOM 2811 CG LEU A 173 13.618 -42.171 -15.328 1.00 0.00 C ATOM 2812 CD1 LEU A 173 13.486 -42.740 -16.743 1.00 0.00 C ATOM 2813 CD2 LEU A 173 13.342 -43.283 -14.307 1.00 0.00 C ATOM 0 H LEU A 173 13.194 -41.335 -13.480 1.00 0.00 H new ATOM 0 HA LEU A 173 15.938 -40.509 -13.512 1.00 0.00 H new ATOM 0 HB2 LEU A 173 15.434 -41.252 -16.070 1.00 0.00 H new ATOM 0 HB3 LEU A 173 15.701 -42.415 -14.786 1.00 0.00 H new ATOM 0 HG LEU A 173 12.898 -41.364 -15.190 1.00 0.00 H new ATOM 0 HD11 LEU A 173 12.478 -43.131 -16.885 1.00 0.00 H new ATOM 0 HD12 LEU A 173 13.676 -41.952 -17.471 1.00 0.00 H new ATOM 0 HD13 LEU A 173 14.210 -43.543 -16.881 1.00 0.00 H new ATOM 0 HD21 LEU A 173 12.335 -43.672 -14.456 1.00 0.00 H new ATOM 0 HD22 LEU A 173 14.065 -44.088 -14.441 1.00 0.00 H new ATOM 0 HD23 LEU A 173 13.430 -42.880 -13.298 1.00 0.00 H new ATOM 2825 N PHE A 174 13.840 -38.960 -15.572 1.00 0.00 N ATOM 2826 CA PHE A 174 13.629 -37.714 -16.301 1.00 0.00 C ATOM 2827 C PHE A 174 14.938 -37.227 -16.919 1.00 0.00 C ATOM 2828 O PHE A 174 15.692 -36.480 -16.295 1.00 0.00 O ATOM 2829 CB PHE A 174 13.067 -36.646 -15.352 1.00 0.00 C ATOM 2830 CG PHE A 174 12.189 -35.686 -16.123 1.00 0.00 C ATOM 2831 CD1 PHE A 174 12.747 -34.863 -17.108 1.00 0.00 C ATOM 2832 CD2 PHE A 174 10.815 -35.620 -15.853 1.00 0.00 C ATOM 2833 CE1 PHE A 174 11.934 -33.974 -17.822 1.00 0.00 C ATOM 2834 CE2 PHE A 174 10.003 -34.731 -16.566 1.00 0.00 C ATOM 2835 CZ PHE A 174 10.562 -33.909 -17.552 1.00 0.00 C ATOM 0 H PHE A 174 13.111 -39.660 -15.709 1.00 0.00 H new ATOM 0 HA PHE A 174 12.914 -37.895 -17.103 1.00 0.00 H new ATOM 0 HB2 PHE A 174 12.492 -37.120 -14.556 1.00 0.00 H new ATOM 0 HB3 PHE A 174 13.884 -36.104 -14.876 1.00 0.00 H new ATOM 0 HD1 PHE A 174 13.805 -34.914 -17.318 1.00 0.00 H new ATOM 0 HD2 PHE A 174 10.383 -36.256 -15.094 1.00 0.00 H new ATOM 0 HE1 PHE A 174 12.366 -33.338 -18.581 1.00 0.00 H new ATOM 0 HE2 PHE A 174 8.945 -34.679 -16.356 1.00 0.00 H new ATOM 0 HZ PHE A 174 9.935 -33.225 -18.104 1.00 0.00 H new ATOM 2845 N GLY A 175 15.203 -37.661 -18.147 1.00 0.00 N ATOM 2846 CA GLY A 175 16.425 -37.267 -18.840 1.00 0.00 C ATOM 2847 C GLY A 175 16.284 -35.878 -19.453 1.00 0.00 C ATOM 2848 O GLY A 175 16.389 -34.867 -18.757 1.00 0.00 O ATOM 0 H GLY A 175 14.593 -38.281 -18.680 1.00 0.00 H new ATOM 0 HA2 GLY A 175 17.262 -37.277 -18.142 1.00 0.00 H new ATOM 0 HA3 GLY A 175 16.653 -37.992 -19.622 1.00 0.00 H new ATOM 2852 N ARG A 176 16.048 -35.835 -20.761 1.00 0.00 N ATOM 2853 CA ARG A 176 15.895 -34.562 -21.461 1.00 0.00 C ATOM 2854 C ARG A 176 14.954 -34.721 -22.653 1.00 0.00 C ATOM 2855 O ARG A 176 14.037 -35.541 -22.627 1.00 0.00 O ATOM 2856 CB ARG A 176 17.265 -34.067 -21.944 1.00 0.00 C ATOM 2857 CG ARG A 176 17.278 -32.533 -21.996 1.00 0.00 C ATOM 2858 CD ARG A 176 17.682 -31.973 -20.630 1.00 0.00 C ATOM 2859 NE ARG A 176 17.600 -30.517 -20.636 1.00 0.00 N ATOM 2860 CZ ARG A 176 17.780 -29.814 -19.523 1.00 0.00 C ATOM 2861 NH1 ARG A 176 18.031 -30.426 -18.398 1.00 0.00 N ATOM 2862 NH2 ARG A 176 17.704 -28.512 -19.554 1.00 0.00 N ATOM 0 H ARG A 176 15.959 -36.660 -21.355 1.00 0.00 H new ATOM 0 HA ARG A 176 15.469 -33.832 -20.772 1.00 0.00 H new ATOM 0 HB2 ARG A 176 18.047 -34.423 -21.274 1.00 0.00 H new ATOM 0 HB3 ARG A 176 17.481 -34.475 -22.931 1.00 0.00 H new ATOM 0 HG2 ARG A 176 17.976 -32.192 -22.760 1.00 0.00 H new ATOM 0 HG3 ARG A 176 16.292 -32.161 -22.275 1.00 0.00 H new ATOM 0 HD2 ARG A 176 17.030 -32.378 -19.856 1.00 0.00 H new ATOM 0 HD3 ARG A 176 18.697 -32.286 -20.387 1.00 0.00 H new ATOM 0 HE ARG A 176 17.401 -30.030 -21.510 1.00 0.00 H new ATOM 0 HH11 ARG A 176 18.089 -31.444 -18.373 1.00 0.00 H new ATOM 0 HH12 ARG A 176 18.169 -29.886 -17.544 1.00 0.00 H new ATOM 0 HH21 ARG A 176 17.506 -28.033 -20.433 1.00 0.00 H new ATOM 0 HH22 ARG A 176 17.842 -27.973 -18.699 1.00 0.00 H new ATOM 2876 N GLY A 177 15.188 -33.929 -23.695 1.00 0.00 N ATOM 2877 CA GLY A 177 14.354 -33.992 -24.889 1.00 0.00 C ATOM 2878 C GLY A 177 14.771 -32.932 -25.902 1.00 0.00 C ATOM 2879 O GLY A 177 14.537 -31.741 -25.700 1.00 0.00 O ATOM 0 H GLY A 177 15.941 -33.242 -23.737 1.00 0.00 H new ATOM 0 HA2 GLY A 177 14.432 -34.981 -25.340 1.00 0.00 H new ATOM 0 HA3 GLY A 177 13.309 -33.848 -24.615 1.00 0.00 H new ATOM 2883 N HIS A 178 15.389 -33.376 -26.994 1.00 0.00 N ATOM 2884 CA HIS A 178 15.838 -32.460 -28.041 1.00 0.00 C ATOM 2885 C HIS A 178 15.307 -32.904 -29.399 1.00 0.00 C ATOM 2886 O HIS A 178 15.035 -32.077 -30.270 1.00 0.00 O ATOM 2887 CB HIS A 178 17.367 -32.420 -28.079 1.00 0.00 C ATOM 2888 CG HIS A 178 17.883 -31.669 -26.883 1.00 0.00 C ATOM 2889 ND1 HIS A 178 18.938 -32.136 -26.115 1.00 0.00 N ATOM 2890 CD2 HIS A 178 17.500 -30.481 -26.310 1.00 0.00 C ATOM 2891 CE1 HIS A 178 19.152 -31.243 -25.132 1.00 0.00 C ATOM 2892 NE2 HIS A 178 18.302 -30.215 -25.205 1.00 0.00 N ATOM 0 H HIS A 178 15.590 -34.359 -27.177 1.00 0.00 H new ATOM 0 HA HIS A 178 15.454 -31.464 -27.818 1.00 0.00 H new ATOM 0 HB2 HIS A 178 17.767 -33.434 -28.084 1.00 0.00 H new ATOM 0 HB3 HIS A 178 17.705 -31.939 -28.997 1.00 0.00 H new ATOM 0 HD2 HIS A 178 16.698 -29.850 -26.663 1.00 0.00 H new ATOM 0 HE1 HIS A 178 19.917 -31.345 -24.377 1.00 0.00 H new ATOM 0 HE2 HIS A 178 18.252 -29.408 -24.583 1.00 0.00 H new ATOM 2901 N HIS A 179 15.160 -34.214 -29.573 1.00 0.00 N ATOM 2902 CA HIS A 179 14.658 -34.756 -30.831 1.00 0.00 C ATOM 2903 C HIS A 179 13.134 -34.747 -30.849 1.00 0.00 C ATOM 2904 O HIS A 179 12.490 -35.422 -30.047 1.00 0.00 O ATOM 2905 CB HIS A 179 15.164 -36.188 -31.022 1.00 0.00 C ATOM 2906 CG HIS A 179 14.957 -36.609 -32.450 1.00 0.00 C ATOM 2907 ND1 HIS A 179 13.825 -37.292 -32.863 1.00 0.00 N ATOM 2908 CD2 HIS A 179 15.730 -36.451 -33.574 1.00 0.00 C ATOM 2909 CE1 HIS A 179 13.947 -37.519 -34.185 1.00 0.00 C ATOM 2910 NE2 HIS A 179 15.090 -37.026 -34.667 1.00 0.00 N ATOM 0 H HIS A 179 15.379 -34.915 -28.865 1.00 0.00 H new ATOM 0 HA HIS A 179 15.023 -34.130 -31.645 1.00 0.00 H new ATOM 0 HB2 HIS A 179 16.221 -36.248 -30.764 1.00 0.00 H new ATOM 0 HB3 HIS A 179 14.633 -36.865 -30.352 1.00 0.00 H new ATOM 0 HD2 HIS A 179 16.689 -35.956 -33.605 1.00 0.00 H new ATOM 0 HE1 HIS A 179 13.210 -38.036 -34.782 1.00 0.00 H new ATOM 0 HE2 HIS A 179 15.423 -37.063 -35.630 1.00 0.00 H new ATOM 2919 N HIS A 180 12.563 -33.977 -31.771 1.00 0.00 N ATOM 2920 CA HIS A 180 11.112 -33.886 -31.887 1.00 0.00 C ATOM 2921 C HIS A 180 10.717 -33.474 -33.301 1.00 0.00 C ATOM 2922 O HIS A 180 9.628 -32.944 -33.523 1.00 0.00 O ATOM 2923 CB HIS A 180 10.571 -32.865 -30.885 1.00 0.00 C ATOM 2924 CG HIS A 180 9.074 -32.989 -30.798 1.00 0.00 C ATOM 2925 ND1 HIS A 180 8.353 -33.826 -31.636 1.00 0.00 N ATOM 2926 CD2 HIS A 180 8.149 -32.391 -29.979 1.00 0.00 C ATOM 2927 CE1 HIS A 180 7.054 -33.709 -31.306 1.00 0.00 C ATOM 2928 NE2 HIS A 180 6.874 -32.848 -30.301 1.00 0.00 N ATOM 0 H HIS A 180 13.079 -33.411 -32.444 1.00 0.00 H new ATOM 0 HA HIS A 180 10.685 -34.865 -31.672 1.00 0.00 H new ATOM 0 HB2 HIS A 180 11.017 -33.031 -29.905 1.00 0.00 H new ATOM 0 HB3 HIS A 180 10.845 -31.856 -31.194 1.00 0.00 H new ATOM 0 HD2 HIS A 180 8.376 -31.675 -29.203 1.00 0.00 H new ATOM 0 HE1 HIS A 180 6.254 -34.246 -31.794 1.00 0.00 H new ATOM 0 HE2 HIS A 180 5.992 -32.582 -29.863 1.00 0.00 H new ATOM 2937 N HIS A 181 11.609 -33.722 -34.255 1.00 0.00 N ATOM 2938 CA HIS A 181 11.344 -33.374 -35.646 1.00 0.00 C ATOM 2939 C HIS A 181 10.383 -34.378 -36.274 1.00 0.00 C ATOM 2940 O HIS A 181 9.886 -35.281 -35.601 1.00 0.00 O ATOM 2941 CB HIS A 181 12.653 -33.352 -36.437 1.00 0.00 C ATOM 2942 CG HIS A 181 12.443 -32.634 -37.743 1.00 0.00 C ATOM 2943 ND1 HIS A 181 11.378 -31.770 -37.951 1.00 0.00 N ATOM 2944 CD2 HIS A 181 13.152 -32.645 -38.919 1.00 0.00 C ATOM 2945 CE1 HIS A 181 11.477 -31.299 -39.207 1.00 0.00 C ATOM 2946 NE2 HIS A 181 12.540 -31.801 -39.842 1.00 0.00 N ATOM 0 H HIS A 181 12.516 -34.160 -34.092 1.00 0.00 H new ATOM 0 HA HIS A 181 10.887 -32.385 -35.674 1.00 0.00 H new ATOM 0 HB2 HIS A 181 13.431 -32.854 -35.858 1.00 0.00 H new ATOM 0 HB3 HIS A 181 12.995 -34.370 -36.621 1.00 0.00 H new ATOM 0 HD2 HIS A 181 14.048 -33.221 -39.100 1.00 0.00 H new ATOM 0 HE1 HIS A 181 10.782 -30.600 -39.648 1.00 0.00 H new ATOM 0 HE2 HIS A 181 12.839 -31.607 -40.798 1.00 0.00 H new ATOM 2955 N HIS A 182 10.125 -34.216 -37.567 1.00 0.00 N ATOM 2956 CA HIS A 182 9.220 -35.115 -38.275 1.00 0.00 C ATOM 2957 C HIS A 182 9.411 -34.992 -39.782 1.00 0.00 C ATOM 2958 O HIS A 182 8.481 -35.220 -40.556 1.00 0.00 O ATOM 2959 CB HIS A 182 7.771 -34.785 -37.915 1.00 0.00 C ATOM 2960 CG HIS A 182 7.470 -33.366 -38.312 1.00 0.00 C ATOM 2961 ND1 HIS A 182 8.458 -32.495 -38.742 1.00 0.00 N ATOM 2962 CD2 HIS A 182 6.298 -32.653 -38.353 1.00 0.00 C ATOM 2963 CE1 HIS A 182 7.869 -31.317 -39.019 1.00 0.00 C ATOM 2964 NE2 HIS A 182 6.552 -31.360 -38.799 1.00 0.00 N ATOM 0 H HIS A 182 10.526 -33.476 -38.143 1.00 0.00 H new ATOM 0 HA HIS A 182 9.446 -36.138 -37.974 1.00 0.00 H new ATOM 0 HB2 HIS A 182 7.093 -35.469 -38.425 1.00 0.00 H new ATOM 0 HB3 HIS A 182 7.611 -34.917 -36.845 1.00 0.00 H new ATOM 0 HD2 HIS A 182 5.326 -33.037 -38.080 1.00 0.00 H new ATOM 0 HE1 HIS A 182 8.396 -30.444 -39.375 1.00 0.00 H new ATOM 0 HE2 HIS A 182 5.877 -30.606 -38.930 1.00 0.00 H new ATOM 2973 N HIS A 183 10.621 -34.628 -40.194 1.00 0.00 N ATOM 2974 CA HIS A 183 10.919 -34.477 -41.613 1.00 0.00 C ATOM 2975 C HIS A 183 12.419 -34.310 -41.832 1.00 0.00 C ATOM 2976 O HIS A 183 12.806 -34.006 -42.948 1.00 0.00 O ATOM 2977 CB HIS A 183 10.179 -33.260 -42.173 1.00 0.00 C ATOM 2978 CG HIS A 183 10.435 -33.146 -43.651 1.00 0.00 C ATOM 2979 ND1 HIS A 183 10.762 -34.082 -44.602 1.00 0.00 N flip ATOM 2980 CD2 HIS A 183 10.362 -31.935 -44.321 1.00 0.00 C flip ATOM 2981 CE1 HIS A 183 10.891 -33.463 -45.842 1.00 0.00 C flip ATOM 2982 NE2 HIS A 183 10.640 -32.171 -45.617 1.00 0.00 N flip ATOM 2983 OXT HIS A 183 13.160 -34.490 -40.880 1.00 0.00 O ATOM 0 H HIS A 183 11.405 -34.434 -39.571 1.00 0.00 H new ATOM 0 HA HIS A 183 10.587 -35.376 -42.133 1.00 0.00 H new ATOM 0 HB2 HIS A 183 9.109 -33.355 -41.986 1.00 0.00 H new ATOM 0 HB3 HIS A 183 10.512 -32.355 -41.666 1.00 0.00 H new ATOM 0 HD2 HIS A 183 10.125 -30.977 -43.883 1.00 0.00 H new ATOM 0 HE1 HIS A 183 11.141 -33.928 -46.784 1.00 0.00 H new ATOM 0 HE2 HIS A 183 10.657 -31.451 -46.339 1.00 0.00 H new TER 2992 HIS A 183 HETATM 2993 C1 UQ2 A 201 -8.754 4.846 5.600 1.00 20.00 C HETATM 2994 C2 UQ2 A 201 -8.692 5.945 6.584 1.00 20.00 C HETATM 2995 C3 UQ2 A 201 -7.634 6.775 6.603 1.00 20.00 C HETATM 2996 C4 UQ2 A 201 -6.533 6.587 5.638 1.00 20.00 C HETATM 2997 C5 UQ2 A 201 -6.588 5.490 4.650 1.00 20.00 C HETATM 2998 C6 UQ2 A 201 -7.655 4.653 4.632 1.00 20.00 C HETATM 2999 CM2 UQ2 A 201 -9.443 5.251 8.592 1.00 20.00 C HETATM 3000 CM3 UQ2 A 201 -8.522 8.790 7.104 1.00 20.00 C HETATM 3001 CM5 UQ2 A 201 -5.448 5.314 3.676 1.00 20.00 C HETATM 3002 C7 UQ2 A 201 -7.741 3.517 3.636 1.00 20.00 C HETATM 3003 C8 UQ2 A 201 -7.456 2.214 4.345 1.00 20.00 C HETATM 3004 C9 UQ2 A 201 -6.764 1.262 3.756 1.00 20.00 C HETATM 3005 C10 UQ2 A 201 -6.239 1.453 2.353 1.00 20.00 C HETATM 3006 C11 UQ2 A 201 -6.496 -0.032 4.494 1.00 20.00 C HETATM 3007 C12 UQ2 A 201 -5.677 0.242 5.762 1.00 20.00 C HETATM 3008 C13 UQ2 A 201 -4.219 -0.023 5.489 1.00 20.00 C HETATM 3009 C14 UQ2 A 201 -3.359 -0.050 6.480 1.00 20.00 C HETATM 3010 C15 UQ2 A 201 -1.900 -0.315 6.204 1.00 20.00 C HETATM 3011 C16 UQ2 A 201 -3.829 0.184 7.895 1.00 20.00 C HETATM 3012 O1 UQ2 A 201 -9.712 4.098 5.586 1.00 20.00 O HETATM 3013 O2 UQ2 A 201 -9.706 6.116 7.476 1.00 20.00 O HETATM 3014 O3 UQ2 A 201 -7.576 7.787 7.512 1.00 20.00 O HETATM 3015 O4 UQ2 A 201 -5.578 7.338 5.656 1.00 20.00 O HETATM 0 H5M3 UQ2 A 201 -5.343 6.215 3.072 1.00 20.00 H new HETATM 0 H5M2 UQ2 A 201 -4.524 5.136 4.226 1.00 20.00 H new HETATM 0 H5M1 UQ2 A 201 -5.653 4.464 3.026 1.00 20.00 H new HETATM 0 H3M3 UQ2 A 201 -8.260 9.155 6.111 1.00 20.00 H new HETATM 0 H3M2 UQ2 A 201 -9.522 8.358 7.079 1.00 20.00 H new HETATM 0 H3M1 UQ2 A 201 -8.502 9.618 7.812 1.00 20.00 H new HETATM 0 H2M3 UQ2 A 201 -9.405 4.217 8.250 1.00 20.00 H new HETATM 0 H2M2 UQ2 A 201 -8.488 5.519 9.043 1.00 20.00 H new HETATM 0 H2M1 UQ2 A 201 -10.236 5.360 9.331 1.00 20.00 H new HETATM 0 H163 UQ2 A 201 -4.284 1.172 7.969 1.00 20.00 H new HETATM 0 H162 UQ2 A 201 -4.564 -0.575 8.164 1.00 20.00 H new HETATM 0 H161 UQ2 A 201 -2.979 0.124 8.575 1.00 20.00 H new HETATM 0 H153 UQ2 A 201 -1.790 -1.292 5.733 1.00 20.00 H new HETATM 0 H152 UQ2 A 201 -1.510 0.455 5.538 1.00 20.00 H new HETATM 0 H151 UQ2 A 201 -1.344 -0.299 7.141 1.00 20.00 H new HETATM 0 H122 UQ2 A 201 -5.816 1.275 6.081 1.00 20.00 H new HETATM 0 H121 UQ2 A 201 -6.026 -0.392 6.577 1.00 20.00 H new HETATM 0 H112 UQ2 A 201 -7.439 -0.511 4.758 1.00 20.00 H new HETATM 0 H111 UQ2 A 201 -5.957 -0.724 3.846 1.00 20.00 H new HETATM 0 H103 UQ2 A 201 -7.073 1.625 1.673 1.00 20.00 H new HETATM 0 H102 UQ2 A 201 -5.569 2.312 2.329 1.00 20.00 H new HETATM 0 H101 UQ2 A 201 -5.696 0.560 2.043 1.00 20.00 H new HETATM 0 H8 UQ2 A 201 -7.828 2.060 5.358 1.00 20.00 H new HETATM 0 H72 UQ2 A 201 -8.732 3.489 3.182 1.00 20.00 H new HETATM 0 H71 UQ2 A 201 -7.025 3.670 2.829 1.00 20.00 H new HETATM 0 H13 UQ2 A 201 -3.878 -0.192 4.468 1.00 20.00 H new