USER MOD reduce.3.24.130724 H: found=0, std=0, add=1335, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1339 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 87 LYS NZ :NH3+ -115:sc= -0.666 (180deg=-1.89!) USER MOD Set 2.1: A 26 GLN : amide:sc= -2.46 K(o=-3.3,f=-5.4!) USER MOD Set 2.2: A 27 HIS : no HD1:sc= -0.804 K(o=-3.3,f=-4.1) USER MOD Set 3.1: A 12 SER OG : rot 140:sc= -0.281 USER MOD Set 3.2: A 16 THR OG1 : rot 72:sc= -0.9 USER MOD Set 4.1: A 11 ASN : amide:sc= -0.639 K(o=-0.72,f=-0.22) USER MOD Set 4.2: A 13 ASN : amide:sc= -0.0835 K(o=-0.72,f=-0.22) USER MOD Single : A 3 THR OG1 : rot -19:sc= 0.761 USER MOD Single : A 8 HIS : no HD1:sc= -0.0172 K(o=-0.017,f=-0.69) USER MOD Single : A 10 SER OG : rot -44:sc= 0.367 USER MOD Single : A 17 HIS : no HD1:sc= -0.312 X(o=-0.31,f=0) USER MOD Single : A 18 SER OG : rot -63:sc= 1.87 USER MOD Single : A 28 ASN : amide:sc= -3.36 K(o=-3.4,f=-5.2!) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 ASN : amide:sc= -4.05! K(o=-4.1!,f=-1.5) USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 THR OG1 : rot 4:sc= -0.371 USER MOD Single : A 53 HIS : no HD1:sc= -0.782 X(o=-0.78,f=-0.59) USER MOD Single : A 54 HIS : no HE2:sc= -0.692 K(o=-0.69,f=-1.4) USER MOD Single : A 64 LYS NZ :NH3+ -112:sc= -1.29 (180deg=-2.79) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ 150:sc= 0 (180deg=-0.0349) USER MOD Single : A 68 TYR OH : rot -30:sc= -2.94 USER MOD Single : A 75 LYS NZ :NH3+ -177:sc= -1.09 (180deg=-1.18) USER MOD Single : A 78 MET CE :methyl -160:sc= -1.22 (180deg=-1.86) USER MOD Single : A 81 LYS NZ :NH3+ -174:sc=-0.00829 (180deg=-0.0532) USER MOD Single : A 82 GLN : amide:sc= 0 K(o=0,f=-0.96) USER MOD Single : A 84 GLN : amide:sc= 0.521 K(o=0.52,f=-0.48) USER MOD Single : A 88 HIS : no HD1:sc= -0.129 K(o=-0.13,f=-1.2) USER MOD Single : A 117 HIS : no HD1:sc= -0.454 X(o=-0.45,f=-0.087) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=-0.069) USER MOD Single : A 126 HIS : no HD1:sc= -3.9 K(o=-3.9,f=-4.7!) USER MOD Single : A 127 HIS : no HD1:sc= -0.0605 K(o=-0.06,f=-0.59) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 THR OG1 : rot 99:sc= 1.15 USER MOD Single : A 133 GLN : amide:sc= -0.246 X(o=-0.25,f=-0.017) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 137 ASN : amide:sc= -0.941 K(o=-0.94,f=-0.0099) USER MOD Single : A 145 SER OG : rot 50:sc= -2.96 USER MOD Single : A 149 HIS : no HE2:sc= -3.48 X(o=-3.5,f=-4!) USER MOD Single : A 151 ASN : amide:sc= -3.94 K(o=-3.9,f=-9.1!) USER MOD Single : A 157 THR OG1 : rot 180:sc= 0 USER MOD Single : A 158 SER OG : rot -66:sc= 1.26 USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 163 MET CE :methyl 157:sc= -0.238 (180deg=-1.07) USER MOD Single : A 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.0426) USER MOD Single : A 172 LYS NZ :NH3+ -167:sc= 0.428 (180deg=0.346) USER MOD Single : A 175 LYS NZ :NH3+ -166:sc= -1.83 (180deg=-2.54) USER MOD Single : A 176 TYR OH : rot 62:sc= -4.41! USER MOD Single : A 177 LYS NZ :NH3+ -156:sc= -0.822 (180deg=-1.48) USER MOD Single : A 181 HIS : no HE2:sc= -3.83 K(o=-3.8,f=-5.2!) USER MOD Single : A 182 LYS NZ :NH3+ -157:sc= -0.401 (180deg=-1.16!) USER MOD Single : A 183 SER OG : rot 180:sc= 0 USER MOD Single : A 190 ASN : amide:sc= -5.78 K(o=-5.8,f=-1.9) USER MOD Single : A 192 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 193 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 28 N THR A 3 -2.786 -22.742 24.344 1.00 0.00 N ATOM 29 CA THR A 3 -3.584 -22.235 23.232 1.00 0.00 C ATOM 30 C THR A 3 -4.994 -21.877 23.695 1.00 0.00 C ATOM 31 O THR A 3 -5.282 -21.876 24.892 1.00 0.00 O ATOM 32 CB THR A 3 -3.646 -23.271 22.106 1.00 0.00 C ATOM 33 OG1 THR A 3 -3.269 -24.552 22.579 1.00 0.00 O ATOM 34 CG2 THR A 3 -2.749 -22.933 20.935 1.00 0.00 C ATOM 0 HA THR A 3 -3.106 -21.331 22.854 1.00 0.00 H new ATOM 0 HB THR A 3 -4.682 -23.266 21.766 1.00 0.00 H new ATOM 0 HG1 THR A 3 -2.773 -24.458 23.419 1.00 0.00 H new ATOM 0 HG21 THR A 3 -2.840 -23.706 20.172 1.00 0.00 H new ATOM 0 HG22 THR A 3 -3.046 -21.972 20.515 1.00 0.00 H new ATOM 0 HG23 THR A 3 -1.714 -22.877 21.274 1.00 0.00 H new ATOM 42 N LEU A 4 -5.865 -21.574 22.739 1.00 0.00 N ATOM 43 CA LEU A 4 -7.243 -21.212 23.049 1.00 0.00 C ATOM 44 C LEU A 4 -8.192 -21.697 21.955 1.00 0.00 C ATOM 45 O LEU A 4 -7.770 -22.352 21.003 1.00 0.00 O ATOM 46 CB LEU A 4 -7.374 -19.695 23.227 1.00 0.00 C ATOM 47 CG LEU A 4 -6.597 -18.840 22.219 1.00 0.00 C ATOM 48 CD1 LEU A 4 -5.106 -18.878 22.517 1.00 0.00 C ATOM 49 CD2 LEU A 4 -6.872 -19.304 20.795 1.00 0.00 C ATOM 0 H LEU A 4 -5.642 -21.572 21.744 1.00 0.00 H new ATOM 0 HA LEU A 4 -7.517 -21.700 23.984 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -8.429 -19.430 23.164 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -7.039 -19.435 24.231 1.00 0.00 H new ATOM 0 HG LEU A 4 -6.937 -17.809 22.314 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -4.574 -18.265 21.790 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -4.925 -18.491 23.520 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -4.749 -19.906 22.455 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -6.311 -18.684 20.096 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -6.565 -20.344 20.685 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -7.938 -19.217 20.583 1.00 0.00 H new ATOM 61 N GLY A 5 -9.473 -21.372 22.099 1.00 0.00 N ATOM 62 CA GLY A 5 -10.461 -21.784 21.116 1.00 0.00 C ATOM 63 C GLY A 5 -10.056 -21.431 19.698 1.00 0.00 C ATOM 64 O GLY A 5 -9.407 -22.225 19.015 1.00 0.00 O ATOM 0 H GLY A 5 -9.846 -20.830 22.879 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -10.613 -22.861 21.189 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -11.416 -21.311 21.346 1.00 0.00 H new ATOM 68 N GLY A 6 -10.438 -20.239 19.253 1.00 0.00 N ATOM 69 CA GLY A 6 -10.099 -19.806 17.910 1.00 0.00 C ATOM 70 C GLY A 6 -11.188 -18.961 17.279 1.00 0.00 C ATOM 71 O GLY A 6 -12.272 -19.458 16.973 1.00 0.00 O ATOM 0 H GLY A 6 -10.976 -19.565 19.798 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -9.171 -19.234 17.940 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -9.915 -20.680 17.286 1.00 0.00 H new ATOM 75 N VAL A 7 -10.899 -17.678 17.084 1.00 0.00 N ATOM 76 CA VAL A 7 -11.860 -16.760 16.484 1.00 0.00 C ATOM 77 C VAL A 7 -13.089 -16.593 17.372 1.00 0.00 C ATOM 78 O VAL A 7 -14.122 -17.224 17.146 1.00 0.00 O ATOM 79 CB VAL A 7 -12.307 -17.246 15.092 1.00 0.00 C ATOM 80 CG1 VAL A 7 -13.168 -16.196 14.409 1.00 0.00 C ATOM 81 CG2 VAL A 7 -11.099 -17.595 14.236 1.00 0.00 C ATOM 0 H VAL A 7 -10.007 -17.251 17.333 1.00 0.00 H new ATOM 0 HA VAL A 7 -11.357 -15.798 16.380 1.00 0.00 H new ATOM 0 HB VAL A 7 -12.908 -18.147 15.218 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -13.473 -16.558 13.427 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -14.053 -16.000 15.015 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -12.596 -15.275 14.294 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -11.434 -17.936 13.256 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -10.470 -16.713 14.117 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -10.527 -18.386 14.720 1.00 0.00 H new ATOM 91 N HIS A 8 -12.971 -15.738 18.384 1.00 0.00 N ATOM 92 CA HIS A 8 -14.073 -15.487 19.305 1.00 0.00 C ATOM 93 C HIS A 8 -13.698 -14.420 20.329 1.00 0.00 C ATOM 94 O HIS A 8 -12.561 -14.371 20.800 1.00 0.00 O ATOM 95 CB HIS A 8 -14.470 -16.779 20.022 1.00 0.00 C ATOM 96 CG HIS A 8 -15.644 -16.619 20.938 1.00 0.00 C ATOM 97 ND1 HIS A 8 -16.729 -15.822 20.639 1.00 0.00 N ATOM 98 CD2 HIS A 8 -15.901 -17.161 22.151 1.00 0.00 C ATOM 99 CE1 HIS A 8 -17.601 -15.879 21.630 1.00 0.00 C ATOM 100 NE2 HIS A 8 -17.123 -16.685 22.559 1.00 0.00 N ATOM 0 H HIS A 8 -12.123 -15.208 18.586 1.00 0.00 H new ATOM 0 HA HIS A 8 -14.921 -15.124 18.724 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -14.701 -17.541 19.278 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -13.618 -17.142 20.597 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -15.264 -17.841 22.697 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -18.544 -15.355 21.672 1.00 0.00 H new ATOM 0 HE2 HIS A 8 -17.586 -16.917 23.438 1.00 0.00 H new ATOM 109 N ASP A 9 -14.660 -13.569 20.670 1.00 0.00 N ATOM 110 CA ASP A 9 -14.432 -12.503 21.638 1.00 0.00 C ATOM 111 C ASP A 9 -14.876 -12.931 23.033 1.00 0.00 C ATOM 112 O ASP A 9 -15.522 -13.966 23.198 1.00 0.00 O ATOM 113 CB ASP A 9 -15.179 -11.236 21.218 1.00 0.00 C ATOM 114 CG ASP A 9 -16.637 -11.504 20.898 1.00 0.00 C ATOM 115 OD1 ASP A 9 -16.909 -12.126 19.849 1.00 0.00 O1- ATOM 116 OD2 ASP A 9 -17.505 -11.092 21.695 1.00 0.00 O ATOM 0 H ASP A 9 -15.606 -13.597 20.290 1.00 0.00 H new ATOM 0 HA ASP A 9 -13.363 -12.293 21.665 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -15.115 -10.498 22.017 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -14.692 -10.803 20.344 1.00 0.00 H new ATOM 121 N SER A 10 -14.526 -12.129 24.032 1.00 0.00 N ATOM 122 CA SER A 10 -14.889 -12.426 25.413 1.00 0.00 C ATOM 123 C SER A 10 -14.718 -11.194 26.298 1.00 0.00 C ATOM 124 O SER A 10 -14.422 -10.104 25.810 1.00 0.00 O ATOM 125 CB SER A 10 -14.037 -13.576 25.951 1.00 0.00 C ATOM 126 OG SER A 10 -13.929 -14.620 24.999 1.00 0.00 O ATOM 0 H SER A 10 -13.992 -11.269 23.912 1.00 0.00 H new ATOM 0 HA SER A 10 -15.938 -12.721 25.430 1.00 0.00 H new ATOM 0 HB2 SER A 10 -13.043 -13.208 26.206 1.00 0.00 H new ATOM 0 HB3 SER A 10 -14.479 -13.962 26.870 1.00 0.00 H new ATOM 0 HG SER A 10 -14.808 -14.793 24.602 1.00 0.00 H new ATOM 132 N ASN A 11 -14.906 -11.378 27.601 1.00 0.00 N ATOM 133 CA ASN A 11 -14.773 -10.283 28.554 1.00 0.00 C ATOM 134 C ASN A 11 -13.587 -10.515 29.486 1.00 0.00 C ATOM 135 O ASN A 11 -13.665 -10.248 30.685 1.00 0.00 O ATOM 136 CB ASN A 11 -16.058 -10.128 29.370 1.00 0.00 C ATOM 137 CG ASN A 11 -16.362 -11.352 30.204 1.00 0.00 C ATOM 138 OD1 ASN A 11 -16.138 -11.367 31.415 1.00 0.00 O ATOM 139 ND2 ASN A 11 -16.874 -12.387 29.556 1.00 0.00 N ATOM 0 H ASN A 11 -15.151 -12.275 28.020 1.00 0.00 H new ATOM 0 HA ASN A 11 -14.597 -9.365 27.993 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -15.968 -9.260 30.023 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -16.892 -9.935 28.696 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -17.100 -13.244 30.061 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -17.042 -12.328 28.552 1.00 0.00 H new ATOM 146 N SER A 12 -12.491 -11.016 28.926 1.00 0.00 N ATOM 147 CA SER A 12 -11.289 -11.287 29.707 1.00 0.00 C ATOM 148 C SER A 12 -11.562 -12.343 30.774 1.00 0.00 C ATOM 149 O SER A 12 -11.227 -12.161 31.945 1.00 0.00 O ATOM 150 CB SER A 12 -10.779 -10.001 30.360 1.00 0.00 C ATOM 151 OG SER A 12 -10.522 -9.002 29.389 1.00 0.00 O ATOM 0 H SER A 12 -12.410 -11.243 27.935 1.00 0.00 H new ATOM 0 HA SER A 12 -10.524 -11.669 29.032 1.00 0.00 H new ATOM 0 HB2 SER A 12 -11.516 -9.636 31.075 1.00 0.00 H new ATOM 0 HB3 SER A 12 -9.868 -10.211 30.920 1.00 0.00 H new ATOM 0 HG SER A 12 -10.819 -8.132 29.728 1.00 0.00 H new ATOM 157 N ASN A 13 -12.173 -13.448 30.361 1.00 0.00 N ATOM 158 CA ASN A 13 -12.492 -14.535 31.281 1.00 0.00 C ATOM 159 C ASN A 13 -11.229 -15.073 31.948 1.00 0.00 C ATOM 160 O ASN A 13 -11.096 -15.028 33.171 1.00 0.00 O ATOM 161 CB ASN A 13 -13.216 -15.662 30.540 1.00 0.00 C ATOM 162 CG ASN A 13 -14.723 -15.556 30.656 1.00 0.00 C ATOM 163 OD1 ASN A 13 -15.306 -15.908 31.682 1.00 0.00 O ATOM 164 ND2 ASN A 13 -15.365 -15.069 29.600 1.00 0.00 N ATOM 0 H ASN A 13 -12.457 -13.615 29.396 1.00 0.00 H new ATOM 0 HA ASN A 13 -13.148 -14.141 32.057 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -12.933 -15.641 29.488 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -12.890 -16.623 30.939 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -16.380 -14.975 29.619 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -14.843 -14.789 28.770 1.00 0.00 H new ATOM 171 N PRO A 14 -10.282 -15.593 31.150 1.00 0.00 N ATOM 172 CA PRO A 14 -9.025 -16.142 31.666 1.00 0.00 C ATOM 173 C PRO A 14 -8.062 -15.052 32.124 1.00 0.00 C ATOM 174 O PRO A 14 -8.442 -13.887 32.248 1.00 0.00 O ATOM 175 CB PRO A 14 -8.452 -16.891 30.464 1.00 0.00 C ATOM 176 CG PRO A 14 -8.999 -16.173 29.279 1.00 0.00 C ATOM 177 CD PRO A 14 -10.365 -15.684 29.680 1.00 0.00 C ATOM 0 HA PRO A 14 -9.181 -16.769 32.544 1.00 0.00 H new ATOM 0 HB2 PRO A 14 -7.362 -16.875 30.469 1.00 0.00 H new ATOM 0 HB3 PRO A 14 -8.755 -17.938 30.468 1.00 0.00 H new ATOM 0 HG2 PRO A 14 -8.355 -15.340 28.996 1.00 0.00 H new ATOM 0 HG3 PRO A 14 -9.060 -16.836 28.416 1.00 0.00 H new ATOM 0 HD2 PRO A 14 -10.593 -14.718 29.231 1.00 0.00 H new ATOM 0 HD3 PRO A 14 -11.147 -16.375 29.364 1.00 0.00 H new ATOM 185 N ASP A 15 -6.814 -15.437 32.372 1.00 0.00 N ATOM 186 CA ASP A 15 -5.797 -14.490 32.815 1.00 0.00 C ATOM 187 C ASP A 15 -5.273 -13.668 31.640 1.00 0.00 C ATOM 188 O ASP A 15 -4.090 -13.729 31.302 1.00 0.00 O ATOM 189 CB ASP A 15 -4.643 -15.231 33.492 1.00 0.00 C ATOM 190 CG ASP A 15 -3.982 -14.404 34.577 1.00 0.00 C ATOM 191 OD1 ASP A 15 -4.696 -13.634 35.254 1.00 0.00 O ATOM 192 OD2 ASP A 15 -2.751 -14.525 34.751 1.00 0.00 O1- ATOM 0 H ASP A 15 -6.483 -16.397 32.274 1.00 0.00 H new ATOM 0 HA ASP A 15 -6.254 -13.811 33.535 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -5.015 -16.160 33.923 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -3.900 -15.502 32.742 1.00 0.00 H new ATOM 197 N THR A 16 -6.163 -12.900 31.020 1.00 0.00 N ATOM 198 CA THR A 16 -5.793 -12.065 29.883 1.00 0.00 C ATOM 199 C THR A 16 -4.925 -10.892 30.325 1.00 0.00 C ATOM 200 O THR A 16 -4.104 -10.391 29.556 1.00 0.00 O ATOM 201 CB THR A 16 -7.046 -11.548 29.174 1.00 0.00 C ATOM 202 OG1 THR A 16 -7.875 -10.835 30.076 1.00 0.00 O ATOM 203 CG2 THR A 16 -7.880 -12.649 28.554 1.00 0.00 C ATOM 0 H THR A 16 -7.146 -12.839 31.286 1.00 0.00 H new ATOM 0 HA THR A 16 -5.217 -12.677 29.189 1.00 0.00 H new ATOM 0 HB THR A 16 -6.681 -10.899 28.378 1.00 0.00 H new ATOM 0 HG1 THR A 16 -7.458 -9.976 30.294 1.00 0.00 H new ATOM 0 HG21 THR A 16 -8.753 -12.214 28.068 1.00 0.00 H new ATOM 0 HG22 THR A 16 -7.283 -13.186 27.816 1.00 0.00 H new ATOM 0 HG23 THR A 16 -8.205 -13.341 29.331 1.00 0.00 H new ATOM 211 N HIS A 17 -5.111 -10.456 31.568 1.00 0.00 N ATOM 212 CA HIS A 17 -4.344 -9.340 32.110 1.00 0.00 C ATOM 213 C HIS A 17 -2.846 -9.625 32.047 1.00 0.00 C ATOM 214 O HIS A 17 -2.077 -8.835 31.500 1.00 0.00 O ATOM 215 CB HIS A 17 -4.762 -9.061 33.554 1.00 0.00 C ATOM 216 CG HIS A 17 -4.280 -7.742 34.073 1.00 0.00 C ATOM 217 ND1 HIS A 17 -4.123 -7.472 35.416 1.00 0.00 N ATOM 218 CD2 HIS A 17 -3.917 -6.612 33.420 1.00 0.00 C ATOM 219 CE1 HIS A 17 -3.687 -6.235 35.567 1.00 0.00 C ATOM 220 NE2 HIS A 17 -3.554 -5.692 34.371 1.00 0.00 N ATOM 0 H HIS A 17 -5.786 -10.859 32.218 1.00 0.00 H new ATOM 0 HA HIS A 17 -4.553 -8.460 31.502 1.00 0.00 H new ATOM 0 HB2 HIS A 17 -5.849 -9.093 33.621 1.00 0.00 H new ATOM 0 HB3 HIS A 17 -4.379 -9.856 34.194 1.00 0.00 H new ATOM 0 HD2 HIS A 17 -3.914 -6.463 32.350 1.00 0.00 H new ATOM 0 HE1 HIS A 17 -3.475 -5.750 36.508 1.00 0.00 H new ATOM 0 HE2 HIS A 17 -3.233 -4.742 34.184 1.00 0.00 H new ATOM 229 N SER A 18 -2.440 -10.758 32.611 1.00 0.00 N ATOM 230 CA SER A 18 -1.035 -11.147 32.619 1.00 0.00 C ATOM 231 C SER A 18 -0.494 -11.277 31.199 1.00 0.00 C ATOM 232 O SER A 18 0.670 -10.975 30.937 1.00 0.00 O ATOM 233 CB SER A 18 -0.855 -12.469 33.368 1.00 0.00 C ATOM 234 OG SER A 18 0.346 -12.470 34.121 1.00 0.00 O ATOM 0 H SER A 18 -3.064 -11.423 33.068 1.00 0.00 H new ATOM 0 HA SER A 18 -0.473 -10.366 33.131 1.00 0.00 H new ATOM 0 HB2 SER A 18 -1.704 -12.633 34.032 1.00 0.00 H new ATOM 0 HB3 SER A 18 -0.842 -13.295 32.657 1.00 0.00 H new ATOM 0 HG SER A 18 1.112 -12.399 33.514 1.00 0.00 H new ATOM 240 N LEU A 19 -1.347 -11.728 30.285 1.00 0.00 N ATOM 241 CA LEU A 19 -0.956 -11.898 28.891 1.00 0.00 C ATOM 242 C LEU A 19 -0.477 -10.581 28.292 1.00 0.00 C ATOM 243 O LEU A 19 0.500 -10.546 27.545 1.00 0.00 O ATOM 244 CB LEU A 19 -2.130 -12.446 28.081 1.00 0.00 C ATOM 245 CG LEU A 19 -2.212 -13.971 28.014 1.00 0.00 C ATOM 246 CD1 LEU A 19 -1.279 -14.509 26.942 1.00 0.00 C ATOM 247 CD2 LEU A 19 -1.889 -14.592 29.367 1.00 0.00 C ATOM 0 H LEU A 19 -2.314 -11.982 30.485 1.00 0.00 H new ATOM 0 HA LEU A 19 -0.131 -12.609 28.853 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -3.057 -12.066 28.510 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -2.065 -12.056 27.065 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.234 -14.245 27.751 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -1.351 -15.596 26.909 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -1.562 -14.097 25.973 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -0.254 -14.220 27.174 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -1.954 -15.678 29.294 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -0.880 -14.308 29.666 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -2.602 -14.235 30.111 1.00 0.00 H new ATOM 259 N ALA A 20 -1.172 -9.501 28.628 1.00 0.00 N ATOM 260 CA ALA A 20 -0.820 -8.179 28.128 1.00 0.00 C ATOM 261 C ALA A 20 0.493 -7.699 28.737 1.00 0.00 C ATOM 262 O ALA A 20 1.282 -7.017 28.082 1.00 0.00 O ATOM 263 CB ALA A 20 -1.940 -7.193 28.423 1.00 0.00 C ATOM 0 H ALA A 20 -1.984 -9.516 29.246 1.00 0.00 H new ATOM 0 HA ALA A 20 -0.685 -8.243 27.048 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -1.666 -6.208 28.045 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -2.856 -7.527 27.936 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -2.101 -7.137 29.500 1.00 0.00 H new ATOM 269 N ARG A 21 0.724 -8.066 29.994 1.00 0.00 N ATOM 270 CA ARG A 21 1.943 -7.680 30.693 1.00 0.00 C ATOM 271 C ARG A 21 3.172 -8.221 29.973 1.00 0.00 C ATOM 272 O ARG A 21 4.167 -7.517 29.801 1.00 0.00 O ATOM 273 CB ARG A 21 1.917 -8.196 32.134 1.00 0.00 C ATOM 274 CG ARG A 21 0.673 -7.787 32.907 1.00 0.00 C ATOM 275 CD ARG A 21 0.738 -6.331 33.334 1.00 0.00 C ATOM 276 NE ARG A 21 0.999 -6.192 34.765 1.00 0.00 N ATOM 277 CZ ARG A 21 1.474 -5.083 35.328 1.00 0.00 C ATOM 278 NH1 ARG A 21 1.739 -4.014 34.586 1.00 0.00 N1+ ATOM 279 NH2 ARG A 21 1.682 -5.041 36.637 1.00 0.00 N ATOM 0 H ARG A 21 0.081 -8.631 30.549 1.00 0.00 H new ATOM 0 HA ARG A 21 1.996 -6.591 30.705 1.00 0.00 H new ATOM 0 HB2 ARG A 21 1.986 -9.284 32.122 1.00 0.00 H new ATOM 0 HB3 ARG A 21 2.798 -7.827 32.659 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -0.210 -7.947 32.289 1.00 0.00 H new ATOM 0 HG3 ARG A 21 0.565 -8.421 33.787 1.00 0.00 H new ATOM 0 HD2 ARG A 21 1.521 -5.823 32.771 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -0.203 -5.838 33.087 1.00 0.00 H new ATOM 0 HE ARG A 21 0.806 -6.992 35.368 1.00 0.00 H new ATOM 0 HH11 ARG A 21 1.579 -4.040 33.579 1.00 0.00 H new ATOM 0 HH12 ARG A 21 2.103 -3.167 35.023 1.00 0.00 H new ATOM 0 HH21 ARG A 21 1.478 -5.858 37.212 1.00 0.00 H new ATOM 0 HH22 ARG A 21 2.046 -4.191 37.069 1.00 0.00 H new ATOM 293 N PHE A 22 3.096 -9.481 29.554 1.00 0.00 N ATOM 294 CA PHE A 22 4.199 -10.124 28.851 1.00 0.00 C ATOM 295 C PHE A 22 4.450 -9.452 27.506 1.00 0.00 C ATOM 296 O PHE A 22 5.596 -9.229 27.115 1.00 0.00 O ATOM 297 CB PHE A 22 3.899 -11.611 28.637 1.00 0.00 C ATOM 298 CG PHE A 22 3.173 -12.263 29.782 1.00 0.00 C ATOM 299 CD1 PHE A 22 3.387 -11.848 31.087 1.00 0.00 C ATOM 300 CD2 PHE A 22 2.274 -13.291 29.550 1.00 0.00 C ATOM 301 CE1 PHE A 22 2.717 -12.445 32.137 1.00 0.00 C ATOM 302 CE2 PHE A 22 1.601 -13.893 30.596 1.00 0.00 C ATOM 303 CZ PHE A 22 1.822 -13.469 31.892 1.00 0.00 C ATOM 0 H PHE A 22 2.280 -10.077 29.690 1.00 0.00 H new ATOM 0 HA PHE A 22 5.094 -10.023 29.464 1.00 0.00 H new ATOM 0 HB2 PHE A 22 3.303 -11.723 27.732 1.00 0.00 H new ATOM 0 HB3 PHE A 22 4.837 -12.139 28.468 1.00 0.00 H new ATOM 0 HD1 PHE A 22 4.086 -11.049 31.285 1.00 0.00 H new ATOM 0 HD2 PHE A 22 2.097 -13.626 28.539 1.00 0.00 H new ATOM 0 HE1 PHE A 22 2.893 -12.112 33.149 1.00 0.00 H new ATOM 0 HE2 PHE A 22 0.903 -14.694 30.401 1.00 0.00 H new ATOM 0 HZ PHE A 22 1.297 -13.937 32.712 1.00 0.00 H new ATOM 313 N ALA A 23 3.370 -9.137 26.799 1.00 0.00 N ATOM 314 CA ALA A 23 3.469 -8.496 25.494 1.00 0.00 C ATOM 315 C ALA A 23 4.181 -7.153 25.593 1.00 0.00 C ATOM 316 O ALA A 23 5.157 -6.903 24.889 1.00 0.00 O ATOM 317 CB ALA A 23 2.085 -8.316 24.888 1.00 0.00 C ATOM 0 H ALA A 23 2.415 -9.316 27.109 1.00 0.00 H new ATOM 0 HA ALA A 23 4.058 -9.143 24.844 1.00 0.00 H new ATOM 0 HB1 ALA A 23 2.174 -7.836 23.913 1.00 0.00 H new ATOM 0 HB2 ALA A 23 1.610 -9.290 24.771 1.00 0.00 H new ATOM 0 HB3 ALA A 23 1.478 -7.693 25.545 1.00 0.00 H new ATOM 323 N VAL A 24 3.689 -6.289 26.472 1.00 0.00 N ATOM 324 CA VAL A 24 4.282 -4.971 26.659 1.00 0.00 C ATOM 325 C VAL A 24 5.730 -5.081 27.124 1.00 0.00 C ATOM 326 O VAL A 24 6.564 -4.234 26.802 1.00 0.00 O ATOM 327 CB VAL A 24 3.490 -4.142 27.686 1.00 0.00 C ATOM 328 CG1 VAL A 24 4.079 -2.745 27.819 1.00 0.00 C ATOM 329 CG2 VAL A 24 2.021 -4.070 27.297 1.00 0.00 C ATOM 0 H VAL A 24 2.882 -6.477 27.066 1.00 0.00 H new ATOM 0 HA VAL A 24 4.250 -4.469 25.692 1.00 0.00 H new ATOM 0 HB VAL A 24 3.564 -4.637 28.654 1.00 0.00 H new ATOM 0 HG11 VAL A 24 3.504 -2.176 28.550 1.00 0.00 H new ATOM 0 HG12 VAL A 24 5.115 -2.817 28.149 1.00 0.00 H new ATOM 0 HG13 VAL A 24 4.040 -2.240 26.854 1.00 0.00 H new ATOM 0 HG21 VAL A 24 1.478 -3.480 28.035 1.00 0.00 H new ATOM 0 HG22 VAL A 24 1.927 -3.602 26.317 1.00 0.00 H new ATOM 0 HG23 VAL A 24 1.605 -5.077 27.260 1.00 0.00 H new ATOM 339 N ASP A 25 6.014 -6.121 27.895 1.00 0.00 N ATOM 340 CA ASP A 25 7.355 -6.341 28.424 1.00 0.00 C ATOM 341 C ASP A 25 8.388 -6.513 27.308 1.00 0.00 C ATOM 342 O ASP A 25 9.483 -5.958 27.382 1.00 0.00 O ATOM 343 CB ASP A 25 7.365 -7.569 29.336 1.00 0.00 C ATOM 344 CG ASP A 25 8.708 -7.783 30.004 1.00 0.00 C ATOM 345 OD1 ASP A 25 9.103 -6.933 30.831 1.00 0.00 O1- ATOM 346 OD2 ASP A 25 9.367 -8.799 29.701 1.00 0.00 O ATOM 0 H ASP A 25 5.332 -6.828 28.170 1.00 0.00 H new ATOM 0 HA ASP A 25 7.631 -5.456 28.998 1.00 0.00 H new ATOM 0 HB2 ASP A 25 6.596 -7.456 30.100 1.00 0.00 H new ATOM 0 HB3 ASP A 25 7.108 -8.453 28.753 1.00 0.00 H new ATOM 351 N GLN A 26 8.044 -7.294 26.286 1.00 0.00 N ATOM 352 CA GLN A 26 8.963 -7.538 25.174 1.00 0.00 C ATOM 353 C GLN A 26 9.205 -6.273 24.356 1.00 0.00 C ATOM 354 O GLN A 26 10.299 -6.063 23.833 1.00 0.00 O ATOM 355 CB GLN A 26 8.429 -8.650 24.265 1.00 0.00 C ATOM 356 CG GLN A 26 7.065 -8.358 23.669 1.00 0.00 C ATOM 357 CD GLN A 26 6.941 -8.880 22.255 1.00 0.00 C ATOM 358 OE1 GLN A 26 6.392 -9.955 22.022 1.00 0.00 O ATOM 359 NE2 GLN A 26 7.456 -8.119 21.299 1.00 0.00 N ATOM 0 H GLN A 26 7.143 -7.766 26.204 1.00 0.00 H new ATOM 0 HA GLN A 26 9.914 -7.852 25.603 1.00 0.00 H new ATOM 0 HB2 GLN A 26 9.140 -8.816 23.456 1.00 0.00 H new ATOM 0 HB3 GLN A 26 8.374 -9.577 24.836 1.00 0.00 H new ATOM 0 HG2 GLN A 26 6.293 -8.810 24.291 1.00 0.00 H new ATOM 0 HG3 GLN A 26 6.889 -7.282 23.675 1.00 0.00 H new ATOM 0 HE21 GLN A 26 7.903 -7.234 21.537 1.00 0.00 H new ATOM 0 HE22 GLN A 26 7.405 -8.419 20.325 1.00 0.00 H new ATOM 368 N HIS A 27 8.181 -5.436 24.244 1.00 0.00 N ATOM 369 CA HIS A 27 8.289 -4.197 23.483 1.00 0.00 C ATOM 370 C HIS A 27 9.066 -3.139 24.259 1.00 0.00 C ATOM 371 O HIS A 27 10.018 -2.552 23.746 1.00 0.00 O ATOM 372 CB HIS A 27 6.896 -3.673 23.130 1.00 0.00 C ATOM 373 CG HIS A 27 6.574 -3.759 21.670 1.00 0.00 C ATOM 374 ND1 HIS A 27 7.163 -4.672 20.822 1.00 0.00 N ATOM 375 CD2 HIS A 27 5.717 -3.039 20.909 1.00 0.00 C ATOM 376 CE1 HIS A 27 6.684 -4.510 19.602 1.00 0.00 C ATOM 377 NE2 HIS A 27 5.804 -3.526 19.628 1.00 0.00 N ATOM 0 H HIS A 27 7.267 -5.592 24.670 1.00 0.00 H new ATOM 0 HA HIS A 27 8.835 -4.411 22.564 1.00 0.00 H new ATOM 0 HB2 HIS A 27 6.152 -4.238 23.691 1.00 0.00 H new ATOM 0 HB3 HIS A 27 6.816 -2.634 23.450 1.00 0.00 H new ATOM 0 HD2 HIS A 27 5.083 -2.232 21.246 1.00 0.00 H new ATOM 0 HE1 HIS A 27 6.964 -5.084 18.731 1.00 0.00 H new ATOM 0 HE2 HIS A 27 5.275 -3.183 18.826 1.00 0.00 H new ATOM 386 N ASN A 28 8.651 -2.899 25.497 1.00 0.00 N ATOM 387 CA ASN A 28 9.301 -1.908 26.345 1.00 0.00 C ATOM 388 C ASN A 28 10.779 -2.224 26.544 1.00 0.00 C ATOM 389 O ASN A 28 11.612 -1.321 26.620 1.00 0.00 O ATOM 390 CB ASN A 28 8.597 -1.834 27.702 1.00 0.00 C ATOM 391 CG ASN A 28 9.188 -0.772 28.607 1.00 0.00 C ATOM 392 OD1 ASN A 28 10.402 -0.715 28.806 1.00 0.00 O ATOM 393 ND2 ASN A 28 8.331 0.078 29.160 1.00 0.00 N ATOM 0 H ASN A 28 7.865 -3.379 25.937 1.00 0.00 H new ATOM 0 HA ASN A 28 9.228 -0.943 25.844 1.00 0.00 H new ATOM 0 HB2 ASN A 28 7.538 -1.626 27.547 1.00 0.00 H new ATOM 0 HB3 ASN A 28 8.663 -2.804 28.195 1.00 0.00 H new ATOM 0 HD21 ASN A 28 8.671 0.815 29.778 1.00 0.00 H new ATOM 0 HD22 ASN A 28 7.333 -0.006 28.967 1.00 0.00 H new ATOM 400 N THR A 29 11.097 -3.507 26.646 1.00 0.00 N ATOM 401 CA THR A 29 12.473 -3.935 26.858 1.00 0.00 C ATOM 402 C THR A 29 13.308 -3.871 25.579 1.00 0.00 C ATOM 403 O THR A 29 14.527 -3.708 25.642 1.00 0.00 O ATOM 404 CB THR A 29 12.500 -5.355 27.422 1.00 0.00 C ATOM 405 OG1 THR A 29 13.814 -5.716 27.810 1.00 0.00 O ATOM 406 CG2 THR A 29 12.009 -6.396 26.442 1.00 0.00 C ATOM 0 H THR A 29 10.422 -4.269 26.585 1.00 0.00 H new ATOM 0 HA THR A 29 12.917 -3.243 27.573 1.00 0.00 H new ATOM 0 HB THR A 29 11.826 -5.339 28.279 1.00 0.00 H new ATOM 0 HG1 THR A 29 13.810 -6.628 28.170 1.00 0.00 H new ATOM 0 HG21 THR A 29 12.054 -7.382 26.905 1.00 0.00 H new ATOM 0 HG22 THR A 29 10.980 -6.174 26.161 1.00 0.00 H new ATOM 0 HG23 THR A 29 12.639 -6.384 25.552 1.00 0.00 H new ATOM 414 N LYS A 30 12.669 -4.032 24.421 1.00 0.00 N ATOM 415 CA LYS A 30 13.404 -4.024 23.158 1.00 0.00 C ATOM 416 C LYS A 30 13.506 -2.634 22.523 1.00 0.00 C ATOM 417 O LYS A 30 14.605 -2.186 22.197 1.00 0.00 O ATOM 418 CB LYS A 30 12.766 -5.004 22.169 1.00 0.00 C ATOM 419 CG LYS A 30 11.397 -4.576 21.671 1.00 0.00 C ATOM 420 CD LYS A 30 10.712 -5.689 20.895 1.00 0.00 C ATOM 421 CE LYS A 30 11.528 -6.104 19.681 1.00 0.00 C ATOM 422 NZ LYS A 30 10.692 -6.793 18.660 1.00 0.00 N1+ ATOM 0 H LYS A 30 11.662 -4.167 24.331 1.00 0.00 H new ATOM 0 HA LYS A 30 14.422 -4.337 23.392 1.00 0.00 H new ATOM 0 HB2 LYS A 30 13.431 -5.125 21.314 1.00 0.00 H new ATOM 0 HB3 LYS A 30 12.679 -5.980 22.646 1.00 0.00 H new ATOM 0 HG2 LYS A 30 10.775 -4.286 22.518 1.00 0.00 H new ATOM 0 HG3 LYS A 30 11.499 -3.697 21.035 1.00 0.00 H new ATOM 0 HD2 LYS A 30 10.563 -6.550 21.546 1.00 0.00 H new ATOM 0 HD3 LYS A 30 9.724 -5.357 20.575 1.00 0.00 H new ATOM 0 HE2 LYS A 30 11.991 -5.223 19.237 1.00 0.00 H new ATOM 0 HE3 LYS A 30 12.336 -6.765 19.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 11.285 -7.060 17.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 10.270 -7.648 19.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 9.936 -6.154 18.341 1.00 0.00 H new ATOM 436 N GLU A 31 12.375 -1.954 22.320 1.00 0.00 N ATOM 437 CA GLU A 31 12.408 -0.631 21.693 1.00 0.00 C ATOM 438 C GLU A 31 11.520 0.395 22.397 1.00 0.00 C ATOM 439 O GLU A 31 11.738 1.599 22.262 1.00 0.00 O ATOM 440 CB GLU A 31 11.994 -0.743 20.224 1.00 0.00 C ATOM 441 CG GLU A 31 10.663 -1.447 20.019 1.00 0.00 C ATOM 442 CD GLU A 31 10.673 -2.377 18.822 1.00 0.00 C ATOM 443 OE1 GLU A 31 11.737 -2.967 18.537 1.00 0.00 O1- ATOM 444 OE2 GLU A 31 9.619 -2.513 18.167 1.00 0.00 O ATOM 0 H GLU A 31 11.445 -2.288 22.574 1.00 0.00 H new ATOM 0 HA GLU A 31 13.434 -0.272 21.777 1.00 0.00 H new ATOM 0 HB2 GLU A 31 11.937 0.257 19.794 1.00 0.00 H new ATOM 0 HB3 GLU A 31 12.768 -1.281 19.677 1.00 0.00 H new ATOM 0 HG2 GLU A 31 10.416 -2.017 20.915 1.00 0.00 H new ATOM 0 HG3 GLU A 31 9.878 -0.702 19.889 1.00 0.00 H new ATOM 451 N ASN A 32 10.513 -0.067 23.128 1.00 0.00 N ATOM 452 CA ASN A 32 9.606 0.841 23.814 1.00 0.00 C ATOM 453 C ASN A 32 10.145 1.231 25.187 1.00 0.00 C ATOM 454 O ASN A 32 11.265 0.871 25.552 1.00 0.00 O ATOM 455 CB ASN A 32 8.216 0.213 23.946 1.00 0.00 C ATOM 456 CG ASN A 32 7.115 1.151 23.494 1.00 0.00 C ATOM 457 OD1 ASN A 32 7.006 1.479 22.313 1.00 0.00 O ATOM 458 ND2 ASN A 32 6.292 1.588 24.439 1.00 0.00 N ATOM 0 H ASN A 32 10.306 -1.057 23.260 1.00 0.00 H new ATOM 0 HA ASN A 32 9.526 1.748 23.214 1.00 0.00 H new ATOM 0 HB2 ASN A 32 8.176 -0.702 23.355 1.00 0.00 H new ATOM 0 HB3 ASN A 32 8.045 -0.070 24.985 1.00 0.00 H new ATOM 0 HD21 ASN A 32 5.531 2.223 24.199 1.00 0.00 H new ATOM 0 HD22 ASN A 32 6.421 1.289 25.406 1.00 0.00 H new ATOM 465 N GLY A 33 9.342 1.973 25.941 1.00 0.00 N ATOM 466 CA GLY A 33 9.754 2.404 27.265 1.00 0.00 C ATOM 467 C GLY A 33 8.909 3.546 27.802 1.00 0.00 C ATOM 468 O GLY A 33 9.413 4.419 28.508 1.00 0.00 O ATOM 0 H GLY A 33 8.412 2.284 25.659 1.00 0.00 H new ATOM 0 HA2 GLY A 33 9.694 1.560 27.952 1.00 0.00 H new ATOM 0 HA3 GLY A 33 10.798 2.715 27.232 1.00 0.00 H new ATOM 472 N LEU A 34 7.620 3.538 27.473 1.00 0.00 N ATOM 473 CA LEU A 34 6.707 4.578 27.933 1.00 0.00 C ATOM 474 C LEU A 34 5.263 4.093 27.907 1.00 0.00 C ATOM 475 O LEU A 34 4.331 4.888 27.790 1.00 0.00 O ATOM 476 CB LEU A 34 6.852 5.836 27.077 1.00 0.00 C ATOM 477 CG LEU A 34 7.011 5.602 25.571 1.00 0.00 C ATOM 478 CD1 LEU A 34 8.424 5.142 25.245 1.00 0.00 C ATOM 479 CD2 LEU A 34 5.987 4.593 25.066 1.00 0.00 C ATOM 0 H LEU A 34 7.185 2.823 26.890 1.00 0.00 H new ATOM 0 HA LEU A 34 6.969 4.819 28.963 1.00 0.00 H new ATOM 0 HB2 LEU A 34 5.976 6.465 27.238 1.00 0.00 H new ATOM 0 HB3 LEU A 34 7.717 6.397 27.432 1.00 0.00 H new ATOM 0 HG LEU A 34 6.833 6.549 25.061 1.00 0.00 H new ATOM 0 HD11 LEU A 34 8.516 4.982 24.171 1.00 0.00 H new ATOM 0 HD12 LEU A 34 9.137 5.904 25.560 1.00 0.00 H new ATOM 0 HD13 LEU A 34 8.634 4.210 25.770 1.00 0.00 H new ATOM 0 HD21 LEU A 34 6.121 4.444 23.994 1.00 0.00 H new ATOM 0 HD22 LEU A 34 6.125 3.644 25.584 1.00 0.00 H new ATOM 0 HD23 LEU A 34 4.982 4.968 25.258 1.00 0.00 H new ATOM 491 N LEU A 35 5.088 2.783 28.015 1.00 0.00 N ATOM 492 CA LEU A 35 3.761 2.182 28.005 1.00 0.00 C ATOM 493 C LEU A 35 3.520 1.368 29.269 1.00 0.00 C ATOM 494 O LEU A 35 4.290 0.463 29.591 1.00 0.00 O ATOM 495 CB LEU A 35 3.600 1.280 26.784 1.00 0.00 C ATOM 496 CG LEU A 35 3.239 2.002 25.489 1.00 0.00 C ATOM 497 CD1 LEU A 35 3.301 1.039 24.317 1.00 0.00 C ATOM 498 CD2 LEU A 35 1.855 2.621 25.592 1.00 0.00 C ATOM 0 H LEU A 35 5.852 2.114 28.111 1.00 0.00 H new ATOM 0 HA LEU A 35 3.029 2.988 27.963 1.00 0.00 H new ATOM 0 HB2 LEU A 35 4.531 0.734 26.630 1.00 0.00 H new ATOM 0 HB3 LEU A 35 2.828 0.541 26.997 1.00 0.00 H new ATOM 0 HG LEU A 35 3.962 2.801 25.324 1.00 0.00 H new ATOM 0 HD11 LEU A 35 3.041 1.566 23.399 1.00 0.00 H new ATOM 0 HD12 LEU A 35 4.310 0.635 24.231 1.00 0.00 H new ATOM 0 HD13 LEU A 35 2.596 0.223 24.479 1.00 0.00 H new ATOM 0 HD21 LEU A 35 1.614 3.132 24.660 1.00 0.00 H new ATOM 0 HD22 LEU A 35 1.119 1.838 25.777 1.00 0.00 H new ATOM 0 HD23 LEU A 35 1.837 3.338 26.413 1.00 0.00 H new ATOM 510 N GLU A 36 2.444 1.687 29.977 1.00 0.00 N ATOM 511 CA GLU A 36 2.106 0.970 31.203 1.00 0.00 C ATOM 512 C GLU A 36 0.687 0.417 31.141 1.00 0.00 C ATOM 513 O GLU A 36 -0.183 0.977 30.482 1.00 0.00 O ATOM 514 CB GLU A 36 2.271 1.878 32.421 1.00 0.00 C ATOM 515 CG GLU A 36 1.185 2.926 32.548 1.00 0.00 C ATOM 516 CD GLU A 36 1.676 4.196 33.213 1.00 0.00 C ATOM 517 OE1 GLU A 36 2.685 4.762 32.740 1.00 0.00 O1- ATOM 518 OE2 GLU A 36 1.051 4.627 34.205 1.00 0.00 O ATOM 0 H GLU A 36 1.794 2.432 29.727 1.00 0.00 H new ATOM 0 HA GLU A 36 2.794 0.130 31.300 1.00 0.00 H new ATOM 0 HB2 GLU A 36 2.280 1.265 33.322 1.00 0.00 H new ATOM 0 HB3 GLU A 36 3.239 2.375 32.364 1.00 0.00 H new ATOM 0 HG2 GLU A 36 0.798 3.165 31.557 1.00 0.00 H new ATOM 0 HG3 GLU A 36 0.355 2.516 33.124 1.00 0.00 H new ATOM 525 N LEU A 37 0.469 -0.691 31.832 1.00 0.00 N ATOM 526 CA LEU A 37 -0.839 -1.332 31.862 1.00 0.00 C ATOM 527 C LEU A 37 -1.697 -0.758 32.983 1.00 0.00 C ATOM 528 O LEU A 37 -1.317 -0.795 34.154 1.00 0.00 O ATOM 529 CB LEU A 37 -0.681 -2.841 32.033 1.00 0.00 C ATOM 530 CG LEU A 37 -0.298 -3.594 30.758 1.00 0.00 C ATOM 531 CD1 LEU A 37 1.215 -3.660 30.612 1.00 0.00 C ATOM 532 CD2 LEU A 37 -0.900 -4.991 30.760 1.00 0.00 C ATOM 0 H LEU A 37 1.183 -1.168 32.382 1.00 0.00 H new ATOM 0 HA LEU A 37 -1.341 -1.135 30.915 1.00 0.00 H new ATOM 0 HB2 LEU A 37 0.079 -3.029 32.791 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -1.618 -3.250 32.412 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.701 -3.051 29.903 1.00 0.00 H new ATOM 0 HD11 LEU A 37 1.469 -4.199 29.699 1.00 0.00 H new ATOM 0 HD12 LEU A 37 1.620 -2.649 30.561 1.00 0.00 H new ATOM 0 HD13 LEU A 37 1.641 -4.179 31.471 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -0.616 -5.511 29.845 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -0.530 -5.546 31.622 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -1.986 -4.919 30.814 1.00 0.00 H new ATOM 544 N VAL A 38 -2.854 -0.218 32.614 1.00 0.00 N ATOM 545 CA VAL A 38 -3.767 0.374 33.582 1.00 0.00 C ATOM 546 C VAL A 38 -4.888 -0.589 33.957 1.00 0.00 C ATOM 547 O VAL A 38 -5.020 -0.977 35.118 1.00 0.00 O ATOM 548 CB VAL A 38 -4.387 1.677 33.043 1.00 0.00 C ATOM 549 CG1 VAL A 38 -5.155 2.394 34.140 1.00 0.00 C ATOM 550 CG2 VAL A 38 -3.311 2.578 32.457 1.00 0.00 C ATOM 0 H VAL A 38 -3.181 -0.179 31.649 1.00 0.00 H new ATOM 0 HA VAL A 38 -3.176 0.596 34.471 1.00 0.00 H new ATOM 0 HB VAL A 38 -5.087 1.424 32.247 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -5.586 3.312 33.742 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -5.952 1.748 34.508 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -4.478 2.637 34.959 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -3.768 3.493 32.081 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -2.584 2.826 33.230 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -2.809 2.061 31.639 1.00 0.00 H new ATOM 560 N ARG A 39 -5.699 -0.969 32.973 1.00 0.00 N ATOM 561 CA ARG A 39 -6.810 -1.886 33.221 1.00 0.00 C ATOM 562 C ARG A 39 -7.263 -2.570 31.936 1.00 0.00 C ATOM 563 O ARG A 39 -7.499 -1.916 30.922 1.00 0.00 O ATOM 564 CB ARG A 39 -7.985 -1.134 33.851 1.00 0.00 C ATOM 565 CG ARG A 39 -7.931 -1.082 35.370 1.00 0.00 C ATOM 566 CD ARG A 39 -7.427 0.264 35.868 1.00 0.00 C ATOM 567 NE ARG A 39 -8.387 0.912 36.758 1.00 0.00 N ATOM 568 CZ ARG A 39 -8.691 0.463 37.975 1.00 0.00 C ATOM 569 NH1 ARG A 39 -8.112 -0.634 38.448 1.00 0.00 N1+ ATOM 570 NH2 ARG A 39 -9.575 1.112 38.719 1.00 0.00 N ATOM 0 H ARG A 39 -5.610 -0.660 32.005 1.00 0.00 H new ATOM 0 HA ARG A 39 -6.460 -2.655 33.910 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -8.005 -0.116 33.462 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -8.916 -1.610 33.545 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -8.924 -1.272 35.776 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -7.279 -1.874 35.739 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -6.482 0.126 36.393 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -7.226 0.914 35.016 1.00 0.00 H new ATOM 0 HE ARG A 39 -8.852 1.758 36.428 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -7.431 -1.137 37.879 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -8.348 -0.974 39.380 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -10.023 1.955 38.360 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -9.808 0.768 39.651 1.00 0.00 H new ATOM 584 N VAL A 40 -7.386 -3.895 31.989 1.00 0.00 N ATOM 585 CA VAL A 40 -7.811 -4.680 30.833 1.00 0.00 C ATOM 586 C VAL A 40 -9.072 -4.104 30.195 1.00 0.00 C ATOM 587 O VAL A 40 -9.887 -3.473 30.867 1.00 0.00 O ATOM 588 CB VAL A 40 -8.073 -6.148 31.220 1.00 0.00 C ATOM 589 CG1 VAL A 40 -8.328 -6.991 29.979 1.00 0.00 C ATOM 590 CG2 VAL A 40 -6.906 -6.707 32.025 1.00 0.00 C ATOM 0 H VAL A 40 -7.196 -4.449 32.824 1.00 0.00 H new ATOM 0 HA VAL A 40 -6.996 -4.636 30.111 1.00 0.00 H new ATOM 0 HB VAL A 40 -8.965 -6.185 31.845 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -8.511 -8.025 30.273 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -9.199 -6.605 29.449 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -7.457 -6.948 29.325 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -7.110 -7.745 32.289 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -5.995 -6.657 31.428 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -6.777 -6.120 32.934 1.00 0.00 H new ATOM 600 N VAL A 41 -9.224 -4.330 28.893 1.00 0.00 N ATOM 601 CA VAL A 41 -10.384 -3.837 28.160 1.00 0.00 C ATOM 602 C VAL A 41 -11.259 -4.991 27.684 1.00 0.00 C ATOM 603 O VAL A 41 -12.401 -5.139 28.120 1.00 0.00 O ATOM 604 CB VAL A 41 -9.959 -2.990 26.945 1.00 0.00 C ATOM 605 CG1 VAL A 41 -11.176 -2.452 26.206 1.00 0.00 C ATOM 606 CG2 VAL A 41 -9.050 -1.852 27.379 1.00 0.00 C ATOM 0 H VAL A 41 -8.557 -4.852 28.324 1.00 0.00 H new ATOM 0 HA VAL A 41 -10.955 -3.211 28.846 1.00 0.00 H new ATOM 0 HB VAL A 41 -9.404 -3.632 26.261 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -10.850 -1.857 25.353 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -11.787 -3.284 25.856 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -11.764 -1.828 26.879 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -8.760 -1.265 26.507 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -9.579 -1.214 28.087 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -8.158 -2.260 27.854 1.00 0.00 H new ATOM 616 N GLU A 42 -10.715 -5.805 26.787 1.00 0.00 N ATOM 617 CA GLU A 42 -11.446 -6.947 26.249 1.00 0.00 C ATOM 618 C GLU A 42 -10.490 -8.060 25.832 1.00 0.00 C ATOM 619 O GLU A 42 -9.271 -7.896 25.875 1.00 0.00 O ATOM 620 CB GLU A 42 -12.299 -6.515 25.054 1.00 0.00 C ATOM 621 CG GLU A 42 -13.765 -6.306 25.398 1.00 0.00 C ATOM 622 CD GLU A 42 -14.380 -5.142 24.646 1.00 0.00 C ATOM 623 OE1 GLU A 42 -14.796 -5.339 23.485 1.00 0.00 O ATOM 624 OE2 GLU A 42 -14.446 -4.034 25.218 1.00 0.00 O1- ATOM 0 H GLU A 42 -9.771 -5.696 26.417 1.00 0.00 H new ATOM 0 HA GLU A 42 -12.099 -7.331 27.033 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -11.895 -5.589 24.645 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -12.222 -7.270 24.271 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -14.321 -7.215 25.170 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -13.862 -6.133 26.470 1.00 0.00 H new ATOM 631 N ALA A 43 -11.055 -9.193 25.430 1.00 0.00 N ATOM 632 CA ALA A 43 -10.256 -10.336 25.003 1.00 0.00 C ATOM 633 C ALA A 43 -10.841 -10.976 23.754 1.00 0.00 C ATOM 634 O ALA A 43 -11.936 -11.542 23.782 1.00 0.00 O ATOM 635 CB ALA A 43 -10.150 -11.357 26.126 1.00 0.00 C ATOM 0 H ALA A 43 -12.063 -9.345 25.391 1.00 0.00 H new ATOM 0 HA ALA A 43 -9.255 -9.978 24.760 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -9.551 -12.204 25.792 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -9.676 -10.897 26.993 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -11.147 -11.703 26.399 1.00 0.00 H new ATOM 641 N ARG A 44 -10.101 -10.881 22.657 1.00 0.00 N ATOM 642 CA ARG A 44 -10.535 -11.448 21.385 1.00 0.00 C ATOM 643 C ARG A 44 -9.611 -12.582 20.954 1.00 0.00 C ATOM 644 O ARG A 44 -8.422 -12.582 21.271 1.00 0.00 O ATOM 645 CB ARG A 44 -10.569 -10.363 20.307 1.00 0.00 C ATOM 646 CG ARG A 44 -11.780 -9.449 20.403 1.00 0.00 C ATOM 647 CD ARG A 44 -11.694 -8.525 21.608 1.00 0.00 C ATOM 648 NE ARG A 44 -12.796 -8.741 22.542 1.00 0.00 N ATOM 649 CZ ARG A 44 -14.030 -8.279 22.352 1.00 0.00 C ATOM 650 NH1 ARG A 44 -14.324 -7.577 21.264 1.00 0.00 N1+ ATOM 651 NH2 ARG A 44 -14.974 -8.520 23.251 1.00 0.00 N ATOM 0 H ARG A 44 -9.194 -10.415 22.622 1.00 0.00 H new ATOM 0 HA ARG A 44 -11.539 -11.852 21.516 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -9.663 -9.761 20.380 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -10.559 -10.837 19.325 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -11.860 -8.854 19.493 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -12.686 -10.051 20.470 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -10.746 -8.686 22.122 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -11.702 -7.488 21.271 1.00 0.00 H new ATOM 0 HE ARG A 44 -12.609 -9.277 23.389 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -13.602 -7.389 20.568 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -15.271 -7.226 21.124 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -14.755 -9.059 24.088 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -15.919 -8.166 23.105 1.00 0.00 H new ATOM 665 N GLU A 45 -10.168 -13.551 20.233 1.00 0.00 N ATOM 666 CA GLU A 45 -9.393 -14.693 19.763 1.00 0.00 C ATOM 667 C GLU A 45 -9.477 -14.826 18.245 1.00 0.00 C ATOM 668 O GLU A 45 -10.382 -14.286 17.612 1.00 0.00 O ATOM 669 CB GLU A 45 -9.887 -15.979 20.430 1.00 0.00 C ATOM 670 CG GLU A 45 -8.900 -16.563 21.428 1.00 0.00 C ATOM 671 CD GLU A 45 -9.406 -16.501 22.856 1.00 0.00 C ATOM 672 OE1 GLU A 45 -10.639 -16.544 23.051 1.00 0.00 O1- ATOM 673 OE2 GLU A 45 -8.570 -16.410 23.778 1.00 0.00 O ATOM 0 H GLU A 45 -11.151 -13.568 19.962 1.00 0.00 H new ATOM 0 HA GLU A 45 -8.350 -14.528 20.034 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -10.829 -15.776 20.939 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -10.095 -16.722 19.660 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -8.694 -17.600 21.165 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -7.956 -16.023 21.358 1.00 0.00 H new ATOM 680 N GLN A 46 -8.518 -15.546 17.672 1.00 0.00 N ATOM 681 CA GLN A 46 -8.466 -15.755 16.232 1.00 0.00 C ATOM 682 C GLN A 46 -7.459 -16.841 15.884 1.00 0.00 C ATOM 683 O GLN A 46 -6.503 -17.076 16.623 1.00 0.00 O ATOM 684 CB GLN A 46 -8.092 -14.452 15.530 1.00 0.00 C ATOM 685 CG GLN A 46 -8.814 -14.240 14.210 1.00 0.00 C ATOM 686 CD GLN A 46 -9.129 -12.781 13.945 1.00 0.00 C ATOM 687 OE1 GLN A 46 -10.083 -12.231 14.496 1.00 0.00 O ATOM 688 NE2 GLN A 46 -8.328 -12.147 13.097 1.00 0.00 N ATOM 0 H GLN A 46 -7.762 -15.997 18.188 1.00 0.00 H new ATOM 0 HA GLN A 46 -9.451 -16.075 15.892 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -8.313 -13.616 16.193 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -7.017 -14.441 15.352 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -8.200 -14.628 13.398 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -9.741 -14.814 14.211 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -7.549 -12.643 12.664 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -8.492 -11.164 12.879 1.00 0.00 H new ATOM 697 N VAL A 47 -7.684 -17.503 14.760 1.00 0.00 N ATOM 698 CA VAL A 47 -6.793 -18.570 14.317 1.00 0.00 C ATOM 699 C VAL A 47 -5.945 -18.129 13.126 1.00 0.00 C ATOM 700 O VAL A 47 -6.452 -17.941 12.021 1.00 0.00 O ATOM 701 CB VAL A 47 -7.581 -19.841 13.938 1.00 0.00 C ATOM 702 CG1 VAL A 47 -8.508 -19.575 12.761 1.00 0.00 C ATOM 703 CG2 VAL A 47 -6.629 -20.988 13.628 1.00 0.00 C ATOM 0 H VAL A 47 -8.472 -17.323 14.138 1.00 0.00 H new ATOM 0 HA VAL A 47 -6.135 -18.798 15.156 1.00 0.00 H new ATOM 0 HB VAL A 47 -8.196 -20.127 14.791 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -9.052 -20.486 12.513 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -9.216 -18.790 13.026 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -7.920 -19.258 11.900 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -7.203 -21.876 13.363 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -5.984 -20.710 12.794 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -6.017 -21.200 14.505 1.00 0.00 H new ATOM 713 N VAL A 48 -4.646 -17.976 13.365 1.00 0.00 N ATOM 714 CA VAL A 48 -3.713 -17.570 12.319 1.00 0.00 C ATOM 715 C VAL A 48 -2.543 -18.542 12.235 1.00 0.00 C ATOM 716 O VAL A 48 -1.707 -18.595 13.137 1.00 0.00 O ATOM 717 CB VAL A 48 -3.173 -16.148 12.567 1.00 0.00 C ATOM 718 CG1 VAL A 48 -2.077 -15.802 11.566 1.00 0.00 C ATOM 719 CG2 VAL A 48 -4.305 -15.133 12.504 1.00 0.00 C ATOM 0 H VAL A 48 -4.215 -18.128 14.277 1.00 0.00 H new ATOM 0 HA VAL A 48 -4.262 -17.577 11.377 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.737 -16.115 13.565 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -1.711 -14.794 11.761 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.256 -16.512 11.666 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.479 -15.853 10.554 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -3.908 -14.134 12.681 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -4.771 -15.169 11.520 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -5.048 -15.369 13.266 1.00 0.00 H new ATOM 729 N ALA A 49 -2.485 -19.312 11.150 1.00 0.00 N ATOM 730 CA ALA A 49 -1.412 -20.284 10.958 1.00 0.00 C ATOM 731 C ALA A 49 -1.153 -21.063 12.244 1.00 0.00 C ATOM 732 O ALA A 49 -0.026 -21.466 12.529 1.00 0.00 O ATOM 733 CB ALA A 49 -0.143 -19.588 10.493 1.00 0.00 C ATOM 0 H ALA A 49 -3.167 -19.281 10.392 1.00 0.00 H new ATOM 0 HA ALA A 49 -1.723 -20.990 10.188 1.00 0.00 H new ATOM 0 HB1 ALA A 49 0.647 -20.326 10.355 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -0.333 -19.078 9.548 1.00 0.00 H new ATOM 0 HB3 ALA A 49 0.168 -18.860 11.242 1.00 0.00 H new ATOM 739 N GLY A 50 -2.212 -21.251 13.022 1.00 0.00 N ATOM 740 CA GLY A 50 -2.106 -21.959 14.281 1.00 0.00 C ATOM 741 C GLY A 50 -3.021 -21.364 15.333 1.00 0.00 C ATOM 742 O GLY A 50 -4.152 -21.817 15.507 1.00 0.00 O ATOM 0 H GLY A 50 -3.151 -20.921 12.799 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -2.357 -23.009 14.131 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -1.075 -21.925 14.633 1.00 0.00 H new ATOM 746 N THR A 51 -2.533 -20.344 16.033 1.00 0.00 N ATOM 747 CA THR A 51 -3.318 -19.686 17.063 1.00 0.00 C ATOM 748 C THR A 51 -2.916 -18.219 17.200 1.00 0.00 C ATOM 749 O THR A 51 -1.736 -17.877 17.118 1.00 0.00 O ATOM 750 CB THR A 51 -3.138 -20.410 18.395 1.00 0.00 C ATOM 751 OG1 THR A 51 -3.749 -21.686 18.359 1.00 0.00 O ATOM 752 CG2 THR A 51 -3.716 -19.657 19.574 1.00 0.00 C ATOM 0 H THR A 51 -1.598 -19.958 15.903 1.00 0.00 H new ATOM 0 HA THR A 51 -4.368 -19.724 16.774 1.00 0.00 H new ATOM 0 HB THR A 51 -2.060 -20.491 18.533 1.00 0.00 H new ATOM 0 HG1 THR A 51 -4.100 -21.855 17.460 1.00 0.00 H new ATOM 0 HG21 THR A 51 -3.552 -20.229 20.487 1.00 0.00 H new ATOM 0 HG22 THR A 51 -3.227 -18.687 19.661 1.00 0.00 H new ATOM 0 HG23 THR A 51 -4.786 -19.512 19.424 1.00 0.00 H new ATOM 760 N LEU A 52 -3.906 -17.359 17.415 1.00 0.00 N ATOM 761 CA LEU A 52 -3.663 -15.930 17.572 1.00 0.00 C ATOM 762 C LEU A 52 -4.395 -15.398 18.799 1.00 0.00 C ATOM 763 O LEU A 52 -5.598 -15.606 18.952 1.00 0.00 O ATOM 764 CB LEU A 52 -4.109 -15.172 16.314 1.00 0.00 C ATOM 765 CG LEU A 52 -4.235 -13.650 16.464 1.00 0.00 C ATOM 766 CD1 LEU A 52 -4.191 -12.976 15.103 1.00 0.00 C ATOM 767 CD2 LEU A 52 -5.521 -13.287 17.193 1.00 0.00 C ATOM 0 H LEU A 52 -4.887 -17.628 17.485 1.00 0.00 H new ATOM 0 HA LEU A 52 -2.593 -15.773 17.712 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -3.399 -15.382 15.514 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -5.073 -15.568 15.996 1.00 0.00 H new ATOM 0 HG LEU A 52 -3.392 -13.294 17.056 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -4.282 -11.897 15.228 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -3.245 -13.206 14.613 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -5.015 -13.341 14.490 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -5.591 -12.204 17.289 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -6.376 -13.657 16.628 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -5.517 -13.740 18.185 1.00 0.00 H new ATOM 779 N HIS A 53 -3.665 -14.707 19.668 1.00 0.00 N ATOM 780 CA HIS A 53 -4.258 -14.145 20.877 1.00 0.00 C ATOM 781 C HIS A 53 -4.304 -12.622 20.810 1.00 0.00 C ATOM 782 O HIS A 53 -3.282 -11.953 20.963 1.00 0.00 O ATOM 783 CB HIS A 53 -3.476 -14.585 22.115 1.00 0.00 C ATOM 784 CG HIS A 53 -4.328 -14.732 23.339 1.00 0.00 C ATOM 785 ND1 HIS A 53 -5.322 -15.680 23.455 1.00 0.00 N ATOM 786 CD2 HIS A 53 -4.330 -14.042 24.504 1.00 0.00 C ATOM 787 CE1 HIS A 53 -5.899 -15.568 24.639 1.00 0.00 C ATOM 788 NE2 HIS A 53 -5.316 -14.581 25.294 1.00 0.00 N ATOM 0 H HIS A 53 -2.668 -14.523 19.559 1.00 0.00 H new ATOM 0 HA HIS A 53 -5.279 -14.520 20.949 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -2.986 -15.536 21.907 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -2.689 -13.858 22.315 1.00 0.00 H new ATOM 0 HD2 HIS A 53 -3.678 -13.221 24.764 1.00 0.00 H new ATOM 0 HE1 HIS A 53 -6.709 -16.180 25.008 1.00 0.00 H new ATOM 0 HE2 HIS A 53 -5.558 -14.269 26.234 1.00 0.00 H new ATOM 797 N HIS A 54 -5.497 -12.081 20.585 1.00 0.00 N ATOM 798 CA HIS A 54 -5.682 -10.637 20.503 1.00 0.00 C ATOM 799 C HIS A 54 -6.306 -10.101 21.787 1.00 0.00 C ATOM 800 O HIS A 54 -7.483 -10.337 22.060 1.00 0.00 O ATOM 801 CB HIS A 54 -6.563 -10.283 19.303 1.00 0.00 C ATOM 802 CG HIS A 54 -6.076 -9.095 18.532 1.00 0.00 C ATOM 803 ND1 HIS A 54 -6.211 -8.980 17.164 1.00 0.00 N ATOM 804 CD2 HIS A 54 -5.451 -7.967 18.943 1.00 0.00 C ATOM 805 CE1 HIS A 54 -5.690 -7.832 16.768 1.00 0.00 C ATOM 806 NE2 HIS A 54 -5.223 -7.198 17.828 1.00 0.00 N ATOM 0 H HIS A 54 -6.352 -12.622 20.456 1.00 0.00 H new ATOM 0 HA HIS A 54 -4.704 -10.173 20.373 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -6.615 -11.143 18.635 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -7.577 -10.088 19.652 1.00 0.00 H new ATOM 0 HD1 HIS A 54 -6.645 -9.673 16.554 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -5.182 -7.718 19.959 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -5.653 -7.473 15.750 1.00 0.00 H new ATOM 815 N LEU A 55 -5.510 -9.387 22.576 1.00 0.00 N ATOM 816 CA LEU A 55 -5.986 -8.828 23.836 1.00 0.00 C ATOM 817 C LEU A 55 -5.895 -7.305 23.838 1.00 0.00 C ATOM 818 O LEU A 55 -4.862 -6.733 23.493 1.00 0.00 O ATOM 819 CB LEU A 55 -5.178 -9.398 25.004 1.00 0.00 C ATOM 820 CG LEU A 55 -5.560 -10.819 25.428 1.00 0.00 C ATOM 821 CD1 LEU A 55 -4.879 -11.181 26.736 1.00 0.00 C ATOM 822 CD2 LEU A 55 -7.069 -10.958 25.562 1.00 0.00 C ATOM 0 H LEU A 55 -4.533 -9.182 22.365 1.00 0.00 H new ATOM 0 HA LEU A 55 -7.034 -9.106 23.950 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -4.122 -9.388 24.734 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -5.294 -8.736 25.862 1.00 0.00 H new ATOM 0 HG LEU A 55 -5.222 -11.508 24.654 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -5.160 -12.194 27.024 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -3.798 -11.126 26.610 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -5.190 -10.483 27.513 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.315 -11.976 25.864 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -7.433 -10.258 26.314 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -7.541 -10.740 24.604 1.00 0.00 H new ATOM 834 N VAL A 56 -6.983 -6.655 24.244 1.00 0.00 N ATOM 835 CA VAL A 56 -7.027 -5.201 24.308 1.00 0.00 C ATOM 836 C VAL A 56 -7.115 -4.743 25.758 1.00 0.00 C ATOM 837 O VAL A 56 -7.913 -5.263 26.541 1.00 0.00 O ATOM 838 CB VAL A 56 -8.215 -4.628 23.508 1.00 0.00 C ATOM 839 CG1 VAL A 56 -9.535 -5.188 24.017 1.00 0.00 C ATOM 840 CG2 VAL A 56 -8.215 -3.105 23.562 1.00 0.00 C ATOM 0 H VAL A 56 -7.846 -7.115 24.533 1.00 0.00 H new ATOM 0 HA VAL A 56 -6.108 -4.825 23.859 1.00 0.00 H new ATOM 0 HB VAL A 56 -8.101 -4.932 22.468 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -10.356 -4.768 23.436 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -9.534 -6.273 23.913 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -9.661 -4.924 25.067 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -9.061 -2.721 22.992 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -8.298 -2.778 24.598 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -7.287 -2.726 23.135 1.00 0.00 H new ATOM 850 N LEU A 57 -6.274 -3.785 26.116 1.00 0.00 N ATOM 851 CA LEU A 57 -6.238 -3.277 27.482 1.00 0.00 C ATOM 852 C LEU A 57 -5.952 -1.777 27.512 1.00 0.00 C ATOM 853 O LEU A 57 -5.382 -1.225 26.573 1.00 0.00 O ATOM 854 CB LEU A 57 -5.169 -4.036 28.275 1.00 0.00 C ATOM 855 CG LEU A 57 -4.889 -3.512 29.685 1.00 0.00 C ATOM 856 CD1 LEU A 57 -4.576 -4.662 30.630 1.00 0.00 C ATOM 857 CD2 LEU A 57 -3.744 -2.511 29.667 1.00 0.00 C ATOM 0 H LEU A 57 -5.608 -3.343 25.482 1.00 0.00 H new ATOM 0 HA LEU A 57 -7.216 -3.434 27.937 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -5.472 -5.080 28.349 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -4.238 -4.014 27.708 1.00 0.00 H new ATOM 0 HG LEU A 57 -5.784 -3.004 30.045 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -4.380 -4.270 31.628 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -5.426 -5.343 30.669 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.697 -5.199 30.272 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -3.560 -2.150 30.679 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -2.845 -2.994 29.285 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -4.005 -1.671 29.024 1.00 0.00 H new ATOM 869 N GLU A 58 -6.346 -1.126 28.603 1.00 0.00 N ATOM 870 CA GLU A 58 -6.123 0.307 28.765 1.00 0.00 C ATOM 871 C GLU A 58 -4.745 0.562 29.366 1.00 0.00 C ATOM 872 O GLU A 58 -4.480 0.184 30.509 1.00 0.00 O ATOM 873 CB GLU A 58 -7.200 0.921 29.661 1.00 0.00 C ATOM 874 CG GLU A 58 -8.608 0.453 29.338 1.00 0.00 C ATOM 875 CD GLU A 58 -9.669 1.220 30.103 1.00 0.00 C ATOM 876 OE1 GLU A 58 -9.435 2.408 30.412 1.00 0.00 O ATOM 877 OE2 GLU A 58 -10.732 0.633 30.394 1.00 0.00 O1- ATOM 0 H GLU A 58 -6.822 -1.569 29.389 1.00 0.00 H new ATOM 0 HA GLU A 58 -6.176 0.775 27.782 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -6.976 0.679 30.700 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -7.159 2.006 29.571 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -8.787 0.563 28.268 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -8.696 -0.609 29.569 1.00 0.00 H new ATOM 884 N VAL A 59 -3.873 1.197 28.587 1.00 0.00 N ATOM 885 CA VAL A 59 -2.517 1.496 29.039 1.00 0.00 C ATOM 886 C VAL A 59 -2.281 2.991 29.158 1.00 0.00 C ATOM 887 O VAL A 59 -2.980 3.796 28.546 1.00 0.00 O ATOM 888 CB VAL A 59 -1.457 0.933 28.077 1.00 0.00 C ATOM 889 CG1 VAL A 59 -1.299 -0.563 28.264 1.00 0.00 C ATOM 890 CG2 VAL A 59 -1.808 1.275 26.638 1.00 0.00 C ATOM 0 H VAL A 59 -4.081 1.514 27.640 1.00 0.00 H new ATOM 0 HA VAL A 59 -2.421 1.024 30.017 1.00 0.00 H new ATOM 0 HB VAL A 59 -0.499 1.398 28.309 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -0.544 -0.938 27.573 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -0.989 -0.771 29.288 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -2.250 -1.057 28.066 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -1.047 0.869 25.972 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -2.777 0.844 26.388 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -1.852 2.358 26.522 1.00 0.00 H new ATOM 900 N LEU A 60 -1.272 3.350 29.938 1.00 0.00 N ATOM 901 CA LEU A 60 -0.911 4.737 30.131 1.00 0.00 C ATOM 902 C LEU A 60 0.389 5.052 29.401 1.00 0.00 C ATOM 903 O LEU A 60 1.430 4.444 29.669 1.00 0.00 O ATOM 904 CB LEU A 60 -0.771 5.032 31.621 1.00 0.00 C ATOM 905 CG LEU A 60 -1.863 5.917 32.201 1.00 0.00 C ATOM 906 CD1 LEU A 60 -2.201 5.480 33.615 1.00 0.00 C ATOM 907 CD2 LEU A 60 -1.441 7.377 32.172 1.00 0.00 C ATOM 0 H LEU A 60 -0.687 2.689 30.450 1.00 0.00 H new ATOM 0 HA LEU A 60 -1.697 5.369 29.719 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.761 4.087 32.165 1.00 0.00 H new ATOM 0 HB3 LEU A 60 0.194 5.509 31.794 1.00 0.00 H new ATOM 0 HG LEU A 60 -2.757 5.812 31.587 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.984 6.123 34.017 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -2.550 4.447 33.603 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.312 5.556 34.241 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -2.236 7.994 32.591 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -0.533 7.505 32.761 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -1.251 7.680 31.142 1.00 0.00 H new ATOM 919 N ASP A 61 0.314 5.999 28.473 1.00 0.00 N ATOM 920 CA ASP A 61 1.472 6.407 27.689 1.00 0.00 C ATOM 921 C ASP A 61 1.933 7.803 28.096 1.00 0.00 C ATOM 922 O ASP A 61 1.283 8.799 27.779 1.00 0.00 O ATOM 923 CB ASP A 61 1.134 6.389 26.200 1.00 0.00 C ATOM 924 CG ASP A 61 2.370 6.446 25.323 1.00 0.00 C ATOM 925 OD1 ASP A 61 3.329 7.151 25.696 1.00 0.00 O ATOM 926 OD2 ASP A 61 2.378 5.783 24.264 1.00 0.00 O1- ATOM 0 H ASP A 61 -0.544 6.501 28.245 1.00 0.00 H new ATOM 0 HA ASP A 61 2.280 5.702 27.882 1.00 0.00 H new ATOM 0 HB2 ASP A 61 0.570 5.485 25.970 1.00 0.00 H new ATOM 0 HB3 ASP A 61 0.488 7.235 25.967 1.00 0.00 H new ATOM 931 N ALA A 62 3.059 7.868 28.797 1.00 0.00 N ATOM 932 CA ALA A 62 3.612 9.135 29.244 1.00 0.00 C ATOM 933 C ALA A 62 2.628 9.903 30.125 1.00 0.00 C ATOM 934 O ALA A 62 2.773 11.111 30.321 1.00 0.00 O ATOM 935 CB ALA A 62 4.027 9.974 28.049 1.00 0.00 C ATOM 0 H ALA A 62 3.607 7.052 29.068 1.00 0.00 H new ATOM 0 HA ALA A 62 4.492 8.920 29.851 1.00 0.00 H new ATOM 0 HB1 ALA A 62 4.440 10.921 28.395 1.00 0.00 H new ATOM 0 HB2 ALA A 62 4.781 9.438 27.473 1.00 0.00 H new ATOM 0 HB3 ALA A 62 3.158 10.166 27.420 1.00 0.00 H new ATOM 941 N GLY A 63 1.635 9.202 30.662 1.00 0.00 N ATOM 942 CA GLY A 63 0.655 9.842 31.520 1.00 0.00 C ATOM 943 C GLY A 63 -0.694 10.026 30.851 1.00 0.00 C ATOM 944 O GLY A 63 -1.524 10.803 31.324 1.00 0.00 O ATOM 0 H GLY A 63 1.491 8.202 30.518 1.00 0.00 H new ATOM 0 HA2 GLY A 63 0.527 9.245 32.423 1.00 0.00 H new ATOM 0 HA3 GLY A 63 1.035 10.815 31.832 1.00 0.00 H new ATOM 948 N LYS A 64 -0.920 9.314 29.751 1.00 0.00 N ATOM 949 CA LYS A 64 -2.182 9.413 29.027 1.00 0.00 C ATOM 950 C LYS A 64 -2.736 8.031 28.722 1.00 0.00 C ATOM 951 O LYS A 64 -2.098 7.229 28.042 1.00 0.00 O ATOM 952 CB LYS A 64 -1.989 10.205 27.732 1.00 0.00 C ATOM 953 CG LYS A 64 -2.530 11.624 27.801 1.00 0.00 C ATOM 954 CD LYS A 64 -3.923 11.717 27.200 1.00 0.00 C ATOM 955 CE LYS A 64 -4.997 11.693 28.276 1.00 0.00 C ATOM 956 NZ LYS A 64 -5.584 10.334 28.444 1.00 0.00 N1+ ATOM 0 H LYS A 64 -0.248 8.664 29.343 1.00 0.00 H new ATOM 0 HA LYS A 64 -2.899 9.939 29.657 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -0.926 10.241 27.493 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -2.481 9.676 26.916 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -2.557 11.954 28.839 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -1.857 12.298 27.270 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -4.009 12.635 26.619 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -4.079 10.888 26.510 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -4.570 12.024 29.223 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -5.786 12.400 28.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -6.573 10.341 28.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -5.041 9.649 27.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -5.549 10.062 29.447 1.00 0.00 H new ATOM 970 N LYS A 65 -3.927 7.758 29.232 1.00 0.00 N ATOM 971 CA LYS A 65 -4.565 6.480 29.024 1.00 0.00 C ATOM 972 C LYS A 65 -4.954 6.290 27.577 1.00 0.00 C ATOM 973 O LYS A 65 -5.314 7.236 26.878 1.00 0.00 O ATOM 974 CB LYS A 65 -5.793 6.355 29.909 1.00 0.00 C ATOM 975 CG LYS A 65 -6.866 7.390 29.617 1.00 0.00 C ATOM 976 CD LYS A 65 -7.576 7.831 30.887 1.00 0.00 C ATOM 977 CE LYS A 65 -8.533 6.764 31.389 1.00 0.00 C ATOM 978 NZ LYS A 65 -8.656 6.781 32.873 1.00 0.00 N1+ ATOM 0 H LYS A 65 -4.469 8.413 29.795 1.00 0.00 H new ATOM 0 HA LYS A 65 -3.849 5.703 29.289 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -6.219 5.359 29.786 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -5.489 6.445 30.952 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -6.415 8.256 29.132 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -7.592 6.975 28.918 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -6.839 8.052 31.659 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -8.125 8.753 30.697 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -9.515 6.918 30.942 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -8.185 5.783 31.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -9.318 6.038 33.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -7.724 6.609 33.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -9.012 7.708 33.181 1.00 0.00 H new ATOM 992 N LYS A 66 -4.880 5.051 27.146 1.00 0.00 N ATOM 993 CA LYS A 66 -5.225 4.697 25.784 1.00 0.00 C ATOM 994 C LYS A 66 -5.357 3.185 25.646 1.00 0.00 C ATOM 995 O LYS A 66 -4.581 2.434 26.237 1.00 0.00 O ATOM 996 CB LYS A 66 -4.168 5.223 24.811 1.00 0.00 C ATOM 997 CG LYS A 66 -4.620 5.214 23.359 1.00 0.00 C ATOM 998 CD LYS A 66 -5.171 6.567 22.938 1.00 0.00 C ATOM 999 CE LYS A 66 -6.685 6.611 23.050 1.00 0.00 C ATOM 1000 NZ LYS A 66 -7.348 6.294 21.754 1.00 0.00 N1+ ATOM 0 H LYS A 66 -4.582 4.264 27.723 1.00 0.00 H new ATOM 0 HA LYS A 66 -6.183 5.156 25.541 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -3.901 6.241 25.093 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -3.266 4.619 24.906 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -3.781 4.946 22.717 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -5.384 4.449 23.220 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -4.736 7.348 23.562 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -4.875 6.778 21.910 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -7.014 5.901 23.809 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -6.996 7.601 23.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -8.268 5.844 21.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -7.492 7.171 21.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -6.747 5.645 21.206 1.00 0.00 H new ATOM 1014 N LEU A 67 -6.333 2.737 24.867 1.00 0.00 N ATOM 1015 CA LEU A 67 -6.539 1.308 24.668 1.00 0.00 C ATOM 1016 C LEU A 67 -5.637 0.781 23.560 1.00 0.00 C ATOM 1017 O LEU A 67 -5.611 1.323 22.455 1.00 0.00 O ATOM 1018 CB LEU A 67 -8.003 1.009 24.334 1.00 0.00 C ATOM 1019 CG LEU A 67 -9.044 1.886 25.042 1.00 0.00 C ATOM 1020 CD1 LEU A 67 -10.396 1.190 25.057 1.00 0.00 C ATOM 1021 CD2 LEU A 67 -8.601 2.221 26.460 1.00 0.00 C ATOM 0 H LEU A 67 -6.989 3.336 24.366 1.00 0.00 H new ATOM 0 HA LEU A 67 -6.283 0.803 25.599 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -8.139 1.115 23.258 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -8.206 -0.033 24.580 1.00 0.00 H new ATOM 0 HG LEU A 67 -9.137 2.820 24.488 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -11.125 1.823 25.562 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -10.722 1.006 24.033 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -10.311 0.241 25.586 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -9.356 2.843 26.940 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -8.475 1.300 27.029 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -7.654 2.760 26.428 1.00 0.00 H new ATOM 1033 N TYR A 68 -4.901 -0.282 23.863 1.00 0.00 N ATOM 1034 CA TYR A 68 -3.998 -0.888 22.893 1.00 0.00 C ATOM 1035 C TYR A 68 -4.313 -2.371 22.721 1.00 0.00 C ATOM 1036 O TYR A 68 -4.793 -3.027 23.649 1.00 0.00 O ATOM 1037 CB TYR A 68 -2.539 -0.688 23.325 1.00 0.00 C ATOM 1038 CG TYR A 68 -2.033 -1.721 24.310 1.00 0.00 C ATOM 1039 CD1 TYR A 68 -2.601 -1.847 25.570 1.00 0.00 C ATOM 1040 CD2 TYR A 68 -0.990 -2.572 23.976 1.00 0.00 C ATOM 1041 CE1 TYR A 68 -2.145 -2.791 26.468 1.00 0.00 C ATOM 1042 CE2 TYR A 68 -0.525 -3.519 24.868 1.00 0.00 C ATOM 1043 CZ TYR A 68 -1.106 -3.625 26.112 1.00 0.00 C ATOM 1044 OH TYR A 68 -0.648 -4.567 27.004 1.00 0.00 O ATOM 0 H TYR A 68 -4.912 -0.742 24.773 1.00 0.00 H new ATOM 0 HA TYR A 68 -4.142 -0.397 21.931 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -1.904 -0.707 22.439 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -2.437 0.302 23.770 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -3.414 -1.195 25.853 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -0.533 -2.493 23.001 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -2.599 -2.876 27.444 1.00 0.00 H new ATOM 0 HE2 TYR A 68 0.289 -4.172 24.591 1.00 0.00 H new ATOM 0 HH TYR A 68 -0.777 -4.241 27.919 1.00 0.00 H new ATOM 1054 N GLU A 69 -4.044 -2.894 21.529 1.00 0.00 N ATOM 1055 CA GLU A 69 -4.302 -4.299 21.236 1.00 0.00 C ATOM 1056 C GLU A 69 -2.999 -5.057 21.014 1.00 0.00 C ATOM 1057 O GLU A 69 -2.124 -4.604 20.277 1.00 0.00 O ATOM 1058 CB GLU A 69 -5.198 -4.428 20.002 1.00 0.00 C ATOM 1059 CG GLU A 69 -6.682 -4.442 20.326 1.00 0.00 C ATOM 1060 CD GLU A 69 -7.551 -4.490 19.084 1.00 0.00 C ATOM 1061 OE1 GLU A 69 -7.045 -4.152 17.993 1.00 0.00 O1- ATOM 1062 OE2 GLU A 69 -8.735 -4.865 19.201 1.00 0.00 O ATOM 0 H GLU A 69 -3.648 -2.366 20.751 1.00 0.00 H new ATOM 0 HA GLU A 69 -4.813 -4.735 22.095 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -4.990 -3.600 19.325 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -4.942 -5.345 19.472 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -6.905 -5.305 20.954 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -6.932 -3.553 20.905 1.00 0.00 H new ATOM 1069 N ALA A 70 -2.877 -6.212 21.656 1.00 0.00 N ATOM 1070 CA ALA A 70 -1.683 -7.036 21.530 1.00 0.00 C ATOM 1071 C ALA A 70 -2.010 -8.379 20.895 1.00 0.00 C ATOM 1072 O ALA A 70 -3.005 -9.015 21.241 1.00 0.00 O ATOM 1073 CB ALA A 70 -1.034 -7.238 22.892 1.00 0.00 C ATOM 0 H ALA A 70 -3.593 -6.600 22.271 1.00 0.00 H new ATOM 0 HA ALA A 70 -0.980 -6.517 20.879 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -0.143 -7.856 22.782 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -0.756 -6.270 23.310 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -1.738 -7.733 23.561 1.00 0.00 H new ATOM 1079 N LYS A 71 -1.165 -8.808 19.964 1.00 0.00 N ATOM 1080 CA LYS A 71 -1.366 -10.079 19.283 1.00 0.00 C ATOM 1081 C LYS A 71 -0.255 -11.060 19.629 1.00 0.00 C ATOM 1082 O LYS A 71 0.928 -10.727 19.556 1.00 0.00 O ATOM 1083 CB LYS A 71 -1.426 -9.880 17.769 1.00 0.00 C ATOM 1084 CG LYS A 71 -0.540 -8.758 17.271 1.00 0.00 C ATOM 1085 CD LYS A 71 -0.653 -8.578 15.766 1.00 0.00 C ATOM 1086 CE LYS A 71 -1.998 -7.988 15.376 1.00 0.00 C ATOM 1087 NZ LYS A 71 -2.517 -8.575 14.110 1.00 0.00 N1+ ATOM 0 H LYS A 71 -0.336 -8.294 19.665 1.00 0.00 H new ATOM 0 HA LYS A 71 -2.317 -10.490 19.622 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -1.135 -10.808 17.277 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -2.456 -9.675 17.478 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -0.814 -7.829 17.770 1.00 0.00 H new ATOM 0 HG3 LYS A 71 0.496 -8.968 17.536 1.00 0.00 H new ATOM 0 HD2 LYS A 71 0.147 -7.926 15.415 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -0.520 -9.541 15.272 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -2.716 -8.161 16.177 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -1.901 -6.908 15.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -3.436 -8.146 13.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -1.844 -8.388 13.339 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -2.634 -9.602 14.226 1.00 0.00 H new ATOM 1101 N ILE A 72 -0.645 -12.271 19.998 1.00 0.00 N ATOM 1102 CA ILE A 72 0.314 -13.308 20.349 1.00 0.00 C ATOM 1103 C ILE A 72 0.194 -14.487 19.393 1.00 0.00 C ATOM 1104 O ILE A 72 -0.892 -15.027 19.185 1.00 0.00 O ATOM 1105 CB ILE A 72 0.123 -13.782 21.803 1.00 0.00 C ATOM 1106 CG1 ILE A 72 0.254 -12.593 22.757 1.00 0.00 C ATOM 1107 CG2 ILE A 72 1.135 -14.864 22.158 1.00 0.00 C ATOM 1108 CD1 ILE A 72 -0.254 -12.870 24.154 1.00 0.00 C ATOM 0 H ILE A 72 -1.621 -12.560 20.062 1.00 0.00 H new ATOM 0 HA ILE A 72 1.313 -12.880 20.263 1.00 0.00 H new ATOM 0 HB ILE A 72 -0.875 -14.210 21.902 1.00 0.00 H new ATOM 0 HG12 ILE A 72 1.302 -12.299 22.814 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -0.293 -11.746 22.343 1.00 0.00 H new ATOM 0 HG21 ILE A 72 0.980 -15.183 23.189 1.00 0.00 H new ATOM 0 HG22 ILE A 72 1.005 -15.717 21.491 1.00 0.00 H new ATOM 0 HG23 ILE A 72 2.145 -14.468 22.048 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -0.127 -11.980 24.770 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -1.311 -13.134 24.111 1.00 0.00 H new ATOM 0 HD13 ILE A 72 0.309 -13.696 24.589 1.00 0.00 H new ATOM 1120 N TRP A 73 1.318 -14.864 18.798 1.00 0.00 N ATOM 1121 CA TRP A 73 1.352 -15.961 17.840 1.00 0.00 C ATOM 1122 C TRP A 73 1.762 -17.267 18.517 1.00 0.00 C ATOM 1123 O TRP A 73 2.901 -17.417 18.959 1.00 0.00 O ATOM 1124 CB TRP A 73 2.347 -15.634 16.722 1.00 0.00 C ATOM 1125 CG TRP A 73 1.717 -15.242 15.419 1.00 0.00 C ATOM 1126 CD1 TRP A 73 2.099 -15.660 14.179 1.00 0.00 C ATOM 1127 CD2 TRP A 73 0.614 -14.348 15.219 1.00 0.00 C ATOM 1128 NE1 TRP A 73 1.301 -15.090 13.219 1.00 0.00 N ATOM 1129 CE2 TRP A 73 0.382 -14.280 13.830 1.00 0.00 C ATOM 1130 CE3 TRP A 73 -0.201 -13.601 16.073 1.00 0.00 C ATOM 1131 CZ2 TRP A 73 -0.628 -13.497 13.281 1.00 0.00 C ATOM 1132 CZ3 TRP A 73 -1.204 -12.823 15.525 1.00 0.00 C ATOM 1133 CH2 TRP A 73 -1.409 -12.777 14.140 1.00 0.00 C ATOM 0 H TRP A 73 2.223 -14.423 18.963 1.00 0.00 H new ATOM 0 HA TRP A 73 0.352 -16.085 17.425 1.00 0.00 H new ATOM 0 HB2 TRP A 73 2.994 -14.823 17.056 1.00 0.00 H new ATOM 0 HB3 TRP A 73 2.984 -16.503 16.555 1.00 0.00 H new ATOM 0 HD1 TRP A 73 2.913 -16.342 13.981 1.00 0.00 H new ATOM 0 HE1 TRP A 73 1.380 -15.245 12.214 1.00 0.00 H new ATOM 0 HE3 TRP A 73 -0.050 -13.631 17.142 1.00 0.00 H new ATOM 0 HZ2 TRP A 73 -0.789 -13.460 12.214 1.00 0.00 H new ATOM 0 HZ3 TRP A 73 -1.840 -12.241 16.176 1.00 0.00 H new ATOM 0 HH2 TRP A 73 -2.201 -12.159 13.743 1.00 0.00 H new ATOM 1144 N VAL A 74 0.832 -18.212 18.584 1.00 0.00 N ATOM 1145 CA VAL A 74 1.104 -19.507 19.195 1.00 0.00 C ATOM 1146 C VAL A 74 0.667 -20.642 18.271 1.00 0.00 C ATOM 1147 O VAL A 74 -0.196 -20.458 17.413 1.00 0.00 O ATOM 1148 CB VAL A 74 0.405 -19.643 20.569 1.00 0.00 C ATOM 1149 CG1 VAL A 74 -0.999 -19.063 20.519 1.00 0.00 C ATOM 1150 CG2 VAL A 74 0.376 -21.095 21.032 1.00 0.00 C ATOM 0 H VAL A 74 -0.116 -18.106 18.223 1.00 0.00 H new ATOM 0 HA VAL A 74 2.180 -19.574 19.354 1.00 0.00 H new ATOM 0 HB VAL A 74 0.984 -19.074 21.296 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -1.472 -19.169 21.495 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -0.947 -18.007 20.254 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.587 -19.596 19.772 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -0.121 -21.158 22.000 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -0.168 -21.698 20.305 1.00 0.00 H new ATOM 0 HG23 VAL A 74 1.396 -21.468 21.123 1.00 0.00 H new ATOM 1160 N LYS A 75 1.271 -21.813 18.448 1.00 0.00 N ATOM 1161 CA LYS A 75 0.944 -22.973 17.627 1.00 0.00 C ATOM 1162 C LYS A 75 0.677 -24.200 18.499 1.00 0.00 C ATOM 1163 O LYS A 75 1.477 -24.532 19.374 1.00 0.00 O ATOM 1164 CB LYS A 75 2.082 -23.267 16.647 1.00 0.00 C ATOM 1165 CG LYS A 75 1.604 -23.751 15.288 1.00 0.00 C ATOM 1166 CD LYS A 75 2.564 -24.765 14.688 1.00 0.00 C ATOM 1167 CE LYS A 75 3.707 -24.083 13.954 1.00 0.00 C ATOM 1168 NZ LYS A 75 4.897 -23.895 14.829 1.00 0.00 N1+ ATOM 0 H LYS A 75 1.989 -21.983 19.152 1.00 0.00 H new ATOM 0 HA LYS A 75 0.039 -22.746 17.064 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.677 -22.364 16.513 1.00 0.00 H new ATOM 0 HB3 LYS A 75 2.739 -24.020 17.081 1.00 0.00 H new ATOM 0 HG2 LYS A 75 0.615 -24.199 15.387 1.00 0.00 H new ATOM 0 HG3 LYS A 75 1.502 -22.901 14.613 1.00 0.00 H new ATOM 0 HD2 LYS A 75 2.965 -25.400 15.478 1.00 0.00 H new ATOM 0 HD3 LYS A 75 2.025 -25.415 13.999 1.00 0.00 H new ATOM 0 HE2 LYS A 75 3.986 -24.678 13.085 1.00 0.00 H new ATOM 0 HE3 LYS A 75 3.373 -23.114 13.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 5.635 -23.381 14.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 4.626 -23.349 15.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 5.263 -24.823 15.122 1.00 0.00 H new ATOM 1182 N PRO A 76 -0.454 -24.895 18.274 1.00 0.00 N ATOM 1183 CA PRO A 76 -0.812 -26.088 19.049 1.00 0.00 C ATOM 1184 C PRO A 76 0.293 -27.139 19.036 1.00 0.00 C ATOM 1185 O PRO A 76 0.776 -27.560 20.088 1.00 0.00 O ATOM 1186 CB PRO A 76 -2.060 -26.619 18.339 1.00 0.00 C ATOM 1187 CG PRO A 76 -2.639 -25.434 17.647 1.00 0.00 C ATOM 1188 CD PRO A 76 -1.470 -24.576 17.253 1.00 0.00 C ATOM 0 HA PRO A 76 -0.973 -25.854 20.101 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -1.806 -27.406 17.629 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -2.767 -27.046 19.050 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -3.215 -25.735 16.772 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -3.318 -24.891 18.304 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -1.119 -24.812 16.249 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -1.728 -23.517 17.260 1.00 0.00 H new ATOM 1196 N TRP A 77 0.688 -27.560 17.838 1.00 0.00 N ATOM 1197 CA TRP A 77 1.736 -28.563 17.687 1.00 0.00 C ATOM 1198 C TRP A 77 3.038 -28.093 18.327 1.00 0.00 C ATOM 1199 O TRP A 77 3.681 -28.835 19.068 1.00 0.00 O ATOM 1200 CB TRP A 77 1.964 -28.872 16.207 1.00 0.00 C ATOM 1201 CG TRP A 77 1.109 -29.992 15.695 1.00 0.00 C ATOM 1202 CD1 TRP A 77 0.218 -29.936 14.663 1.00 0.00 C ATOM 1203 CD2 TRP A 77 1.064 -31.334 16.194 1.00 0.00 C ATOM 1204 NE1 TRP A 77 -0.378 -31.162 14.488 1.00 0.00 N ATOM 1205 CE2 TRP A 77 0.124 -32.036 15.416 1.00 0.00 C ATOM 1206 CE3 TRP A 77 1.728 -32.009 17.222 1.00 0.00 C ATOM 1207 CZ2 TRP A 77 -0.168 -33.380 15.636 1.00 0.00 C ATOM 1208 CZ3 TRP A 77 1.436 -33.343 17.439 1.00 0.00 C ATOM 1209 CH2 TRP A 77 0.496 -34.016 16.648 1.00 0.00 C ATOM 0 H TRP A 77 0.298 -27.222 16.958 1.00 0.00 H new ATOM 0 HA TRP A 77 1.411 -29.471 18.196 1.00 0.00 H new ATOM 0 HB2 TRP A 77 1.764 -27.975 15.621 1.00 0.00 H new ATOM 0 HB3 TRP A 77 3.013 -29.126 16.054 1.00 0.00 H new ATOM 0 HD1 TRP A 77 0.011 -29.057 14.070 1.00 0.00 H new ATOM 0 HE1 TRP A 77 -1.080 -31.385 13.782 1.00 0.00 H new ATOM 0 HE3 TRP A 77 2.456 -31.498 17.835 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 -0.893 -33.901 15.029 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 1.941 -33.875 18.232 1.00 0.00 H new ATOM 0 HH2 TRP A 77 0.292 -35.059 16.841 1.00 0.00 H new ATOM 1220 N MET A 78 3.423 -26.854 18.033 1.00 0.00 N ATOM 1221 CA MET A 78 4.649 -26.285 18.580 1.00 0.00 C ATOM 1222 C MET A 78 4.608 -26.266 20.105 1.00 0.00 C ATOM 1223 O MET A 78 5.633 -26.437 20.764 1.00 0.00 O ATOM 1224 CB MET A 78 4.861 -24.867 18.045 1.00 0.00 C ATOM 1225 CG MET A 78 6.297 -24.383 18.158 1.00 0.00 C ATOM 1226 SD MET A 78 6.413 -22.597 18.380 1.00 0.00 S ATOM 1227 CE MET A 78 8.086 -22.441 19.000 1.00 0.00 C ATOM 0 H MET A 78 2.904 -26.226 17.420 1.00 0.00 H new ATOM 0 HA MET A 78 5.483 -26.913 18.266 1.00 0.00 H new ATOM 0 HB2 MET A 78 4.556 -24.833 16.999 1.00 0.00 H new ATOM 0 HB3 MET A 78 4.211 -24.181 18.589 1.00 0.00 H new ATOM 0 HG2 MET A 78 6.779 -24.882 18.999 1.00 0.00 H new ATOM 0 HG3 MET A 78 6.845 -24.670 17.260 1.00 0.00 H new ATOM 0 HE1 MET A 78 8.197 -21.485 19.512 1.00 0.00 H new ATOM 0 HE2 MET A 78 8.292 -23.252 19.698 1.00 0.00 H new ATOM 0 HE3 MET A 78 8.788 -22.491 18.168 1.00 0.00 H new ATOM 1237 N ASP A 79 3.418 -26.056 20.656 1.00 0.00 N ATOM 1238 CA ASP A 79 3.244 -26.016 22.104 1.00 0.00 C ATOM 1239 C ASP A 79 4.093 -24.908 22.723 1.00 0.00 C ATOM 1240 O ASP A 79 4.542 -25.022 23.864 1.00 0.00 O ATOM 1241 CB ASP A 79 3.612 -27.368 22.719 1.00 0.00 C ATOM 1242 CG ASP A 79 2.390 -28.182 23.098 1.00 0.00 C ATOM 1243 OD1 ASP A 79 1.833 -27.943 24.191 1.00 0.00 O ATOM 1244 OD2 ASP A 79 1.988 -29.057 22.302 1.00 0.00 O1- ATOM 0 H ASP A 79 2.560 -25.911 20.123 1.00 0.00 H new ATOM 0 HA ASP A 79 2.196 -25.804 22.316 1.00 0.00 H new ATOM 0 HB2 ASP A 79 4.217 -27.934 22.010 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.226 -27.206 23.605 1.00 0.00 H new ATOM 1249 N PHE A 80 4.308 -23.840 21.963 1.00 0.00 N ATOM 1250 CA PHE A 80 5.103 -22.713 22.437 1.00 0.00 C ATOM 1251 C PHE A 80 4.494 -21.389 21.988 1.00 0.00 C ATOM 1252 O PHE A 80 4.578 -21.022 20.816 1.00 0.00 O ATOM 1253 CB PHE A 80 6.540 -22.826 21.928 1.00 0.00 C ATOM 1254 CG PHE A 80 7.567 -22.356 22.918 1.00 0.00 C ATOM 1255 CD1 PHE A 80 7.823 -23.084 24.069 1.00 0.00 C ATOM 1256 CD2 PHE A 80 8.277 -21.186 22.697 1.00 0.00 C ATOM 1257 CE1 PHE A 80 8.767 -22.653 24.981 1.00 0.00 C ATOM 1258 CE2 PHE A 80 9.222 -20.751 23.606 1.00 0.00 C ATOM 1259 CZ PHE A 80 9.468 -21.485 24.750 1.00 0.00 C ATOM 0 H PHE A 80 3.943 -23.731 21.017 1.00 0.00 H new ATOM 0 HA PHE A 80 5.108 -22.738 23.527 1.00 0.00 H new ATOM 0 HB2 PHE A 80 6.745 -23.865 21.670 1.00 0.00 H new ATOM 0 HB3 PHE A 80 6.639 -22.245 21.011 1.00 0.00 H new ATOM 0 HD1 PHE A 80 7.279 -23.998 24.255 1.00 0.00 H new ATOM 0 HD2 PHE A 80 8.089 -20.608 21.804 1.00 0.00 H new ATOM 0 HE1 PHE A 80 8.957 -23.229 25.875 1.00 0.00 H new ATOM 0 HE2 PHE A 80 9.768 -19.838 23.422 1.00 0.00 H new ATOM 0 HZ PHE A 80 10.206 -21.147 25.462 1.00 0.00 H new ATOM 1269 N LYS A 81 3.882 -20.676 22.927 1.00 0.00 N ATOM 1270 CA LYS A 81 3.260 -19.392 22.628 1.00 0.00 C ATOM 1271 C LYS A 81 4.294 -18.270 22.657 1.00 0.00 C ATOM 1272 O LYS A 81 5.234 -18.300 23.452 1.00 0.00 O ATOM 1273 CB LYS A 81 2.135 -19.103 23.630 1.00 0.00 C ATOM 1274 CG LYS A 81 1.554 -17.702 23.517 1.00 0.00 C ATOM 1275 CD LYS A 81 0.362 -17.519 24.443 1.00 0.00 C ATOM 1276 CE LYS A 81 0.802 -17.208 25.866 1.00 0.00 C ATOM 1277 NZ LYS A 81 -0.021 -17.933 26.873 1.00 0.00 N1+ ATOM 0 H LYS A 81 3.803 -20.966 23.902 1.00 0.00 H new ATOM 0 HA LYS A 81 2.836 -19.441 21.625 1.00 0.00 H new ATOM 0 HB2 LYS A 81 1.336 -19.830 23.484 1.00 0.00 H new ATOM 0 HB3 LYS A 81 2.516 -19.247 24.641 1.00 0.00 H new ATOM 0 HG2 LYS A 81 2.322 -16.967 23.760 1.00 0.00 H new ATOM 0 HG3 LYS A 81 1.249 -17.515 22.487 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -0.268 -16.711 24.071 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -0.245 -18.424 24.439 1.00 0.00 H new ATOM 0 HE2 LYS A 81 1.850 -17.481 25.990 1.00 0.00 H new ATOM 0 HE3 LYS A 81 0.729 -16.135 26.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 0.242 -17.618 27.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -1.028 -17.733 26.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 0.147 -18.956 26.788 1.00 0.00 H new ATOM 1291 N GLN A 82 4.115 -17.284 21.784 1.00 0.00 N ATOM 1292 CA GLN A 82 5.035 -16.155 21.711 1.00 0.00 C ATOM 1293 C GLN A 82 4.313 -14.887 21.267 1.00 0.00 C ATOM 1294 O GLN A 82 3.648 -14.867 20.230 1.00 0.00 O ATOM 1295 CB GLN A 82 6.182 -16.466 20.746 1.00 0.00 C ATOM 1296 CG GLN A 82 7.343 -15.491 20.846 1.00 0.00 C ATOM 1297 CD GLN A 82 8.474 -15.834 19.897 1.00 0.00 C ATOM 1298 OE1 GLN A 82 8.372 -16.769 19.103 1.00 0.00 O ATOM 1299 NE2 GLN A 82 9.562 -15.074 19.975 1.00 0.00 N ATOM 0 H GLN A 82 3.343 -17.244 21.119 1.00 0.00 H new ATOM 0 HA GLN A 82 5.441 -15.988 22.708 1.00 0.00 H new ATOM 0 HB2 GLN A 82 6.547 -17.474 20.942 1.00 0.00 H new ATOM 0 HB3 GLN A 82 5.799 -16.459 19.725 1.00 0.00 H new ATOM 0 HG2 GLN A 82 6.986 -14.484 20.632 1.00 0.00 H new ATOM 0 HG3 GLN A 82 7.721 -15.485 21.868 1.00 0.00 H new ATOM 0 HE21 GLN A 82 9.603 -14.309 20.649 1.00 0.00 H new ATOM 0 HE22 GLN A 82 10.356 -15.256 19.361 1.00 0.00 H new ATOM 1308 N LEU A 83 4.451 -13.831 22.061 1.00 0.00 N ATOM 1309 CA LEU A 83 3.818 -12.553 21.756 1.00 0.00 C ATOM 1310 C LEU A 83 4.498 -11.882 20.568 1.00 0.00 C ATOM 1311 O LEU A 83 5.725 -11.798 20.512 1.00 0.00 O ATOM 1312 CB LEU A 83 3.865 -11.633 22.980 1.00 0.00 C ATOM 1313 CG LEU A 83 3.716 -12.342 24.332 1.00 0.00 C ATOM 1314 CD1 LEU A 83 4.979 -12.180 25.165 1.00 0.00 C ATOM 1315 CD2 LEU A 83 2.505 -11.812 25.088 1.00 0.00 C ATOM 0 H LEU A 83 4.997 -13.835 22.923 1.00 0.00 H new ATOM 0 HA LEU A 83 2.777 -12.741 21.494 1.00 0.00 H new ATOM 0 HB2 LEU A 83 4.812 -11.092 22.973 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.073 -10.890 22.888 1.00 0.00 H new ATOM 0 HG LEU A 83 3.563 -13.405 24.144 1.00 0.00 H new ATOM 0 HD11 LEU A 83 4.853 -12.690 26.120 1.00 0.00 H new ATOM 0 HD12 LEU A 83 5.825 -12.613 24.631 1.00 0.00 H new ATOM 0 HD13 LEU A 83 5.165 -11.121 25.341 1.00 0.00 H new ATOM 0 HD21 LEU A 83 2.418 -12.329 26.044 1.00 0.00 H new ATOM 0 HD22 LEU A 83 2.625 -10.743 25.263 1.00 0.00 H new ATOM 0 HD23 LEU A 83 1.604 -11.985 24.499 1.00 0.00 H new ATOM 1327 N GLN A 84 3.699 -11.412 19.614 1.00 0.00 N ATOM 1328 CA GLN A 84 4.234 -10.758 18.426 1.00 0.00 C ATOM 1329 C GLN A 84 4.440 -9.264 18.669 1.00 0.00 C ATOM 1330 O GLN A 84 5.574 -8.788 18.733 1.00 0.00 O ATOM 1331 CB GLN A 84 3.298 -10.974 17.234 1.00 0.00 C ATOM 1332 CG GLN A 84 3.508 -12.306 16.528 1.00 0.00 C ATOM 1333 CD GLN A 84 4.481 -12.209 15.372 1.00 0.00 C ATOM 1334 OE1 GLN A 84 5.362 -11.348 15.357 1.00 0.00 O ATOM 1335 NE2 GLN A 84 4.326 -13.093 14.396 1.00 0.00 N ATOM 0 H GLN A 84 2.681 -11.472 19.641 1.00 0.00 H new ATOM 0 HA GLN A 84 5.203 -11.204 18.202 1.00 0.00 H new ATOM 0 HB2 GLN A 84 2.265 -10.913 17.578 1.00 0.00 H new ATOM 0 HB3 GLN A 84 3.443 -10.166 16.517 1.00 0.00 H new ATOM 0 HG2 GLN A 84 3.876 -13.039 17.246 1.00 0.00 H new ATOM 0 HG3 GLN A 84 2.549 -12.673 16.161 1.00 0.00 H new ATOM 0 HE21 GLN A 84 3.582 -13.788 14.451 1.00 0.00 H new ATOM 0 HE22 GLN A 84 4.951 -13.078 13.590 1.00 0.00 H new ATOM 1344 N GLU A 85 3.339 -8.530 18.804 1.00 0.00 N ATOM 1345 CA GLU A 85 3.401 -7.090 19.039 1.00 0.00 C ATOM 1346 C GLU A 85 1.998 -6.504 19.194 1.00 0.00 C ATOM 1347 O GLU A 85 1.008 -7.138 18.831 1.00 0.00 O ATOM 1348 CB GLU A 85 4.134 -6.390 17.890 1.00 0.00 C ATOM 1349 CG GLU A 85 3.359 -6.386 16.582 1.00 0.00 C ATOM 1350 CD GLU A 85 4.208 -5.955 15.403 1.00 0.00 C ATOM 1351 OE1 GLU A 85 5.434 -6.191 15.436 1.00 0.00 O ATOM 1352 OE2 GLU A 85 3.647 -5.382 14.445 1.00 0.00 O1- ATOM 0 H GLU A 85 2.393 -8.908 18.755 1.00 0.00 H new ATOM 0 HA GLU A 85 3.952 -6.923 19.965 1.00 0.00 H new ATOM 0 HB2 GLU A 85 4.346 -5.361 18.180 1.00 0.00 H new ATOM 0 HB3 GLU A 85 5.094 -6.880 17.731 1.00 0.00 H new ATOM 0 HG2 GLU A 85 2.964 -7.385 16.395 1.00 0.00 H new ATOM 0 HG3 GLU A 85 2.503 -5.717 16.673 1.00 0.00 H new ATOM 1359 N PHE A 86 1.919 -5.290 19.734 1.00 0.00 N ATOM 1360 CA PHE A 86 0.633 -4.624 19.930 1.00 0.00 C ATOM 1361 C PHE A 86 0.560 -3.322 19.140 1.00 0.00 C ATOM 1362 O PHE A 86 1.570 -2.652 18.929 1.00 0.00 O ATOM 1363 CB PHE A 86 0.387 -4.338 21.414 1.00 0.00 C ATOM 1364 CG PHE A 86 1.619 -3.945 22.176 1.00 0.00 C ATOM 1365 CD1 PHE A 86 2.526 -4.907 22.586 1.00 0.00 C ATOM 1366 CD2 PHE A 86 1.870 -2.616 22.487 1.00 0.00 C ATOM 1367 CE1 PHE A 86 3.659 -4.555 23.292 1.00 0.00 C ATOM 1368 CE2 PHE A 86 3.000 -2.259 23.193 1.00 0.00 C ATOM 1369 CZ PHE A 86 3.895 -3.228 23.597 1.00 0.00 C ATOM 0 H PHE A 86 2.727 -4.749 20.043 1.00 0.00 H new ATOM 0 HA PHE A 86 -0.141 -5.299 19.565 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -0.351 -3.541 21.502 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -0.046 -5.225 21.877 1.00 0.00 H new ATOM 0 HD1 PHE A 86 2.345 -5.945 22.351 1.00 0.00 H new ATOM 0 HD2 PHE A 86 1.173 -1.853 22.173 1.00 0.00 H new ATOM 0 HE1 PHE A 86 4.359 -5.315 23.605 1.00 0.00 H new ATOM 0 HE2 PHE A 86 3.184 -1.221 23.429 1.00 0.00 H new ATOM 0 HZ PHE A 86 4.779 -2.950 24.151 1.00 0.00 H new ATOM 1379 N LYS A 87 -0.648 -2.969 18.709 1.00 0.00 N ATOM 1380 CA LYS A 87 -0.862 -1.745 17.945 1.00 0.00 C ATOM 1381 C LYS A 87 -1.821 -0.812 18.676 1.00 0.00 C ATOM 1382 O LYS A 87 -2.683 -1.260 19.434 1.00 0.00 O ATOM 1383 CB LYS A 87 -1.410 -2.075 16.555 1.00 0.00 C ATOM 1384 CG LYS A 87 -2.522 -3.112 16.570 1.00 0.00 C ATOM 1385 CD LYS A 87 -2.009 -4.485 16.166 1.00 0.00 C ATOM 1386 CE LYS A 87 -1.545 -4.503 14.719 1.00 0.00 C ATOM 1387 NZ LYS A 87 -2.570 -5.094 13.814 1.00 0.00 N1+ ATOM 0 H LYS A 87 -1.494 -3.514 18.876 1.00 0.00 H new ATOM 0 HA LYS A 87 0.098 -1.239 17.837 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -1.783 -1.160 16.094 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -0.595 -2.438 15.929 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -2.958 -3.165 17.567 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -3.317 -2.805 15.890 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -1.184 -4.772 16.817 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -2.797 -5.225 16.306 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -1.320 -3.486 14.397 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -0.620 -5.074 14.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -2.203 -5.976 13.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -3.435 -5.298 14.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -2.789 -4.422 13.051 1.00 0.00 H new ATOM 1401 N HIS A 88 -1.667 0.487 18.444 1.00 0.00 N ATOM 1402 CA HIS A 88 -2.519 1.484 19.082 1.00 0.00 C ATOM 1403 C HIS A 88 -3.920 1.470 18.478 1.00 0.00 C ATOM 1404 O HIS A 88 -4.088 1.639 17.270 1.00 0.00 O ATOM 1405 CB HIS A 88 -1.904 2.878 18.939 1.00 0.00 C ATOM 1406 CG HIS A 88 -1.764 3.327 17.518 1.00 0.00 C ATOM 1407 ND1 HIS A 88 -0.736 2.915 16.695 1.00 0.00 N ATOM 1408 CD2 HIS A 88 -2.531 4.158 16.772 1.00 0.00 C ATOM 1409 CE1 HIS A 88 -0.876 3.474 15.506 1.00 0.00 C ATOM 1410 NE2 HIS A 88 -1.956 4.232 15.525 1.00 0.00 N ATOM 0 H HIS A 88 -0.960 0.874 17.819 1.00 0.00 H new ATOM 0 HA HIS A 88 -2.596 1.235 20.140 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -2.521 3.596 19.479 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -0.922 2.883 19.412 1.00 0.00 H new ATOM 0 HD2 HIS A 88 -3.427 4.667 17.096 1.00 0.00 H new ATOM 0 HE1 HIS A 88 -0.218 3.334 14.661 1.00 0.00 H new ATOM 0 HE2 HIS A 88 -2.307 4.783 14.742 1.00 0.00 H new ATOM 1419 N VAL A 89 -4.922 1.269 19.327 1.00 0.00 N ATOM 1420 CA VAL A 89 -6.309 1.234 18.878 1.00 0.00 C ATOM 1421 C VAL A 89 -7.145 2.291 19.592 1.00 0.00 C ATOM 1422 O VAL A 89 -6.633 3.045 20.422 1.00 0.00 O ATOM 1423 CB VAL A 89 -6.941 -0.150 19.116 1.00 0.00 C ATOM 1424 CG1 VAL A 89 -6.255 -1.205 18.262 1.00 0.00 C ATOM 1425 CG2 VAL A 89 -6.876 -0.520 20.591 1.00 0.00 C ATOM 0 H VAL A 89 -4.800 1.128 20.330 1.00 0.00 H new ATOM 0 HA VAL A 89 -6.300 1.443 17.808 1.00 0.00 H new ATOM 0 HB VAL A 89 -7.990 -0.106 18.823 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -6.715 -2.176 18.444 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -6.360 -0.945 17.209 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -5.197 -1.251 18.520 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -7.327 -1.501 20.740 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -5.835 -0.546 20.914 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -7.419 0.222 21.177 1.00 0.00 H new ATOM 1435 N ARG A 90 -8.432 2.341 19.266 1.00 0.00 N ATOM 1436 CA ARG A 90 -9.339 3.306 19.878 1.00 0.00 C ATOM 1437 C ARG A 90 -10.472 2.596 20.612 1.00 0.00 C ATOM 1438 O ARG A 90 -10.536 1.368 20.636 1.00 0.00 O ATOM 1439 CB ARG A 90 -9.913 4.243 18.814 1.00 0.00 C ATOM 1440 CG ARG A 90 -10.170 5.652 19.319 1.00 0.00 C ATOM 1441 CD ARG A 90 -9.936 6.686 18.230 1.00 0.00 C ATOM 1442 NE ARG A 90 -10.789 7.861 18.397 1.00 0.00 N ATOM 1443 CZ ARG A 90 -12.083 7.887 18.091 1.00 0.00 C ATOM 1444 NH1 ARG A 90 -12.679 6.805 17.604 1.00 0.00 N1+ ATOM 1445 NH2 ARG A 90 -12.786 8.996 18.274 1.00 0.00 N ATOM 0 H ARG A 90 -8.871 1.725 18.582 1.00 0.00 H new ATOM 0 HA ARG A 90 -8.773 3.893 20.601 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -9.223 4.288 17.971 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -10.847 3.824 18.439 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -11.195 5.729 19.680 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -9.517 5.861 20.166 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -8.890 6.993 18.241 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -10.126 6.236 17.256 1.00 0.00 H new ATOM 0 HE ARG A 90 -10.367 8.711 18.770 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -12.144 5.948 17.463 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -13.672 6.831 17.371 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -12.334 9.830 18.650 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -13.778 9.015 18.039 1.00 0.00 H new ATOM 1459 N ASP A 91 -11.364 3.380 21.210 1.00 0.00 N ATOM 1460 CA ASP A 91 -12.496 2.826 21.944 1.00 0.00 C ATOM 1461 C ASP A 91 -13.465 2.121 21.001 1.00 0.00 C ATOM 1462 O ASP A 91 -14.530 2.649 20.678 1.00 0.00 O ATOM 1463 CB ASP A 91 -13.224 3.932 22.710 1.00 0.00 C ATOM 1464 CG ASP A 91 -14.026 3.395 23.879 1.00 0.00 C ATOM 1465 OD1 ASP A 91 -13.522 2.492 24.579 1.00 0.00 O1- ATOM 1466 OD2 ASP A 91 -15.158 3.877 24.094 1.00 0.00 O ATOM 0 H ASP A 91 -11.325 4.399 21.201 1.00 0.00 H new ATOM 0 HA ASP A 91 -12.113 2.093 22.654 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -12.496 4.657 23.075 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -13.890 4.463 22.030 1.00 0.00 H new ATOM 1751 N ARG A 112 16.222 -2.492 -10.485 1.00 0.00 N ATOM 1752 CA ARG A 112 15.307 -3.617 -10.645 1.00 0.00 C ATOM 1753 C ARG A 112 14.389 -3.408 -11.846 1.00 0.00 C ATOM 1754 O ARG A 112 14.155 -2.277 -12.272 1.00 0.00 O ATOM 1755 CB ARG A 112 14.472 -3.806 -9.377 1.00 0.00 C ATOM 1756 CG ARG A 112 13.865 -2.517 -8.851 1.00 0.00 C ATOM 1757 CD ARG A 112 12.548 -2.199 -9.541 1.00 0.00 C ATOM 1758 NE ARG A 112 11.577 -1.608 -8.623 1.00 0.00 N ATOM 1759 CZ ARG A 112 10.939 -2.294 -7.678 1.00 0.00 C ATOM 1760 NH1 ARG A 112 11.166 -3.593 -7.521 1.00 0.00 N1+ ATOM 1761 NH2 ARG A 112 10.071 -1.680 -6.885 1.00 0.00 N ATOM 0 HA ARG A 112 15.902 -4.514 -10.818 1.00 0.00 H new ATOM 0 HB2 ARG A 112 13.672 -4.518 -9.582 1.00 0.00 H new ATOM 0 HB3 ARG A 112 15.099 -4.246 -8.601 1.00 0.00 H new ATOM 0 HG2 ARG A 112 13.703 -2.602 -7.776 1.00 0.00 H new ATOM 0 HG3 ARG A 112 14.565 -1.695 -9.004 1.00 0.00 H new ATOM 0 HD2 ARG A 112 12.729 -1.513 -10.368 1.00 0.00 H new ATOM 0 HD3 ARG A 112 12.133 -3.112 -9.969 1.00 0.00 H new ATOM 0 HE ARG A 112 11.377 -0.612 -8.712 1.00 0.00 H new ATOM 0 HH11 ARG A 112 11.833 -4.071 -8.127 1.00 0.00 H new ATOM 0 HH12 ARG A 112 10.673 -4.113 -6.795 1.00 0.00 H new ATOM 0 HH21 ARG A 112 9.893 -0.682 -7.000 1.00 0.00 H new ATOM 0 HH22 ARG A 112 9.582 -2.206 -6.161 1.00 0.00 H new ATOM 1775 N PRO A 113 13.856 -4.505 -12.412 1.00 0.00 N ATOM 1776 CA PRO A 113 12.960 -4.441 -13.571 1.00 0.00 C ATOM 1777 C PRO A 113 11.605 -3.831 -13.225 1.00 0.00 C ATOM 1778 O PRO A 113 11.444 -3.208 -12.176 1.00 0.00 O ATOM 1779 CB PRO A 113 12.798 -5.909 -13.977 1.00 0.00 C ATOM 1780 CG PRO A 113 13.058 -6.679 -12.730 1.00 0.00 C ATOM 1781 CD PRO A 113 14.086 -5.893 -11.966 1.00 0.00 C ATOM 0 HA PRO A 113 13.362 -3.808 -14.362 1.00 0.00 H new ATOM 0 HB2 PRO A 113 11.797 -6.105 -14.362 1.00 0.00 H new ATOM 0 HB3 PRO A 113 13.501 -6.182 -14.764 1.00 0.00 H new ATOM 0 HG2 PRO A 113 12.145 -6.798 -12.147 1.00 0.00 H new ATOM 0 HG3 PRO A 113 13.423 -7.680 -12.958 1.00 0.00 H new ATOM 0 HD2 PRO A 113 13.952 -5.996 -10.889 1.00 0.00 H new ATOM 0 HD3 PRO A 113 15.098 -6.226 -12.195 1.00 0.00 H new ATOM 1789 N VAL A 114 10.635 -4.011 -14.117 1.00 0.00 N ATOM 1790 CA VAL A 114 9.295 -3.477 -13.908 1.00 0.00 C ATOM 1791 C VAL A 114 8.234 -4.398 -14.502 1.00 0.00 C ATOM 1792 O VAL A 114 8.507 -5.156 -15.432 1.00 0.00 O ATOM 1793 CB VAL A 114 9.140 -2.081 -14.537 1.00 0.00 C ATOM 1794 CG1 VAL A 114 10.015 -1.067 -13.816 1.00 0.00 C ATOM 1795 CG2 VAL A 114 9.476 -2.124 -16.020 1.00 0.00 C ATOM 0 H VAL A 114 10.753 -4.523 -14.991 1.00 0.00 H new ATOM 0 HA VAL A 114 9.154 -3.405 -12.830 1.00 0.00 H new ATOM 0 HB VAL A 114 8.101 -1.770 -14.430 1.00 0.00 H new ATOM 0 HG11 VAL A 114 9.891 -0.087 -14.276 1.00 0.00 H new ATOM 0 HG12 VAL A 114 9.723 -1.015 -12.767 1.00 0.00 H new ATOM 0 HG13 VAL A 114 11.059 -1.372 -13.887 1.00 0.00 H new ATOM 0 HG21 VAL A 114 9.361 -1.128 -16.448 1.00 0.00 H new ATOM 0 HG22 VAL A 114 10.505 -2.458 -16.150 1.00 0.00 H new ATOM 0 HG23 VAL A 114 8.803 -2.816 -16.526 1.00 0.00 H new ATOM 1805 N PRO A 115 7.002 -4.341 -13.970 1.00 0.00 N ATOM 1806 CA PRO A 115 5.893 -5.170 -14.455 1.00 0.00 C ATOM 1807 C PRO A 115 5.510 -4.834 -15.892 1.00 0.00 C ATOM 1808 O PRO A 115 6.241 -4.136 -16.594 1.00 0.00 O ATOM 1809 CB PRO A 115 4.742 -4.828 -13.503 1.00 0.00 C ATOM 1810 CG PRO A 115 5.092 -3.497 -12.934 1.00 0.00 C ATOM 1811 CD PRO A 115 6.591 -3.462 -12.861 1.00 0.00 C ATOM 0 HA PRO A 115 6.152 -6.229 -14.465 1.00 0.00 H new ATOM 0 HB2 PRO A 115 3.790 -4.792 -14.032 1.00 0.00 H new ATOM 0 HB3 PRO A 115 4.643 -5.578 -12.719 1.00 0.00 H new ATOM 0 HG2 PRO A 115 4.713 -2.691 -13.563 1.00 0.00 H new ATOM 0 HG3 PRO A 115 4.650 -3.366 -11.946 1.00 0.00 H new ATOM 0 HD2 PRO A 115 6.977 -2.450 -12.985 1.00 0.00 H new ATOM 0 HD3 PRO A 115 6.956 -3.827 -11.901 1.00 0.00 H new ATOM 1819 N VAL A 116 4.355 -5.333 -16.323 1.00 0.00 N ATOM 1820 CA VAL A 116 3.870 -5.083 -17.674 1.00 0.00 C ATOM 1821 C VAL A 116 2.401 -4.676 -17.658 1.00 0.00 C ATOM 1822 O VAL A 116 1.612 -5.195 -16.869 1.00 0.00 O ATOM 1823 CB VAL A 116 4.038 -6.322 -18.575 1.00 0.00 C ATOM 1824 CG1 VAL A 116 5.482 -6.455 -19.038 1.00 0.00 C ATOM 1825 CG2 VAL A 116 3.583 -7.579 -17.850 1.00 0.00 C ATOM 0 H VAL A 116 3.738 -5.913 -15.755 1.00 0.00 H new ATOM 0 HA VAL A 116 4.470 -4.268 -18.080 1.00 0.00 H new ATOM 0 HB VAL A 116 3.409 -6.194 -19.456 1.00 0.00 H new ATOM 0 HG11 VAL A 116 5.581 -7.335 -19.673 1.00 0.00 H new ATOM 0 HG12 VAL A 116 5.766 -5.567 -19.602 1.00 0.00 H new ATOM 0 HG13 VAL A 116 6.134 -6.558 -18.171 1.00 0.00 H new ATOM 0 HG21 VAL A 116 3.710 -8.442 -18.504 1.00 0.00 H new ATOM 0 HG22 VAL A 116 4.180 -7.715 -16.949 1.00 0.00 H new ATOM 0 HG23 VAL A 116 2.532 -7.482 -17.578 1.00 0.00 H new ATOM 1835 N HIS A 117 2.041 -3.739 -18.534 1.00 0.00 N ATOM 1836 CA HIS A 117 0.665 -3.252 -18.623 1.00 0.00 C ATOM 1837 C HIS A 117 0.327 -2.311 -17.466 1.00 0.00 C ATOM 1838 O HIS A 117 -0.804 -1.837 -17.354 1.00 0.00 O ATOM 1839 CB HIS A 117 -0.319 -4.424 -18.638 1.00 0.00 C ATOM 1840 CG HIS A 117 -1.668 -4.067 -19.181 1.00 0.00 C ATOM 1841 ND1 HIS A 117 -1.996 -4.176 -20.517 1.00 0.00 N ATOM 1842 CD2 HIS A 117 -2.778 -3.600 -18.561 1.00 0.00 C ATOM 1843 CE1 HIS A 117 -3.247 -3.790 -20.694 1.00 0.00 C ATOM 1844 NE2 HIS A 117 -3.744 -3.437 -19.524 1.00 0.00 N ATOM 0 H HIS A 117 2.684 -3.301 -19.193 1.00 0.00 H new ATOM 0 HA HIS A 117 0.576 -2.694 -19.555 1.00 0.00 H new ATOM 0 HB2 HIS A 117 0.101 -5.233 -19.235 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -0.434 -4.804 -17.623 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -2.884 -3.394 -17.506 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -3.774 -3.767 -21.637 1.00 0.00 H new ATOM 0 HE2 HIS A 117 -4.692 -3.098 -19.361 1.00 0.00 H new ATOM 1853 N ASP A 118 1.309 -2.039 -16.610 1.00 0.00 N ATOM 1854 CA ASP A 118 1.106 -1.154 -15.469 1.00 0.00 C ATOM 1855 C ASP A 118 0.982 0.299 -15.925 1.00 0.00 C ATOM 1856 O ASP A 118 1.281 0.625 -17.074 1.00 0.00 O ATOM 1857 CB ASP A 118 2.263 -1.296 -14.477 1.00 0.00 C ATOM 1858 CG ASP A 118 1.898 -2.160 -13.285 1.00 0.00 C ATOM 1859 OD1 ASP A 118 1.198 -3.176 -13.480 1.00 0.00 O ATOM 1860 OD2 ASP A 118 2.313 -1.820 -12.157 1.00 0.00 O1- ATOM 0 H ASP A 118 2.252 -2.419 -16.686 1.00 0.00 H new ATOM 0 HA ASP A 118 0.177 -1.441 -14.975 1.00 0.00 H new ATOM 0 HB2 ASP A 118 3.124 -1.729 -14.986 1.00 0.00 H new ATOM 0 HB3 ASP A 118 2.563 -0.308 -14.128 1.00 0.00 H new ATOM 1865 N PRO A 119 0.539 1.195 -15.026 1.00 0.00 N ATOM 1866 CA PRO A 119 0.379 2.618 -15.345 1.00 0.00 C ATOM 1867 C PRO A 119 1.715 3.309 -15.596 1.00 0.00 C ATOM 1868 O PRO A 119 1.780 4.315 -16.302 1.00 0.00 O ATOM 1869 CB PRO A 119 -0.295 3.194 -14.097 1.00 0.00 C ATOM 1870 CG PRO A 119 0.067 2.254 -12.999 1.00 0.00 C ATOM 1871 CD PRO A 119 0.160 0.895 -13.633 1.00 0.00 C ATOM 0 HA PRO A 119 -0.195 2.766 -16.260 1.00 0.00 H new ATOM 0 HB2 PRO A 119 0.059 4.203 -13.886 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -1.376 3.256 -14.224 1.00 0.00 H new ATOM 0 HG2 PRO A 119 1.014 2.536 -12.540 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -0.685 2.266 -12.211 1.00 0.00 H new ATOM 0 HD2 PRO A 119 0.905 0.271 -13.139 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -0.789 0.361 -13.580 1.00 0.00 H new ATOM 1879 N VAL A 120 2.778 2.763 -15.014 1.00 0.00 N ATOM 1880 CA VAL A 120 4.113 3.330 -15.177 1.00 0.00 C ATOM 1881 C VAL A 120 4.767 2.833 -16.464 1.00 0.00 C ATOM 1882 O VAL A 120 5.410 3.601 -17.180 1.00 0.00 O ATOM 1883 CB VAL A 120 5.021 2.983 -13.979 1.00 0.00 C ATOM 1884 CG1 VAL A 120 5.218 1.479 -13.867 1.00 0.00 C ATOM 1885 CG2 VAL A 120 6.360 3.696 -14.100 1.00 0.00 C ATOM 0 H VAL A 120 2.742 1.930 -14.426 1.00 0.00 H new ATOM 0 HA VAL A 120 3.995 4.412 -15.229 1.00 0.00 H new ATOM 0 HB VAL A 120 4.531 3.327 -13.068 1.00 0.00 H new ATOM 0 HG11 VAL A 120 5.862 1.259 -13.015 1.00 0.00 H new ATOM 0 HG12 VAL A 120 4.252 0.995 -13.726 1.00 0.00 H new ATOM 0 HG13 VAL A 120 5.682 1.104 -14.779 1.00 0.00 H new ATOM 0 HG21 VAL A 120 6.987 3.439 -13.246 1.00 0.00 H new ATOM 0 HG22 VAL A 120 6.855 3.386 -15.020 1.00 0.00 H new ATOM 0 HG23 VAL A 120 6.198 4.774 -14.120 1.00 0.00 H new ATOM 1895 N VAL A 121 4.599 1.546 -16.751 1.00 0.00 N ATOM 1896 CA VAL A 121 5.174 0.950 -17.951 1.00 0.00 C ATOM 1897 C VAL A 121 4.406 1.377 -19.196 1.00 0.00 C ATOM 1898 O VAL A 121 4.987 1.906 -20.145 1.00 0.00 O ATOM 1899 CB VAL A 121 5.181 -0.588 -17.867 1.00 0.00 C ATOM 1900 CG1 VAL A 121 5.935 -1.184 -19.045 1.00 0.00 C ATOM 1901 CG2 VAL A 121 5.786 -1.045 -16.548 1.00 0.00 C ATOM 0 H VAL A 121 4.070 0.897 -16.169 1.00 0.00 H new ATOM 0 HA VAL A 121 6.202 1.306 -18.021 1.00 0.00 H new ATOM 0 HB VAL A 121 4.151 -0.943 -17.911 1.00 0.00 H new ATOM 0 HG11 VAL A 121 5.929 -2.271 -18.968 1.00 0.00 H new ATOM 0 HG12 VAL A 121 5.453 -0.883 -19.975 1.00 0.00 H new ATOM 0 HG13 VAL A 121 6.964 -0.825 -19.037 1.00 0.00 H new ATOM 0 HG21 VAL A 121 5.783 -2.134 -16.505 1.00 0.00 H new ATOM 0 HG22 VAL A 121 6.811 -0.681 -16.472 1.00 0.00 H new ATOM 0 HG23 VAL A 121 5.198 -0.648 -15.721 1.00 0.00 H new ATOM 1911 N GLN A 122 3.096 1.147 -19.188 1.00 0.00 N ATOM 1912 CA GLN A 122 2.248 1.512 -20.318 1.00 0.00 C ATOM 1913 C GLN A 122 2.398 2.992 -20.655 1.00 0.00 C ATOM 1914 O GLN A 122 2.287 3.390 -21.815 1.00 0.00 O ATOM 1915 CB GLN A 122 0.785 1.191 -20.011 1.00 0.00 C ATOM 1916 CG GLN A 122 0.449 -0.287 -20.127 1.00 0.00 C ATOM 1917 CD GLN A 122 0.118 -0.701 -21.547 1.00 0.00 C ATOM 1918 OE1 GLN A 122 -0.808 -0.169 -22.160 1.00 0.00 O ATOM 1919 NE2 GLN A 122 0.875 -1.654 -22.077 1.00 0.00 N ATOM 0 H GLN A 122 2.599 0.710 -18.412 1.00 0.00 H new ATOM 0 HA GLN A 122 2.566 0.928 -21.182 1.00 0.00 H new ATOM 0 HB2 GLN A 122 0.551 1.530 -19.002 1.00 0.00 H new ATOM 0 HB3 GLN A 122 0.147 1.755 -20.692 1.00 0.00 H new ATOM 0 HG2 GLN A 122 1.293 -0.877 -19.768 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -0.398 -0.515 -19.480 1.00 0.00 H new ATOM 0 HE21 GLN A 122 1.632 -2.066 -21.532 1.00 0.00 H new ATOM 0 HE22 GLN A 122 0.700 -1.974 -23.030 1.00 0.00 H new ATOM 1928 N ASP A 123 2.653 3.803 -19.633 1.00 0.00 N ATOM 1929 CA ASP A 123 2.822 5.239 -19.821 1.00 0.00 C ATOM 1930 C ASP A 123 4.124 5.536 -20.555 1.00 0.00 C ATOM 1931 O ASP A 123 4.139 6.275 -21.541 1.00 0.00 O ATOM 1932 CB ASP A 123 2.809 5.957 -18.471 1.00 0.00 C ATOM 1933 CG ASP A 123 1.415 6.388 -18.058 1.00 0.00 C ATOM 1934 OD1 ASP A 123 0.441 5.732 -18.482 1.00 0.00 O1- ATOM 1935 OD2 ASP A 123 1.298 7.382 -17.312 1.00 0.00 O ATOM 0 H ASP A 123 2.747 3.490 -18.667 1.00 0.00 H new ATOM 0 HA ASP A 123 1.991 5.604 -20.425 1.00 0.00 H new ATOM 0 HB2 ASP A 123 3.223 5.298 -17.708 1.00 0.00 H new ATOM 0 HB3 ASP A 123 3.457 6.832 -18.522 1.00 0.00 H new ATOM 1940 N ALA A 124 5.216 4.952 -20.072 1.00 0.00 N ATOM 1941 CA ALA A 124 6.523 5.150 -20.684 1.00 0.00 C ATOM 1942 C ALA A 124 6.576 4.522 -22.070 1.00 0.00 C ATOM 1943 O ALA A 124 7.133 5.099 -23.005 1.00 0.00 O ATOM 1944 CB ALA A 124 7.615 4.571 -19.798 1.00 0.00 C ATOM 0 H ALA A 124 5.221 4.337 -19.258 1.00 0.00 H new ATOM 0 HA ALA A 124 6.690 6.222 -20.791 1.00 0.00 H new ATOM 0 HB1 ALA A 124 8.586 4.726 -20.268 1.00 0.00 H new ATOM 0 HB2 ALA A 124 7.598 5.068 -18.828 1.00 0.00 H new ATOM 0 HB3 ALA A 124 7.445 3.503 -19.662 1.00 0.00 H new ATOM 1950 N ALA A 125 5.991 3.334 -22.199 1.00 0.00 N ATOM 1951 CA ALA A 125 5.971 2.629 -23.474 1.00 0.00 C ATOM 1952 C ALA A 125 5.268 3.454 -24.545 1.00 0.00 C ATOM 1953 O ALA A 125 5.863 3.800 -25.565 1.00 0.00 O ATOM 1954 CB ALA A 125 5.296 1.274 -23.318 1.00 0.00 C ATOM 0 H ALA A 125 5.526 2.841 -21.437 1.00 0.00 H new ATOM 0 HA ALA A 125 7.002 2.473 -23.792 1.00 0.00 H new ATOM 0 HB1 ALA A 125 5.288 0.759 -24.278 1.00 0.00 H new ATOM 0 HB2 ALA A 125 5.844 0.676 -22.590 1.00 0.00 H new ATOM 0 HB3 ALA A 125 4.271 1.415 -22.974 1.00 0.00 H new ATOM 1960 N HIS A 126 3.997 3.768 -24.306 1.00 0.00 N ATOM 1961 CA HIS A 126 3.211 4.557 -25.251 1.00 0.00 C ATOM 1962 C HIS A 126 3.917 5.868 -25.585 1.00 0.00 C ATOM 1963 O HIS A 126 4.056 6.228 -26.753 1.00 0.00 O ATOM 1964 CB HIS A 126 1.821 4.842 -24.676 1.00 0.00 C ATOM 1965 CG HIS A 126 0.740 3.998 -25.277 1.00 0.00 C ATOM 1966 ND1 HIS A 126 0.414 4.032 -26.616 1.00 0.00 N ATOM 1967 CD2 HIS A 126 -0.092 3.090 -24.713 1.00 0.00 C ATOM 1968 CE1 HIS A 126 -0.572 3.185 -26.850 1.00 0.00 C ATOM 1969 NE2 HIS A 126 -0.897 2.601 -25.711 1.00 0.00 N ATOM 0 H HIS A 126 3.490 3.488 -23.466 1.00 0.00 H new ATOM 0 HA HIS A 126 3.105 3.980 -26.170 1.00 0.00 H new ATOM 0 HB2 HIS A 126 1.842 4.678 -23.599 1.00 0.00 H new ATOM 0 HB3 HIS A 126 1.580 5.893 -24.834 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -0.117 2.804 -23.672 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -1.034 3.001 -27.809 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -1.628 1.900 -25.592 1.00 0.00 H new ATOM 1978 N HIS A 127 4.364 6.574 -24.551 1.00 0.00 N ATOM 1979 CA HIS A 127 5.061 7.841 -24.738 1.00 0.00 C ATOM 1980 C HIS A 127 6.294 7.652 -25.614 1.00 0.00 C ATOM 1981 O HIS A 127 6.646 8.525 -26.406 1.00 0.00 O ATOM 1982 CB HIS A 127 5.465 8.430 -23.385 1.00 0.00 C ATOM 1983 CG HIS A 127 4.378 9.224 -22.729 1.00 0.00 C ATOM 1984 ND1 HIS A 127 3.094 8.749 -22.564 1.00 0.00 N ATOM 1985 CD2 HIS A 127 4.388 10.469 -22.195 1.00 0.00 C ATOM 1986 CE1 HIS A 127 2.361 9.666 -21.958 1.00 0.00 C ATOM 1987 NE2 HIS A 127 3.123 10.718 -21.722 1.00 0.00 N ATOM 0 H HIS A 127 4.256 6.291 -23.577 1.00 0.00 H new ATOM 0 HA HIS A 127 4.383 8.534 -25.237 1.00 0.00 H new ATOM 0 HB2 HIS A 127 5.764 7.620 -22.720 1.00 0.00 H new ATOM 0 HB3 HIS A 127 6.338 9.068 -23.522 1.00 0.00 H new ATOM 0 HD2 HIS A 127 5.233 11.140 -22.150 1.00 0.00 H new ATOM 0 HE1 HIS A 127 1.317 9.571 -21.700 1.00 0.00 H new ATOM 0 HE2 HIS A 127 2.821 11.577 -21.263 1.00 0.00 H new ATOM 1996 N ALA A 128 6.944 6.504 -25.466 1.00 0.00 N ATOM 1997 CA ALA A 128 8.135 6.194 -26.246 1.00 0.00 C ATOM 1998 C ALA A 128 7.778 5.928 -27.706 1.00 0.00 C ATOM 1999 O ALA A 128 8.509 6.320 -28.615 1.00 0.00 O ATOM 2000 CB ALA A 128 8.860 4.997 -25.649 1.00 0.00 C ATOM 0 H ALA A 128 6.666 5.772 -24.812 1.00 0.00 H new ATOM 0 HA ALA A 128 8.799 7.058 -26.213 1.00 0.00 H new ATOM 0 HB1 ALA A 128 9.748 4.777 -26.242 1.00 0.00 H new ATOM 0 HB2 ALA A 128 9.155 5.224 -24.625 1.00 0.00 H new ATOM 0 HB3 ALA A 128 8.197 4.132 -25.652 1.00 0.00 H new ATOM 2006 N ILE A 129 6.648 5.262 -27.922 1.00 0.00 N ATOM 2007 CA ILE A 129 6.191 4.942 -29.272 1.00 0.00 C ATOM 2008 C ILE A 129 6.098 6.201 -30.133 1.00 0.00 C ATOM 2009 O ILE A 129 6.638 6.248 -31.238 1.00 0.00 O ATOM 2010 CB ILE A 129 4.815 4.243 -29.244 1.00 0.00 C ATOM 2011 CG1 ILE A 129 4.906 2.914 -28.488 1.00 0.00 C ATOM 2012 CG2 ILE A 129 4.289 4.021 -30.657 1.00 0.00 C ATOM 2013 CD1 ILE A 129 5.620 1.822 -29.259 1.00 0.00 C ATOM 0 H ILE A 129 6.031 4.933 -27.180 1.00 0.00 H new ATOM 0 HA ILE A 129 6.925 4.264 -29.707 1.00 0.00 H new ATOM 0 HB ILE A 129 4.113 4.892 -28.721 1.00 0.00 H new ATOM 0 HG12 ILE A 129 5.425 3.078 -27.544 1.00 0.00 H new ATOM 0 HG13 ILE A 129 3.899 2.575 -28.244 1.00 0.00 H new ATOM 0 HG21 ILE A 129 3.318 3.527 -30.611 1.00 0.00 H new ATOM 0 HG22 ILE A 129 4.184 4.982 -31.161 1.00 0.00 H new ATOM 0 HG23 ILE A 129 4.988 3.395 -31.211 1.00 0.00 H new ATOM 0 HD11 ILE A 129 5.646 0.911 -28.661 1.00 0.00 H new ATOM 0 HD12 ILE A 129 5.090 1.629 -30.192 1.00 0.00 H new ATOM 0 HD13 ILE A 129 6.639 2.139 -29.480 1.00 0.00 H new ATOM 2025 N LYS A 130 5.409 7.214 -29.621 1.00 0.00 N ATOM 2026 CA LYS A 130 5.245 8.468 -30.346 1.00 0.00 C ATOM 2027 C LYS A 130 6.545 9.267 -30.368 1.00 0.00 C ATOM 2028 O LYS A 130 6.896 9.870 -31.381 1.00 0.00 O ATOM 2029 CB LYS A 130 4.128 9.306 -29.719 1.00 0.00 C ATOM 2030 CG LYS A 130 4.331 9.586 -28.238 1.00 0.00 C ATOM 2031 CD LYS A 130 4.929 10.963 -28.008 1.00 0.00 C ATOM 2032 CE LYS A 130 4.604 11.487 -26.618 1.00 0.00 C ATOM 2033 NZ LYS A 130 3.466 12.447 -26.637 1.00 0.00 N1+ ATOM 0 H LYS A 130 4.955 7.192 -28.708 1.00 0.00 H new ATOM 0 HA LYS A 130 4.975 8.225 -31.374 1.00 0.00 H new ATOM 0 HB2 LYS A 130 4.054 10.254 -30.252 1.00 0.00 H new ATOM 0 HB3 LYS A 130 3.178 8.789 -29.855 1.00 0.00 H new ATOM 0 HG2 LYS A 130 3.376 9.512 -27.718 1.00 0.00 H new ATOM 0 HG3 LYS A 130 4.986 8.828 -27.810 1.00 0.00 H new ATOM 0 HD2 LYS A 130 6.010 10.917 -28.137 1.00 0.00 H new ATOM 0 HD3 LYS A 130 4.548 11.656 -28.758 1.00 0.00 H new ATOM 0 HE2 LYS A 130 4.362 10.650 -25.962 1.00 0.00 H new ATOM 0 HE3 LYS A 130 5.484 11.976 -26.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 3.277 12.780 -25.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 3.706 13.258 -27.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 2.619 11.974 -27.012 1.00 0.00 H new ATOM 2047 N THR A 131 7.255 9.269 -29.244 1.00 0.00 N ATOM 2048 CA THR A 131 8.514 10.000 -29.136 1.00 0.00 C ATOM 2049 C THR A 131 9.554 9.458 -30.114 1.00 0.00 C ATOM 2050 O THR A 131 10.164 10.217 -30.866 1.00 0.00 O ATOM 2051 CB THR A 131 9.054 9.926 -27.706 1.00 0.00 C ATOM 2052 OG1 THR A 131 8.122 10.472 -26.791 1.00 0.00 O ATOM 2053 CG2 THR A 131 10.363 10.664 -27.522 1.00 0.00 C ATOM 0 H THR A 131 6.981 8.773 -28.396 1.00 0.00 H new ATOM 0 HA THR A 131 8.316 11.042 -29.389 1.00 0.00 H new ATOM 0 HB THR A 131 9.223 8.866 -27.515 1.00 0.00 H new ATOM 0 HG1 THR A 131 7.615 9.747 -26.369 1.00 0.00 H new ATOM 0 HG21 THR A 131 10.690 10.572 -26.486 1.00 0.00 H new ATOM 0 HG22 THR A 131 11.118 10.235 -28.181 1.00 0.00 H new ATOM 0 HG23 THR A 131 10.224 11.717 -27.766 1.00 0.00 H new ATOM 2061 N ILE A 132 9.757 8.144 -30.096 1.00 0.00 N ATOM 2062 CA ILE A 132 10.729 7.509 -30.980 1.00 0.00 C ATOM 2063 C ILE A 132 10.490 7.901 -32.437 1.00 0.00 C ATOM 2064 O ILE A 132 11.394 8.391 -33.113 1.00 0.00 O ATOM 2065 CB ILE A 132 10.687 5.971 -30.850 1.00 0.00 C ATOM 2066 CG1 ILE A 132 11.009 5.554 -29.415 1.00 0.00 C ATOM 2067 CG2 ILE A 132 11.660 5.321 -31.824 1.00 0.00 C ATOM 2068 CD1 ILE A 132 10.307 4.286 -28.981 1.00 0.00 C ATOM 0 H ILE A 132 9.262 7.499 -29.480 1.00 0.00 H new ATOM 0 HA ILE A 132 11.714 7.862 -30.674 1.00 0.00 H new ATOM 0 HB ILE A 132 9.681 5.631 -31.096 1.00 0.00 H new ATOM 0 HG12 ILE A 132 12.086 5.414 -29.319 1.00 0.00 H new ATOM 0 HG13 ILE A 132 10.731 6.363 -28.739 1.00 0.00 H new ATOM 0 HG21 ILE A 132 11.614 4.237 -31.715 1.00 0.00 H new ATOM 0 HG22 ILE A 132 11.391 5.595 -32.844 1.00 0.00 H new ATOM 0 HG23 ILE A 132 12.672 5.664 -31.611 1.00 0.00 H new ATOM 0 HD11 ILE A 132 10.583 4.051 -27.953 1.00 0.00 H new ATOM 0 HD12 ILE A 132 9.228 4.428 -29.044 1.00 0.00 H new ATOM 0 HD13 ILE A 132 10.604 3.464 -29.633 1.00 0.00 H new ATOM 2080 N GLN A 133 9.268 7.688 -32.911 1.00 0.00 N ATOM 2081 CA GLN A 133 8.916 8.024 -34.286 1.00 0.00 C ATOM 2082 C GLN A 133 8.951 9.535 -34.498 1.00 0.00 C ATOM 2083 O GLN A 133 9.260 10.013 -35.590 1.00 0.00 O ATOM 2084 CB GLN A 133 7.527 7.480 -34.628 1.00 0.00 C ATOM 2085 CG GLN A 133 7.358 6.004 -34.307 1.00 0.00 C ATOM 2086 CD GLN A 133 8.315 5.125 -35.089 1.00 0.00 C ATOM 2087 OE1 GLN A 133 8.068 4.796 -36.249 1.00 0.00 O ATOM 2088 NE2 GLN A 133 9.415 4.739 -34.453 1.00 0.00 N ATOM 0 H GLN A 133 8.506 7.285 -32.366 1.00 0.00 H new ATOM 0 HA GLN A 133 9.649 7.563 -34.948 1.00 0.00 H new ATOM 0 HB2 GLN A 133 6.777 8.051 -34.081 1.00 0.00 H new ATOM 0 HB3 GLN A 133 7.335 7.637 -35.689 1.00 0.00 H new ATOM 0 HG2 GLN A 133 7.516 5.847 -33.240 1.00 0.00 H new ATOM 0 HG3 GLN A 133 6.333 5.703 -34.525 1.00 0.00 H new ATOM 0 HE21 GLN A 133 9.579 5.036 -33.491 1.00 0.00 H new ATOM 0 HE22 GLN A 133 10.096 4.146 -34.926 1.00 0.00 H new ATOM 2097 N GLU A 134 8.634 10.281 -33.446 1.00 0.00 N ATOM 2098 CA GLU A 134 8.629 11.738 -33.511 1.00 0.00 C ATOM 2099 C GLU A 134 10.050 12.295 -33.498 1.00 0.00 C ATOM 2100 O GLU A 134 10.300 13.390 -33.999 1.00 0.00 O ATOM 2101 CB GLU A 134 7.831 12.322 -32.343 1.00 0.00 C ATOM 2102 CG GLU A 134 6.326 12.281 -32.555 1.00 0.00 C ATOM 2103 CD GLU A 134 5.551 12.594 -31.290 1.00 0.00 C ATOM 2104 OE1 GLU A 134 6.142 13.186 -30.363 1.00 0.00 O1- ATOM 2105 OE2 GLU A 134 4.353 12.246 -31.227 1.00 0.00 O ATOM 0 H GLU A 134 8.376 9.900 -32.536 1.00 0.00 H new ATOM 0 HA GLU A 134 8.155 12.028 -34.449 1.00 0.00 H new ATOM 0 HB2 GLU A 134 8.077 11.772 -31.435 1.00 0.00 H new ATOM 0 HB3 GLU A 134 8.139 13.355 -32.183 1.00 0.00 H new ATOM 0 HG2 GLU A 134 6.052 12.996 -33.331 1.00 0.00 H new ATOM 0 HG3 GLU A 134 6.040 11.293 -32.917 1.00 0.00 H new ATOM 2112 N ARG A 135 10.976 11.537 -32.917 1.00 0.00 N ATOM 2113 CA ARG A 135 12.369 11.962 -32.836 1.00 0.00 C ATOM 2114 C ARG A 135 12.950 12.197 -34.229 1.00 0.00 C ATOM 2115 O ARG A 135 13.942 12.910 -34.383 1.00 0.00 O ATOM 2116 CB ARG A 135 13.202 10.914 -32.097 1.00 0.00 C ATOM 2117 CG ARG A 135 12.957 10.887 -30.597 1.00 0.00 C ATOM 2118 CD ARG A 135 14.059 11.611 -29.839 1.00 0.00 C ATOM 2119 NE ARG A 135 13.542 12.333 -28.679 1.00 0.00 N ATOM 2120 CZ ARG A 135 14.261 13.194 -27.962 1.00 0.00 C ATOM 2121 NH1 ARG A 135 15.526 13.443 -28.283 1.00 0.00 N1+ ATOM 2122 NH2 ARG A 135 13.715 13.809 -26.922 1.00 0.00 N ATOM 0 H ARG A 135 10.787 10.627 -32.496 1.00 0.00 H new ATOM 0 HA ARG A 135 12.403 12.901 -32.283 1.00 0.00 H new ATOM 0 HB2 ARG A 135 12.981 9.930 -32.510 1.00 0.00 H new ATOM 0 HB3 ARG A 135 14.259 11.107 -32.280 1.00 0.00 H new ATOM 0 HG2 ARG A 135 11.996 11.352 -30.376 1.00 0.00 H new ATOM 0 HG3 ARG A 135 12.898 9.854 -30.256 1.00 0.00 H new ATOM 0 HD2 ARG A 135 14.809 10.890 -29.513 1.00 0.00 H new ATOM 0 HD3 ARG A 135 14.560 12.311 -30.508 1.00 0.00 H new ATOM 0 HE ARG A 135 12.574 12.168 -28.402 1.00 0.00 H new ATOM 0 HH11 ARG A 135 15.951 12.974 -29.082 1.00 0.00 H new ATOM 0 HH12 ARG A 135 16.072 14.104 -27.730 1.00 0.00 H new ATOM 0 HH21 ARG A 135 12.744 13.622 -26.671 1.00 0.00 H new ATOM 0 HH22 ARG A 135 14.266 14.469 -26.373 1.00 0.00 H new ATOM 2136 N SER A 136 12.324 11.602 -35.240 1.00 0.00 N ATOM 2137 CA SER A 136 12.780 11.756 -36.616 1.00 0.00 C ATOM 2138 C SER A 136 11.934 12.790 -37.351 1.00 0.00 C ATOM 2139 O SER A 136 12.463 13.671 -38.030 1.00 0.00 O ATOM 2140 CB SER A 136 12.720 10.415 -37.350 1.00 0.00 C ATOM 2141 OG SER A 136 13.787 10.289 -38.274 1.00 0.00 O ATOM 0 H SER A 136 11.501 11.010 -35.132 1.00 0.00 H new ATOM 0 HA SER A 136 13.813 12.102 -36.596 1.00 0.00 H new ATOM 0 HB2 SER A 136 12.763 9.600 -36.628 1.00 0.00 H new ATOM 0 HB3 SER A 136 11.769 10.327 -37.875 1.00 0.00 H new ATOM 0 HG SER A 136 13.726 9.423 -38.728 1.00 0.00 H new ATOM 2147 N ASN A 137 10.617 12.678 -37.209 1.00 0.00 N ATOM 2148 CA ASN A 137 9.692 13.602 -37.856 1.00 0.00 C ATOM 2149 C ASN A 137 8.248 13.261 -37.502 1.00 0.00 C ATOM 2150 O ASN A 137 7.966 12.183 -36.979 1.00 0.00 O ATOM 2151 CB ASN A 137 9.878 13.565 -39.375 1.00 0.00 C ATOM 2152 CG ASN A 137 9.581 12.198 -39.962 1.00 0.00 C ATOM 2153 OD1 ASN A 137 8.492 11.957 -40.484 1.00 0.00 O ATOM 2154 ND2 ASN A 137 10.550 11.295 -39.878 1.00 0.00 N ATOM 0 H ASN A 137 10.165 11.954 -36.650 1.00 0.00 H new ATOM 0 HA ASN A 137 9.910 14.607 -37.495 1.00 0.00 H new ATOM 0 HB2 ASN A 137 9.224 14.305 -39.836 1.00 0.00 H new ATOM 0 HB3 ASN A 137 10.902 13.848 -39.620 1.00 0.00 H new ATOM 0 HD21 ASN A 137 10.408 10.358 -40.255 1.00 0.00 H new ATOM 0 HD22 ASN A 137 11.437 11.538 -39.437 1.00 0.00 H new ATOM 2261 N LEU A 144 1.312 1.774 -29.228 1.00 0.00 N ATOM 2262 CA LEU A 144 1.592 0.604 -28.401 1.00 0.00 C ATOM 2263 C LEU A 144 0.626 -0.532 -28.720 1.00 0.00 C ATOM 2264 O LEU A 144 -0.572 -0.310 -28.894 1.00 0.00 O ATOM 2265 CB LEU A 144 1.498 0.969 -26.919 1.00 0.00 C ATOM 2266 CG LEU A 144 2.305 0.072 -25.978 1.00 0.00 C ATOM 2267 CD1 LEU A 144 2.363 0.677 -24.583 1.00 0.00 C ATOM 2268 CD2 LEU A 144 1.703 -1.324 -25.930 1.00 0.00 C ATOM 0 HA LEU A 144 2.605 0.267 -28.622 1.00 0.00 H new ATOM 0 HB2 LEU A 144 1.834 1.998 -26.792 1.00 0.00 H new ATOM 0 HB3 LEU A 144 0.451 0.936 -26.618 1.00 0.00 H new ATOM 0 HG LEU A 144 3.323 -0.004 -26.361 1.00 0.00 H new ATOM 0 HD11 LEU A 144 2.941 0.025 -23.928 1.00 0.00 H new ATOM 0 HD12 LEU A 144 2.838 1.657 -24.631 1.00 0.00 H new ATOM 0 HD13 LEU A 144 1.352 0.783 -24.190 1.00 0.00 H new ATOM 0 HD21 LEU A 144 2.288 -1.950 -25.256 1.00 0.00 H new ATOM 0 HD22 LEU A 144 0.676 -1.265 -25.570 1.00 0.00 H new ATOM 0 HD23 LEU A 144 1.713 -1.759 -26.929 1.00 0.00 H new ATOM 2280 N SER A 145 1.155 -1.749 -28.793 1.00 0.00 N ATOM 2281 CA SER A 145 0.339 -2.921 -29.091 1.00 0.00 C ATOM 2282 C SER A 145 0.319 -3.886 -27.909 1.00 0.00 C ATOM 2283 O SER A 145 -0.708 -4.061 -27.255 1.00 0.00 O ATOM 2284 CB SER A 145 0.865 -3.632 -30.338 1.00 0.00 C ATOM 2285 OG SER A 145 -0.200 -4.127 -31.132 1.00 0.00 O ATOM 0 H SER A 145 2.145 -1.950 -28.650 1.00 0.00 H new ATOM 0 HA SER A 145 -0.681 -2.584 -29.278 1.00 0.00 H new ATOM 0 HB2 SER A 145 1.470 -2.942 -30.926 1.00 0.00 H new ATOM 0 HB3 SER A 145 1.516 -4.455 -30.043 1.00 0.00 H new ATOM 0 HG SER A 145 -0.857 -3.415 -31.279 1.00 0.00 H new ATOM 2291 N GLU A 146 1.462 -4.510 -27.643 1.00 0.00 N ATOM 2292 CA GLU A 146 1.576 -5.457 -26.540 1.00 0.00 C ATOM 2293 C GLU A 146 2.997 -5.477 -25.986 1.00 0.00 C ATOM 2294 O GLU A 146 3.961 -5.661 -26.729 1.00 0.00 O ATOM 2295 CB GLU A 146 1.176 -6.859 -27.001 1.00 0.00 C ATOM 2296 CG GLU A 146 1.789 -7.260 -28.334 1.00 0.00 C ATOM 2297 CD GLU A 146 1.401 -8.664 -28.755 1.00 0.00 C ATOM 2298 OE1 GLU A 146 0.358 -9.160 -28.279 1.00 0.00 O ATOM 2299 OE2 GLU A 146 2.140 -9.266 -29.561 1.00 0.00 O1- ATOM 0 H GLU A 146 2.322 -4.377 -28.176 1.00 0.00 H new ATOM 0 HA GLU A 146 0.900 -5.137 -25.747 1.00 0.00 H new ATOM 0 HB2 GLU A 146 1.475 -7.581 -26.241 1.00 0.00 H new ATOM 0 HB3 GLU A 146 0.090 -6.910 -27.080 1.00 0.00 H new ATOM 0 HG2 GLU A 146 1.473 -6.554 -29.102 1.00 0.00 H new ATOM 0 HG3 GLU A 146 2.875 -7.192 -28.266 1.00 0.00 H new ATOM 2306 N VAL A 147 3.119 -5.288 -24.676 1.00 0.00 N ATOM 2307 CA VAL A 147 4.423 -5.283 -24.024 1.00 0.00 C ATOM 2308 C VAL A 147 4.887 -6.701 -23.710 1.00 0.00 C ATOM 2309 O VAL A 147 4.131 -7.509 -23.171 1.00 0.00 O ATOM 2310 CB VAL A 147 4.397 -4.463 -22.721 1.00 0.00 C ATOM 2311 CG1 VAL A 147 5.799 -4.318 -22.150 1.00 0.00 C ATOM 2312 CG2 VAL A 147 3.767 -3.099 -22.961 1.00 0.00 C ATOM 0 H VAL A 147 2.331 -5.136 -24.046 1.00 0.00 H new ATOM 0 HA VAL A 147 5.122 -4.821 -24.721 1.00 0.00 H new ATOM 0 HB VAL A 147 3.788 -4.996 -21.991 1.00 0.00 H new ATOM 0 HG11 VAL A 147 5.759 -3.735 -21.230 1.00 0.00 H new ATOM 0 HG12 VAL A 147 6.209 -5.305 -21.937 1.00 0.00 H new ATOM 0 HG13 VAL A 147 6.436 -3.809 -22.874 1.00 0.00 H new ATOM 0 HG21 VAL A 147 3.757 -2.534 -22.029 1.00 0.00 H new ATOM 0 HG22 VAL A 147 4.347 -2.557 -23.708 1.00 0.00 H new ATOM 0 HG23 VAL A 147 2.745 -3.228 -23.318 1.00 0.00 H new ATOM 2322 N VAL A 148 6.136 -6.997 -24.054 1.00 0.00 N ATOM 2323 CA VAL A 148 6.706 -8.317 -23.811 1.00 0.00 C ATOM 2324 C VAL A 148 7.349 -8.390 -22.429 1.00 0.00 C ATOM 2325 O VAL A 148 7.046 -9.284 -21.639 1.00 0.00 O ATOM 2326 CB VAL A 148 7.759 -8.678 -24.875 1.00 0.00 C ATOM 2327 CG1 VAL A 148 8.211 -10.122 -24.712 1.00 0.00 C ATOM 2328 CG2 VAL A 148 7.209 -8.439 -26.272 1.00 0.00 C ATOM 0 H VAL A 148 6.774 -6.339 -24.503 1.00 0.00 H new ATOM 0 HA VAL A 148 5.886 -9.033 -23.866 1.00 0.00 H new ATOM 0 HB VAL A 148 8.626 -8.033 -24.735 1.00 0.00 H new ATOM 0 HG11 VAL A 148 8.955 -10.358 -25.473 1.00 0.00 H new ATOM 0 HG12 VAL A 148 8.648 -10.257 -23.723 1.00 0.00 H new ATOM 0 HG13 VAL A 148 7.354 -10.786 -24.824 1.00 0.00 H new ATOM 0 HG21 VAL A 148 7.967 -8.699 -27.011 1.00 0.00 H new ATOM 0 HG22 VAL A 148 6.325 -9.057 -26.426 1.00 0.00 H new ATOM 0 HG23 VAL A 148 6.941 -7.388 -26.383 1.00 0.00 H new ATOM 2338 N HIS A 149 8.236 -7.443 -22.146 1.00 0.00 N ATOM 2339 CA HIS A 149 8.923 -7.397 -20.860 1.00 0.00 C ATOM 2340 C HIS A 149 9.586 -6.040 -20.649 1.00 0.00 C ATOM 2341 O HIS A 149 10.336 -5.566 -21.501 1.00 0.00 O ATOM 2342 CB HIS A 149 9.970 -8.510 -20.777 1.00 0.00 C ATOM 2343 CG HIS A 149 11.063 -8.382 -21.791 1.00 0.00 C ATOM 2344 ND1 HIS A 149 12.320 -8.923 -21.616 1.00 0.00 N ATOM 2345 CD2 HIS A 149 11.084 -7.771 -23.000 1.00 0.00 C ATOM 2346 CE1 HIS A 149 13.066 -8.649 -22.671 1.00 0.00 C ATOM 2347 NE2 HIS A 149 12.339 -7.952 -23.525 1.00 0.00 N ATOM 0 H HIS A 149 8.497 -6.696 -22.790 1.00 0.00 H new ATOM 0 HA HIS A 149 8.183 -7.547 -20.073 1.00 0.00 H new ATOM 0 HB2 HIS A 149 10.410 -8.510 -19.780 1.00 0.00 H new ATOM 0 HB3 HIS A 149 9.476 -9.473 -20.908 1.00 0.00 H new ATOM 0 HD1 HIS A 149 12.626 -9.452 -20.799 1.00 0.00 H new ATOM 0 HD2 HIS A 149 10.266 -7.240 -23.464 1.00 0.00 H new ATOM 0 HE1 HIS A 149 14.095 -8.945 -22.811 1.00 0.00 H new ATOM 2356 N ALA A 150 9.303 -5.420 -19.509 1.00 0.00 N ATOM 2357 CA ALA A 150 9.871 -4.117 -19.188 1.00 0.00 C ATOM 2358 C ALA A 150 10.734 -4.185 -17.933 1.00 0.00 C ATOM 2359 O ALA A 150 10.447 -4.946 -17.010 1.00 0.00 O ATOM 2360 CB ALA A 150 8.765 -3.089 -19.011 1.00 0.00 C ATOM 0 H ALA A 150 8.684 -5.799 -18.792 1.00 0.00 H new ATOM 0 HA ALA A 150 10.508 -3.814 -20.019 1.00 0.00 H new ATOM 0 HB1 ALA A 150 9.204 -2.120 -18.772 1.00 0.00 H new ATOM 0 HB2 ALA A 150 8.191 -3.009 -19.934 1.00 0.00 H new ATOM 0 HB3 ALA A 150 8.106 -3.399 -18.200 1.00 0.00 H new ATOM 2366 N ASN A 151 11.793 -3.382 -17.907 1.00 0.00 N ATOM 2367 CA ASN A 151 12.699 -3.350 -16.765 1.00 0.00 C ATOM 2368 C ASN A 151 13.269 -1.947 -16.565 1.00 0.00 C ATOM 2369 O ASN A 151 13.625 -1.269 -17.528 1.00 0.00 O ATOM 2370 CB ASN A 151 13.826 -4.375 -16.949 1.00 0.00 C ATOM 2371 CG ASN A 151 15.001 -3.834 -17.742 1.00 0.00 C ATOM 2372 OD1 ASN A 151 15.109 -4.058 -18.947 1.00 0.00 O ATOM 2373 ND2 ASN A 151 15.890 -3.119 -17.064 1.00 0.00 N ATOM 0 H ASN A 151 12.044 -2.745 -18.663 1.00 0.00 H new ATOM 0 HA ASN A 151 12.136 -3.615 -15.870 1.00 0.00 H new ATOM 0 HB2 ASN A 151 14.176 -4.701 -15.969 1.00 0.00 H new ATOM 0 HB3 ASN A 151 13.429 -5.255 -17.455 1.00 0.00 H new ATOM 0 HD21 ASN A 151 16.703 -2.730 -17.542 1.00 0.00 H new ATOM 0 HD22 ASN A 151 15.760 -2.958 -16.065 1.00 0.00 H new ATOM 2380 N ALA A 152 13.346 -1.517 -15.310 1.00 0.00 N ATOM 2381 CA ALA A 152 13.867 -0.196 -14.990 1.00 0.00 C ATOM 2382 C ALA A 152 15.297 -0.275 -14.466 1.00 0.00 C ATOM 2383 O ALA A 152 15.721 -1.301 -13.935 1.00 0.00 O ATOM 2384 CB ALA A 152 12.972 0.490 -13.970 1.00 0.00 C ATOM 0 H ALA A 152 13.054 -2.064 -14.500 1.00 0.00 H new ATOM 0 HA ALA A 152 13.877 0.391 -15.908 1.00 0.00 H new ATOM 0 HB1 ALA A 152 13.373 1.477 -13.740 1.00 0.00 H new ATOM 0 HB2 ALA A 152 11.967 0.593 -14.379 1.00 0.00 H new ATOM 0 HB3 ALA A 152 12.934 -0.108 -13.059 1.00 0.00 H new ATOM 2390 N GLU A 153 16.034 0.820 -14.620 1.00 0.00 N ATOM 2391 CA GLU A 153 17.417 0.884 -14.163 1.00 0.00 C ATOM 2392 C GLU A 153 17.726 2.254 -13.569 1.00 0.00 C ATOM 2393 O GLU A 153 17.178 3.268 -14.003 1.00 0.00 O ATOM 2394 CB GLU A 153 18.374 0.588 -15.320 1.00 0.00 C ATOM 2395 CG GLU A 153 19.595 -0.218 -14.907 1.00 0.00 C ATOM 2396 CD GLU A 153 20.518 -0.514 -16.073 1.00 0.00 C ATOM 2397 OE1 GLU A 153 20.997 0.446 -16.711 1.00 0.00 O1- ATOM 2398 OE2 GLU A 153 20.762 -1.708 -16.348 1.00 0.00 O ATOM 0 H GLU A 153 15.696 1.676 -15.059 1.00 0.00 H new ATOM 0 HA GLU A 153 17.555 0.130 -13.388 1.00 0.00 H new ATOM 0 HB2 GLU A 153 17.835 0.044 -16.096 1.00 0.00 H new ATOM 0 HB3 GLU A 153 18.702 1.530 -15.760 1.00 0.00 H new ATOM 0 HG2 GLU A 153 20.146 0.329 -14.142 1.00 0.00 H new ATOM 0 HG3 GLU A 153 19.271 -1.156 -14.457 1.00 0.00 H new ATOM 2405 N VAL A 154 18.604 2.279 -12.573 1.00 0.00 N ATOM 2406 CA VAL A 154 18.982 3.524 -11.919 1.00 0.00 C ATOM 2407 C VAL A 154 20.336 4.019 -12.415 1.00 0.00 C ATOM 2408 O VAL A 154 21.372 3.420 -12.124 1.00 0.00 O ATOM 2409 CB VAL A 154 19.041 3.364 -10.389 1.00 0.00 C ATOM 2410 CG1 VAL A 154 19.192 4.717 -9.714 1.00 0.00 C ATOM 2411 CG2 VAL A 154 17.801 2.641 -9.879 1.00 0.00 C ATOM 0 H VAL A 154 19.067 1.450 -12.201 1.00 0.00 H new ATOM 0 HA VAL A 154 18.214 4.255 -12.172 1.00 0.00 H new ATOM 0 HB VAL A 154 19.914 2.761 -10.140 1.00 0.00 H new ATOM 0 HG11 VAL A 154 19.232 4.582 -8.633 1.00 0.00 H new ATOM 0 HG12 VAL A 154 20.112 5.193 -10.054 1.00 0.00 H new ATOM 0 HG13 VAL A 154 18.341 5.348 -9.970 1.00 0.00 H new ATOM 0 HG21 VAL A 154 17.860 2.537 -8.796 1.00 0.00 H new ATOM 0 HG22 VAL A 154 16.912 3.215 -10.140 1.00 0.00 H new ATOM 0 HG23 VAL A 154 17.742 1.653 -10.336 1.00 0.00 H new ATOM 2421 N VAL A 155 20.321 5.119 -13.160 1.00 0.00 N ATOM 2422 CA VAL A 155 21.547 5.697 -13.692 1.00 0.00 C ATOM 2423 C VAL A 155 22.184 6.642 -12.668 1.00 0.00 C ATOM 2424 O VAL A 155 21.678 6.792 -11.557 1.00 0.00 O ATOM 2425 CB VAL A 155 21.283 6.430 -15.032 1.00 0.00 C ATOM 2426 CG1 VAL A 155 20.743 7.838 -14.811 1.00 0.00 C ATOM 2427 CG2 VAL A 155 22.542 6.460 -15.886 1.00 0.00 C ATOM 0 H VAL A 155 19.472 5.627 -13.409 1.00 0.00 H new ATOM 0 HA VAL A 155 22.246 4.885 -13.890 1.00 0.00 H new ATOM 0 HB VAL A 155 20.516 5.869 -15.566 1.00 0.00 H new ATOM 0 HG11 VAL A 155 20.571 8.317 -15.775 1.00 0.00 H new ATOM 0 HG12 VAL A 155 19.804 7.785 -14.260 1.00 0.00 H new ATOM 0 HG13 VAL A 155 21.467 8.420 -14.240 1.00 0.00 H new ATOM 0 HG21 VAL A 155 22.335 6.979 -16.822 1.00 0.00 H new ATOM 0 HG22 VAL A 155 23.334 6.983 -15.349 1.00 0.00 H new ATOM 0 HG23 VAL A 155 22.861 5.440 -16.100 1.00 0.00 H new ATOM 2437 N ASP A 156 23.299 7.266 -13.039 1.00 0.00 N ATOM 2438 CA ASP A 156 24.002 8.178 -12.140 1.00 0.00 C ATOM 2439 C ASP A 156 23.059 9.234 -11.562 1.00 0.00 C ATOM 2440 O ASP A 156 23.235 9.677 -10.427 1.00 0.00 O ATOM 2441 CB ASP A 156 25.156 8.861 -12.876 1.00 0.00 C ATOM 2442 CG ASP A 156 26.168 7.867 -13.411 1.00 0.00 C ATOM 2443 OD1 ASP A 156 27.044 7.434 -12.633 1.00 0.00 O1- ATOM 2444 OD2 ASP A 156 26.085 7.521 -14.608 1.00 0.00 O ATOM 0 H ASP A 156 23.735 7.157 -13.955 1.00 0.00 H new ATOM 0 HA ASP A 156 24.397 7.588 -11.313 1.00 0.00 H new ATOM 0 HB2 ASP A 156 24.758 9.451 -13.702 1.00 0.00 H new ATOM 0 HB3 ASP A 156 25.655 9.555 -12.200 1.00 0.00 H new ATOM 2449 N THR A 157 22.063 9.635 -12.344 1.00 0.00 N ATOM 2450 CA THR A 157 21.102 10.639 -11.897 1.00 0.00 C ATOM 2451 C THR A 157 19.676 10.255 -12.285 1.00 0.00 C ATOM 2452 O THR A 157 18.799 10.143 -11.428 1.00 0.00 O ATOM 2453 CB THR A 157 21.453 12.013 -12.476 1.00 0.00 C ATOM 2454 OG1 THR A 157 20.362 12.906 -12.341 1.00 0.00 O ATOM 2455 CG2 THR A 157 21.834 11.975 -13.941 1.00 0.00 C ATOM 0 H THR A 157 21.899 9.283 -13.287 1.00 0.00 H new ATOM 0 HA THR A 157 21.156 10.688 -10.809 1.00 0.00 H new ATOM 0 HB THR A 157 22.318 12.350 -11.905 1.00 0.00 H new ATOM 0 HG1 THR A 157 20.605 13.779 -12.715 1.00 0.00 H new ATOM 0 HG21 THR A 157 22.069 12.983 -14.282 1.00 0.00 H new ATOM 0 HG22 THR A 157 22.706 11.334 -14.074 1.00 0.00 H new ATOM 0 HG23 THR A 157 21.001 11.580 -14.523 1.00 0.00 H new ATOM 2463 N SER A 158 19.447 10.062 -13.580 1.00 0.00 N ATOM 2464 CA SER A 158 18.124 9.697 -14.079 1.00 0.00 C ATOM 2465 C SER A 158 17.858 8.203 -13.895 1.00 0.00 C ATOM 2466 O SER A 158 18.511 7.541 -13.088 1.00 0.00 O ATOM 2467 CB SER A 158 17.998 10.080 -15.556 1.00 0.00 C ATOM 2468 OG SER A 158 16.771 10.744 -15.808 1.00 0.00 O ATOM 0 H SER A 158 20.160 10.152 -14.304 1.00 0.00 H new ATOM 0 HA SER A 158 17.379 10.245 -13.502 1.00 0.00 H new ATOM 0 HB2 SER A 158 18.829 10.725 -15.840 1.00 0.00 H new ATOM 0 HB3 SER A 158 18.064 9.185 -16.174 1.00 0.00 H new ATOM 0 HG SER A 158 16.027 10.123 -15.663 1.00 0.00 H new ATOM 2474 N ALA A 159 16.893 7.678 -14.646 1.00 0.00 N ATOM 2475 CA ALA A 159 16.541 6.266 -14.566 1.00 0.00 C ATOM 2476 C ALA A 159 16.269 5.693 -15.954 1.00 0.00 C ATOM 2477 O ALA A 159 15.376 6.158 -16.662 1.00 0.00 O ATOM 2478 CB ALA A 159 15.329 6.073 -13.666 1.00 0.00 C ATOM 0 H ALA A 159 16.341 8.212 -15.317 1.00 0.00 H new ATOM 0 HA ALA A 159 17.386 5.728 -14.136 1.00 0.00 H new ATOM 0 HB1 ALA A 159 15.078 5.013 -13.616 1.00 0.00 H new ATOM 0 HB2 ALA A 159 15.557 6.440 -12.665 1.00 0.00 H new ATOM 0 HB3 ALA A 159 14.483 6.628 -14.071 1.00 0.00 H new ATOM 2484 N LYS A 160 17.046 4.686 -16.337 1.00 0.00 N ATOM 2485 CA LYS A 160 16.889 4.056 -17.643 1.00 0.00 C ATOM 2486 C LYS A 160 15.700 3.100 -17.651 1.00 0.00 C ATOM 2487 O LYS A 160 15.288 2.595 -16.607 1.00 0.00 O ATOM 2488 CB LYS A 160 18.165 3.303 -18.026 1.00 0.00 C ATOM 2489 CG LYS A 160 19.439 4.084 -17.748 1.00 0.00 C ATOM 2490 CD LYS A 160 20.637 3.461 -18.446 1.00 0.00 C ATOM 2491 CE LYS A 160 21.784 4.451 -18.574 1.00 0.00 C ATOM 2492 NZ LYS A 160 22.509 4.296 -19.865 1.00 0.00 N1+ ATOM 0 H LYS A 160 17.790 4.289 -15.763 1.00 0.00 H new ATOM 0 HA LYS A 160 16.703 4.842 -18.375 1.00 0.00 H new ATOM 0 HB2 LYS A 160 18.199 2.361 -17.478 1.00 0.00 H new ATOM 0 HB3 LYS A 160 18.126 3.054 -19.086 1.00 0.00 H new ATOM 0 HG2 LYS A 160 19.316 5.114 -18.083 1.00 0.00 H new ATOM 0 HG3 LYS A 160 19.619 4.118 -16.674 1.00 0.00 H new ATOM 0 HD2 LYS A 160 20.971 2.586 -17.888 1.00 0.00 H new ATOM 0 HD3 LYS A 160 20.342 3.114 -19.436 1.00 0.00 H new ATOM 0 HE2 LYS A 160 21.397 5.467 -18.494 1.00 0.00 H new ATOM 0 HE3 LYS A 160 22.480 4.309 -17.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 23.283 4.989 -19.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 22.900 3.334 -19.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 21.851 4.456 -20.654 1.00 0.00 H new ATOM 2506 N PHE A 161 15.155 2.857 -18.838 1.00 0.00 N ATOM 2507 CA PHE A 161 14.013 1.962 -18.990 1.00 0.00 C ATOM 2508 C PHE A 161 14.211 1.029 -20.181 1.00 0.00 C ATOM 2509 O PHE A 161 14.092 1.445 -21.333 1.00 0.00 O ATOM 2510 CB PHE A 161 12.726 2.769 -19.167 1.00 0.00 C ATOM 2511 CG PHE A 161 11.784 2.664 -18.002 1.00 0.00 C ATOM 2512 CD1 PHE A 161 11.510 1.434 -17.425 1.00 0.00 C ATOM 2513 CD2 PHE A 161 11.171 3.794 -17.485 1.00 0.00 C ATOM 2514 CE1 PHE A 161 10.643 1.335 -16.354 1.00 0.00 C ATOM 2515 CE2 PHE A 161 10.304 3.701 -16.415 1.00 0.00 C ATOM 2516 CZ PHE A 161 10.039 2.469 -15.848 1.00 0.00 C ATOM 0 H PHE A 161 15.486 3.268 -19.711 1.00 0.00 H new ATOM 0 HA PHE A 161 13.932 1.358 -18.086 1.00 0.00 H new ATOM 0 HB2 PHE A 161 12.983 3.817 -19.322 1.00 0.00 H new ATOM 0 HB3 PHE A 161 12.215 2.429 -20.068 1.00 0.00 H new ATOM 0 HD1 PHE A 161 11.979 0.544 -17.817 1.00 0.00 H new ATOM 0 HD2 PHE A 161 11.374 4.759 -17.925 1.00 0.00 H new ATOM 0 HE1 PHE A 161 10.438 0.371 -15.913 1.00 0.00 H new ATOM 0 HE2 PHE A 161 9.833 4.590 -16.021 1.00 0.00 H new ATOM 0 HZ PHE A 161 9.361 2.393 -15.011 1.00 0.00 H new ATOM 2526 N ASP A 162 14.509 -0.234 -19.896 1.00 0.00 N ATOM 2527 CA ASP A 162 14.721 -1.224 -20.947 1.00 0.00 C ATOM 2528 C ASP A 162 13.497 -2.120 -21.098 1.00 0.00 C ATOM 2529 O ASP A 162 13.301 -3.056 -20.322 1.00 0.00 O ATOM 2530 CB ASP A 162 15.955 -2.071 -20.637 1.00 0.00 C ATOM 2531 CG ASP A 162 17.220 -1.493 -21.241 1.00 0.00 C ATOM 2532 OD1 ASP A 162 17.261 -1.314 -22.476 1.00 0.00 O1- ATOM 2533 OD2 ASP A 162 18.170 -1.219 -20.477 1.00 0.00 O ATOM 0 H ASP A 162 14.609 -0.596 -18.948 1.00 0.00 H new ATOM 0 HA ASP A 162 14.882 -0.695 -21.887 1.00 0.00 H new ATOM 0 HB2 ASP A 162 16.075 -2.151 -19.557 1.00 0.00 H new ATOM 0 HB3 ASP A 162 15.803 -3.081 -21.017 1.00 0.00 H new ATOM 2538 N MET A 163 12.672 -1.825 -22.097 1.00 0.00 N ATOM 2539 CA MET A 163 11.464 -2.605 -22.346 1.00 0.00 C ATOM 2540 C MET A 163 11.423 -3.111 -23.783 1.00 0.00 C ATOM 2541 O MET A 163 12.217 -2.692 -24.624 1.00 0.00 O ATOM 2542 CB MET A 163 10.218 -1.764 -22.054 1.00 0.00 C ATOM 2543 CG MET A 163 10.369 -0.840 -20.857 1.00 0.00 C ATOM 2544 SD MET A 163 8.791 -0.178 -20.288 1.00 0.00 S ATOM 2545 CE MET A 163 8.797 1.433 -21.071 1.00 0.00 C ATOM 0 H MET A 163 12.817 -1.052 -22.747 1.00 0.00 H new ATOM 0 HA MET A 163 11.479 -3.467 -21.679 1.00 0.00 H new ATOM 0 HB2 MET A 163 9.979 -1.167 -22.934 1.00 0.00 H new ATOM 0 HB3 MET A 163 9.373 -2.431 -21.882 1.00 0.00 H new ATOM 0 HG2 MET A 163 10.846 -1.383 -20.041 1.00 0.00 H new ATOM 0 HG3 MET A 163 11.031 -0.015 -21.121 1.00 0.00 H new ATOM 0 HE1 MET A 163 7.773 1.794 -21.169 1.00 0.00 H new ATOM 0 HE2 MET A 163 9.371 2.131 -20.462 1.00 0.00 H new ATOM 0 HE3 MET A 163 9.250 1.356 -22.059 1.00 0.00 H new ATOM 2555 N LEU A 164 10.486 -4.013 -24.056 1.00 0.00 N ATOM 2556 CA LEU A 164 10.331 -4.579 -25.390 1.00 0.00 C ATOM 2557 C LEU A 164 8.865 -4.894 -25.674 1.00 0.00 C ATOM 2558 O LEU A 164 8.240 -5.678 -24.961 1.00 0.00 O ATOM 2559 CB LEU A 164 11.175 -5.848 -25.531 1.00 0.00 C ATOM 2560 CG LEU A 164 11.898 -5.996 -26.872 1.00 0.00 C ATOM 2561 CD1 LEU A 164 12.747 -7.257 -26.884 1.00 0.00 C ATOM 2562 CD2 LEU A 164 10.897 -6.013 -28.017 1.00 0.00 C ATOM 0 H LEU A 164 9.821 -4.368 -23.369 1.00 0.00 H new ATOM 0 HA LEU A 164 10.676 -3.842 -26.115 1.00 0.00 H new ATOM 0 HB2 LEU A 164 11.916 -5.865 -24.732 1.00 0.00 H new ATOM 0 HB3 LEU A 164 10.529 -6.714 -25.385 1.00 0.00 H new ATOM 0 HG LEU A 164 12.557 -5.138 -27.005 1.00 0.00 H new ATOM 0 HD11 LEU A 164 13.253 -7.346 -27.845 1.00 0.00 H new ATOM 0 HD12 LEU A 164 13.488 -7.204 -26.087 1.00 0.00 H new ATOM 0 HD13 LEU A 164 12.109 -8.127 -26.729 1.00 0.00 H new ATOM 0 HD21 LEU A 164 11.428 -6.119 -28.963 1.00 0.00 H new ATOM 0 HD22 LEU A 164 10.212 -6.852 -27.889 1.00 0.00 H new ATOM 0 HD23 LEU A 164 10.332 -5.081 -28.020 1.00 0.00 H new ATOM 2574 N LEU A 165 8.323 -4.276 -26.717 1.00 0.00 N ATOM 2575 CA LEU A 165 6.929 -4.491 -27.089 1.00 0.00 C ATOM 2576 C LEU A 165 6.775 -4.572 -28.604 1.00 0.00 C ATOM 2577 O LEU A 165 7.623 -4.087 -29.353 1.00 0.00 O ATOM 2578 CB LEU A 165 6.052 -3.367 -26.532 1.00 0.00 C ATOM 2579 CG LEU A 165 6.379 -1.967 -27.060 1.00 0.00 C ATOM 2580 CD1 LEU A 165 5.339 -1.521 -28.075 1.00 0.00 C ATOM 2581 CD2 LEU A 165 6.465 -0.972 -25.910 1.00 0.00 C ATOM 0 H LEU A 165 8.826 -3.624 -27.319 1.00 0.00 H new ATOM 0 HA LEU A 165 6.606 -5.440 -26.660 1.00 0.00 H new ATOM 0 HB2 LEU A 165 5.011 -3.591 -26.762 1.00 0.00 H new ATOM 0 HB3 LEU A 165 6.144 -3.360 -25.446 1.00 0.00 H new ATOM 0 HG LEU A 165 7.348 -2.005 -27.558 1.00 0.00 H new ATOM 0 HD11 LEU A 165 5.589 -0.524 -28.438 1.00 0.00 H new ATOM 0 HD12 LEU A 165 5.325 -2.219 -28.912 1.00 0.00 H new ATOM 0 HD13 LEU A 165 4.356 -1.499 -27.604 1.00 0.00 H new ATOM 0 HD21 LEU A 165 6.698 0.018 -26.302 1.00 0.00 H new ATOM 0 HD22 LEU A 165 5.510 -0.939 -25.385 1.00 0.00 H new ATOM 0 HD23 LEU A 165 7.248 -1.282 -25.218 1.00 0.00 H new ATOM 2593 N LYS A 166 5.685 -5.190 -29.049 1.00 0.00 N ATOM 2594 CA LYS A 166 5.417 -5.337 -30.475 1.00 0.00 C ATOM 2595 C LYS A 166 4.569 -4.181 -30.992 1.00 0.00 C ATOM 2596 O LYS A 166 3.736 -3.636 -30.267 1.00 0.00 O ATOM 2597 CB LYS A 166 4.710 -6.666 -30.748 1.00 0.00 C ATOM 2598 CG LYS A 166 4.767 -7.097 -32.204 1.00 0.00 C ATOM 2599 CD LYS A 166 3.755 -8.192 -32.501 1.00 0.00 C ATOM 2600 CE LYS A 166 4.404 -9.566 -32.501 1.00 0.00 C ATOM 2601 NZ LYS A 166 3.399 -10.657 -32.616 1.00 0.00 N1+ ATOM 0 H LYS A 166 4.973 -5.597 -28.442 1.00 0.00 H new ATOM 0 HA LYS A 166 6.372 -5.326 -31.001 1.00 0.00 H new ATOM 0 HB2 LYS A 166 5.162 -7.442 -30.130 1.00 0.00 H new ATOM 0 HB3 LYS A 166 3.667 -6.583 -30.443 1.00 0.00 H new ATOM 0 HG2 LYS A 166 4.574 -6.238 -32.847 1.00 0.00 H new ATOM 0 HG3 LYS A 166 5.770 -7.453 -32.440 1.00 0.00 H new ATOM 0 HD2 LYS A 166 2.959 -8.165 -31.757 1.00 0.00 H new ATOM 0 HD3 LYS A 166 3.292 -8.007 -33.470 1.00 0.00 H new ATOM 0 HE2 LYS A 166 5.109 -9.634 -33.329 1.00 0.00 H new ATOM 0 HE3 LYS A 166 4.977 -9.696 -31.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 166 3.884 -11.577 -32.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 166 2.741 -10.609 -31.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 166 2.869 -10.549 -33.504 1.00 0.00 H new ATOM 2615 N VAL A 167 4.786 -3.810 -32.250 1.00 0.00 N ATOM 2616 CA VAL A 167 4.040 -2.719 -32.864 1.00 0.00 C ATOM 2617 C VAL A 167 3.127 -3.232 -33.973 1.00 0.00 C ATOM 2618 O VAL A 167 3.520 -4.082 -34.771 1.00 0.00 O ATOM 2619 CB VAL A 167 4.985 -1.651 -33.449 1.00 0.00 C ATOM 2620 CG1 VAL A 167 5.570 -0.790 -32.340 1.00 0.00 C ATOM 2621 CG2 VAL A 167 6.089 -2.304 -34.267 1.00 0.00 C ATOM 0 H VAL A 167 5.472 -4.249 -32.863 1.00 0.00 H new ATOM 0 HA VAL A 167 3.435 -2.269 -32.077 1.00 0.00 H new ATOM 0 HB VAL A 167 4.408 -1.006 -34.112 1.00 0.00 H new ATOM 0 HG11 VAL A 167 6.234 -0.042 -32.772 1.00 0.00 H new ATOM 0 HG12 VAL A 167 4.763 -0.292 -31.802 1.00 0.00 H new ATOM 0 HG13 VAL A 167 6.132 -1.419 -31.649 1.00 0.00 H new ATOM 0 HG21 VAL A 167 6.746 -1.534 -34.672 1.00 0.00 H new ATOM 0 HG22 VAL A 167 6.666 -2.975 -33.630 1.00 0.00 H new ATOM 0 HG23 VAL A 167 5.648 -2.872 -35.086 1.00 0.00 H new ATOM 2631 N LYS A 168 1.905 -2.710 -34.015 1.00 0.00 N ATOM 2632 CA LYS A 168 0.935 -3.115 -35.025 1.00 0.00 C ATOM 2633 C LYS A 168 0.671 -1.983 -36.012 1.00 0.00 C ATOM 2634 O LYS A 168 0.646 -0.811 -35.635 1.00 0.00 O ATOM 2635 CB LYS A 168 -0.375 -3.547 -34.361 1.00 0.00 C ATOM 2636 CG LYS A 168 -0.469 -5.044 -34.115 1.00 0.00 C ATOM 2637 CD LYS A 168 0.713 -5.552 -33.306 1.00 0.00 C ATOM 2638 CE LYS A 168 0.281 -6.579 -32.271 1.00 0.00 C ATOM 2639 NZ LYS A 168 0.251 -7.957 -32.833 1.00 0.00 N1+ ATOM 0 H LYS A 168 1.564 -2.006 -33.361 1.00 0.00 H new ATOM 0 HA LYS A 168 1.351 -3.960 -35.574 1.00 0.00 H new ATOM 0 HB2 LYS A 168 -0.480 -3.024 -33.411 1.00 0.00 H new ATOM 0 HB3 LYS A 168 -1.210 -3.238 -34.989 1.00 0.00 H new ATOM 0 HG2 LYS A 168 -1.396 -5.269 -33.587 1.00 0.00 H new ATOM 0 HG3 LYS A 168 -0.510 -5.569 -35.070 1.00 0.00 H new ATOM 0 HD2 LYS A 168 1.449 -5.997 -33.976 1.00 0.00 H new ATOM 0 HD3 LYS A 168 1.201 -4.714 -32.807 1.00 0.00 H new ATOM 0 HE2 LYS A 168 0.964 -6.548 -31.422 1.00 0.00 H new ATOM 0 HE3 LYS A 168 -0.708 -6.320 -31.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 168 0.170 -8.646 -32.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 168 -0.565 -8.054 -33.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 168 1.128 -8.135 -33.364 1.00 0.00 H new ATOM 2653 N ARG A 169 0.475 -2.341 -37.276 1.00 0.00 N ATOM 2654 CA ARG A 169 0.213 -1.356 -38.318 1.00 0.00 C ATOM 2655 C ARG A 169 -0.447 -2.007 -39.529 1.00 0.00 C ATOM 2656 O ARG A 169 0.233 -2.504 -40.426 1.00 0.00 O ATOM 2657 CB ARG A 169 1.514 -0.670 -38.740 1.00 0.00 C ATOM 2658 CG ARG A 169 1.303 0.698 -39.367 1.00 0.00 C ATOM 2659 CD ARG A 169 2.528 1.146 -40.150 1.00 0.00 C ATOM 2660 NE ARG A 169 2.393 0.875 -41.579 1.00 0.00 N ATOM 2661 CZ ARG A 169 3.143 1.449 -42.517 1.00 0.00 C ATOM 2662 NH1 ARG A 169 4.082 2.326 -42.181 1.00 0.00 N1+ ATOM 2663 NH2 ARG A 169 2.956 1.146 -43.794 1.00 0.00 N ATOM 0 H ARG A 169 0.493 -3.307 -37.604 1.00 0.00 H new ATOM 0 HA ARG A 169 -0.469 -0.609 -37.913 1.00 0.00 H new ATOM 0 HB2 ARG A 169 2.160 -0.565 -37.868 1.00 0.00 H new ATOM 0 HB3 ARG A 169 2.039 -1.309 -39.450 1.00 0.00 H new ATOM 0 HG2 ARG A 169 0.438 0.667 -40.029 1.00 0.00 H new ATOM 0 HG3 ARG A 169 1.081 1.427 -38.587 1.00 0.00 H new ATOM 0 HD2 ARG A 169 2.686 2.214 -39.997 1.00 0.00 H new ATOM 0 HD3 ARG A 169 3.411 0.635 -39.766 1.00 0.00 H new ATOM 0 HE ARG A 169 1.682 0.206 -41.876 1.00 0.00 H new ATOM 0 HH11 ARG A 169 4.231 2.563 -41.200 1.00 0.00 H new ATOM 0 HH12 ARG A 169 4.654 2.763 -42.904 1.00 0.00 H new ATOM 0 HH21 ARG A 169 2.237 0.473 -44.058 1.00 0.00 H new ATOM 0 HH22 ARG A 169 3.531 1.586 -44.512 1.00 0.00 H new ATOM 2677 N GLY A 170 -1.776 -2.001 -39.548 1.00 0.00 N ATOM 2678 CA GLY A 170 -2.505 -2.596 -40.653 1.00 0.00 C ATOM 2679 C GLY A 170 -2.542 -4.110 -40.581 1.00 0.00 C ATOM 2680 O GLY A 170 -2.792 -4.778 -41.585 1.00 0.00 O ATOM 0 H GLY A 170 -2.361 -1.595 -38.818 1.00 0.00 H new ATOM 0 HA2 GLY A 170 -3.525 -2.211 -40.659 1.00 0.00 H new ATOM 0 HA3 GLY A 170 -2.044 -2.292 -41.593 1.00 0.00 H new ATOM 2684 N GLY A 171 -2.297 -4.655 -39.393 1.00 0.00 N ATOM 2685 CA GLY A 171 -2.313 -6.096 -39.222 1.00 0.00 C ATOM 2686 C GLY A 171 -0.929 -6.711 -39.301 1.00 0.00 C ATOM 2687 O GLY A 171 -0.785 -7.886 -39.638 1.00 0.00 O ATOM 0 H GLY A 171 -2.088 -4.125 -38.547 1.00 0.00 H new ATOM 0 HA2 GLY A 171 -2.759 -6.338 -38.257 1.00 0.00 H new ATOM 0 HA3 GLY A 171 -2.948 -6.541 -39.988 1.00 0.00 H new ATOM 2691 N LYS A 172 0.091 -5.918 -38.988 1.00 0.00 N ATOM 2692 CA LYS A 172 1.469 -6.397 -39.025 1.00 0.00 C ATOM 2693 C LYS A 172 1.976 -6.700 -37.619 1.00 0.00 C ATOM 2694 O LYS A 172 1.270 -6.482 -36.634 1.00 0.00 O ATOM 2695 CB LYS A 172 2.375 -5.365 -39.703 1.00 0.00 C ATOM 2696 CG LYS A 172 2.648 -4.133 -38.852 1.00 0.00 C ATOM 2697 CD LYS A 172 4.138 -3.921 -38.635 1.00 0.00 C ATOM 2698 CE LYS A 172 4.406 -2.725 -37.735 1.00 0.00 C ATOM 2699 NZ LYS A 172 5.586 -1.940 -38.192 1.00 0.00 N1+ ATOM 0 H LYS A 172 -0.010 -4.943 -38.706 1.00 0.00 H new ATOM 0 HA LYS A 172 1.492 -7.320 -39.605 1.00 0.00 H new ATOM 0 HB2 LYS A 172 3.324 -5.838 -39.955 1.00 0.00 H new ATOM 0 HB3 LYS A 172 1.916 -5.053 -40.641 1.00 0.00 H new ATOM 0 HG2 LYS A 172 2.222 -3.254 -39.336 1.00 0.00 H new ATOM 0 HG3 LYS A 172 2.151 -4.239 -37.888 1.00 0.00 H new ATOM 0 HD2 LYS A 172 4.573 -4.816 -38.191 1.00 0.00 H new ATOM 0 HD3 LYS A 172 4.629 -3.771 -39.597 1.00 0.00 H new ATOM 0 HE2 LYS A 172 3.527 -2.081 -37.716 1.00 0.00 H new ATOM 0 HE3 LYS A 172 4.572 -3.069 -36.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 172 5.870 -1.274 -37.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 172 6.374 -2.586 -38.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 172 5.339 -1.411 -39.052 1.00 0.00 H new ATOM 2713 N GLU A 173 3.204 -7.199 -37.533 1.00 0.00 N ATOM 2714 CA GLU A 173 3.804 -7.526 -36.245 1.00 0.00 C ATOM 2715 C GLU A 173 5.324 -7.427 -36.311 1.00 0.00 C ATOM 2716 O GLU A 173 5.968 -8.125 -37.094 1.00 0.00 O ATOM 2717 CB GLU A 173 3.390 -8.932 -35.809 1.00 0.00 C ATOM 2718 CG GLU A 173 3.614 -9.991 -36.876 1.00 0.00 C ATOM 2719 CD GLU A 173 4.067 -11.317 -36.295 1.00 0.00 C ATOM 2720 OE1 GLU A 173 5.242 -11.416 -35.888 1.00 0.00 O1- ATOM 2721 OE2 GLU A 173 3.244 -12.257 -36.249 1.00 0.00 O ATOM 0 H GLU A 173 3.802 -7.386 -38.338 1.00 0.00 H new ATOM 0 HA GLU A 173 3.444 -6.805 -35.511 1.00 0.00 H new ATOM 0 HB2 GLU A 173 3.950 -9.205 -34.915 1.00 0.00 H new ATOM 0 HB3 GLU A 173 2.335 -8.922 -35.534 1.00 0.00 H new ATOM 0 HG2 GLU A 173 2.690 -10.140 -37.435 1.00 0.00 H new ATOM 0 HG3 GLU A 173 4.361 -9.635 -37.585 1.00 0.00 H new ATOM 2728 N GLU A 174 5.891 -6.554 -35.485 1.00 0.00 N ATOM 2729 CA GLU A 174 7.336 -6.364 -35.448 1.00 0.00 C ATOM 2730 C GLU A 174 7.786 -5.868 -34.078 1.00 0.00 C ATOM 2731 O GLU A 174 7.362 -4.805 -33.621 1.00 0.00 O ATOM 2732 CB GLU A 174 7.768 -5.371 -36.530 1.00 0.00 C ATOM 2733 CG GLU A 174 7.392 -5.803 -37.937 1.00 0.00 C ATOM 2734 CD GLU A 174 8.038 -4.942 -39.004 1.00 0.00 C ATOM 2735 OE1 GLU A 174 8.023 -3.701 -38.855 1.00 0.00 O1- ATOM 2736 OE2 GLU A 174 8.559 -5.507 -39.988 1.00 0.00 O ATOM 0 H GLU A 174 5.372 -5.967 -34.832 1.00 0.00 H new ATOM 0 HA GLU A 174 7.809 -7.328 -35.638 1.00 0.00 H new ATOM 0 HB2 GLU A 174 7.315 -4.401 -36.323 1.00 0.00 H new ATOM 0 HB3 GLU A 174 8.848 -5.236 -36.477 1.00 0.00 H new ATOM 0 HG2 GLU A 174 7.688 -6.842 -38.085 1.00 0.00 H new ATOM 0 HG3 GLU A 174 6.309 -5.761 -38.048 1.00 0.00 H new ATOM 2743 N LYS A 175 8.647 -6.643 -33.427 1.00 0.00 N ATOM 2744 CA LYS A 175 9.155 -6.283 -32.108 1.00 0.00 C ATOM 2745 C LYS A 175 10.358 -5.353 -32.225 1.00 0.00 C ATOM 2746 O LYS A 175 10.997 -5.280 -33.276 1.00 0.00 O ATOM 2747 CB LYS A 175 9.541 -7.542 -31.328 1.00 0.00 C ATOM 2748 CG LYS A 175 8.945 -7.598 -29.931 1.00 0.00 C ATOM 2749 CD LYS A 175 7.546 -8.193 -29.946 1.00 0.00 C ATOM 2750 CE LYS A 175 7.587 -9.710 -30.008 1.00 0.00 C ATOM 2751 NZ LYS A 175 7.959 -10.310 -28.697 1.00 0.00 N1+ ATOM 0 H LYS A 175 9.008 -7.525 -33.791 1.00 0.00 H new ATOM 0 HA LYS A 175 8.365 -5.759 -31.570 1.00 0.00 H new ATOM 0 HB2 LYS A 175 9.217 -8.420 -31.888 1.00 0.00 H new ATOM 0 HB3 LYS A 175 10.627 -7.594 -31.253 1.00 0.00 H new ATOM 0 HG2 LYS A 175 9.588 -8.194 -29.283 1.00 0.00 H new ATOM 0 HG3 LYS A 175 8.910 -6.594 -29.509 1.00 0.00 H new ATOM 0 HD2 LYS A 175 7.006 -7.879 -29.053 1.00 0.00 H new ATOM 0 HD3 LYS A 175 6.995 -7.808 -30.804 1.00 0.00 H new ATOM 0 HE2 LYS A 175 6.612 -10.087 -30.316 1.00 0.00 H new ATOM 0 HE3 LYS A 175 8.304 -10.023 -30.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 175 8.207 -11.311 -28.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 175 8.775 -9.801 -28.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 175 7.155 -10.237 -28.041 1.00 0.00 H new ATOM 2765 N TYR A 176 10.664 -4.646 -31.143 1.00 0.00 N ATOM 2766 CA TYR A 176 11.792 -3.723 -31.130 1.00 0.00 C ATOM 2767 C TYR A 176 12.145 -3.308 -29.704 1.00 0.00 C ATOM 2768 O TYR A 176 11.283 -3.265 -28.827 1.00 0.00 O ATOM 2769 CB TYR A 176 11.480 -2.489 -31.985 1.00 0.00 C ATOM 2770 CG TYR A 176 10.629 -1.450 -31.286 1.00 0.00 C ATOM 2771 CD1 TYR A 176 9.294 -1.697 -30.993 1.00 0.00 C ATOM 2772 CD2 TYR A 176 11.167 -0.223 -30.917 1.00 0.00 C ATOM 2773 CE1 TYR A 176 8.518 -0.749 -30.353 1.00 0.00 C ATOM 2774 CE2 TYR A 176 10.397 0.729 -30.278 1.00 0.00 C ATOM 2775 CZ TYR A 176 9.075 0.462 -29.998 1.00 0.00 C ATOM 2776 OH TYR A 176 8.307 1.409 -29.360 1.00 0.00 O ATOM 0 H TYR A 176 10.147 -4.694 -30.265 1.00 0.00 H new ATOM 0 HA TYR A 176 12.655 -4.236 -31.555 1.00 0.00 H new ATOM 0 HB2 TYR A 176 12.418 -2.027 -32.293 1.00 0.00 H new ATOM 0 HB3 TYR A 176 10.970 -2.809 -32.893 1.00 0.00 H new ATOM 0 HD1 TYR A 176 8.855 -2.644 -31.270 1.00 0.00 H new ATOM 0 HD2 TYR A 176 12.204 -0.010 -31.133 1.00 0.00 H new ATOM 0 HE1 TYR A 176 7.481 -0.955 -30.132 1.00 0.00 H new ATOM 0 HE2 TYR A 176 10.829 1.679 -29.999 1.00 0.00 H new ATOM 0 HH TYR A 176 7.999 1.055 -28.500 1.00 0.00 H new ATOM 2786 N LYS A 177 13.419 -3.002 -29.483 1.00 0.00 N ATOM 2787 CA LYS A 177 13.891 -2.587 -28.168 1.00 0.00 C ATOM 2788 C LYS A 177 13.595 -1.110 -27.930 1.00 0.00 C ATOM 2789 O LYS A 177 13.414 -0.344 -28.877 1.00 0.00 O ATOM 2790 CB LYS A 177 15.394 -2.843 -28.032 1.00 0.00 C ATOM 2791 CG LYS A 177 15.854 -4.143 -28.673 1.00 0.00 C ATOM 2792 CD LYS A 177 15.092 -5.338 -28.121 1.00 0.00 C ATOM 2793 CE LYS A 177 15.290 -5.484 -26.620 1.00 0.00 C ATOM 2794 NZ LYS A 177 15.839 -6.820 -26.260 1.00 0.00 N1+ ATOM 0 H LYS A 177 14.144 -3.034 -30.200 1.00 0.00 H new ATOM 0 HA LYS A 177 13.362 -3.176 -27.419 1.00 0.00 H new ATOM 0 HB2 LYS A 177 15.937 -2.013 -28.484 1.00 0.00 H new ATOM 0 HB3 LYS A 177 15.657 -2.857 -26.974 1.00 0.00 H new ATOM 0 HG2 LYS A 177 15.713 -4.087 -29.752 1.00 0.00 H new ATOM 0 HG3 LYS A 177 16.921 -4.278 -28.498 1.00 0.00 H new ATOM 0 HD2 LYS A 177 14.030 -5.225 -28.339 1.00 0.00 H new ATOM 0 HD3 LYS A 177 15.426 -6.246 -28.623 1.00 0.00 H new ATOM 0 HE2 LYS A 177 15.966 -4.706 -26.266 1.00 0.00 H new ATOM 0 HE3 LYS A 177 14.337 -5.334 -26.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 177 15.589 -7.044 -25.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 177 15.438 -7.542 -26.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 177 16.874 -6.809 -26.361 1.00 0.00 H new ATOM 2808 N VAL A 178 13.548 -0.716 -26.663 1.00 0.00 N ATOM 2809 CA VAL A 178 13.276 0.670 -26.304 1.00 0.00 C ATOM 2810 C VAL A 178 14.067 1.086 -25.070 1.00 0.00 C ATOM 2811 O VAL A 178 14.138 0.348 -24.087 1.00 0.00 O ATOM 2812 CB VAL A 178 11.777 0.899 -26.041 1.00 0.00 C ATOM 2813 CG1 VAL A 178 10.996 0.875 -27.345 1.00 0.00 C ATOM 2814 CG2 VAL A 178 11.241 -0.141 -25.071 1.00 0.00 C ATOM 0 H VAL A 178 13.695 -1.337 -25.867 1.00 0.00 H new ATOM 0 HA VAL A 178 13.586 1.281 -27.152 1.00 0.00 H new ATOM 0 HB VAL A 178 11.652 1.883 -25.589 1.00 0.00 H new ATOM 0 HG11 VAL A 178 9.938 1.039 -27.139 1.00 0.00 H new ATOM 0 HG12 VAL A 178 11.363 1.662 -28.004 1.00 0.00 H new ATOM 0 HG13 VAL A 178 11.126 -0.093 -27.829 1.00 0.00 H new ATOM 0 HG21 VAL A 178 10.180 0.037 -24.897 1.00 0.00 H new ATOM 0 HG22 VAL A 178 11.378 -1.137 -25.493 1.00 0.00 H new ATOM 0 HG23 VAL A 178 11.780 -0.070 -24.127 1.00 0.00 H new ATOM 2824 N GLU A 179 14.659 2.273 -25.128 1.00 0.00 N ATOM 2825 CA GLU A 179 15.445 2.792 -24.016 1.00 0.00 C ATOM 2826 C GLU A 179 15.079 4.243 -23.724 1.00 0.00 C ATOM 2827 O GLU A 179 15.461 5.151 -24.463 1.00 0.00 O ATOM 2828 CB GLU A 179 16.939 2.680 -24.322 1.00 0.00 C ATOM 2829 CG GLU A 179 17.829 3.290 -23.251 1.00 0.00 C ATOM 2830 CD GLU A 179 19.288 2.919 -23.424 1.00 0.00 C ATOM 2831 OE1 GLU A 179 19.571 1.739 -23.720 1.00 0.00 O ATOM 2832 OE2 GLU A 179 20.150 3.809 -23.264 1.00 0.00 O1- ATOM 0 H GLU A 179 14.609 2.895 -25.935 1.00 0.00 H new ATOM 0 HA GLU A 179 15.219 2.194 -23.133 1.00 0.00 H new ATOM 0 HB2 GLU A 179 17.199 1.628 -24.442 1.00 0.00 H new ATOM 0 HB3 GLU A 179 17.144 3.169 -25.274 1.00 0.00 H new ATOM 0 HG2 GLU A 179 17.729 4.375 -23.275 1.00 0.00 H new ATOM 0 HG3 GLU A 179 17.488 2.960 -22.270 1.00 0.00 H new ATOM 2839 N VAL A 180 14.338 4.454 -22.642 1.00 0.00 N ATOM 2840 CA VAL A 180 13.920 5.794 -22.251 1.00 0.00 C ATOM 2841 C VAL A 180 14.390 6.122 -20.837 1.00 0.00 C ATOM 2842 O VAL A 180 14.510 5.237 -19.991 1.00 0.00 O ATOM 2843 CB VAL A 180 12.388 5.954 -22.329 1.00 0.00 C ATOM 2844 CG1 VAL A 180 11.697 5.016 -21.352 1.00 0.00 C ATOM 2845 CG2 VAL A 180 11.986 7.398 -22.067 1.00 0.00 C ATOM 0 H VAL A 180 14.014 3.713 -22.020 1.00 0.00 H new ATOM 0 HA VAL A 180 14.380 6.489 -22.954 1.00 0.00 H new ATOM 0 HB VAL A 180 12.068 5.688 -23.337 1.00 0.00 H new ATOM 0 HG11 VAL A 180 10.617 5.146 -21.424 1.00 0.00 H new ATOM 0 HG12 VAL A 180 11.955 3.985 -21.593 1.00 0.00 H new ATOM 0 HG13 VAL A 180 12.023 5.244 -20.337 1.00 0.00 H new ATOM 0 HG21 VAL A 180 10.902 7.490 -22.126 1.00 0.00 H new ATOM 0 HG22 VAL A 180 12.321 7.694 -21.073 1.00 0.00 H new ATOM 0 HG23 VAL A 180 12.447 8.045 -22.813 1.00 0.00 H new ATOM 2855 N HIS A 181 14.659 7.399 -20.589 1.00 0.00 N ATOM 2856 CA HIS A 181 15.119 7.840 -19.278 1.00 0.00 C ATOM 2857 C HIS A 181 13.970 8.438 -18.473 1.00 0.00 C ATOM 2858 O HIS A 181 13.013 8.969 -19.036 1.00 0.00 O ATOM 2859 CB HIS A 181 16.241 8.867 -19.421 1.00 0.00 C ATOM 2860 CG HIS A 181 17.610 8.260 -19.438 1.00 0.00 C ATOM 2861 ND1 HIS A 181 18.764 8.998 -19.278 1.00 0.00 N ATOM 2862 CD2 HIS A 181 18.007 6.975 -19.596 1.00 0.00 C ATOM 2863 CE1 HIS A 181 19.811 8.194 -19.337 1.00 0.00 C ATOM 2864 NE2 HIS A 181 19.378 6.962 -19.529 1.00 0.00 N ATOM 0 H HIS A 181 14.567 8.146 -21.278 1.00 0.00 H new ATOM 0 HA HIS A 181 15.502 6.969 -18.746 1.00 0.00 H new ATOM 0 HB2 HIS A 181 16.091 9.431 -20.342 1.00 0.00 H new ATOM 0 HB3 HIS A 181 16.178 9.579 -18.598 1.00 0.00 H new ATOM 0 HD1 HIS A 181 18.803 10.007 -19.136 1.00 0.00 H new ATOM 0 HD2 HIS A 181 17.365 6.120 -19.747 1.00 0.00 H new ATOM 0 HE1 HIS A 181 20.844 8.494 -19.244 1.00 0.00 H new ATOM 2873 N LYS A 182 14.070 8.341 -17.153 1.00 0.00 N ATOM 2874 CA LYS A 182 13.038 8.868 -16.268 1.00 0.00 C ATOM 2875 C LYS A 182 13.528 10.117 -15.544 1.00 0.00 C ATOM 2876 O LYS A 182 14.548 10.088 -14.854 1.00 0.00 O ATOM 2877 CB LYS A 182 12.619 7.804 -15.252 1.00 0.00 C ATOM 2878 CG LYS A 182 11.343 7.073 -15.634 1.00 0.00 C ATOM 2879 CD LYS A 182 10.122 7.718 -14.999 1.00 0.00 C ATOM 2880 CE LYS A 182 9.956 7.287 -13.551 1.00 0.00 C ATOM 2881 NZ LYS A 182 10.064 5.811 -13.393 1.00 0.00 N1+ ATOM 0 H LYS A 182 14.855 7.902 -16.672 1.00 0.00 H new ATOM 0 HA LYS A 182 12.175 9.140 -16.876 1.00 0.00 H new ATOM 0 HB2 LYS A 182 13.425 7.079 -15.143 1.00 0.00 H new ATOM 0 HB3 LYS A 182 12.481 8.276 -14.279 1.00 0.00 H new ATOM 0 HG2 LYS A 182 11.233 7.072 -16.718 1.00 0.00 H new ATOM 0 HG3 LYS A 182 11.411 6.031 -15.320 1.00 0.00 H new ATOM 0 HD2 LYS A 182 10.215 8.803 -15.049 1.00 0.00 H new ATOM 0 HD3 LYS A 182 9.230 7.448 -15.565 1.00 0.00 H new ATOM 0 HE2 LYS A 182 10.715 7.774 -12.939 1.00 0.00 H new ATOM 0 HE3 LYS A 182 8.986 7.621 -13.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 182 9.579 5.519 -12.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 182 9.622 5.341 -14.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 182 11.067 5.540 -13.338 1.00 0.00 H new ATOM 2895 N SER A 183 12.796 11.214 -15.705 1.00 0.00 N ATOM 2896 CA SER A 183 13.156 12.475 -15.066 1.00 0.00 C ATOM 2897 C SER A 183 11.916 13.194 -14.544 1.00 0.00 C ATOM 2898 O SER A 183 10.863 13.176 -15.179 1.00 0.00 O ATOM 2899 CB SER A 183 13.905 13.374 -16.051 1.00 0.00 C ATOM 2900 OG SER A 183 14.459 14.500 -15.393 1.00 0.00 O ATOM 0 H SER A 183 11.950 11.256 -16.273 1.00 0.00 H new ATOM 0 HA SER A 183 13.807 12.253 -14.221 1.00 0.00 H new ATOM 0 HB2 SER A 183 14.698 12.806 -16.536 1.00 0.00 H new ATOM 0 HB3 SER A 183 13.225 13.705 -16.836 1.00 0.00 H new ATOM 0 HG SER A 183 14.934 15.058 -16.044 1.00 0.00 H new ATOM 2964 N PHE A 189 9.069 12.038 -19.918 1.00 0.00 N ATOM 2965 CA PHE A 189 10.060 11.048 -20.323 1.00 0.00 C ATOM 2966 C PHE A 189 10.983 11.610 -21.401 1.00 0.00 C ATOM 2967 O PHE A 189 10.638 12.570 -22.089 1.00 0.00 O ATOM 2968 CB PHE A 189 9.369 9.785 -20.842 1.00 0.00 C ATOM 2969 CG PHE A 189 8.918 8.856 -19.752 1.00 0.00 C ATOM 2970 CD1 PHE A 189 7.672 9.007 -19.165 1.00 0.00 C ATOM 2971 CD2 PHE A 189 9.739 7.828 -19.316 1.00 0.00 C ATOM 2972 CE1 PHE A 189 7.252 8.153 -18.163 1.00 0.00 C ATOM 2973 CE2 PHE A 189 9.326 6.970 -18.313 1.00 0.00 C ATOM 2974 CZ PHE A 189 8.080 7.132 -17.737 1.00 0.00 C ATOM 0 HA PHE A 189 10.660 10.795 -19.449 1.00 0.00 H new ATOM 0 HB2 PHE A 189 8.506 10.074 -21.442 1.00 0.00 H new ATOM 0 HB3 PHE A 189 10.053 9.252 -21.502 1.00 0.00 H new ATOM 0 HD1 PHE A 189 7.020 9.803 -19.495 1.00 0.00 H new ATOM 0 HD2 PHE A 189 10.712 7.695 -19.765 1.00 0.00 H new ATOM 0 HE1 PHE A 189 6.279 8.283 -17.714 1.00 0.00 H new ATOM 0 HE2 PHE A 189 9.976 6.174 -17.980 1.00 0.00 H new ATOM 0 HZ PHE A 189 7.754 6.462 -16.955 1.00 0.00 H new ATOM 2984 N ASN A 190 12.155 11.000 -21.545 1.00 0.00 N ATOM 2985 CA ASN A 190 13.126 11.434 -22.543 1.00 0.00 C ATOM 2986 C ASN A 190 13.781 10.233 -23.217 1.00 0.00 C ATOM 2987 O ASN A 190 14.828 9.755 -22.780 1.00 0.00 O ATOM 2988 CB ASN A 190 14.200 12.335 -21.914 1.00 0.00 C ATOM 2989 CG ASN A 190 14.283 12.200 -20.404 1.00 0.00 C ATOM 2990 OD1 ASN A 190 14.304 13.196 -19.682 1.00 0.00 O ATOM 2991 ND2 ASN A 190 14.333 10.964 -19.920 1.00 0.00 N ATOM 0 H ASN A 190 12.455 10.203 -20.983 1.00 0.00 H new ATOM 0 HA ASN A 190 12.591 12.011 -23.297 1.00 0.00 H new ATOM 0 HB2 ASN A 190 15.170 12.091 -22.348 1.00 0.00 H new ATOM 0 HB3 ASN A 190 13.989 13.374 -22.169 1.00 0.00 H new ATOM 0 HD21 ASN A 190 14.391 10.813 -18.913 1.00 0.00 H new ATOM 0 HD22 ASN A 190 14.313 10.166 -20.555 1.00 0.00 H new ATOM 2998 N LEU A 191 13.154 9.751 -24.286 1.00 0.00 N ATOM 2999 CA LEU A 191 13.665 8.604 -25.031 1.00 0.00 C ATOM 3000 C LEU A 191 15.140 8.789 -25.382 1.00 0.00 C ATOM 3001 O LEU A 191 15.511 9.750 -26.054 1.00 0.00 O ATOM 3002 CB LEU A 191 12.849 8.405 -26.311 1.00 0.00 C ATOM 3003 CG LEU A 191 13.011 7.041 -26.985 1.00 0.00 C ATOM 3004 CD1 LEU A 191 14.424 6.871 -27.524 1.00 0.00 C ATOM 3005 CD2 LEU A 191 12.671 5.920 -26.014 1.00 0.00 C ATOM 0 H LEU A 191 12.287 10.139 -24.657 1.00 0.00 H new ATOM 0 HA LEU A 191 13.571 7.721 -24.399 1.00 0.00 H new ATOM 0 HB2 LEU A 191 11.795 8.553 -26.077 1.00 0.00 H new ATOM 0 HB3 LEU A 191 13.129 9.180 -27.025 1.00 0.00 H new ATOM 0 HG LEU A 191 12.317 6.991 -27.824 1.00 0.00 H new ATOM 0 HD11 LEU A 191 14.517 5.894 -27.999 1.00 0.00 H new ATOM 0 HD12 LEU A 191 14.631 7.652 -28.256 1.00 0.00 H new ATOM 0 HD13 LEU A 191 15.138 6.945 -26.704 1.00 0.00 H new ATOM 0 HD21 LEU A 191 12.792 4.958 -26.512 1.00 0.00 H new ATOM 0 HD22 LEU A 191 13.338 5.970 -25.153 1.00 0.00 H new ATOM 0 HD23 LEU A 191 11.639 6.028 -25.680 1.00 0.00 H new ATOM 3017 N LYS A 192 15.974 7.860 -24.927 1.00 0.00 N ATOM 3018 CA LYS A 192 17.406 7.922 -25.199 1.00 0.00 C ATOM 3019 C LYS A 192 17.728 7.295 -26.551 1.00 0.00 C ATOM 3020 O LYS A 192 18.089 7.992 -27.500 1.00 0.00 O ATOM 3021 CB LYS A 192 18.189 7.212 -24.093 1.00 0.00 C ATOM 3022 CG LYS A 192 17.947 7.791 -22.708 1.00 0.00 C ATOM 3023 CD LYS A 192 18.248 9.282 -22.667 1.00 0.00 C ATOM 3024 CE LYS A 192 19.710 9.564 -22.969 1.00 0.00 C ATOM 3025 NZ LYS A 192 20.166 10.844 -22.361 1.00 0.00 N1+ ATOM 0 H LYS A 192 15.684 7.057 -24.369 1.00 0.00 H new ATOM 0 HA LYS A 192 17.701 8.971 -25.225 1.00 0.00 H new ATOM 0 HB2 LYS A 192 17.919 6.156 -24.089 1.00 0.00 H new ATOM 0 HB3 LYS A 192 19.254 7.268 -24.320 1.00 0.00 H new ATOM 0 HG2 LYS A 192 16.911 7.620 -22.417 1.00 0.00 H new ATOM 0 HG3 LYS A 192 18.572 7.272 -21.981 1.00 0.00 H new ATOM 0 HD2 LYS A 192 17.619 9.801 -23.391 1.00 0.00 H new ATOM 0 HD3 LYS A 192 17.996 9.678 -21.683 1.00 0.00 H new ATOM 0 HE2 LYS A 192 20.323 8.745 -22.593 1.00 0.00 H new ATOM 0 HE3 LYS A 192 19.857 9.602 -24.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 192 21.168 11.000 -22.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 192 19.598 11.629 -22.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 192 20.050 10.799 -21.328 1.00 0.00 H new ATOM 3039 N LYS A 193 17.596 5.974 -26.634 1.00 0.00 N ATOM 3040 CA LYS A 193 17.874 5.254 -27.870 1.00 0.00 C ATOM 3041 C LYS A 193 16.803 4.201 -28.139 1.00 0.00 C ATOM 3042 O LYS A 193 15.924 3.968 -27.309 1.00 0.00 O ATOM 3043 CB LYS A 193 19.251 4.594 -27.800 1.00 0.00 C ATOM 3044 CG LYS A 193 19.436 3.693 -26.589 1.00 0.00 C ATOM 3045 CD LYS A 193 19.025 2.261 -26.892 1.00 0.00 C ATOM 3046 CE LYS A 193 20.220 1.414 -27.300 1.00 0.00 C ATOM 3047 NZ LYS A 193 20.142 0.037 -26.741 1.00 0.00 N1+ ATOM 0 H LYS A 193 17.298 5.382 -25.859 1.00 0.00 H new ATOM 0 HA LYS A 193 17.865 5.972 -28.690 1.00 0.00 H new ATOM 0 HB2 LYS A 193 19.410 4.008 -28.705 1.00 0.00 H new ATOM 0 HB3 LYS A 193 20.016 5.370 -27.784 1.00 0.00 H new ATOM 0 HG2 LYS A 193 20.479 3.714 -26.274 1.00 0.00 H new ATOM 0 HG3 LYS A 193 18.844 4.074 -25.757 1.00 0.00 H new ATOM 0 HD2 LYS A 193 18.550 1.824 -26.014 1.00 0.00 H new ATOM 0 HD3 LYS A 193 18.284 2.255 -27.691 1.00 0.00 H new ATOM 0 HE2 LYS A 193 20.273 1.362 -28.387 1.00 0.00 H new ATOM 0 HE3 LYS A 193 21.138 1.893 -26.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 193 20.975 -0.508 -27.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 193 20.117 0.085 -25.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 193 19.279 -0.430 -27.087 1.00 0.00 H new ATOM 3061 N VAL A 194 16.883 3.568 -29.305 1.00 0.00 N ATOM 3062 CA VAL A 194 15.921 2.540 -29.686 1.00 0.00 C ATOM 3063 C VAL A 194 16.533 1.558 -30.681 1.00 0.00 C ATOM 3064 O VAL A 194 17.337 1.940 -31.532 1.00 0.00 O ATOM 3065 CB VAL A 194 14.651 3.162 -30.301 1.00 0.00 C ATOM 3066 CG1 VAL A 194 14.990 3.935 -31.567 1.00 0.00 C ATOM 3067 CG2 VAL A 194 13.611 2.088 -30.584 1.00 0.00 C ATOM 0 H VAL A 194 17.605 3.749 -30.003 1.00 0.00 H new ATOM 0 HA VAL A 194 15.648 2.005 -28.777 1.00 0.00 H new ATOM 0 HB VAL A 194 14.229 3.862 -29.580 1.00 0.00 H new ATOM 0 HG11 VAL A 194 14.080 4.366 -31.985 1.00 0.00 H new ATOM 0 HG12 VAL A 194 15.693 4.733 -31.329 1.00 0.00 H new ATOM 0 HG13 VAL A 194 15.440 3.261 -32.296 1.00 0.00 H new ATOM 0 HG21 VAL A 194 12.723 2.547 -31.018 1.00 0.00 H new ATOM 0 HG22 VAL A 194 14.021 1.360 -31.284 1.00 0.00 H new ATOM 0 HG23 VAL A 194 13.343 1.587 -29.654 1.00 0.00 H new ATOM 3077 N ASP A 195 16.147 0.291 -30.570 1.00 0.00 N ATOM 3078 CA ASP A 195 16.655 -0.747 -31.459 1.00 0.00 C ATOM 3079 C ASP A 195 15.523 -1.637 -31.960 1.00 0.00 C ATOM 3080 O ASP A 195 14.429 -1.642 -31.397 1.00 0.00 O ATOM 3081 CB ASP A 195 17.704 -1.595 -30.738 1.00 0.00 C ATOM 3082 CG ASP A 195 18.849 -1.994 -31.648 1.00 0.00 C ATOM 3083 OD1 ASP A 195 19.718 -1.139 -31.920 1.00 0.00 O ATOM 3084 OD2 ASP A 195 18.879 -3.163 -32.087 1.00 0.00 O1- ATOM 0 H ASP A 195 15.483 -0.042 -29.871 1.00 0.00 H new ATOM 0 HA ASP A 195 17.117 -0.260 -32.318 1.00 0.00 H new ATOM 0 HB2 ASP A 195 18.097 -1.037 -29.888 1.00 0.00 H new ATOM 0 HB3 ASP A 195 17.231 -2.492 -30.339 1.00 0.00 H new ATOM 3089 N LEU A 196 15.793 -2.391 -33.021 1.00 0.00 N ATOM 3090 CA LEU A 196 14.796 -3.289 -33.595 1.00 0.00 C ATOM 3091 C LEU A 196 15.089 -4.738 -33.218 1.00 0.00 C ATOM 3092 O LEU A 196 16.247 -5.125 -33.060 1.00 0.00 O ATOM 3093 CB LEU A 196 14.759 -3.140 -35.117 1.00 0.00 C ATOM 3094 CG LEU A 196 13.757 -2.110 -35.643 1.00 0.00 C ATOM 3095 CD1 LEU A 196 12.332 -2.563 -35.366 1.00 0.00 C ATOM 3096 CD2 LEU A 196 14.016 -0.747 -35.017 1.00 0.00 C ATOM 0 H LEU A 196 16.693 -2.398 -33.501 1.00 0.00 H new ATOM 0 HA LEU A 196 13.822 -3.018 -33.189 1.00 0.00 H new ATOM 0 HB2 LEU A 196 15.755 -2.865 -35.464 1.00 0.00 H new ATOM 0 HB3 LEU A 196 14.524 -4.110 -35.556 1.00 0.00 H new ATOM 0 HG LEU A 196 13.886 -2.023 -36.722 1.00 0.00 H new ATOM 0 HD11 LEU A 196 11.633 -1.818 -35.747 1.00 0.00 H new ATOM 0 HD12 LEU A 196 12.151 -3.517 -35.861 1.00 0.00 H new ATOM 0 HD13 LEU A 196 12.189 -2.679 -34.292 1.00 0.00 H new ATOM 0 HD21 LEU A 196 13.294 -0.027 -35.402 1.00 0.00 H new ATOM 0 HD22 LEU A 196 13.914 -0.819 -33.934 1.00 0.00 H new ATOM 0 HD23 LEU A 196 15.025 -0.418 -35.266 1.00 0.00 H new ATOM 3108 N ASP A 197 14.035 -5.535 -33.075 1.00 0.00 N ATOM 3109 CA ASP A 197 14.183 -6.942 -32.718 1.00 0.00 C ATOM 3110 C ASP A 197 13.521 -7.840 -33.757 1.00 0.00 C ATOM 3111 O ASP A 197 12.329 -8.136 -33.669 1.00 0.00 O ATOM 3112 CB ASP A 197 13.576 -7.205 -31.338 1.00 0.00 C ATOM 3113 CG ASP A 197 14.425 -8.141 -30.502 1.00 0.00 C ATOM 3114 OD1 ASP A 197 15.667 -8.020 -30.552 1.00 0.00 O ATOM 3115 OD2 ASP A 197 13.849 -8.995 -29.796 1.00 0.00 O1- ATOM 0 H ASP A 197 13.069 -5.231 -33.201 1.00 0.00 H new ATOM 0 HA ASP A 197 15.248 -7.174 -32.690 1.00 0.00 H new ATOM 0 HB2 ASP A 197 13.456 -6.259 -30.810 1.00 0.00 H new ATOM 0 HB3 ASP A 197 12.580 -7.631 -31.458 1.00 0.00 H new