USER MOD reduce.3.24.130724 H: found=0, std=0, add=1156, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1156 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 73 GLN : amide:sc= -7.07! C(o=-10!,f=-12!) USER MOD Set 1.2: A 118 ASN : amide:sc= -3.2 K(o=-10,f=-11!) USER MOD Set 2.1: A 63 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 65 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 14 GLN : amide:sc= -7.37! C(o=-11!,f=-15!) USER MOD Set 3.2: A 62 GLN : amide:sc= -3.47! C(o=-11!,f=-15!) USER MOD Set 4.1: A 7 THR OG1 : rot 180:sc= -0.897 USER MOD Set 4.2: A 8 SER OG : rot 131:sc= -4.17! USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -175:sc= -1.44! (180deg=-1.53!) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ -163:sc= -3.64! (180deg=-4.34!) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 165:sc=-0.00187 (180deg=-0.289) USER MOD Single : A 41 SER OG : rot -91:sc= 0.749 USER MOD Single : A 42 ASN : amide:sc= -0.376 K(o=-0.38,f=-2.2!) USER MOD Single : A 43 SER OG : rot 150:sc= 0 USER MOD Single : A 44 GLN :FLIP amide:sc= -0.529 F(o=-1.5,f=-0.53) USER MOD Single : A 49 GLN :FLIP amide:sc= -2.81! F(o=-3.7,f=-2.8!) USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 HIS : no HE2:sc= -1.95 K(o=-1.9,f=-3.5!) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -105:sc= 0.503 (180deg=-0.933) USER MOD Single : A 68 LYS NZ :NH3+ -164:sc= -0.0146 (180deg=-0.275) USER MOD Single : A 71 SER OG : rot -130:sc= 0 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot -35:sc= 0.471 USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= -1.05 K(o=-1,f=-2.2!) USER MOD Single : A 88 LYS NZ :NH3+ -161:sc= -0.0257 (180deg=-0.344) USER MOD Single : A 90 MET CE :methyl 140:sc= -0.382 (180deg=-2.41!) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 CYS SG : rot 180:sc= 0 USER MOD Single : A 96 THR OG1 : rot 180:sc= -0.513 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 157:sc= -1.31 (180deg=-2.58!) USER MOD Single : A 101 ASN : amide:sc= -0.739 K(o=-0.74,f=-2.5!) USER MOD Single : A 104 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 105 LYS NZ :NH3+ -158:sc= -0.107 (180deg=-0.766) USER MOD Single : A 107 ASN : amide:sc= -2.27! C(o=-2.3!,f=-3.9!) USER MOD Single : A 108 THR OG1 : rot 138:sc= 0.519 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 111 GLN : amide:sc= -3.28! C(o=-3.3!,f=-3.4!) USER MOD Single : A 112 SER OG : rot 180:sc= -0.169 USER MOD Single : A 116 GLN :FLIP amide:sc= -0.048 F(o=-1.1,f=-0.048) USER MOD Single : A 122 CYS SG : rot -6:sc= -0.444! USER MOD Single : A 124 LYS NZ :NH3+ -164:sc= -0.0235 (180deg=-0.276) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 SER OG : rot 23:sc= 0.0962! USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= -0.204 USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ -129:sc= -1.55 (180deg=-4.08!) USER MOD Single : A 141 HIS : no HD1:sc= -0.12 K(o=-0.12,f=-0.81) USER MOD Single : A 142 CYS SG : rot 180:sc= 0 USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 ASN :FLIP amide:sc= -0.254 F(o=-5.3!,f=-0.25) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.187 -24.022 -11.198 1.00 0.00 N ATOM 2 CA MET A 1 2.508 -23.409 -10.885 1.00 0.00 C ATOM 3 C MET A 1 2.337 -22.369 -9.773 1.00 0.00 C ATOM 4 O MET A 1 3.281 -21.729 -9.360 1.00 0.00 O ATOM 5 CB MET A 1 3.064 -22.731 -12.140 1.00 0.00 C ATOM 6 CG MET A 1 1.985 -21.830 -12.749 1.00 0.00 C ATOM 7 SD MET A 1 0.791 -22.845 -13.649 1.00 0.00 S ATOM 8 CE MET A 1 -0.468 -21.567 -13.881 1.00 0.00 C ATOM 0 H1 MET A 1 1.315 -24.787 -11.891 1.00 0.00 H new ATOM 0 H2 MET A 1 0.769 -24.410 -10.328 1.00 0.00 H new ATOM 0 H3 MET A 1 0.553 -23.298 -11.593 1.00 0.00 H new ATOM 0 HA MET A 1 3.200 -24.183 -10.554 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.946 -22.142 -11.889 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.378 -23.482 -12.864 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.481 -21.267 -11.964 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.440 -21.103 -13.421 1.00 0.00 H new ATOM 0 HE1 MET A 1 -1.314 -21.985 -14.427 1.00 0.00 H new ATOM 0 HE2 MET A 1 -0.805 -21.207 -12.909 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.045 -20.738 -14.448 1.00 0.00 H new ATOM 20 N ASP A 2 1.135 -22.199 -9.285 1.00 0.00 N ATOM 21 CA ASP A 2 0.911 -21.199 -8.203 1.00 0.00 C ATOM 22 C ASP A 2 1.043 -21.882 -6.840 1.00 0.00 C ATOM 23 O ASP A 2 0.823 -21.281 -5.809 1.00 0.00 O ATOM 24 CB ASP A 2 -0.493 -20.604 -8.346 1.00 0.00 C ATOM 25 CG ASP A 2 -0.579 -19.798 -9.642 1.00 0.00 C ATOM 26 OD1 ASP A 2 0.462 -19.410 -10.146 1.00 0.00 O ATOM 27 OD2 ASP A 2 -1.687 -19.583 -10.108 1.00 0.00 O ATOM 0 H ASP A 2 0.304 -22.707 -9.588 1.00 0.00 H new ATOM 0 HA ASP A 2 1.653 -20.404 -8.281 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -1.237 -21.400 -8.351 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -0.716 -19.964 -7.492 1.00 0.00 H new ATOM 32 N ASP A 3 1.388 -23.142 -6.833 1.00 0.00 N ATOM 33 CA ASP A 3 1.533 -23.875 -5.537 1.00 0.00 C ATOM 34 C ASP A 3 2.619 -23.210 -4.686 1.00 0.00 C ATOM 35 O ASP A 3 2.455 -23.019 -3.497 1.00 0.00 O ATOM 36 CB ASP A 3 1.925 -25.324 -5.823 1.00 0.00 C ATOM 37 CG ASP A 3 0.814 -26.002 -6.628 1.00 0.00 C ATOM 38 OD1 ASP A 3 -0.308 -25.526 -6.563 1.00 0.00 O ATOM 39 OD2 ASP A 3 1.101 -26.978 -7.297 1.00 0.00 O ATOM 0 H ASP A 3 1.576 -23.697 -7.668 1.00 0.00 H new ATOM 0 HA ASP A 3 0.588 -23.849 -4.995 1.00 0.00 H new ATOM 0 HB2 ASP A 3 2.863 -25.356 -6.378 1.00 0.00 H new ATOM 0 HB3 ASP A 3 2.090 -25.859 -4.888 1.00 0.00 H new ATOM 44 N SER A 4 3.726 -22.854 -5.280 1.00 0.00 N ATOM 45 CA SER A 4 4.814 -22.195 -4.503 1.00 0.00 C ATOM 46 C SER A 4 4.725 -20.684 -4.702 1.00 0.00 C ATOM 47 O SER A 4 4.895 -20.174 -5.793 1.00 0.00 O ATOM 48 CB SER A 4 6.171 -22.693 -4.996 1.00 0.00 C ATOM 49 OG SER A 4 7.202 -22.052 -4.256 1.00 0.00 O ATOM 0 H SER A 4 3.924 -22.991 -6.271 1.00 0.00 H new ATOM 0 HA SER A 4 4.705 -22.435 -3.445 1.00 0.00 H new ATOM 0 HB2 SER A 4 6.240 -23.774 -4.877 1.00 0.00 H new ATOM 0 HB3 SER A 4 6.285 -22.482 -6.059 1.00 0.00 H new ATOM 0 HG SER A 4 8.075 -22.370 -4.568 1.00 0.00 H new ATOM 55 N GLU A 5 4.465 -19.962 -3.645 1.00 0.00 N ATOM 56 CA GLU A 5 4.358 -18.472 -3.733 1.00 0.00 C ATOM 57 C GLU A 5 5.666 -17.922 -4.294 1.00 0.00 C ATOM 58 O GLU A 5 6.732 -18.470 -4.078 1.00 0.00 O ATOM 59 CB GLU A 5 4.123 -17.895 -2.331 1.00 0.00 C ATOM 60 CG GLU A 5 5.138 -18.490 -1.345 1.00 0.00 C ATOM 61 CD GLU A 5 4.661 -19.871 -0.884 1.00 0.00 C ATOM 62 OE1 GLU A 5 3.466 -20.031 -0.691 1.00 0.00 O ATOM 63 OE2 GLU A 5 5.498 -20.745 -0.733 1.00 0.00 O ATOM 0 H GLU A 5 4.320 -20.345 -2.711 1.00 0.00 H new ATOM 0 HA GLU A 5 3.527 -18.194 -4.381 1.00 0.00 H new ATOM 0 HB2 GLU A 5 4.219 -16.809 -2.354 1.00 0.00 H new ATOM 0 HB3 GLU A 5 3.108 -18.119 -2.001 1.00 0.00 H new ATOM 0 HG2 GLU A 5 6.116 -18.572 -1.820 1.00 0.00 H new ATOM 0 HG3 GLU A 5 5.255 -17.830 -0.486 1.00 0.00 H new ATOM 70 N ASP A 6 5.588 -16.858 -5.047 1.00 0.00 N ATOM 71 CA ASP A 6 6.817 -16.270 -5.660 1.00 0.00 C ATOM 72 C ASP A 6 7.840 -15.865 -4.594 1.00 0.00 C ATOM 73 O ASP A 6 7.583 -16.002 -3.413 1.00 0.00 O ATOM 74 CB ASP A 6 6.426 -15.033 -6.469 1.00 0.00 C ATOM 75 CG ASP A 6 5.205 -15.351 -7.333 1.00 0.00 C ATOM 76 OD1 ASP A 6 4.790 -16.495 -7.337 1.00 0.00 O ATOM 77 OD2 ASP A 6 4.706 -14.441 -7.970 1.00 0.00 O ATOM 0 H ASP A 6 4.721 -16.367 -5.266 1.00 0.00 H new ATOM 0 HA ASP A 6 7.273 -17.025 -6.301 1.00 0.00 H new ATOM 0 HB2 ASP A 6 6.204 -14.203 -5.799 1.00 0.00 H new ATOM 0 HB3 ASP A 6 7.259 -14.720 -7.099 1.00 0.00 H new ATOM 82 N THR A 7 9.000 -15.374 -4.984 1.00 0.00 N ATOM 83 CA THR A 7 10.033 -14.968 -3.975 1.00 0.00 C ATOM 84 C THR A 7 10.376 -13.479 -4.197 1.00 0.00 C ATOM 85 O THR A 7 10.530 -13.082 -5.324 1.00 0.00 O ATOM 86 CB THR A 7 11.257 -15.924 -4.054 1.00 0.00 C ATOM 87 OG1 THR A 7 12.428 -15.214 -3.678 1.00 0.00 O ATOM 88 CG2 THR A 7 11.461 -16.461 -5.483 1.00 0.00 C ATOM 0 H THR A 7 9.273 -15.238 -5.957 1.00 0.00 H new ATOM 0 HA THR A 7 9.656 -15.061 -2.956 1.00 0.00 H new ATOM 0 HB THR A 7 11.071 -16.763 -3.383 1.00 0.00 H new ATOM 0 HG1 THR A 7 13.203 -15.813 -3.725 1.00 0.00 H new ATOM 0 HG21 THR A 7 12.325 -17.126 -5.502 1.00 0.00 H new ATOM 0 HG22 THR A 7 10.573 -17.011 -5.795 1.00 0.00 H new ATOM 0 HG23 THR A 7 11.630 -15.627 -6.164 1.00 0.00 H new ATOM 96 N SER A 8 10.649 -12.662 -3.175 1.00 0.00 N ATOM 97 CA SER A 8 10.502 -13.047 -1.729 1.00 0.00 C ATOM 98 C SER A 8 10.546 -11.749 -0.953 1.00 0.00 C ATOM 99 O SER A 8 11.588 -11.191 -0.683 1.00 0.00 O ATOM 100 CB SER A 8 11.641 -13.982 -1.301 1.00 0.00 C ATOM 101 OG SER A 8 11.263 -15.336 -1.513 1.00 0.00 O ATOM 0 H SER A 8 10.981 -11.706 -3.306 1.00 0.00 H new ATOM 0 HA SER A 8 9.573 -13.587 -1.547 1.00 0.00 H new ATOM 0 HB2 SER A 8 12.543 -13.754 -1.869 1.00 0.00 H new ATOM 0 HB3 SER A 8 11.878 -13.822 -0.249 1.00 0.00 H new ATOM 0 HG SER A 8 11.973 -15.801 -2.002 1.00 0.00 H new ATOM 107 N TRP A 9 9.413 -11.388 -0.451 1.00 0.00 N ATOM 108 CA TRP A 9 9.276 -10.274 0.459 1.00 0.00 C ATOM 109 C TRP A 9 7.775 -10.176 0.640 1.00 0.00 C ATOM 110 O TRP A 9 7.040 -10.189 -0.295 1.00 0.00 O ATOM 111 CB TRP A 9 9.964 -9.012 -0.131 1.00 0.00 C ATOM 112 CG TRP A 9 9.140 -8.575 -1.323 1.00 0.00 C ATOM 113 CD1 TRP A 9 8.912 -9.359 -2.386 1.00 0.00 C ATOM 114 CD2 TRP A 9 8.421 -7.333 -1.586 1.00 0.00 C ATOM 115 NE1 TRP A 9 8.059 -8.747 -3.263 1.00 0.00 N ATOM 116 CE2 TRP A 9 7.743 -7.469 -2.841 1.00 0.00 C ATOM 117 CE3 TRP A 9 8.280 -6.116 -0.879 1.00 0.00 C ATOM 118 CZ2 TRP A 9 6.955 -6.433 -3.361 1.00 0.00 C ATOM 119 CZ3 TRP A 9 7.490 -5.071 -1.407 1.00 0.00 C ATOM 120 CH2 TRP A 9 6.833 -5.228 -2.643 1.00 0.00 C ATOM 0 H TRP A 9 8.533 -11.860 -0.658 1.00 0.00 H new ATOM 0 HA TRP A 9 9.768 -10.389 1.425 1.00 0.00 H new ATOM 0 HB2 TRP A 9 10.016 -8.218 0.614 1.00 0.00 H new ATOM 0 HB3 TRP A 9 10.988 -9.236 -0.431 1.00 0.00 H new ATOM 0 HD1 TRP A 9 9.342 -10.339 -2.530 1.00 0.00 H new ATOM 0 HE1 TRP A 9 7.703 -9.177 -4.116 1.00 0.00 H new ATOM 0 HE3 TRP A 9 8.779 -5.985 0.070 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 6.445 -6.558 -4.305 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 7.389 -4.146 -0.859 1.00 0.00 H new ATOM 0 HH2 TRP A 9 6.234 -4.422 -3.041 1.00 0.00 H new ATOM 131 N ASP A 10 7.310 -10.083 1.845 1.00 0.00 N ATOM 132 CA ASP A 10 5.842 -10.011 2.048 1.00 0.00 C ATOM 133 C ASP A 10 5.409 -8.569 2.246 1.00 0.00 C ATOM 134 O ASP A 10 5.830 -7.928 3.188 1.00 0.00 O ATOM 135 CB ASP A 10 5.446 -10.932 3.246 1.00 0.00 C ATOM 136 CG ASP A 10 3.929 -11.235 3.350 1.00 0.00 C ATOM 137 OD1 ASP A 10 3.123 -10.457 2.862 1.00 0.00 O ATOM 138 OD2 ASP A 10 3.604 -12.285 3.875 1.00 0.00 O ATOM 0 H ASP A 10 7.875 -10.054 2.694 1.00 0.00 H new ATOM 0 HA ASP A 10 5.318 -10.373 1.164 1.00 0.00 H new ATOM 0 HB2 ASP A 10 5.987 -11.874 3.158 1.00 0.00 H new ATOM 0 HB3 ASP A 10 5.774 -10.462 4.173 1.00 0.00 H new ATOM 143 N PHE A 11 4.534 -8.062 1.443 1.00 0.00 N ATOM 144 CA PHE A 11 4.088 -6.658 1.712 1.00 0.00 C ATOM 145 C PHE A 11 2.551 -6.647 1.582 1.00 0.00 C ATOM 146 O PHE A 11 2.040 -5.968 0.753 1.00 0.00 O ATOM 147 CB PHE A 11 4.678 -5.697 0.638 1.00 0.00 C ATOM 148 CG PHE A 11 5.188 -4.386 1.223 1.00 0.00 C ATOM 149 CD1 PHE A 11 4.291 -3.308 1.375 1.00 0.00 C ATOM 150 CD2 PHE A 11 6.551 -4.202 1.564 1.00 0.00 C ATOM 151 CE1 PHE A 11 4.740 -2.070 1.867 1.00 0.00 C ATOM 152 CE2 PHE A 11 6.995 -2.953 2.044 1.00 0.00 C ATOM 153 CZ PHE A 11 6.090 -1.893 2.198 1.00 0.00 C ATOM 0 H PHE A 11 4.114 -8.527 0.638 1.00 0.00 H new ATOM 0 HA PHE A 11 4.419 -6.334 2.699 1.00 0.00 H new ATOM 0 HB2 PHE A 11 5.495 -6.199 0.120 1.00 0.00 H new ATOM 0 HB3 PHE A 11 3.913 -5.482 -0.108 1.00 0.00 H new ATOM 0 HD1 PHE A 11 3.251 -3.435 1.111 1.00 0.00 H new ATOM 0 HD2 PHE A 11 7.250 -5.019 1.456 1.00 0.00 H new ATOM 0 HE1 PHE A 11 4.043 -1.254 1.990 1.00 0.00 H new ATOM 0 HE2 PHE A 11 8.036 -2.812 2.294 1.00 0.00 H new ATOM 0 HZ PHE A 11 6.434 -0.940 2.572 1.00 0.00 H new ATOM 163 N GLY A 12 1.788 -7.314 2.418 1.00 0.00 N ATOM 164 CA GLY A 12 0.296 -7.222 2.218 1.00 0.00 C ATOM 165 C GLY A 12 -0.168 -5.769 2.051 1.00 0.00 C ATOM 166 O GLY A 12 -0.822 -5.409 1.083 1.00 0.00 O ATOM 0 H GLY A 12 2.108 -7.892 3.195 1.00 0.00 H new ATOM 0 HA2 GLY A 12 0.011 -7.798 1.338 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -0.213 -7.671 3.071 1.00 0.00 H new ATOM 170 N PRO A 13 0.232 -4.918 2.958 1.00 0.00 N ATOM 171 CA PRO A 13 -0.136 -3.486 2.926 1.00 0.00 C ATOM 172 C PRO A 13 -0.178 -2.950 1.498 1.00 0.00 C ATOM 173 O PRO A 13 -1.148 -2.346 1.080 1.00 0.00 O ATOM 174 CB PRO A 13 0.969 -2.807 3.745 1.00 0.00 C ATOM 175 CG PRO A 13 1.354 -3.816 4.776 1.00 0.00 C ATOM 176 CD PRO A 13 1.090 -5.202 4.164 1.00 0.00 C ATOM 0 HA PRO A 13 -1.132 -3.302 3.328 1.00 0.00 H new ATOM 0 HB2 PRO A 13 1.819 -2.539 3.117 1.00 0.00 H new ATOM 0 HB3 PRO A 13 0.611 -1.887 4.206 1.00 0.00 H new ATOM 0 HG2 PRO A 13 2.404 -3.708 5.049 1.00 0.00 H new ATOM 0 HG3 PRO A 13 0.772 -3.679 5.687 1.00 0.00 H new ATOM 0 HD2 PRO A 13 2.020 -5.697 3.883 1.00 0.00 H new ATOM 0 HD3 PRO A 13 0.580 -5.858 4.870 1.00 0.00 H new ATOM 184 N GLN A 14 0.865 -3.153 0.740 1.00 0.00 N ATOM 185 CA GLN A 14 0.850 -2.637 -0.646 1.00 0.00 C ATOM 186 C GLN A 14 -0.351 -3.217 -1.389 1.00 0.00 C ATOM 187 O GLN A 14 -0.989 -2.510 -2.112 1.00 0.00 O ATOM 188 CB GLN A 14 2.168 -2.972 -1.385 1.00 0.00 C ATOM 189 CG GLN A 14 3.217 -1.861 -1.170 1.00 0.00 C ATOM 190 CD GLN A 14 4.623 -2.384 -1.473 1.00 0.00 C ATOM 191 OE1 GLN A 14 4.907 -3.543 -1.258 1.00 0.00 O ATOM 192 NE2 GLN A 14 5.516 -1.566 -1.954 1.00 0.00 N ATOM 0 H GLN A 14 1.712 -3.647 1.020 1.00 0.00 H new ATOM 0 HA GLN A 14 0.764 -1.551 -0.615 1.00 0.00 H new ATOM 0 HB2 GLN A 14 2.560 -3.923 -1.024 1.00 0.00 H new ATOM 0 HB3 GLN A 14 1.972 -3.092 -2.451 1.00 0.00 H new ATOM 0 HG2 GLN A 14 2.992 -1.011 -1.814 1.00 0.00 H new ATOM 0 HG3 GLN A 14 3.170 -1.503 -0.142 1.00 0.00 H new ATOM 0 HE21 GLN A 14 5.272 -0.592 -2.133 1.00 0.00 H new ATOM 0 HE22 GLN A 14 6.459 -1.900 -2.152 1.00 0.00 H new ATOM 201 N ALA A 15 -0.684 -4.474 -1.229 1.00 0.00 N ATOM 202 CA ALA A 15 -1.864 -4.975 -1.985 1.00 0.00 C ATOM 203 C ALA A 15 -3.089 -4.265 -1.454 1.00 0.00 C ATOM 204 O ALA A 15 -3.967 -3.887 -2.202 1.00 0.00 O ATOM 205 CB ALA A 15 -2.016 -6.497 -1.882 1.00 0.00 C ATOM 0 H ALA A 15 -0.209 -5.150 -0.631 1.00 0.00 H new ATOM 0 HA ALA A 15 -1.731 -4.761 -3.046 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -2.891 -6.815 -2.450 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -1.126 -6.980 -2.286 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -2.139 -6.780 -0.837 1.00 0.00 H new ATOM 211 N PHE A 16 -3.137 -4.001 -0.175 1.00 0.00 N ATOM 212 CA PHE A 16 -4.310 -3.287 0.358 1.00 0.00 C ATOM 213 C PHE A 16 -4.284 -1.948 -0.351 1.00 0.00 C ATOM 214 O PHE A 16 -5.252 -1.488 -0.885 1.00 0.00 O ATOM 215 CB PHE A 16 -4.177 -3.121 1.890 1.00 0.00 C ATOM 216 CG PHE A 16 -4.848 -4.273 2.623 1.00 0.00 C ATOM 217 CD1 PHE A 16 -6.229 -4.491 2.469 1.00 0.00 C ATOM 218 CD2 PHE A 16 -4.089 -5.120 3.457 1.00 0.00 C ATOM 219 CE1 PHE A 16 -6.853 -5.557 3.152 1.00 0.00 C ATOM 220 CE2 PHE A 16 -4.717 -6.185 4.137 1.00 0.00 C ATOM 221 CZ PHE A 16 -6.096 -6.402 3.982 1.00 0.00 C ATOM 0 H PHE A 16 -2.421 -4.249 0.507 1.00 0.00 H new ATOM 0 HA PHE A 16 -5.249 -3.815 0.190 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -3.123 -3.075 2.164 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -4.628 -2.178 2.198 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -6.811 -3.844 1.829 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -3.028 -4.954 3.575 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -7.914 -5.724 3.037 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -4.137 -6.834 4.777 1.00 0.00 H new ATOM 0 HZ PHE A 16 -6.575 -7.219 4.501 1.00 0.00 H new ATOM 231 N LYS A 17 -3.143 -1.348 -0.420 1.00 0.00 N ATOM 232 CA LYS A 17 -3.061 -0.036 -1.098 1.00 0.00 C ATOM 233 C LYS A 17 -3.493 -0.174 -2.568 1.00 0.00 C ATOM 234 O LYS A 17 -4.301 0.601 -3.029 1.00 0.00 O ATOM 235 CB LYS A 17 -1.633 0.514 -0.950 1.00 0.00 C ATOM 236 CG LYS A 17 -1.269 0.832 0.527 1.00 0.00 C ATOM 237 CD LYS A 17 0.200 1.296 0.729 1.00 0.00 C ATOM 238 CE LYS A 17 0.366 2.767 0.261 1.00 0.00 C ATOM 239 NZ LYS A 17 1.724 3.273 0.609 1.00 0.00 N ATOM 0 H LYS A 17 -2.266 -1.704 -0.040 1.00 0.00 H new ATOM 0 HA LYS A 17 -3.744 0.677 -0.636 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -0.924 -0.212 -1.347 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -1.532 1.419 -1.549 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -1.939 1.609 0.897 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -1.445 -0.056 1.133 1.00 0.00 H new ATOM 0 HD2 LYS A 17 0.476 1.208 1.780 1.00 0.00 H new ATOM 0 HD3 LYS A 17 0.874 0.649 0.167 1.00 0.00 H new ATOM 0 HE2 LYS A 17 0.212 2.832 -0.816 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -0.393 3.392 0.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 1.730 4.312 0.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 1.971 2.970 1.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 2.420 2.891 -0.063 1.00 0.00 H new ATOM 253 N LEU A 18 -3.026 -1.151 -3.323 1.00 0.00 N ATOM 254 CA LEU A 18 -3.487 -1.221 -4.740 1.00 0.00 C ATOM 255 C LEU A 18 -4.923 -1.721 -4.684 1.00 0.00 C ATOM 256 O LEU A 18 -5.805 -1.131 -5.256 1.00 0.00 O ATOM 257 CB LEU A 18 -2.621 -2.205 -5.582 1.00 0.00 C ATOM 258 CG LEU A 18 -3.076 -2.280 -7.055 1.00 0.00 C ATOM 259 CD1 LEU A 18 -2.772 -0.965 -7.791 1.00 0.00 C ATOM 260 CD2 LEU A 18 -2.407 -3.462 -7.773 1.00 0.00 C ATOM 0 H LEU A 18 -2.370 -1.874 -3.027 1.00 0.00 H new ATOM 0 HA LEU A 18 -3.403 -0.245 -5.217 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -1.578 -1.891 -5.543 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -2.671 -3.199 -5.138 1.00 0.00 H new ATOM 0 HG LEU A 18 -4.155 -2.436 -7.065 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -3.102 -1.043 -8.827 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -3.299 -0.145 -7.303 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -1.699 -0.773 -7.765 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -2.742 -3.495 -8.810 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -1.324 -3.339 -7.746 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -2.679 -4.392 -7.274 1.00 0.00 H new ATOM 272 N LEU A 19 -5.163 -2.785 -3.974 1.00 0.00 N ATOM 273 CA LEU A 19 -6.536 -3.322 -3.916 1.00 0.00 C ATOM 274 C LEU A 19 -7.531 -2.294 -3.290 1.00 0.00 C ATOM 275 O LEU A 19 -8.653 -2.170 -3.789 1.00 0.00 O ATOM 276 CB LEU A 19 -6.517 -4.691 -3.197 1.00 0.00 C ATOM 277 CG LEU A 19 -5.603 -5.730 -3.883 1.00 0.00 C ATOM 278 CD1 LEU A 19 -5.560 -7.092 -3.129 1.00 0.00 C ATOM 279 CD2 LEU A 19 -6.146 -5.987 -5.298 1.00 0.00 C ATOM 0 H LEU A 19 -4.467 -3.300 -3.435 1.00 0.00 H new ATOM 0 HA LEU A 19 -6.910 -3.489 -4.926 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -6.185 -4.549 -2.169 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -7.533 -5.084 -3.153 1.00 0.00 H new ATOM 0 HG LEU A 19 -4.592 -5.323 -3.892 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -4.902 -7.781 -3.659 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -5.184 -6.936 -2.118 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -6.564 -7.514 -3.082 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -5.515 -6.719 -5.802 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -7.165 -6.369 -5.233 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -6.144 -5.055 -5.863 1.00 0.00 H new ATOM 291 N SER A 20 -7.242 -1.571 -2.200 1.00 0.00 N ATOM 292 CA SER A 20 -8.365 -0.661 -1.721 1.00 0.00 C ATOM 293 C SER A 20 -8.575 0.524 -2.706 1.00 0.00 C ATOM 294 O SER A 20 -9.693 1.008 -2.887 1.00 0.00 O ATOM 295 CB SER A 20 -8.139 -0.148 -0.287 1.00 0.00 C ATOM 296 OG SER A 20 -9.388 0.228 0.281 1.00 0.00 O ATOM 0 H SER A 20 -6.370 -1.567 -1.671 1.00 0.00 H new ATOM 0 HA SER A 20 -9.273 -1.264 -1.701 1.00 0.00 H new ATOM 0 HB2 SER A 20 -7.670 -0.923 0.319 1.00 0.00 H new ATOM 0 HB3 SER A 20 -7.460 0.704 -0.296 1.00 0.00 H new ATOM 0 HG SER A 20 -9.247 0.554 1.195 1.00 0.00 H new ATOM 302 N ALA A 21 -7.546 1.025 -3.345 1.00 0.00 N ATOM 303 CA ALA A 21 -7.774 2.197 -4.255 1.00 0.00 C ATOM 304 C ALA A 21 -8.627 1.798 -5.474 1.00 0.00 C ATOM 305 O ALA A 21 -9.532 2.516 -5.846 1.00 0.00 O ATOM 306 CB ALA A 21 -6.447 2.802 -4.728 1.00 0.00 C ATOM 0 H ALA A 21 -6.585 0.688 -3.282 1.00 0.00 H new ATOM 0 HA ALA A 21 -8.314 2.949 -3.680 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -6.647 3.648 -5.385 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -5.873 3.140 -3.865 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -5.876 2.048 -5.271 1.00 0.00 H new ATOM 312 N VAL A 22 -8.374 0.669 -6.097 1.00 0.00 N ATOM 313 CA VAL A 22 -9.211 0.281 -7.286 1.00 0.00 C ATOM 314 C VAL A 22 -10.651 0.143 -6.803 1.00 0.00 C ATOM 315 O VAL A 22 -11.580 0.592 -7.433 1.00 0.00 O ATOM 316 CB VAL A 22 -8.654 -1.052 -7.889 1.00 0.00 C ATOM 317 CG1 VAL A 22 -7.328 -0.863 -8.636 1.00 0.00 C ATOM 318 CG2 VAL A 22 -8.466 -2.134 -6.795 1.00 0.00 C ATOM 0 H VAL A 22 -7.639 0.009 -5.842 1.00 0.00 H new ATOM 0 HA VAL A 22 -9.176 1.031 -8.077 1.00 0.00 H new ATOM 0 HB VAL A 22 -9.404 -1.381 -8.608 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -6.993 -1.822 -9.031 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -7.470 -0.162 -9.458 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -6.577 -0.471 -7.950 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -8.078 -3.046 -7.248 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -7.762 -1.774 -6.044 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -9.425 -2.344 -6.322 1.00 0.00 H new ATOM 328 N ASP A 23 -10.810 -0.448 -5.675 1.00 0.00 N ATOM 329 CA ASP A 23 -12.162 -0.645 -5.101 1.00 0.00 C ATOM 330 C ASP A 23 -12.815 0.721 -4.887 1.00 0.00 C ATOM 331 O ASP A 23 -13.933 0.946 -5.305 1.00 0.00 O ATOM 332 CB ASP A 23 -12.051 -1.380 -3.763 1.00 0.00 C ATOM 333 CG ASP A 23 -13.451 -1.722 -3.247 1.00 0.00 C ATOM 334 OD1 ASP A 23 -14.411 -1.281 -3.857 1.00 0.00 O ATOM 335 OD2 ASP A 23 -13.536 -2.418 -2.249 1.00 0.00 O ATOM 0 H ASP A 23 -10.047 -0.815 -5.106 1.00 0.00 H new ATOM 0 HA ASP A 23 -12.769 -1.240 -5.783 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -11.465 -2.291 -3.885 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -11.527 -0.758 -3.037 1.00 0.00 H new ATOM 340 N ILE A 24 -12.134 1.660 -4.263 1.00 0.00 N ATOM 341 CA ILE A 24 -12.794 2.992 -4.066 1.00 0.00 C ATOM 342 C ILE A 24 -13.090 3.573 -5.462 1.00 0.00 C ATOM 343 O ILE A 24 -14.155 4.083 -5.729 1.00 0.00 O ATOM 344 CB ILE A 24 -11.889 3.929 -3.205 1.00 0.00 C ATOM 345 CG1 ILE A 24 -11.758 3.363 -1.779 1.00 0.00 C ATOM 346 CG2 ILE A 24 -12.460 5.358 -3.111 1.00 0.00 C ATOM 347 CD1 ILE A 24 -13.145 3.219 -1.137 1.00 0.00 C ATOM 0 H ILE A 24 -11.187 1.568 -3.895 1.00 0.00 H new ATOM 0 HA ILE A 24 -13.730 2.891 -3.516 1.00 0.00 H new ATOM 0 HB ILE A 24 -10.916 3.975 -3.695 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -11.260 2.394 -1.809 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -11.136 4.022 -1.174 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -11.798 5.975 -2.503 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -12.538 5.785 -4.111 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -13.448 5.325 -2.653 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -13.039 2.818 -0.129 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -13.627 4.195 -1.090 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -13.754 2.541 -1.735 1.00 0.00 H new ATOM 359 N LEU A 25 -12.143 3.445 -6.355 1.00 0.00 N ATOM 360 CA LEU A 25 -12.316 3.946 -7.751 1.00 0.00 C ATOM 361 C LEU A 25 -13.368 3.068 -8.416 1.00 0.00 C ATOM 362 O LEU A 25 -13.729 3.258 -9.558 1.00 0.00 O ATOM 363 CB LEU A 25 -10.970 3.849 -8.488 1.00 0.00 C ATOM 364 CG LEU A 25 -9.961 4.856 -7.889 1.00 0.00 C ATOM 365 CD1 LEU A 25 -8.525 4.410 -8.181 1.00 0.00 C ATOM 366 CD2 LEU A 25 -10.187 6.247 -8.504 1.00 0.00 C ATOM 0 H LEU A 25 -11.241 3.006 -6.172 1.00 0.00 H new ATOM 0 HA LEU A 25 -12.637 4.987 -7.771 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -10.575 2.836 -8.408 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -11.112 4.053 -9.549 1.00 0.00 H new ATOM 0 HG LEU A 25 -10.113 4.898 -6.810 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -7.827 5.129 -7.753 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -8.352 3.429 -7.739 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -8.373 4.354 -9.259 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -9.474 6.953 -8.079 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -10.046 6.195 -9.584 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -11.202 6.581 -8.286 1.00 0.00 H new ATOM 378 N GLY A 26 -13.852 2.090 -7.683 1.00 0.00 N ATOM 379 CA GLY A 26 -14.886 1.160 -8.219 1.00 0.00 C ATOM 380 C GLY A 26 -14.310 0.350 -9.384 1.00 0.00 C ATOM 381 O GLY A 26 -15.033 -0.084 -10.248 1.00 0.00 O ATOM 0 H GLY A 26 -13.566 1.899 -6.723 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -15.226 0.488 -7.431 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -15.756 1.725 -8.553 1.00 0.00 H new ATOM 385 N GLU A 27 -13.008 0.156 -9.377 1.00 0.00 N ATOM 386 CA GLU A 27 -12.292 -0.625 -10.454 1.00 0.00 C ATOM 387 C GLU A 27 -12.559 -0.074 -11.880 1.00 0.00 C ATOM 388 O GLU A 27 -12.286 -0.758 -12.846 1.00 0.00 O ATOM 389 CB GLU A 27 -12.697 -2.113 -10.453 1.00 0.00 C ATOM 390 CG GLU A 27 -12.274 -2.850 -9.160 1.00 0.00 C ATOM 391 CD GLU A 27 -12.773 -4.301 -9.199 1.00 0.00 C ATOM 392 OE1 GLU A 27 -13.257 -4.722 -10.240 1.00 0.00 O ATOM 393 OE2 GLU A 27 -12.658 -4.967 -8.187 1.00 0.00 O ATOM 0 H GLU A 27 -12.391 0.516 -8.649 1.00 0.00 H new ATOM 0 HA GLU A 27 -11.234 -0.517 -10.215 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -13.778 -2.191 -10.573 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -12.245 -2.608 -11.312 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -11.189 -2.832 -9.059 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -12.684 -2.339 -8.289 1.00 0.00 H new ATOM 400 N LYS A 28 -13.051 1.137 -12.061 1.00 0.00 N ATOM 401 CA LYS A 28 -13.264 1.618 -13.483 1.00 0.00 C ATOM 402 C LYS A 28 -12.020 2.401 -13.918 1.00 0.00 C ATOM 403 O LYS A 28 -12.053 3.299 -14.731 1.00 0.00 O ATOM 404 CB LYS A 28 -14.575 2.456 -13.598 1.00 0.00 C ATOM 405 CG LYS A 28 -15.844 1.697 -13.136 1.00 0.00 C ATOM 406 CD LYS A 28 -16.238 0.550 -14.124 1.00 0.00 C ATOM 407 CE LYS A 28 -17.491 -0.183 -13.628 1.00 0.00 C ATOM 408 NZ LYS A 28 -18.659 0.744 -13.665 1.00 0.00 N ATOM 0 H LYS A 28 -13.307 1.793 -11.323 1.00 0.00 H new ATOM 0 HA LYS A 28 -13.394 0.771 -14.156 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -14.469 3.363 -13.003 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -14.706 2.768 -14.634 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -15.674 1.278 -12.144 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -16.673 2.399 -13.047 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -16.421 0.964 -15.116 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -15.412 -0.155 -14.220 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -17.686 -1.055 -14.252 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -17.334 -0.547 -12.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -19.539 0.197 -13.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -18.591 1.419 -12.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -18.662 1.263 -14.566 1.00 0.00 H new ATOM 422 N PHE A 29 -10.891 2.039 -13.418 1.00 0.00 N ATOM 423 CA PHE A 29 -9.665 2.779 -13.824 1.00 0.00 C ATOM 424 C PHE A 29 -8.477 1.824 -13.866 1.00 0.00 C ATOM 425 O PHE A 29 -8.436 0.809 -13.185 1.00 0.00 O ATOM 426 CB PHE A 29 -9.376 3.899 -12.834 1.00 0.00 C ATOM 427 CG PHE A 29 -10.476 4.918 -12.925 1.00 0.00 C ATOM 428 CD1 PHE A 29 -11.695 4.688 -12.284 1.00 0.00 C ATOM 429 CD2 PHE A 29 -10.270 6.091 -13.650 1.00 0.00 C ATOM 430 CE1 PHE A 29 -12.721 5.638 -12.377 1.00 0.00 C ATOM 431 CE2 PHE A 29 -11.299 7.049 -13.746 1.00 0.00 C ATOM 432 CZ PHE A 29 -12.528 6.818 -13.110 1.00 0.00 C ATOM 0 H PHE A 29 -10.753 1.276 -12.755 1.00 0.00 H new ATOM 0 HA PHE A 29 -9.825 3.207 -14.813 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -9.312 3.501 -11.821 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -8.414 4.361 -13.056 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -11.847 3.781 -11.718 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -9.322 6.265 -14.138 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -13.664 5.461 -11.882 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -11.142 7.958 -14.307 1.00 0.00 H new ATOM 0 HZ PHE A 29 -13.322 7.546 -13.185 1.00 0.00 H new ATOM 442 N GLY A 30 -7.523 2.178 -14.689 1.00 0.00 N ATOM 443 CA GLY A 30 -6.294 1.362 -14.892 1.00 0.00 C ATOM 444 C GLY A 30 -5.209 1.808 -13.895 1.00 0.00 C ATOM 445 O GLY A 30 -5.479 2.471 -12.914 1.00 0.00 O ATOM 0 H GLY A 30 -7.550 3.031 -15.247 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -6.520 0.305 -14.751 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -5.933 1.477 -15.914 1.00 0.00 H new ATOM 449 N ILE A 31 -3.983 1.419 -14.144 1.00 0.00 N ATOM 450 CA ILE A 31 -2.841 1.777 -13.220 1.00 0.00 C ATOM 451 C ILE A 31 -2.471 3.280 -13.284 1.00 0.00 C ATOM 452 O ILE A 31 -1.964 3.864 -12.319 1.00 0.00 O ATOM 453 CB ILE A 31 -1.619 0.942 -13.624 1.00 0.00 C ATOM 454 CG1 ILE A 31 -0.517 1.131 -12.573 1.00 0.00 C ATOM 455 CG2 ILE A 31 -1.112 1.406 -14.990 1.00 0.00 C ATOM 456 CD1 ILE A 31 0.608 0.117 -12.806 1.00 0.00 C ATOM 0 H ILE A 31 -3.713 0.862 -14.955 1.00 0.00 H new ATOM 0 HA ILE A 31 -3.154 1.566 -12.197 1.00 0.00 H new ATOM 0 HB ILE A 31 -1.894 -0.111 -13.684 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -0.121 2.145 -12.628 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -0.931 1.004 -11.573 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -0.244 0.813 -15.277 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -1.900 1.279 -15.733 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -0.831 2.458 -14.936 1.00 0.00 H new ATOM 0 HD11 ILE A 31 1.386 0.258 -12.056 1.00 0.00 H new ATOM 0 HD12 ILE A 31 0.208 -0.894 -12.729 1.00 0.00 H new ATOM 0 HD13 ILE A 31 1.031 0.265 -13.800 1.00 0.00 H new ATOM 468 N GLY A 32 -2.668 3.882 -14.424 1.00 0.00 N ATOM 469 CA GLY A 32 -2.289 5.320 -14.639 1.00 0.00 C ATOM 470 C GLY A 32 -2.903 6.285 -13.612 1.00 0.00 C ATOM 471 O GLY A 32 -2.205 7.071 -13.001 1.00 0.00 O ATOM 0 H GLY A 32 -3.085 3.432 -15.239 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -1.203 5.409 -14.603 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -2.601 5.622 -15.639 1.00 0.00 H new ATOM 475 N LEU A 33 -4.205 6.283 -13.459 1.00 0.00 N ATOM 476 CA LEU A 33 -4.848 7.241 -12.501 1.00 0.00 C ATOM 477 C LEU A 33 -4.444 6.922 -11.039 1.00 0.00 C ATOM 478 O LEU A 33 -4.016 7.809 -10.333 1.00 0.00 O ATOM 479 CB LEU A 33 -6.388 7.224 -12.682 1.00 0.00 C ATOM 480 CG LEU A 33 -7.109 7.884 -11.474 1.00 0.00 C ATOM 481 CD1 LEU A 33 -6.640 9.341 -11.306 1.00 0.00 C ATOM 482 CD2 LEU A 33 -8.618 7.865 -11.739 1.00 0.00 C ATOM 0 H LEU A 33 -4.848 5.664 -13.952 1.00 0.00 H new ATOM 0 HA LEU A 33 -4.491 8.247 -12.722 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -6.654 7.751 -13.598 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -6.731 6.196 -12.795 1.00 0.00 H new ATOM 0 HG LEU A 33 -6.875 7.333 -10.563 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -7.152 9.792 -10.456 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -5.564 9.359 -11.132 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -6.871 9.904 -12.210 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -9.141 8.325 -10.900 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -8.834 8.422 -12.651 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -8.954 6.835 -11.855 1.00 0.00 H new ATOM 494 N PRO A 34 -4.563 5.700 -10.563 1.00 0.00 N ATOM 495 CA PRO A 34 -4.218 5.350 -9.143 1.00 0.00 C ATOM 496 C PRO A 34 -2.706 5.372 -8.844 1.00 0.00 C ATOM 497 O PRO A 34 -2.304 5.714 -7.751 1.00 0.00 O ATOM 498 CB PRO A 34 -4.765 3.932 -9.019 1.00 0.00 C ATOM 499 CG PRO A 34 -4.664 3.385 -10.406 1.00 0.00 C ATOM 500 CD PRO A 34 -5.025 4.541 -11.356 1.00 0.00 C ATOM 0 HA PRO A 34 -4.632 6.070 -8.437 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -4.183 3.340 -8.313 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -5.795 3.931 -8.663 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -3.658 3.018 -10.606 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -5.343 2.544 -10.542 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -4.512 4.464 -12.315 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -6.093 4.584 -11.568 1.00 0.00 H new ATOM 508 N ILE A 35 -1.846 5.051 -9.771 1.00 0.00 N ATOM 509 CA ILE A 35 -0.373 5.111 -9.425 1.00 0.00 C ATOM 510 C ILE A 35 -0.013 6.578 -9.112 1.00 0.00 C ATOM 511 O ILE A 35 0.629 6.867 -8.124 1.00 0.00 O ATOM 512 CB ILE A 35 0.425 4.567 -10.602 1.00 0.00 C ATOM 513 CG1 ILE A 35 1.895 4.363 -10.215 1.00 0.00 C ATOM 514 CG2 ILE A 35 0.311 5.498 -11.810 1.00 0.00 C ATOM 515 CD1 ILE A 35 2.638 3.576 -11.310 1.00 0.00 C ATOM 0 H ILE A 35 -2.073 4.759 -10.721 1.00 0.00 H new ATOM 0 HA ILE A 35 -0.137 4.504 -8.551 1.00 0.00 H new ATOM 0 HB ILE A 35 0.007 3.598 -10.876 1.00 0.00 H new ATOM 0 HG12 ILE A 35 2.375 5.330 -10.065 1.00 0.00 H new ATOM 0 HG13 ILE A 35 1.957 3.826 -9.268 1.00 0.00 H new ATOM 0 HG21 ILE A 35 0.889 5.090 -12.639 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -0.735 5.585 -12.105 1.00 0.00 H new ATOM 0 HG23 ILE A 35 0.698 6.483 -11.548 1.00 0.00 H new ATOM 0 HD11 ILE A 35 3.679 3.441 -11.018 1.00 0.00 H new ATOM 0 HD12 ILE A 35 2.168 2.601 -11.440 1.00 0.00 H new ATOM 0 HD13 ILE A 35 2.593 4.128 -12.249 1.00 0.00 H new ATOM 527 N LEU A 36 -0.467 7.503 -9.926 1.00 0.00 N ATOM 528 CA LEU A 36 -0.197 8.952 -9.652 1.00 0.00 C ATOM 529 C LEU A 36 -0.724 9.355 -8.256 1.00 0.00 C ATOM 530 O LEU A 36 -0.041 10.037 -7.501 1.00 0.00 O ATOM 531 CB LEU A 36 -0.865 9.831 -10.720 1.00 0.00 C ATOM 532 CG LEU A 36 -0.190 9.624 -12.083 1.00 0.00 C ATOM 533 CD1 LEU A 36 -1.040 10.274 -13.187 1.00 0.00 C ATOM 534 CD2 LEU A 36 1.206 10.260 -12.077 1.00 0.00 C ATOM 0 H LEU A 36 -1.012 7.317 -10.768 1.00 0.00 H new ATOM 0 HA LEU A 36 0.882 9.103 -9.680 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.925 9.586 -10.791 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.799 10.880 -10.430 1.00 0.00 H new ATOM 0 HG LEU A 36 -0.099 8.555 -12.274 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.558 10.125 -14.153 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -2.029 9.817 -13.201 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -1.137 11.342 -12.991 1.00 0.00 H new ATOM 0 HD21 LEU A 36 1.679 10.109 -13.047 1.00 0.00 H new ATOM 0 HD22 LEU A 36 1.118 11.328 -11.878 1.00 0.00 H new ATOM 0 HD23 LEU A 36 1.814 9.795 -11.301 1.00 0.00 H new ATOM 546 N PHE A 37 -1.932 8.956 -7.906 1.00 0.00 N ATOM 547 CA PHE A 37 -2.481 9.295 -6.544 1.00 0.00 C ATOM 548 C PHE A 37 -1.801 8.396 -5.522 1.00 0.00 C ATOM 549 O PHE A 37 -1.843 9.200 -4.600 1.00 0.00 O ATOM 550 CB PHE A 37 -4.001 8.948 -6.442 1.00 0.00 C ATOM 551 CG PHE A 37 -4.715 9.511 -5.229 1.00 0.00 C ATOM 552 CD1 PHE A 37 -4.689 8.798 -4.007 1.00 0.00 C ATOM 553 CD2 PHE A 37 -5.504 10.664 -5.336 1.00 0.00 C ATOM 554 CE1 PHE A 37 -5.430 9.252 -2.906 1.00 0.00 C ATOM 555 CE2 PHE A 37 -6.268 11.111 -4.244 1.00 0.00 C ATOM 556 CZ PHE A 37 -6.229 10.405 -3.025 1.00 0.00 C ATOM 0 H PHE A 37 -2.558 8.413 -8.501 1.00 0.00 H new ATOM 0 HA PHE A 37 -2.315 10.359 -6.373 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -4.501 9.313 -7.339 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -4.109 7.863 -6.436 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -4.096 7.900 -3.922 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -5.525 11.214 -6.265 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -5.388 8.718 -1.968 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -6.883 11.993 -4.339 1.00 0.00 H new ATOM 0 HZ PHE A 37 -6.812 10.748 -2.183 1.00 0.00 H new ATOM 566 N LEU A 38 -1.285 7.235 -5.382 1.00 0.00 N ATOM 567 CA LEU A 38 -0.740 6.821 -4.138 1.00 0.00 C ATOM 568 C LEU A 38 0.423 7.750 -3.762 1.00 0.00 C ATOM 569 O LEU A 38 0.529 8.113 -2.623 1.00 0.00 O ATOM 570 CB LEU A 38 -0.373 5.354 -4.379 1.00 0.00 C ATOM 571 CG LEU A 38 -1.698 4.532 -4.635 1.00 0.00 C ATOM 572 CD1 LEU A 38 -1.384 3.100 -5.147 1.00 0.00 C ATOM 573 CD2 LEU A 38 -2.545 4.433 -3.340 1.00 0.00 C ATOM 0 H LEU A 38 -1.226 6.539 -6.126 1.00 0.00 H new ATOM 0 HA LEU A 38 -1.408 6.888 -3.279 1.00 0.00 H new ATOM 0 HB2 LEU A 38 0.296 5.268 -5.236 1.00 0.00 H new ATOM 0 HB3 LEU A 38 0.160 4.952 -3.517 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.264 5.065 -5.399 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -2.316 2.560 -5.313 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -0.829 3.162 -6.083 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -0.786 2.571 -4.405 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.452 3.863 -3.541 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.966 3.932 -2.564 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -2.813 5.434 -3.003 1.00 0.00 H new ATOM 585 N ARG A 39 1.271 8.161 -4.673 1.00 0.00 N ATOM 586 CA ARG A 39 2.422 9.053 -4.301 1.00 0.00 C ATOM 587 C ARG A 39 2.001 10.463 -3.779 1.00 0.00 C ATOM 588 O ARG A 39 2.843 11.256 -3.424 1.00 0.00 O ATOM 589 CB ARG A 39 3.314 9.229 -5.541 1.00 0.00 C ATOM 590 CG ARG A 39 3.853 7.870 -6.018 1.00 0.00 C ATOM 591 CD ARG A 39 5.067 8.061 -6.934 1.00 0.00 C ATOM 592 NE ARG A 39 6.234 8.488 -6.111 1.00 0.00 N ATOM 593 CZ ARG A 39 7.443 8.342 -6.570 1.00 0.00 C ATOM 594 NH1 ARG A 39 7.631 7.803 -7.745 1.00 0.00 N ATOM 595 NH2 ARG A 39 8.465 8.725 -5.856 1.00 0.00 N ATOM 0 H ARG A 39 1.218 7.918 -5.662 1.00 0.00 H new ATOM 0 HA ARG A 39 2.944 8.567 -3.476 1.00 0.00 H new ATOM 0 HB2 ARG A 39 2.744 9.701 -6.341 1.00 0.00 H new ATOM 0 HB3 ARG A 39 4.145 9.894 -5.306 1.00 0.00 H new ATOM 0 HG2 ARG A 39 4.132 7.261 -5.158 1.00 0.00 H new ATOM 0 HG3 ARG A 39 3.071 7.329 -6.551 1.00 0.00 H new ATOM 0 HD2 ARG A 39 5.295 7.132 -7.456 1.00 0.00 H new ATOM 0 HD3 ARG A 39 4.850 8.810 -7.696 1.00 0.00 H new ATOM 0 HE ARG A 39 6.085 8.895 -5.188 1.00 0.00 H new ATOM 0 HH11 ARG A 39 6.831 7.498 -8.300 1.00 0.00 H new ATOM 0 HH12 ARG A 39 8.577 7.687 -8.107 1.00 0.00 H new ATOM 0 HH21 ARG A 39 8.318 9.140 -4.936 1.00 0.00 H new ATOM 0 HH22 ARG A 39 9.412 8.610 -6.218 1.00 0.00 H new ATOM 609 N GLY A 40 0.730 10.754 -3.662 1.00 0.00 N ATOM 610 CA GLY A 40 0.293 12.079 -3.118 1.00 0.00 C ATOM 611 C GLY A 40 0.611 13.158 -4.120 1.00 0.00 C ATOM 612 O GLY A 40 1.159 14.186 -3.792 1.00 0.00 O ATOM 0 H GLY A 40 -0.031 10.126 -3.922 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -0.777 12.064 -2.909 1.00 0.00 H new ATOM 0 HA3 GLY A 40 0.799 12.282 -2.174 1.00 0.00 H new ATOM 616 N SER A 41 0.271 12.922 -5.357 1.00 0.00 N ATOM 617 CA SER A 41 0.566 13.948 -6.428 1.00 0.00 C ATOM 618 C SER A 41 -0.204 15.290 -6.231 1.00 0.00 C ATOM 619 O SER A 41 -1.200 15.379 -5.508 1.00 0.00 O ATOM 620 CB SER A 41 0.459 13.376 -7.824 1.00 0.00 C ATOM 621 OG SER A 41 -0.796 12.726 -7.967 1.00 0.00 O ATOM 0 H SER A 41 -0.195 12.075 -5.682 1.00 0.00 H new ATOM 0 HA SER A 41 1.615 14.219 -6.306 1.00 0.00 H new ATOM 0 HB2 SER A 41 0.557 14.170 -8.564 1.00 0.00 H new ATOM 0 HB3 SER A 41 1.270 12.671 -8.004 1.00 0.00 H new ATOM 0 HG SER A 41 -0.705 11.782 -7.721 1.00 0.00 H new ATOM 627 N ASN A 42 0.268 16.336 -6.865 1.00 0.00 N ATOM 628 CA ASN A 42 -0.401 17.681 -6.769 1.00 0.00 C ATOM 629 C ASN A 42 -1.601 17.592 -7.717 1.00 0.00 C ATOM 630 O ASN A 42 -1.478 17.638 -8.923 1.00 0.00 O ATOM 631 CB ASN A 42 0.499 18.845 -7.191 1.00 0.00 C ATOM 632 CG ASN A 42 -0.241 20.166 -6.945 1.00 0.00 C ATOM 633 OD1 ASN A 42 -1.256 20.428 -7.561 1.00 0.00 O ATOM 634 ND2 ASN A 42 0.214 21.004 -6.054 1.00 0.00 N ATOM 0 H ASN A 42 1.100 16.319 -7.454 1.00 0.00 H new ATOM 0 HA ASN A 42 -0.670 17.888 -5.733 1.00 0.00 H new ATOM 0 HB2 ASN A 42 1.430 18.825 -6.625 1.00 0.00 H new ATOM 0 HB3 ASN A 42 0.764 18.753 -8.244 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -0.282 21.877 -5.875 1.00 0.00 H new ATOM 0 HD22 ASN A 42 1.065 20.786 -5.536 1.00 0.00 H new ATOM 641 N SER A 43 -2.768 17.467 -7.131 1.00 0.00 N ATOM 642 CA SER A 43 -4.043 17.368 -7.907 1.00 0.00 C ATOM 643 C SER A 43 -5.250 17.627 -7.001 1.00 0.00 C ATOM 644 O SER A 43 -5.707 16.761 -6.296 1.00 0.00 O ATOM 645 CB SER A 43 -4.160 15.971 -8.514 1.00 0.00 C ATOM 646 OG SER A 43 -5.422 15.845 -9.150 1.00 0.00 O ATOM 0 H SER A 43 -2.891 17.429 -6.119 1.00 0.00 H new ATOM 0 HA SER A 43 -4.029 18.120 -8.696 1.00 0.00 H new ATOM 0 HB2 SER A 43 -3.358 15.805 -9.234 1.00 0.00 H new ATOM 0 HB3 SER A 43 -4.053 15.214 -7.738 1.00 0.00 H new ATOM 0 HG SER A 43 -5.348 15.223 -9.904 1.00 0.00 H new ATOM 652 N GLN A 44 -5.751 18.834 -6.996 1.00 0.00 N ATOM 653 CA GLN A 44 -6.917 19.156 -6.124 1.00 0.00 C ATOM 654 C GLN A 44 -8.194 18.433 -6.595 1.00 0.00 C ATOM 655 O GLN A 44 -9.033 18.076 -5.793 1.00 0.00 O ATOM 656 CB GLN A 44 -7.157 20.667 -6.152 1.00 0.00 C ATOM 657 CG GLN A 44 -8.196 21.037 -5.091 1.00 0.00 C ATOM 658 CD GLN A 44 -7.601 20.834 -3.697 1.00 0.00 C ATOM 659 OE1 GLN A 44 -8.159 19.983 -2.880 1.00 0.00 O flip ATOM 660 NE2 GLN A 44 -6.617 21.454 -3.350 1.00 0.00 N flip ATOM 0 H GLN A 44 -5.403 19.610 -7.558 1.00 0.00 H new ATOM 0 HA GLN A 44 -6.690 18.819 -5.112 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -6.224 21.198 -5.964 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -7.504 20.973 -7.139 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -8.506 22.074 -5.217 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -9.087 20.421 -5.210 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -6.181 22.119 -3.989 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -6.226 21.310 -2.419 1.00 0.00 H new ATOM 669 N ARG A 45 -8.373 18.252 -7.879 1.00 0.00 N ATOM 670 CA ARG A 45 -9.625 17.585 -8.376 1.00 0.00 C ATOM 671 C ARG A 45 -9.770 16.163 -7.812 1.00 0.00 C ATOM 672 O ARG A 45 -10.843 15.754 -7.392 1.00 0.00 O ATOM 673 CB ARG A 45 -9.574 17.518 -9.910 1.00 0.00 C ATOM 674 CG ARG A 45 -10.882 16.919 -10.462 1.00 0.00 C ATOM 675 CD ARG A 45 -10.848 16.881 -11.999 1.00 0.00 C ATOM 676 NE ARG A 45 -12.174 16.430 -12.517 1.00 0.00 N ATOM 677 CZ ARG A 45 -12.448 15.156 -12.595 1.00 0.00 C ATOM 678 NH1 ARG A 45 -11.567 14.267 -12.231 1.00 0.00 N ATOM 679 NH2 ARG A 45 -13.615 14.773 -13.045 1.00 0.00 N ATOM 0 H ARG A 45 -7.713 18.534 -8.604 1.00 0.00 H new ATOM 0 HA ARG A 45 -10.483 18.169 -8.042 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -9.422 18.517 -10.320 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -8.726 16.911 -10.226 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -11.022 15.912 -10.070 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -11.732 17.513 -10.125 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -10.609 17.869 -12.392 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -10.064 16.205 -12.339 1.00 0.00 H new ATOM 0 HE ARG A 45 -12.867 17.119 -12.810 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -10.656 14.565 -11.882 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -11.789 13.273 -12.295 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -14.304 15.468 -13.332 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -13.836 13.779 -13.109 1.00 0.00 H new ATOM 693 N LEU A 46 -8.713 15.400 -7.806 1.00 0.00 N ATOM 694 CA LEU A 46 -8.808 14.004 -7.282 1.00 0.00 C ATOM 695 C LEU A 46 -8.663 14.038 -5.759 1.00 0.00 C ATOM 696 O LEU A 46 -8.824 13.040 -5.077 1.00 0.00 O ATOM 697 CB LEU A 46 -7.678 13.165 -7.902 1.00 0.00 C ATOM 698 CG LEU A 46 -7.836 13.060 -9.432 1.00 0.00 C ATOM 699 CD1 LEU A 46 -6.564 12.452 -10.028 1.00 0.00 C ATOM 700 CD2 LEU A 46 -9.029 12.168 -9.792 1.00 0.00 C ATOM 0 H LEU A 46 -7.790 15.679 -8.139 1.00 0.00 H new ATOM 0 HA LEU A 46 -9.770 13.561 -7.542 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -6.714 13.615 -7.663 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -7.681 12.167 -7.464 1.00 0.00 H new ATOM 0 HG LEU A 46 -8.006 14.058 -9.835 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -6.670 12.375 -11.110 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -5.711 13.088 -9.791 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -6.404 11.459 -9.608 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -9.123 12.107 -10.876 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -8.873 11.169 -9.384 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -9.941 12.593 -9.372 1.00 0.00 H new ATOM 712 N ALA A 47 -8.381 15.185 -5.206 1.00 0.00 N ATOM 713 CA ALA A 47 -8.242 15.247 -3.736 1.00 0.00 C ATOM 714 C ALA A 47 -9.609 15.529 -3.121 1.00 0.00 C ATOM 715 O ALA A 47 -10.162 14.685 -2.485 1.00 0.00 O ATOM 716 CB ALA A 47 -7.239 16.339 -3.337 1.00 0.00 C ATOM 0 H ALA A 47 -8.244 16.065 -5.703 1.00 0.00 H new ATOM 0 HA ALA A 47 -7.866 14.293 -3.366 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -7.149 16.371 -2.251 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -6.266 16.117 -3.776 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -7.589 17.305 -3.701 1.00 0.00 H new ATOM 722 N ASP A 48 -10.170 16.704 -3.309 1.00 0.00 N ATOM 723 CA ASP A 48 -11.511 16.991 -2.700 1.00 0.00 C ATOM 724 C ASP A 48 -12.460 15.830 -3.014 1.00 0.00 C ATOM 725 O ASP A 48 -13.249 15.409 -2.192 1.00 0.00 O ATOM 726 CB ASP A 48 -12.088 18.288 -3.265 1.00 0.00 C ATOM 727 CG ASP A 48 -11.270 19.477 -2.754 1.00 0.00 C ATOM 728 OD1 ASP A 48 -10.464 19.276 -1.859 1.00 0.00 O ATOM 729 OD2 ASP A 48 -11.465 20.568 -3.264 1.00 0.00 O ATOM 0 H ASP A 48 -9.763 17.467 -3.850 1.00 0.00 H new ATOM 0 HA ASP A 48 -11.397 17.101 -1.622 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -12.070 18.262 -4.355 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -13.131 18.395 -2.966 1.00 0.00 H new ATOM 734 N GLN A 49 -12.356 15.296 -4.201 1.00 0.00 N ATOM 735 CA GLN A 49 -13.233 14.146 -4.585 1.00 0.00 C ATOM 736 C GLN A 49 -12.893 12.923 -3.714 1.00 0.00 C ATOM 737 O GLN A 49 -13.705 12.455 -2.941 1.00 0.00 O ATOM 738 CB GLN A 49 -13.002 13.798 -6.057 1.00 0.00 C ATOM 739 CG GLN A 49 -13.520 14.937 -6.934 1.00 0.00 C ATOM 740 CD GLN A 49 -13.182 14.653 -8.398 1.00 0.00 C ATOM 741 OE1 GLN A 49 -13.224 15.629 -9.264 1.00 0.00 O flip ATOM 742 NE2 GLN A 49 -12.881 13.533 -8.758 1.00 0.00 N flip ATOM 0 H GLN A 49 -11.704 15.604 -4.922 1.00 0.00 H new ATOM 0 HA GLN A 49 -14.276 14.422 -4.433 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -11.940 13.636 -6.242 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -13.514 12.869 -6.307 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -14.598 15.041 -6.813 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -13.072 15.881 -6.624 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -12.848 12.771 -8.081 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -12.661 13.354 -9.738 1.00 0.00 H new ATOM 751 N TYR A 50 -11.696 12.407 -3.839 1.00 0.00 N ATOM 752 CA TYR A 50 -11.287 11.203 -3.039 1.00 0.00 C ATOM 753 C TYR A 50 -10.663 11.653 -1.710 1.00 0.00 C ATOM 754 O TYR A 50 -9.721 11.074 -1.214 1.00 0.00 O ATOM 755 CB TYR A 50 -10.286 10.390 -3.854 1.00 0.00 C ATOM 756 CG TYR A 50 -10.981 9.895 -5.097 1.00 0.00 C ATOM 757 CD1 TYR A 50 -11.852 8.793 -5.023 1.00 0.00 C ATOM 758 CD2 TYR A 50 -10.776 10.544 -6.329 1.00 0.00 C ATOM 759 CE1 TYR A 50 -12.517 8.337 -6.177 1.00 0.00 C ATOM 760 CE2 TYR A 50 -11.444 10.092 -7.483 1.00 0.00 C ATOM 761 CZ TYR A 50 -12.312 8.988 -7.406 1.00 0.00 C ATOM 762 OH TYR A 50 -12.966 8.543 -8.539 1.00 0.00 O ATOM 0 H TYR A 50 -10.976 12.768 -4.465 1.00 0.00 H new ATOM 0 HA TYR A 50 -12.157 10.585 -2.817 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -9.425 11.003 -4.119 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -9.912 9.551 -3.268 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -12.011 8.295 -4.078 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -10.106 11.389 -6.389 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -13.183 7.489 -6.118 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -11.290 10.593 -8.427 1.00 0.00 H new ATOM 0 HH TYR A 50 -12.715 9.103 -9.303 1.00 0.00 H new ATOM 772 N ARG A 51 -11.189 12.711 -1.174 1.00 0.00 N ATOM 773 CA ARG A 51 -10.702 13.315 0.106 1.00 0.00 C ATOM 774 C ARG A 51 -10.724 12.314 1.269 1.00 0.00 C ATOM 775 O ARG A 51 -9.809 12.303 2.071 1.00 0.00 O ATOM 776 CB ARG A 51 -11.611 14.530 0.466 1.00 0.00 C ATOM 777 CG ARG A 51 -12.971 14.059 1.000 1.00 0.00 C ATOM 778 CD ARG A 51 -13.906 15.266 1.156 1.00 0.00 C ATOM 779 NE ARG A 51 -15.207 14.817 1.726 1.00 0.00 N ATOM 780 CZ ARG A 51 -16.174 15.677 1.904 1.00 0.00 C ATOM 781 NH1 ARG A 51 -16.001 16.924 1.574 1.00 0.00 N ATOM 782 NH2 ARG A 51 -17.308 15.282 2.416 1.00 0.00 N ATOM 0 H ARG A 51 -11.976 13.211 -1.587 1.00 0.00 H new ATOM 0 HA ARG A 51 -9.668 13.625 -0.044 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -11.117 15.149 1.215 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -11.758 15.153 -0.416 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -13.410 13.332 0.317 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -12.843 13.558 1.960 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -13.449 16.011 1.807 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -14.066 15.743 0.189 1.00 0.00 H new ATOM 0 HE ARG A 51 -15.343 13.838 1.977 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -15.112 17.228 1.177 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -16.755 17.597 1.712 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -17.437 14.304 2.676 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -18.065 15.951 2.556 1.00 0.00 H new ATOM 796 N ARG A 52 -11.743 11.519 1.438 1.00 0.00 N ATOM 797 CA ARG A 52 -11.702 10.599 2.602 1.00 0.00 C ATOM 798 C ARG A 52 -10.555 9.618 2.434 1.00 0.00 C ATOM 799 O ARG A 52 -9.900 9.236 3.385 1.00 0.00 O ATOM 800 CB ARG A 52 -13.025 9.831 2.692 1.00 0.00 C ATOM 801 CG ARG A 52 -14.205 10.811 2.829 1.00 0.00 C ATOM 802 CD ARG A 52 -14.282 11.353 4.262 1.00 0.00 C ATOM 803 NE ARG A 52 -15.532 12.147 4.426 1.00 0.00 N ATOM 804 CZ ARG A 52 -15.686 12.907 5.473 1.00 0.00 C ATOM 805 NH1 ARG A 52 -14.752 12.963 6.382 1.00 0.00 N ATOM 806 NH2 ARG A 52 -16.780 13.609 5.617 1.00 0.00 N ATOM 0 H ARG A 52 -12.571 11.466 0.845 1.00 0.00 H new ATOM 0 HA ARG A 52 -11.554 11.175 3.515 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -13.157 9.215 1.802 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -13.004 9.156 3.547 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -14.085 11.636 2.127 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -15.137 10.307 2.573 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -14.266 10.529 4.975 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -13.413 11.975 4.474 1.00 0.00 H new ATOM 0 HE ARG A 52 -16.266 12.096 3.720 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -13.901 12.412 6.273 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -14.873 13.558 7.202 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -17.513 13.562 4.909 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -16.900 14.204 6.437 1.00 0.00 H new ATOM 820 N HIS A 53 -10.326 9.192 1.227 1.00 0.00 N ATOM 821 CA HIS A 53 -9.242 8.209 0.949 1.00 0.00 C ATOM 822 C HIS A 53 -7.938 8.553 1.675 1.00 0.00 C ATOM 823 O HIS A 53 -7.197 9.419 1.256 1.00 0.00 O ATOM 824 CB HIS A 53 -9.015 8.230 -0.532 1.00 0.00 C ATOM 825 CG HIS A 53 -8.543 6.871 -0.975 1.00 0.00 C ATOM 826 ND1 HIS A 53 -9.077 5.701 -0.447 1.00 0.00 N ATOM 827 CD2 HIS A 53 -7.586 6.474 -1.871 1.00 0.00 C ATOM 828 CE1 HIS A 53 -8.439 4.668 -1.027 1.00 0.00 C ATOM 829 NE2 HIS A 53 -7.522 5.087 -1.900 1.00 0.00 N ATOM 0 H HIS A 53 -10.853 9.488 0.405 1.00 0.00 H new ATOM 0 HA HIS A 53 -9.543 7.225 1.308 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -9.936 8.496 -1.050 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -8.275 8.988 -0.789 1.00 0.00 H new ATOM 0 HD1 HIS A 53 -9.817 5.637 0.252 1.00 0.00 H new ATOM 0 HD2 HIS A 53 -6.975 7.138 -2.464 1.00 0.00 H new ATOM 0 HE1 HIS A 53 -8.644 3.630 -0.812 1.00 0.00 H new ATOM 838 N SER A 54 -7.634 7.868 2.745 1.00 0.00 N ATOM 839 CA SER A 54 -6.368 8.157 3.485 1.00 0.00 C ATOM 840 C SER A 54 -5.130 7.765 2.647 1.00 0.00 C ATOM 841 O SER A 54 -4.088 8.376 2.746 1.00 0.00 O ATOM 842 CB SER A 54 -6.358 7.362 4.791 1.00 0.00 C ATOM 843 OG SER A 54 -5.175 7.670 5.518 1.00 0.00 O ATOM 0 H SER A 54 -8.206 7.121 3.139 1.00 0.00 H new ATOM 0 HA SER A 54 -6.324 9.227 3.688 1.00 0.00 H new ATOM 0 HB2 SER A 54 -7.238 7.606 5.386 1.00 0.00 H new ATOM 0 HB3 SER A 54 -6.402 6.293 4.580 1.00 0.00 H new ATOM 0 HG SER A 54 -5.165 7.163 6.357 1.00 0.00 H new ATOM 849 N LEU A 55 -5.224 6.729 1.849 1.00 0.00 N ATOM 850 CA LEU A 55 -4.044 6.273 1.034 1.00 0.00 C ATOM 851 C LEU A 55 -3.369 7.476 0.331 1.00 0.00 C ATOM 852 O LEU A 55 -2.319 7.351 -0.325 1.00 0.00 O ATOM 853 CB LEU A 55 -4.508 5.326 -0.124 1.00 0.00 C ATOM 854 CG LEU A 55 -5.088 3.952 0.333 1.00 0.00 C ATOM 855 CD1 LEU A 55 -5.180 2.985 -0.861 1.00 0.00 C ATOM 856 CD2 LEU A 55 -4.197 3.335 1.413 1.00 0.00 C ATOM 0 H LEU A 55 -6.070 6.174 1.724 1.00 0.00 H new ATOM 0 HA LEU A 55 -3.364 5.771 1.722 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -5.265 5.844 -0.714 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -3.660 5.143 -0.784 1.00 0.00 H new ATOM 0 HG LEU A 55 -6.086 4.120 0.738 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -5.586 2.031 -0.526 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -5.833 3.410 -1.624 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -4.186 2.829 -1.280 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -4.613 2.376 1.724 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -3.194 3.184 1.014 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -4.149 4.005 2.272 1.00 0.00 H new ATOM 868 N PHE A 56 -3.945 8.641 0.370 1.00 0.00 N ATOM 869 CA PHE A 56 -3.266 9.702 -0.361 1.00 0.00 C ATOM 870 C PHE A 56 -1.837 9.869 0.167 1.00 0.00 C ATOM 871 O PHE A 56 -1.641 10.081 1.337 1.00 0.00 O ATOM 872 CB PHE A 56 -4.134 10.916 -0.146 1.00 0.00 C ATOM 873 CG PHE A 56 -3.439 12.209 -0.587 1.00 0.00 C ATOM 874 CD1 PHE A 56 -2.495 12.867 0.245 1.00 0.00 C ATOM 875 CD2 PHE A 56 -3.696 12.738 -1.877 1.00 0.00 C ATOM 876 CE1 PHE A 56 -1.843 14.019 -0.218 1.00 0.00 C ATOM 877 CE2 PHE A 56 -3.025 13.879 -2.324 1.00 0.00 C ATOM 878 CZ PHE A 56 -2.108 14.518 -1.496 1.00 0.00 C ATOM 0 H PHE A 56 -4.810 8.884 0.853 1.00 0.00 H new ATOM 0 HA PHE A 56 -3.148 9.502 -1.426 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -5.065 10.798 -0.701 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -4.399 10.989 0.909 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -2.280 12.482 1.231 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -4.417 12.255 -2.520 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -1.131 14.524 0.418 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -3.219 14.265 -3.314 1.00 0.00 H new ATOM 0 HZ PHE A 56 -1.598 15.405 -1.843 1.00 0.00 H new ATOM 888 N GLY A 57 -0.886 9.861 -0.711 1.00 0.00 N ATOM 889 CA GLY A 57 0.581 10.070 -0.410 1.00 0.00 C ATOM 890 C GLY A 57 1.320 9.028 0.453 1.00 0.00 C ATOM 891 O GLY A 57 2.372 9.372 1.006 1.00 0.00 O ATOM 0 H GLY A 57 -1.066 9.708 -1.703 1.00 0.00 H new ATOM 0 HA2 GLY A 57 1.106 10.141 -1.363 1.00 0.00 H new ATOM 0 HA3 GLY A 57 0.682 11.037 0.083 1.00 0.00 H new ATOM 895 N THR A 58 0.897 7.801 0.639 1.00 0.00 N ATOM 896 CA THR A 58 1.790 6.994 1.541 1.00 0.00 C ATOM 897 C THR A 58 2.777 6.265 0.584 1.00 0.00 C ATOM 898 O THR A 58 3.816 5.840 0.951 1.00 0.00 O ATOM 899 CB THR A 58 0.838 6.000 2.245 1.00 0.00 C ATOM 900 OG1 THR A 58 -0.095 6.741 3.012 1.00 0.00 O ATOM 901 CG2 THR A 58 1.613 5.060 3.184 1.00 0.00 C ATOM 0 H THR A 58 0.064 7.355 0.255 1.00 0.00 H new ATOM 0 HA THR A 58 2.354 7.557 2.285 1.00 0.00 H new ATOM 0 HB THR A 58 0.337 5.397 1.488 1.00 0.00 H new ATOM 0 HG1 THR A 58 -0.709 6.125 3.465 1.00 0.00 H new ATOM 0 HG21 THR A 58 0.918 4.372 3.665 1.00 0.00 H new ATOM 0 HG22 THR A 58 2.345 4.493 2.608 1.00 0.00 H new ATOM 0 HG23 THR A 58 2.127 5.648 3.945 1.00 0.00 H new ATOM 909 N GLY A 59 2.468 6.238 -0.682 1.00 0.00 N ATOM 910 CA GLY A 59 3.320 5.619 -1.761 1.00 0.00 C ATOM 911 C GLY A 59 4.353 6.601 -2.163 1.00 0.00 C ATOM 912 O GLY A 59 5.149 6.404 -3.061 1.00 0.00 O ATOM 0 H GLY A 59 1.605 6.645 -1.042 1.00 0.00 H new ATOM 0 HA2 GLY A 59 3.788 4.704 -1.397 1.00 0.00 H new ATOM 0 HA3 GLY A 59 2.705 5.343 -2.618 1.00 0.00 H new ATOM 916 N LYS A 60 4.282 7.665 -1.490 1.00 0.00 N ATOM 917 CA LYS A 60 5.177 8.813 -1.701 1.00 0.00 C ATOM 918 C LYS A 60 6.675 8.450 -1.435 1.00 0.00 C ATOM 919 O LYS A 60 7.547 8.930 -2.132 1.00 0.00 O ATOM 920 CB LYS A 60 4.687 9.892 -0.690 1.00 0.00 C ATOM 921 CG LYS A 60 5.453 11.287 -0.853 1.00 0.00 C ATOM 922 CD LYS A 60 4.869 12.319 0.134 1.00 0.00 C ATOM 923 CE LYS A 60 5.305 12.009 1.581 1.00 0.00 C ATOM 924 NZ LYS A 60 4.246 11.202 2.252 1.00 0.00 N ATOM 0 H LYS A 60 3.598 7.810 -0.748 1.00 0.00 H new ATOM 0 HA LYS A 60 5.140 9.157 -2.735 1.00 0.00 H new ATOM 0 HB2 LYS A 60 3.617 10.052 -0.826 1.00 0.00 H new ATOM 0 HB3 LYS A 60 4.827 9.522 0.326 1.00 0.00 H new ATOM 0 HG2 LYS A 60 6.518 11.152 -0.665 1.00 0.00 H new ATOM 0 HG3 LYS A 60 5.353 11.650 -1.876 1.00 0.00 H new ATOM 0 HD2 LYS A 60 5.200 13.320 -0.143 1.00 0.00 H new ATOM 0 HD3 LYS A 60 3.781 12.314 0.069 1.00 0.00 H new ATOM 0 HE2 LYS A 60 6.248 11.463 1.580 1.00 0.00 H new ATOM 0 HE3 LYS A 60 5.474 12.936 2.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 3.720 11.804 2.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 3.593 10.823 1.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 4.686 10.415 2.771 1.00 0.00 H new ATOM 938 N ASP A 61 6.977 7.614 -0.476 1.00 0.00 N ATOM 939 CA ASP A 61 8.417 7.208 -0.201 1.00 0.00 C ATOM 940 C ASP A 61 8.898 6.238 -1.296 1.00 0.00 C ATOM 941 O ASP A 61 10.042 5.826 -1.318 1.00 0.00 O ATOM 942 CB ASP A 61 8.545 6.543 1.171 1.00 0.00 C ATOM 943 CG ASP A 61 7.544 5.385 1.267 1.00 0.00 C ATOM 944 OD1 ASP A 61 6.615 5.361 0.481 1.00 0.00 O ATOM 945 OD2 ASP A 61 7.727 4.539 2.131 1.00 0.00 O ATOM 0 H ASP A 61 6.290 7.183 0.143 1.00 0.00 H new ATOM 0 HA ASP A 61 9.036 8.105 -0.206 1.00 0.00 H new ATOM 0 HB2 ASP A 61 9.560 6.174 1.316 1.00 0.00 H new ATOM 0 HB3 ASP A 61 8.354 7.270 1.960 1.00 0.00 H new ATOM 950 N GLN A 62 8.002 5.795 -2.127 1.00 0.00 N ATOM 951 CA GLN A 62 8.347 4.788 -3.185 1.00 0.00 C ATOM 952 C GLN A 62 8.422 5.400 -4.552 1.00 0.00 C ATOM 953 O GLN A 62 7.579 6.150 -4.985 1.00 0.00 O ATOM 954 CB GLN A 62 7.184 3.815 -3.253 1.00 0.00 C ATOM 955 CG GLN A 62 7.175 2.937 -1.945 1.00 0.00 C ATOM 956 CD GLN A 62 5.986 1.963 -1.955 1.00 0.00 C ATOM 957 OE1 GLN A 62 6.039 0.914 -1.346 1.00 0.00 O ATOM 958 NE2 GLN A 62 4.911 2.273 -2.627 1.00 0.00 N ATOM 0 H GLN A 62 7.025 6.089 -2.124 1.00 0.00 H new ATOM 0 HA GLN A 62 9.309 4.343 -2.929 1.00 0.00 H new ATOM 0 HB2 GLN A 62 6.244 4.358 -3.349 1.00 0.00 H new ATOM 0 HB3 GLN A 62 7.276 3.179 -4.133 1.00 0.00 H new ATOM 0 HG2 GLN A 62 8.108 2.379 -1.869 1.00 0.00 H new ATOM 0 HG3 GLN A 62 7.116 3.582 -1.068 1.00 0.00 H new ATOM 0 HE21 GLN A 62 4.866 3.154 -3.139 1.00 0.00 H new ATOM 0 HE22 GLN A 62 4.116 1.634 -2.640 1.00 0.00 H new ATOM 967 N THR A 63 9.434 5.031 -5.254 1.00 0.00 N ATOM 968 CA THR A 63 9.580 5.546 -6.611 1.00 0.00 C ATOM 969 C THR A 63 8.500 4.950 -7.512 1.00 0.00 C ATOM 970 O THR A 63 7.815 4.022 -7.161 1.00 0.00 O ATOM 971 CB THR A 63 10.999 5.264 -7.145 1.00 0.00 C ATOM 972 OG1 THR A 63 11.166 3.860 -7.288 1.00 0.00 O ATOM 973 CG2 THR A 63 12.057 5.803 -6.171 1.00 0.00 C ATOM 0 H THR A 63 10.166 4.393 -4.942 1.00 0.00 H new ATOM 0 HA THR A 63 9.448 6.628 -6.604 1.00 0.00 H new ATOM 0 HB THR A 63 11.123 5.761 -8.107 1.00 0.00 H new ATOM 0 HG1 THR A 63 12.065 3.671 -7.629 1.00 0.00 H new ATOM 0 HG21 THR A 63 13.052 5.595 -6.564 1.00 0.00 H new ATOM 0 HG22 THR A 63 11.930 6.879 -6.055 1.00 0.00 H new ATOM 0 HG23 THR A 63 11.941 5.317 -5.202 1.00 0.00 H new ATOM 981 N GLU A 64 8.414 5.504 -8.686 1.00 0.00 N ATOM 982 CA GLU A 64 7.460 5.076 -9.755 1.00 0.00 C ATOM 983 C GLU A 64 7.603 3.586 -10.172 1.00 0.00 C ATOM 984 O GLU A 64 6.618 2.906 -10.296 1.00 0.00 O ATOM 985 CB GLU A 64 7.741 5.950 -10.990 1.00 0.00 C ATOM 986 CG GLU A 64 6.673 5.722 -12.066 1.00 0.00 C ATOM 987 CD GLU A 64 5.346 6.325 -11.600 1.00 0.00 C ATOM 988 OE1 GLU A 64 5.342 6.971 -10.565 1.00 0.00 O ATOM 989 OE2 GLU A 64 4.358 6.130 -12.287 1.00 0.00 O ATOM 0 H GLU A 64 9.004 6.287 -8.967 1.00 0.00 H new ATOM 0 HA GLU A 64 6.450 5.192 -9.361 1.00 0.00 H new ATOM 0 HB2 GLU A 64 7.757 7.001 -10.702 1.00 0.00 H new ATOM 0 HB3 GLU A 64 8.726 5.715 -11.392 1.00 0.00 H new ATOM 0 HG2 GLU A 64 6.983 6.180 -13.005 1.00 0.00 H new ATOM 0 HG3 GLU A 64 6.554 4.655 -12.256 1.00 0.00 H new ATOM 996 N SER A 65 8.777 3.081 -10.455 1.00 0.00 N ATOM 997 CA SER A 65 8.897 1.679 -10.872 1.00 0.00 C ATOM 998 C SER A 65 8.592 0.740 -9.716 1.00 0.00 C ATOM 999 O SER A 65 8.091 -0.318 -9.915 1.00 0.00 O ATOM 1000 CB SER A 65 10.329 1.472 -11.369 1.00 0.00 C ATOM 1001 OG SER A 65 11.237 1.798 -10.327 1.00 0.00 O ATOM 0 H SER A 65 9.656 3.596 -10.410 1.00 0.00 H new ATOM 0 HA SER A 65 8.180 1.457 -11.662 1.00 0.00 H new ATOM 0 HB2 SER A 65 10.472 0.438 -11.682 1.00 0.00 H new ATOM 0 HB3 SER A 65 10.518 2.098 -12.241 1.00 0.00 H new ATOM 0 HG SER A 65 12.156 1.665 -10.640 1.00 0.00 H new ATOM 1007 N TRP A 66 8.819 1.104 -8.502 1.00 0.00 N ATOM 1008 CA TRP A 66 8.496 0.153 -7.400 1.00 0.00 C ATOM 1009 C TRP A 66 7.009 -0.087 -7.497 1.00 0.00 C ATOM 1010 O TRP A 66 6.506 -1.140 -7.328 1.00 0.00 O ATOM 1011 CB TRP A 66 8.886 0.706 -6.028 1.00 0.00 C ATOM 1012 CG TRP A 66 8.744 -0.359 -5.018 1.00 0.00 C ATOM 1013 CD1 TRP A 66 7.583 -0.871 -4.610 1.00 0.00 C ATOM 1014 CD2 TRP A 66 9.780 -1.010 -4.250 1.00 0.00 C ATOM 1015 NE1 TRP A 66 7.838 -1.876 -3.693 1.00 0.00 N ATOM 1016 CE2 TRP A 66 9.179 -1.962 -3.405 1.00 0.00 C ATOM 1017 CE3 TRP A 66 11.180 -0.870 -4.216 1.00 0.00 C ATOM 1018 CZ2 TRP A 66 9.939 -2.746 -2.539 1.00 0.00 C ATOM 1019 CZ3 TRP A 66 11.945 -1.652 -3.344 1.00 0.00 C ATOM 1020 CH2 TRP A 66 11.328 -2.588 -2.499 1.00 0.00 C ATOM 0 H TRP A 66 9.208 2.002 -8.215 1.00 0.00 H new ATOM 0 HA TRP A 66 9.062 -0.773 -7.503 1.00 0.00 H new ATOM 0 HB2 TRP A 66 9.913 1.070 -6.048 1.00 0.00 H new ATOM 0 HB3 TRP A 66 8.252 1.554 -5.771 1.00 0.00 H new ATOM 0 HD1 TRP A 66 6.605 -0.554 -4.940 1.00 0.00 H new ATOM 0 HE1 TRP A 66 7.122 -2.476 -3.283 1.00 0.00 H new ATOM 0 HE3 TRP A 66 11.665 -0.156 -4.865 1.00 0.00 H new ATOM 0 HZ2 TRP A 66 9.457 -3.473 -1.901 1.00 0.00 H new ATOM 0 HZ3 TRP A 66 13.018 -1.535 -3.321 1.00 0.00 H new ATOM 0 HH2 TRP A 66 11.923 -3.183 -1.822 1.00 0.00 H new ATOM 1031 N TRP A 67 6.298 0.938 -7.763 1.00 0.00 N ATOM 1032 CA TRP A 67 4.848 0.793 -7.817 1.00 0.00 C ATOM 1033 C TRP A 67 4.603 0.008 -9.134 1.00 0.00 C ATOM 1034 O TRP A 67 3.958 -1.039 -9.145 1.00 0.00 O ATOM 1035 CB TRP A 67 4.188 2.187 -7.813 1.00 0.00 C ATOM 1036 CG TRP A 67 3.867 2.702 -6.389 1.00 0.00 C ATOM 1037 CD1 TRP A 67 4.380 3.807 -5.736 1.00 0.00 C ATOM 1038 CD2 TRP A 67 2.936 2.110 -5.426 1.00 0.00 C ATOM 1039 NE1 TRP A 67 3.789 3.939 -4.508 1.00 0.00 N ATOM 1040 CE2 TRP A 67 2.902 2.916 -4.248 1.00 0.00 C ATOM 1041 CE3 TRP A 67 2.103 0.965 -5.468 1.00 0.00 C ATOM 1042 CZ2 TRP A 67 2.083 2.596 -3.160 1.00 0.00 C ATOM 1043 CZ3 TRP A 67 1.280 0.634 -4.371 1.00 0.00 C ATOM 1044 CH2 TRP A 67 1.271 1.448 -3.220 1.00 0.00 C ATOM 0 H TRP A 67 6.657 1.875 -7.947 1.00 0.00 H new ATOM 0 HA TRP A 67 4.417 0.268 -6.964 1.00 0.00 H new ATOM 0 HB2 TRP A 67 4.849 2.897 -8.309 1.00 0.00 H new ATOM 0 HB3 TRP A 67 3.267 2.148 -8.395 1.00 0.00 H new ATOM 0 HD1 TRP A 67 5.135 4.468 -6.135 1.00 0.00 H new ATOM 0 HE1 TRP A 67 3.982 4.704 -3.862 1.00 0.00 H new ATOM 0 HE3 TRP A 67 2.098 0.339 -6.348 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 2.074 3.224 -2.282 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 0.655 -0.246 -4.413 1.00 0.00 H new ATOM 0 HH2 TRP A 67 0.640 1.190 -2.383 1.00 0.00 H new ATOM 1055 N LYS A 68 5.220 0.438 -10.219 1.00 0.00 N ATOM 1056 CA LYS A 68 5.056 -0.298 -11.537 1.00 0.00 C ATOM 1057 C LYS A 68 5.393 -1.757 -11.290 1.00 0.00 C ATOM 1058 O LYS A 68 4.659 -2.664 -11.623 1.00 0.00 O ATOM 1059 CB LYS A 68 6.022 0.275 -12.649 1.00 0.00 C ATOM 1060 CG LYS A 68 5.564 -0.028 -14.138 1.00 0.00 C ATOM 1061 CD LYS A 68 4.397 0.911 -14.576 1.00 0.00 C ATOM 1062 CE LYS A 68 4.028 0.664 -16.049 1.00 0.00 C ATOM 1063 NZ LYS A 68 5.142 1.117 -16.927 1.00 0.00 N ATOM 0 H LYS A 68 5.825 1.258 -10.255 1.00 0.00 H new ATOM 0 HA LYS A 68 4.033 -0.174 -11.893 1.00 0.00 H new ATOM 0 HB2 LYS A 68 6.104 1.354 -12.520 1.00 0.00 H new ATOM 0 HB3 LYS A 68 7.018 -0.141 -12.497 1.00 0.00 H new ATOM 0 HG2 LYS A 68 6.410 0.100 -14.814 1.00 0.00 H new ATOM 0 HG3 LYS A 68 5.246 -1.068 -14.218 1.00 0.00 H new ATOM 0 HD2 LYS A 68 3.526 0.738 -13.943 1.00 0.00 H new ATOM 0 HD3 LYS A 68 4.689 1.952 -14.438 1.00 0.00 H new ATOM 0 HE2 LYS A 68 3.831 -0.396 -16.212 1.00 0.00 H new ATOM 0 HE3 LYS A 68 3.113 1.200 -16.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 4.799 1.206 -17.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 5.491 2.040 -16.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 5.915 0.422 -16.893 1.00 0.00 H new ATOM 1077 N ALA A 69 6.537 -1.953 -10.738 1.00 0.00 N ATOM 1078 CA ALA A 69 7.037 -3.292 -10.470 1.00 0.00 C ATOM 1079 C ALA A 69 6.042 -4.061 -9.597 1.00 0.00 C ATOM 1080 O ALA A 69 5.765 -5.205 -9.850 1.00 0.00 O ATOM 1081 CB ALA A 69 8.401 -3.186 -9.795 1.00 0.00 C ATOM 0 H ALA A 69 7.167 -1.203 -10.452 1.00 0.00 H new ATOM 0 HA ALA A 69 7.149 -3.842 -11.404 1.00 0.00 H new ATOM 0 HB1 ALA A 69 8.784 -4.186 -9.590 1.00 0.00 H new ATOM 0 HB2 ALA A 69 9.093 -2.660 -10.453 1.00 0.00 H new ATOM 0 HB3 ALA A 69 8.302 -2.636 -8.859 1.00 0.00 H new ATOM 1087 N PHE A 70 5.491 -3.442 -8.583 1.00 0.00 N ATOM 1088 CA PHE A 70 4.496 -4.167 -7.706 1.00 0.00 C ATOM 1089 C PHE A 70 3.300 -4.628 -8.540 1.00 0.00 C ATOM 1090 O PHE A 70 2.834 -5.740 -8.416 1.00 0.00 O ATOM 1091 CB PHE A 70 3.973 -3.227 -6.640 1.00 0.00 C ATOM 1092 CG PHE A 70 3.082 -3.903 -5.622 1.00 0.00 C ATOM 1093 CD1 PHE A 70 3.606 -4.933 -4.820 1.00 0.00 C ATOM 1094 CD2 PHE A 70 1.719 -3.561 -5.532 1.00 0.00 C ATOM 1095 CE1 PHE A 70 2.771 -5.621 -3.923 1.00 0.00 C ATOM 1096 CE2 PHE A 70 0.884 -4.245 -4.628 1.00 0.00 C ATOM 1097 CZ PHE A 70 1.409 -5.278 -3.828 1.00 0.00 C ATOM 0 H PHE A 70 5.679 -2.475 -8.319 1.00 0.00 H new ATOM 0 HA PHE A 70 4.998 -5.022 -7.254 1.00 0.00 H new ATOM 0 HB2 PHE A 70 4.817 -2.769 -6.125 1.00 0.00 H new ATOM 0 HB3 PHE A 70 3.417 -2.421 -7.119 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.651 -5.195 -4.894 1.00 0.00 H new ATOM 0 HD2 PHE A 70 1.315 -2.776 -6.155 1.00 0.00 H new ATOM 0 HE1 PHE A 70 3.174 -6.412 -3.307 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -0.159 -3.977 -4.548 1.00 0.00 H new ATOM 0 HZ PHE A 70 0.766 -5.808 -3.141 1.00 0.00 H new ATOM 1107 N SER A 71 2.797 -3.763 -9.395 1.00 0.00 N ATOM 1108 CA SER A 71 1.639 -4.167 -10.238 1.00 0.00 C ATOM 1109 C SER A 71 2.027 -5.378 -11.094 1.00 0.00 C ATOM 1110 O SER A 71 1.258 -6.304 -11.270 1.00 0.00 O ATOM 1111 CB SER A 71 1.246 -3.005 -11.150 1.00 0.00 C ATOM 1112 OG SER A 71 0.875 -1.886 -10.357 1.00 0.00 O ATOM 0 H SER A 71 3.137 -2.812 -9.539 1.00 0.00 H new ATOM 0 HA SER A 71 0.797 -4.430 -9.598 1.00 0.00 H new ATOM 0 HB2 SER A 71 2.079 -2.742 -11.802 1.00 0.00 H new ATOM 0 HB3 SER A 71 0.417 -3.298 -11.794 1.00 0.00 H new ATOM 0 HG SER A 71 0.012 -1.538 -10.665 1.00 0.00 H new ATOM 1118 N ARG A 72 3.220 -5.363 -11.622 1.00 0.00 N ATOM 1119 CA ARG A 72 3.687 -6.492 -12.479 1.00 0.00 C ATOM 1120 C ARG A 72 3.690 -7.805 -11.675 1.00 0.00 C ATOM 1121 O ARG A 72 3.293 -8.844 -12.164 1.00 0.00 O ATOM 1122 CB ARG A 72 5.105 -6.144 -12.978 1.00 0.00 C ATOM 1123 CG ARG A 72 5.647 -7.219 -13.930 1.00 0.00 C ATOM 1124 CD ARG A 72 7.057 -6.833 -14.387 1.00 0.00 C ATOM 1125 NE ARG A 72 6.982 -5.634 -15.269 1.00 0.00 N ATOM 1126 CZ ARG A 72 7.969 -5.356 -16.080 1.00 0.00 C ATOM 1127 NH1 ARG A 72 9.022 -6.130 -16.112 1.00 0.00 N ATOM 1128 NH2 ARG A 72 7.901 -4.310 -16.855 1.00 0.00 N ATOM 0 H ARG A 72 3.898 -4.611 -11.496 1.00 0.00 H new ATOM 0 HA ARG A 72 3.019 -6.634 -13.328 1.00 0.00 H new ATOM 0 HB2 ARG A 72 5.086 -5.181 -13.488 1.00 0.00 H new ATOM 0 HB3 ARG A 72 5.776 -6.040 -12.126 1.00 0.00 H new ATOM 0 HG2 ARG A 72 5.668 -8.187 -13.429 1.00 0.00 H new ATOM 0 HG3 ARG A 72 4.989 -7.321 -14.793 1.00 0.00 H new ATOM 0 HD2 ARG A 72 7.686 -6.623 -13.522 1.00 0.00 H new ATOM 0 HD3 ARG A 72 7.518 -7.663 -14.922 1.00 0.00 H new ATOM 0 HE ARG A 72 6.160 -5.030 -15.240 1.00 0.00 H new ATOM 0 HH11 ARG A 72 9.072 -6.948 -15.505 1.00 0.00 H new ATOM 0 HH12 ARG A 72 9.794 -5.916 -16.744 1.00 0.00 H new ATOM 0 HH21 ARG A 72 7.078 -3.708 -16.829 1.00 0.00 H new ATOM 0 HH22 ARG A 72 8.671 -4.093 -17.488 1.00 0.00 H new ATOM 1142 N GLN A 73 4.143 -7.768 -10.456 1.00 0.00 N ATOM 1143 CA GLN A 73 4.183 -9.006 -9.621 1.00 0.00 C ATOM 1144 C GLN A 73 2.787 -9.663 -9.528 1.00 0.00 C ATOM 1145 O GLN A 73 2.647 -10.870 -9.651 1.00 0.00 O ATOM 1146 CB GLN A 73 4.635 -8.642 -8.191 1.00 0.00 C ATOM 1147 CG GLN A 73 6.075 -8.124 -8.163 1.00 0.00 C ATOM 1148 CD GLN A 73 6.489 -7.858 -6.682 1.00 0.00 C ATOM 1149 OE1 GLN A 73 5.876 -8.376 -5.776 1.00 0.00 O ATOM 1150 NE2 GLN A 73 7.494 -7.039 -6.401 1.00 0.00 N ATOM 0 H GLN A 73 4.491 -6.928 -9.995 1.00 0.00 H new ATOM 0 HA GLN A 73 4.878 -9.704 -10.088 1.00 0.00 H new ATOM 0 HB2 GLN A 73 3.968 -7.883 -7.781 1.00 0.00 H new ATOM 0 HB3 GLN A 73 4.552 -9.519 -7.549 1.00 0.00 H new ATOM 0 HG2 GLN A 73 6.746 -8.853 -8.617 1.00 0.00 H new ATOM 0 HG3 GLN A 73 6.157 -7.208 -8.748 1.00 0.00 H new ATOM 0 HE21 GLN A 73 8.018 -6.597 -7.156 1.00 0.00 H new ATOM 0 HE22 GLN A 73 7.743 -6.852 -5.430 1.00 0.00 H new ATOM 1159 N LEU A 74 1.764 -8.879 -9.272 1.00 0.00 N ATOM 1160 CA LEU A 74 0.370 -9.435 -9.141 1.00 0.00 C ATOM 1161 C LEU A 74 -0.148 -10.058 -10.448 1.00 0.00 C ATOM 1162 O LEU A 74 -0.936 -10.983 -10.427 1.00 0.00 O ATOM 1163 CB LEU A 74 -0.579 -8.301 -8.724 1.00 0.00 C ATOM 1164 CG LEU A 74 -0.003 -7.561 -7.482 1.00 0.00 C ATOM 1165 CD1 LEU A 74 -0.877 -6.326 -7.136 1.00 0.00 C ATOM 1166 CD2 LEU A 74 0.080 -8.504 -6.248 1.00 0.00 C ATOM 0 H LEU A 74 1.833 -7.869 -9.147 1.00 0.00 H new ATOM 0 HA LEU A 74 0.403 -10.226 -8.391 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -0.708 -7.600 -9.549 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -1.564 -8.706 -8.493 1.00 0.00 H new ATOM 0 HG LEU A 74 1.006 -7.233 -7.732 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -0.462 -5.819 -6.265 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -0.890 -5.641 -7.983 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -1.894 -6.650 -6.916 1.00 0.00 H new ATOM 0 HD21 LEU A 74 0.486 -7.956 -5.398 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -0.917 -8.869 -6.001 1.00 0.00 H new ATOM 0 HD23 LEU A 74 0.729 -9.349 -6.479 1.00 0.00 H new ATOM 1178 N ILE A 75 0.237 -9.529 -11.572 1.00 0.00 N ATOM 1179 CA ILE A 75 -0.264 -10.085 -12.871 1.00 0.00 C ATOM 1180 C ILE A 75 0.165 -11.546 -13.077 1.00 0.00 C ATOM 1181 O ILE A 75 -0.616 -12.373 -13.508 1.00 0.00 O ATOM 1182 CB ILE A 75 0.284 -9.236 -14.017 1.00 0.00 C ATOM 1183 CG1 ILE A 75 -0.302 -7.824 -13.925 1.00 0.00 C ATOM 1184 CG2 ILE A 75 -0.103 -9.867 -15.355 1.00 0.00 C ATOM 1185 CD1 ILE A 75 0.410 -6.901 -14.918 1.00 0.00 C ATOM 0 H ILE A 75 0.875 -8.738 -11.655 1.00 0.00 H new ATOM 0 HA ILE A 75 -1.353 -10.058 -12.851 1.00 0.00 H new ATOM 0 HB ILE A 75 1.371 -9.185 -13.946 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -1.370 -7.849 -14.140 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -0.189 -7.439 -12.912 1.00 0.00 H new ATOM 0 HG21 ILE A 75 0.289 -9.260 -16.171 1.00 0.00 H new ATOM 0 HG22 ILE A 75 0.315 -10.872 -15.418 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -1.189 -9.920 -15.432 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -0.011 -5.898 -14.848 1.00 0.00 H new ATOM 0 HD12 ILE A 75 1.474 -6.865 -14.683 1.00 0.00 H new ATOM 0 HD13 ILE A 75 0.274 -7.282 -15.930 1.00 0.00 H new ATOM 1197 N THR A 76 1.404 -11.862 -12.826 1.00 0.00 N ATOM 1198 CA THR A 76 1.887 -13.266 -13.031 1.00 0.00 C ATOM 1199 C THR A 76 1.233 -14.237 -12.036 1.00 0.00 C ATOM 1200 O THR A 76 0.870 -15.337 -12.396 1.00 0.00 O ATOM 1201 CB THR A 76 3.408 -13.308 -12.859 1.00 0.00 C ATOM 1202 OG1 THR A 76 3.992 -12.259 -13.617 1.00 0.00 O ATOM 1203 CG2 THR A 76 3.951 -14.655 -13.347 1.00 0.00 C ATOM 0 H THR A 76 2.110 -11.209 -12.486 1.00 0.00 H new ATOM 0 HA THR A 76 1.611 -13.578 -14.038 1.00 0.00 H new ATOM 0 HB THR A 76 3.657 -13.185 -11.805 1.00 0.00 H new ATOM 0 HG1 THR A 76 4.966 -12.280 -13.509 1.00 0.00 H new ATOM 0 HG21 THR A 76 5.034 -14.678 -13.222 1.00 0.00 H new ATOM 0 HG22 THR A 76 3.501 -15.460 -12.766 1.00 0.00 H new ATOM 0 HG23 THR A 76 3.705 -14.786 -14.401 1.00 0.00 H new ATOM 1211 N GLU A 77 1.106 -13.868 -10.791 1.00 0.00 N ATOM 1212 CA GLU A 77 0.495 -14.812 -9.803 1.00 0.00 C ATOM 1213 C GLU A 77 -0.965 -15.132 -10.168 1.00 0.00 C ATOM 1214 O GLU A 77 -1.485 -16.160 -9.788 1.00 0.00 O ATOM 1215 CB GLU A 77 0.541 -14.175 -8.408 1.00 0.00 C ATOM 1216 CG GLU A 77 1.999 -13.989 -7.976 1.00 0.00 C ATOM 1217 CD GLU A 77 2.039 -13.229 -6.652 1.00 0.00 C ATOM 1218 OE1 GLU A 77 0.983 -12.836 -6.185 1.00 0.00 O ATOM 1219 OE2 GLU A 77 3.123 -13.054 -6.122 1.00 0.00 O ATOM 0 H GLU A 77 1.394 -12.965 -10.415 1.00 0.00 H new ATOM 0 HA GLU A 77 1.062 -15.743 -9.816 1.00 0.00 H new ATOM 0 HB2 GLU A 77 0.029 -13.213 -8.419 1.00 0.00 H new ATOM 0 HB3 GLU A 77 0.016 -14.807 -7.691 1.00 0.00 H new ATOM 0 HG2 GLU A 77 2.485 -14.959 -7.867 1.00 0.00 H new ATOM 0 HG3 GLU A 77 2.550 -13.441 -8.740 1.00 0.00 H new ATOM 1226 N GLY A 78 -1.644 -14.268 -10.876 1.00 0.00 N ATOM 1227 CA GLY A 78 -3.068 -14.564 -11.241 1.00 0.00 C ATOM 1228 C GLY A 78 -3.972 -13.662 -10.399 1.00 0.00 C ATOM 1229 O GLY A 78 -5.144 -13.488 -10.672 1.00 0.00 O ATOM 0 H GLY A 78 -1.282 -13.377 -11.216 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -3.234 -14.384 -12.303 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -3.298 -15.613 -11.056 1.00 0.00 H new ATOM 1233 N PHE A 79 -3.399 -13.059 -9.399 1.00 0.00 N ATOM 1234 CA PHE A 79 -4.134 -12.121 -8.505 1.00 0.00 C ATOM 1235 C PHE A 79 -4.714 -10.977 -9.345 1.00 0.00 C ATOM 1236 O PHE A 79 -5.736 -10.415 -9.018 1.00 0.00 O ATOM 1237 CB PHE A 79 -3.096 -11.571 -7.516 1.00 0.00 C ATOM 1238 CG PHE A 79 -3.033 -12.425 -6.261 1.00 0.00 C ATOM 1239 CD1 PHE A 79 -2.419 -13.690 -6.319 1.00 0.00 C ATOM 1240 CD2 PHE A 79 -3.587 -11.971 -5.041 1.00 0.00 C ATOM 1241 CE1 PHE A 79 -2.354 -14.500 -5.167 1.00 0.00 C ATOM 1242 CE2 PHE A 79 -3.520 -12.783 -3.893 1.00 0.00 C ATOM 1243 CZ PHE A 79 -2.902 -14.046 -3.956 1.00 0.00 C ATOM 0 H PHE A 79 -2.416 -13.181 -9.155 1.00 0.00 H new ATOM 0 HA PHE A 79 -4.954 -12.613 -7.982 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -2.115 -11.543 -7.991 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -3.350 -10.545 -7.250 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.996 -14.041 -7.249 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -4.061 -11.002 -4.990 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -1.882 -15.470 -5.216 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -3.944 -12.436 -2.962 1.00 0.00 H new ATOM 0 HZ PHE A 79 -2.849 -14.666 -3.073 1.00 0.00 H new ATOM 1253 N LEU A 80 -4.045 -10.598 -10.413 1.00 0.00 N ATOM 1254 CA LEU A 80 -4.544 -9.456 -11.248 1.00 0.00 C ATOM 1255 C LEU A 80 -4.475 -9.798 -12.749 1.00 0.00 C ATOM 1256 O LEU A 80 -3.582 -10.474 -13.222 1.00 0.00 O ATOM 1257 CB LEU A 80 -3.655 -8.224 -10.943 1.00 0.00 C ATOM 1258 CG LEU A 80 -4.170 -6.941 -11.628 1.00 0.00 C ATOM 1259 CD1 LEU A 80 -5.548 -6.549 -11.070 1.00 0.00 C ATOM 1260 CD2 LEU A 80 -3.155 -5.792 -11.459 1.00 0.00 C ATOM 0 H LEU A 80 -3.180 -11.028 -10.740 1.00 0.00 H new ATOM 0 HA LEU A 80 -5.587 -9.250 -11.006 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -3.616 -8.066 -9.865 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -2.636 -8.425 -11.273 1.00 0.00 H new ATOM 0 HG LEU A 80 -4.281 -7.137 -12.694 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -5.896 -5.642 -11.564 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -6.257 -7.356 -11.252 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -5.469 -6.370 -9.998 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -3.535 -4.896 -11.949 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -3.006 -5.591 -10.398 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -2.205 -6.077 -11.911 1.00 0.00 H new ATOM 1272 N VAL A 81 -5.425 -9.285 -13.486 1.00 0.00 N ATOM 1273 CA VAL A 81 -5.488 -9.482 -14.965 1.00 0.00 C ATOM 1274 C VAL A 81 -5.678 -8.089 -15.575 1.00 0.00 C ATOM 1275 O VAL A 81 -6.279 -7.242 -14.958 1.00 0.00 O ATOM 1276 CB VAL A 81 -6.684 -10.374 -15.326 1.00 0.00 C ATOM 1277 CG1 VAL A 81 -7.991 -9.680 -14.922 1.00 0.00 C ATOM 1278 CG2 VAL A 81 -6.689 -10.636 -16.839 1.00 0.00 C ATOM 0 H VAL A 81 -6.185 -8.718 -13.110 1.00 0.00 H new ATOM 0 HA VAL A 81 -4.585 -9.964 -15.340 1.00 0.00 H new ATOM 0 HB VAL A 81 -6.600 -11.321 -14.792 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -8.836 -10.318 -15.181 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -7.989 -9.498 -13.847 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -8.077 -8.731 -15.451 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -7.538 -11.269 -17.096 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -6.769 -9.689 -17.372 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -5.764 -11.136 -17.125 1.00 0.00 H new ATOM 1288 N GLU A 82 -5.172 -7.815 -16.751 1.00 0.00 N ATOM 1289 CA GLU A 82 -5.373 -6.435 -17.327 1.00 0.00 C ATOM 1290 C GLU A 82 -6.058 -6.494 -18.683 1.00 0.00 C ATOM 1291 O GLU A 82 -5.755 -7.341 -19.501 1.00 0.00 O ATOM 1292 CB GLU A 82 -4.015 -5.732 -17.455 1.00 0.00 C ATOM 1293 CG GLU A 82 -3.418 -5.496 -16.062 1.00 0.00 C ATOM 1294 CD GLU A 82 -2.052 -4.815 -16.195 1.00 0.00 C ATOM 1295 OE1 GLU A 82 -1.596 -4.660 -17.315 1.00 0.00 O ATOM 1296 OE2 GLU A 82 -1.488 -4.460 -15.173 1.00 0.00 O ATOM 0 H GLU A 82 -4.640 -8.464 -17.331 1.00 0.00 H new ATOM 0 HA GLU A 82 -6.018 -5.872 -16.652 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -3.336 -6.339 -18.053 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -4.135 -4.782 -17.975 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -4.089 -4.875 -15.469 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -3.313 -6.444 -15.535 1.00 0.00 H new ATOM 1303 N VAL A 83 -6.980 -5.588 -18.951 1.00 0.00 N ATOM 1304 CA VAL A 83 -7.649 -5.626 -20.275 1.00 0.00 C ATOM 1305 C VAL A 83 -7.286 -4.353 -21.025 1.00 0.00 C ATOM 1306 O VAL A 83 -7.508 -3.222 -20.588 1.00 0.00 O ATOM 1307 CB VAL A 83 -9.163 -5.745 -20.107 1.00 0.00 C ATOM 1308 CG1 VAL A 83 -9.843 -5.730 -21.478 1.00 0.00 C ATOM 1309 CG2 VAL A 83 -9.490 -7.066 -19.399 1.00 0.00 C ATOM 0 H VAL A 83 -7.284 -4.847 -18.320 1.00 0.00 H new ATOM 0 HA VAL A 83 -7.315 -6.496 -20.840 1.00 0.00 H new ATOM 0 HB VAL A 83 -9.525 -4.904 -19.515 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -10.922 -5.815 -21.350 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -9.611 -4.796 -21.989 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -9.481 -6.569 -22.073 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -10.569 -7.156 -19.277 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -9.122 -7.900 -19.997 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -9.011 -7.082 -18.420 1.00 0.00 H new ATOM 1319 N SER A 84 -6.763 -4.570 -22.177 1.00 0.00 N ATOM 1320 CA SER A 84 -6.366 -3.476 -23.070 1.00 0.00 C ATOM 1321 C SER A 84 -7.551 -3.056 -23.904 1.00 0.00 C ATOM 1322 O SER A 84 -7.477 -2.096 -24.624 1.00 0.00 O ATOM 1323 CB SER A 84 -5.175 -3.871 -23.947 1.00 0.00 C ATOM 1324 OG SER A 84 -4.752 -2.740 -24.697 1.00 0.00 O ATOM 0 H SER A 84 -6.587 -5.502 -22.553 1.00 0.00 H new ATOM 0 HA SER A 84 -6.041 -2.629 -22.466 1.00 0.00 H new ATOM 0 HB2 SER A 84 -4.357 -4.238 -23.327 1.00 0.00 H new ATOM 0 HB3 SER A 84 -5.455 -4.683 -24.618 1.00 0.00 H new ATOM 0 HG SER A 84 -5.532 -2.203 -24.947 1.00 0.00 H new ATOM 1330 N ARG A 85 -8.621 -3.813 -23.912 1.00 0.00 N ATOM 1331 CA ARG A 85 -9.762 -3.446 -24.804 1.00 0.00 C ATOM 1332 C ARG A 85 -10.610 -2.379 -24.107 1.00 0.00 C ATOM 1333 O ARG A 85 -11.733 -2.061 -24.438 1.00 0.00 O ATOM 1334 CB ARG A 85 -10.618 -4.695 -25.066 1.00 0.00 C ATOM 1335 CG ARG A 85 -9.849 -5.718 -25.956 1.00 0.00 C ATOM 1336 CD ARG A 85 -10.691 -6.990 -26.149 1.00 0.00 C ATOM 1337 NE ARG A 85 -9.940 -7.966 -26.986 1.00 0.00 N ATOM 1338 CZ ARG A 85 -10.479 -9.118 -27.279 1.00 0.00 C ATOM 1339 NH1 ARG A 85 -11.668 -9.414 -26.834 1.00 0.00 N ATOM 1340 NH2 ARG A 85 -9.828 -9.976 -28.018 1.00 0.00 N ATOM 0 H ARG A 85 -8.752 -4.654 -23.350 1.00 0.00 H new ATOM 0 HA ARG A 85 -9.389 -3.058 -25.752 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -10.888 -5.161 -24.119 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -11.548 -4.407 -25.556 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -9.624 -5.272 -26.925 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -8.896 -5.971 -25.492 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -10.927 -7.432 -25.181 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -11.639 -6.741 -26.625 1.00 0.00 H new ATOM 0 HE ARG A 85 -9.008 -7.735 -27.329 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -12.178 -8.745 -26.257 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -12.089 -10.314 -27.063 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -8.897 -9.746 -28.367 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -10.250 -10.876 -28.246 1.00 0.00 H new ATOM 1354 N TYR A 86 -10.008 -1.950 -23.032 1.00 0.00 N ATOM 1355 CA TYR A 86 -10.552 -0.988 -22.042 1.00 0.00 C ATOM 1356 C TYR A 86 -9.470 -0.086 -21.416 1.00 0.00 C ATOM 1357 O TYR A 86 -8.566 -0.532 -20.740 1.00 0.00 O ATOM 1358 CB TYR A 86 -11.205 -1.851 -20.925 1.00 0.00 C ATOM 1359 CG TYR A 86 -12.611 -2.266 -21.329 1.00 0.00 C ATOM 1360 CD1 TYR A 86 -12.812 -3.393 -22.155 1.00 0.00 C ATOM 1361 CD2 TYR A 86 -13.718 -1.516 -20.879 1.00 0.00 C ATOM 1362 CE1 TYR A 86 -14.116 -3.770 -22.526 1.00 0.00 C ATOM 1363 CE2 TYR A 86 -15.022 -1.898 -21.250 1.00 0.00 C ATOM 1364 CZ TYR A 86 -15.221 -3.022 -22.075 1.00 0.00 C ATOM 1365 OH TYR A 86 -16.497 -3.393 -22.440 1.00 0.00 O ATOM 0 H TYR A 86 -9.070 -2.265 -22.786 1.00 0.00 H new ATOM 0 HA TYR A 86 -11.255 -0.318 -22.537 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -10.597 -2.736 -20.739 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -11.239 -1.286 -19.993 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -11.965 -3.966 -22.502 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -13.566 -0.651 -20.251 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -14.270 -4.633 -23.157 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -15.871 -1.328 -20.901 1.00 0.00 H new ATOM 0 HH TYR A 86 -17.144 -2.773 -22.044 1.00 0.00 H new ATOM 1375 N ASN A 87 -9.575 1.182 -21.747 1.00 0.00 N ATOM 1376 CA ASN A 87 -8.623 2.275 -21.340 1.00 0.00 C ATOM 1377 C ASN A 87 -7.289 2.084 -22.073 1.00 0.00 C ATOM 1378 O ASN A 87 -6.294 1.748 -21.462 1.00 0.00 O ATOM 1379 CB ASN A 87 -8.375 2.259 -19.827 1.00 0.00 C ATOM 1380 CG ASN A 87 -9.669 2.622 -19.095 1.00 0.00 C ATOM 1381 OD1 ASN A 87 -10.649 2.987 -19.709 1.00 0.00 O ATOM 1382 ND2 ASN A 87 -9.711 2.528 -17.791 1.00 0.00 N ATOM 0 H ASN A 87 -10.341 1.526 -22.326 1.00 0.00 H new ATOM 0 HA ASN A 87 -9.067 3.234 -21.606 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -8.032 1.273 -19.514 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -7.588 2.967 -19.569 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -10.568 2.762 -17.290 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -8.886 2.221 -17.275 1.00 0.00 H new ATOM 1389 N LYS A 88 -7.216 2.414 -23.340 1.00 0.00 N ATOM 1390 CA LYS A 88 -5.896 2.330 -24.046 1.00 0.00 C ATOM 1391 C LYS A 88 -4.989 3.396 -23.414 1.00 0.00 C ATOM 1392 O LYS A 88 -3.812 3.505 -23.687 1.00 0.00 O ATOM 1393 CB LYS A 88 -6.079 2.637 -25.538 1.00 0.00 C ATOM 1394 CG LYS A 88 -6.721 4.016 -25.718 1.00 0.00 C ATOM 1395 CD LYS A 88 -6.991 4.251 -27.206 1.00 0.00 C ATOM 1396 CE LYS A 88 -7.659 5.614 -27.387 1.00 0.00 C ATOM 1397 NZ LYS A 88 -9.039 5.569 -26.822 1.00 0.00 N ATOM 0 H LYS A 88 -7.999 2.733 -23.910 1.00 0.00 H new ATOM 0 HA LYS A 88 -5.467 1.333 -23.951 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -5.114 2.608 -26.044 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -6.704 1.873 -26.000 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -7.651 4.075 -25.153 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -6.062 4.792 -25.328 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -6.058 4.213 -27.768 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -7.633 3.463 -27.600 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -7.075 6.387 -26.887 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -7.696 5.876 -28.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -9.600 6.352 -27.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -9.486 4.664 -27.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -8.994 5.660 -25.787 1.00 0.00 H new ATOM 1411 N PHE A 89 -5.585 4.146 -22.517 1.00 0.00 N ATOM 1412 CA PHE A 89 -4.904 5.242 -21.760 1.00 0.00 C ATOM 1413 C PHE A 89 -3.997 4.536 -20.756 1.00 0.00 C ATOM 1414 O PHE A 89 -2.949 5.010 -20.380 1.00 0.00 O ATOM 1415 CB PHE A 89 -5.932 6.108 -21.033 1.00 0.00 C ATOM 1416 CG PHE A 89 -6.429 7.186 -21.968 1.00 0.00 C ATOM 1417 CD1 PHE A 89 -7.200 6.844 -23.092 1.00 0.00 C ATOM 1418 CD2 PHE A 89 -6.111 8.534 -21.718 1.00 0.00 C ATOM 1419 CE1 PHE A 89 -7.659 7.848 -23.965 1.00 0.00 C ATOM 1420 CE2 PHE A 89 -6.569 9.542 -22.592 1.00 0.00 C ATOM 1421 CZ PHE A 89 -7.340 9.199 -23.715 1.00 0.00 C ATOM 0 H PHE A 89 -6.568 4.034 -22.269 1.00 0.00 H new ATOM 0 HA PHE A 89 -4.343 5.903 -22.420 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -6.766 5.494 -20.692 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -5.484 6.558 -20.147 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -7.441 5.809 -23.286 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -5.516 8.797 -20.856 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -8.255 7.584 -24.826 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -6.327 10.577 -22.398 1.00 0.00 H new ATOM 0 HZ PHE A 89 -7.688 9.970 -24.387 1.00 0.00 H new ATOM 1431 N MET A 90 -4.499 3.455 -20.244 1.00 0.00 N ATOM 1432 CA MET A 90 -3.813 2.666 -19.177 1.00 0.00 C ATOM 1433 C MET A 90 -4.433 1.316 -18.836 1.00 0.00 C ATOM 1434 O MET A 90 -4.583 0.925 -17.698 1.00 0.00 O ATOM 1435 CB MET A 90 -3.792 3.489 -17.883 1.00 0.00 C ATOM 1436 CG MET A 90 -5.207 4.023 -17.552 1.00 0.00 C ATOM 1437 SD MET A 90 -5.173 4.878 -15.957 1.00 0.00 S ATOM 1438 CE MET A 90 -6.921 5.354 -15.909 1.00 0.00 C ATOM 0 H MET A 90 -5.397 3.065 -20.531 1.00 0.00 H new ATOM 0 HA MET A 90 -2.824 2.458 -19.587 1.00 0.00 H new ATOM 0 HB2 MET A 90 -3.428 2.873 -17.060 1.00 0.00 H new ATOM 0 HB3 MET A 90 -3.098 4.323 -17.988 1.00 0.00 H new ATOM 0 HG2 MET A 90 -5.542 4.704 -18.334 1.00 0.00 H new ATOM 0 HG3 MET A 90 -5.920 3.199 -17.520 1.00 0.00 H new ATOM 0 HE1 MET A 90 -7.304 5.231 -14.896 1.00 0.00 H new ATOM 0 HE2 MET A 90 -7.023 6.396 -16.211 1.00 0.00 H new ATOM 0 HE3 MET A 90 -7.489 4.721 -16.591 1.00 0.00 H new ATOM 1448 N LYS A 91 -4.733 0.607 -19.907 1.00 0.00 N ATOM 1449 CA LYS A 91 -5.296 -0.769 -19.852 1.00 0.00 C ATOM 1450 C LYS A 91 -6.109 -1.025 -18.597 1.00 0.00 C ATOM 1451 O LYS A 91 -5.533 -1.429 -17.613 1.00 0.00 O ATOM 1452 CB LYS A 91 -4.130 -1.806 -19.961 1.00 0.00 C ATOM 1453 CG LYS A 91 -3.241 -1.608 -21.246 1.00 0.00 C ATOM 1454 CD LYS A 91 -2.055 -0.639 -20.956 1.00 0.00 C ATOM 1455 CE LYS A 91 -1.089 -0.528 -22.164 1.00 0.00 C ATOM 1456 NZ LYS A 91 0.033 0.382 -21.816 1.00 0.00 N ATOM 0 H LYS A 91 -4.600 0.954 -20.857 1.00 0.00 H new ATOM 0 HA LYS A 91 -5.982 -0.878 -20.692 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -3.499 -1.728 -19.075 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -4.547 -2.813 -19.968 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -2.856 -2.572 -21.579 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -3.851 -1.211 -22.058 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -2.445 0.349 -20.711 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -1.505 -0.990 -20.083 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -0.704 -1.513 -22.428 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -1.622 -0.149 -23.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 0.682 0.458 -22.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -0.343 1.324 -21.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 0.546 0.002 -20.995 1.00 0.00 H new ATOM 1470 N ILE A 92 -7.437 -0.863 -18.545 1.00 0.00 N ATOM 1471 CA ILE A 92 -8.000 -1.188 -17.193 1.00 0.00 C ATOM 1472 C ILE A 92 -7.450 -2.432 -16.494 1.00 0.00 C ATOM 1473 O ILE A 92 -7.490 -3.533 -17.006 1.00 0.00 O ATOM 1474 CB ILE A 92 -9.570 -1.210 -17.283 1.00 0.00 C ATOM 1475 CG1 ILE A 92 -10.222 -0.304 -16.201 1.00 0.00 C ATOM 1476 CG2 ILE A 92 -10.085 -2.653 -17.149 1.00 0.00 C ATOM 1477 CD1 ILE A 92 -9.983 -0.876 -14.791 1.00 0.00 C ATOM 0 H ILE A 92 -8.073 -0.560 -19.283 1.00 0.00 H new ATOM 0 HA ILE A 92 -7.655 -0.389 -16.537 1.00 0.00 H new ATOM 0 HB ILE A 92 -9.853 -0.814 -18.258 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -9.808 0.702 -16.265 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -11.293 -0.220 -16.388 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -11.173 -2.658 -17.212 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -9.672 -3.263 -17.952 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -9.776 -3.062 -16.187 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -10.448 -0.225 -14.051 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -10.420 -1.872 -14.724 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -8.912 -0.936 -14.599 1.00 0.00 H new ATOM 1489 N CYS A 93 -7.085 -2.271 -15.228 1.00 0.00 N ATOM 1490 CA CYS A 93 -6.644 -3.447 -14.464 1.00 0.00 C ATOM 1491 C CYS A 93 -7.971 -3.950 -13.867 1.00 0.00 C ATOM 1492 O CYS A 93 -8.852 -3.159 -13.596 1.00 0.00 O ATOM 1493 CB CYS A 93 -5.661 -3.040 -13.356 1.00 0.00 C ATOM 1494 SG CYS A 93 -4.365 -1.985 -14.062 1.00 0.00 S ATOM 0 H CYS A 93 -7.081 -1.386 -14.721 1.00 0.00 H new ATOM 0 HA CYS A 93 -6.117 -4.193 -15.059 1.00 0.00 H new ATOM 0 HB2 CYS A 93 -6.188 -2.508 -12.564 1.00 0.00 H new ATOM 0 HB3 CYS A 93 -5.218 -3.927 -12.904 1.00 0.00 H new ATOM 0 HG CYS A 93 -3.532 -1.636 -13.127 1.00 0.00 H new ATOM 1500 N ALA A 94 -8.165 -5.225 -13.717 1.00 0.00 N ATOM 1501 CA ALA A 94 -9.467 -5.724 -13.164 1.00 0.00 C ATOM 1502 C ALA A 94 -9.254 -6.849 -12.158 1.00 0.00 C ATOM 1503 O ALA A 94 -8.419 -7.719 -12.331 1.00 0.00 O ATOM 1504 CB ALA A 94 -10.321 -6.246 -14.325 1.00 0.00 C ATOM 0 H ALA A 94 -7.486 -5.949 -13.950 1.00 0.00 H new ATOM 0 HA ALA A 94 -9.964 -4.901 -12.650 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -11.272 -6.613 -13.940 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -10.504 -5.439 -15.034 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -9.795 -7.058 -14.827 1.00 0.00 H new ATOM 1510 N LEU A 95 -10.032 -6.843 -11.108 1.00 0.00 N ATOM 1511 CA LEU A 95 -9.918 -7.906 -10.063 1.00 0.00 C ATOM 1512 C LEU A 95 -10.752 -9.113 -10.504 1.00 0.00 C ATOM 1513 O LEU A 95 -11.894 -8.974 -10.913 1.00 0.00 O ATOM 1514 CB LEU A 95 -10.423 -7.361 -8.711 1.00 0.00 C ATOM 1515 CG LEU A 95 -9.345 -6.496 -8.044 1.00 0.00 C ATOM 1516 CD1 LEU A 95 -9.989 -5.525 -7.041 1.00 0.00 C ATOM 1517 CD2 LEU A 95 -8.359 -7.413 -7.312 1.00 0.00 C ATOM 0 H LEU A 95 -10.749 -6.141 -10.927 1.00 0.00 H new ATOM 0 HA LEU A 95 -8.878 -8.209 -9.942 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -11.327 -6.772 -8.865 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -10.690 -8.190 -8.055 1.00 0.00 H new ATOM 0 HG LEU A 95 -8.822 -5.916 -8.805 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -9.214 -4.917 -6.574 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -10.694 -4.877 -7.563 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -10.517 -6.091 -6.274 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -7.588 -6.810 -6.834 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -8.891 -7.989 -6.555 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -7.896 -8.094 -8.026 1.00 0.00 H new ATOM 1529 N THR A 96 -10.197 -10.300 -10.444 1.00 0.00 N ATOM 1530 CA THR A 96 -10.953 -11.531 -10.861 1.00 0.00 C ATOM 1531 C THR A 96 -11.535 -12.236 -9.632 1.00 0.00 C ATOM 1532 O THR A 96 -11.539 -11.704 -8.536 1.00 0.00 O ATOM 1533 CB THR A 96 -9.990 -12.481 -11.578 1.00 0.00 C ATOM 1534 OG1 THR A 96 -8.808 -12.629 -10.800 1.00 0.00 O ATOM 1535 CG2 THR A 96 -9.636 -11.912 -12.951 1.00 0.00 C ATOM 0 H THR A 96 -9.245 -10.473 -10.122 1.00 0.00 H new ATOM 0 HA THR A 96 -11.769 -11.246 -11.525 1.00 0.00 H new ATOM 0 HB THR A 96 -10.464 -13.454 -11.705 1.00 0.00 H new ATOM 0 HG1 THR A 96 -8.190 -13.238 -11.256 1.00 0.00 H new ATOM 0 HG21 THR A 96 -8.950 -12.590 -13.460 1.00 0.00 H new ATOM 0 HG22 THR A 96 -10.544 -11.801 -13.544 1.00 0.00 H new ATOM 0 HG23 THR A 96 -9.161 -10.939 -12.830 1.00 0.00 H new ATOM 1543 N LYS A 97 -12.024 -13.434 -9.808 1.00 0.00 N ATOM 1544 CA LYS A 97 -12.608 -14.194 -8.659 1.00 0.00 C ATOM 1545 C LYS A 97 -11.527 -14.412 -7.598 1.00 0.00 C ATOM 1546 O LYS A 97 -11.753 -14.216 -6.420 1.00 0.00 O ATOM 1547 CB LYS A 97 -13.116 -15.550 -9.145 1.00 0.00 C ATOM 1548 CG LYS A 97 -14.174 -15.340 -10.241 1.00 0.00 C ATOM 1549 CD LYS A 97 -15.514 -14.893 -9.627 1.00 0.00 C ATOM 1550 CE LYS A 97 -16.585 -14.789 -10.718 1.00 0.00 C ATOM 1551 NZ LYS A 97 -17.870 -14.344 -10.111 1.00 0.00 N ATOM 0 H LYS A 97 -12.045 -13.924 -10.702 1.00 0.00 H new ATOM 0 HA LYS A 97 -13.436 -13.628 -8.233 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -12.288 -16.142 -9.533 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -13.545 -16.109 -8.313 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -13.825 -14.590 -10.951 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -14.315 -16.266 -10.799 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -15.829 -15.605 -8.864 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -15.393 -13.929 -9.133 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -16.270 -14.083 -11.486 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -16.716 -15.754 -11.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -18.597 -14.273 -10.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -18.172 -15.033 -9.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -17.739 -13.414 -9.664 1.00 0.00 H new ATOM 1565 N LYS A 98 -10.358 -14.821 -8.008 1.00 0.00 N ATOM 1566 CA LYS A 98 -9.251 -15.059 -7.038 1.00 0.00 C ATOM 1567 C LYS A 98 -8.860 -13.738 -6.368 1.00 0.00 C ATOM 1568 O LYS A 98 -8.672 -13.672 -5.170 1.00 0.00 O ATOM 1569 CB LYS A 98 -8.049 -15.703 -7.789 1.00 0.00 C ATOM 1570 CG LYS A 98 -7.670 -14.967 -9.100 1.00 0.00 C ATOM 1571 CD LYS A 98 -6.906 -15.905 -10.043 1.00 0.00 C ATOM 1572 CE LYS A 98 -5.650 -16.424 -9.336 1.00 0.00 C ATOM 1573 NZ LYS A 98 -4.828 -17.215 -10.292 1.00 0.00 N ATOM 0 H LYS A 98 -10.120 -15.002 -8.983 1.00 0.00 H new ATOM 0 HA LYS A 98 -9.572 -15.745 -6.254 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -7.183 -15.717 -7.127 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -8.290 -16.740 -8.021 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -8.571 -14.602 -9.593 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -7.057 -14.095 -8.870 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -7.542 -16.740 -10.338 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -6.631 -15.376 -10.956 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -5.069 -15.588 -8.946 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -5.930 -17.043 -8.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -3.840 -17.235 -9.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -5.195 -18.187 -10.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -4.873 -16.777 -11.234 1.00 0.00 H new ATOM 1587 N GLY A 99 -8.672 -12.709 -7.134 1.00 0.00 N ATOM 1588 CA GLY A 99 -8.247 -11.406 -6.531 1.00 0.00 C ATOM 1589 C GLY A 99 -9.448 -10.673 -5.911 1.00 0.00 C ATOM 1590 O GLY A 99 -9.303 -10.033 -4.913 1.00 0.00 O ATOM 0 H GLY A 99 -8.791 -12.704 -8.147 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -7.490 -11.584 -5.767 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -7.788 -10.779 -7.295 1.00 0.00 H new ATOM 1594 N ARG A 100 -10.628 -10.786 -6.462 1.00 0.00 N ATOM 1595 CA ARG A 100 -11.820 -10.084 -5.853 1.00 0.00 C ATOM 1596 C ARG A 100 -12.131 -10.710 -4.487 1.00 0.00 C ATOM 1597 O ARG A 100 -12.416 -10.014 -3.481 1.00 0.00 O ATOM 1598 CB ARG A 100 -13.033 -10.253 -6.773 1.00 0.00 C ATOM 1599 CG ARG A 100 -14.217 -9.474 -6.203 1.00 0.00 C ATOM 1600 CD ARG A 100 -15.363 -9.468 -7.219 1.00 0.00 C ATOM 1601 NE ARG A 100 -14.985 -8.631 -8.390 1.00 0.00 N ATOM 1602 CZ ARG A 100 -15.826 -8.463 -9.374 1.00 0.00 C ATOM 1603 NH1 ARG A 100 -16.997 -9.040 -9.337 1.00 0.00 N ATOM 1604 NH2 ARG A 100 -15.495 -7.721 -10.391 1.00 0.00 N ATOM 0 H ARG A 100 -10.827 -11.328 -7.302 1.00 0.00 H new ATOM 0 HA ARG A 100 -11.598 -9.024 -5.731 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -12.796 -9.894 -7.775 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -13.289 -11.309 -6.865 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -14.548 -9.927 -5.269 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -13.916 -8.452 -5.972 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -15.582 -10.486 -7.542 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -16.270 -9.078 -6.757 1.00 0.00 H new ATOM 0 HE ARG A 100 -14.067 -8.188 -8.424 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -17.254 -9.622 -8.539 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -17.655 -8.909 -10.106 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -14.580 -7.272 -10.418 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -16.151 -7.589 -11.161 1.00 0.00 H new ATOM 1618 N ASN A 101 -12.021 -12.024 -4.411 1.00 0.00 N ATOM 1619 CA ASN A 101 -12.271 -12.701 -3.117 1.00 0.00 C ATOM 1620 C ASN A 101 -11.226 -12.145 -2.176 1.00 0.00 C ATOM 1621 O ASN A 101 -11.504 -11.783 -1.057 1.00 0.00 O ATOM 1622 CB ASN A 101 -12.111 -14.221 -3.258 1.00 0.00 C ATOM 1623 CG ASN A 101 -13.282 -14.786 -4.070 1.00 0.00 C ATOM 1624 OD1 ASN A 101 -14.321 -14.168 -4.170 1.00 0.00 O ATOM 1625 ND2 ASN A 101 -13.152 -15.945 -4.658 1.00 0.00 N ATOM 0 H ASN A 101 -11.771 -12.638 -5.187 1.00 0.00 H new ATOM 0 HA ASN A 101 -13.285 -12.527 -2.756 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -11.167 -14.454 -3.751 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -12.079 -14.687 -2.273 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -13.924 -16.331 -5.201 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -12.278 -16.464 -4.574 1.00 0.00 H new ATOM 1632 N TRP A 102 -10.025 -11.957 -2.666 1.00 0.00 N ATOM 1633 CA TRP A 102 -9.000 -11.352 -1.796 1.00 0.00 C ATOM 1634 C TRP A 102 -9.457 -9.968 -1.280 1.00 0.00 C ATOM 1635 O TRP A 102 -9.379 -9.667 -0.108 1.00 0.00 O ATOM 1636 CB TRP A 102 -7.672 -11.171 -2.547 1.00 0.00 C ATOM 1637 CG TRP A 102 -6.563 -11.274 -1.540 1.00 0.00 C ATOM 1638 CD1 TRP A 102 -5.938 -12.409 -1.209 1.00 0.00 C ATOM 1639 CD2 TRP A 102 -6.020 -10.246 -0.675 1.00 0.00 C ATOM 1640 NE1 TRP A 102 -5.029 -12.155 -0.196 1.00 0.00 N ATOM 1641 CE2 TRP A 102 -5.038 -10.830 0.167 1.00 0.00 C ATOM 1642 CE3 TRP A 102 -6.273 -8.871 -0.543 1.00 0.00 C ATOM 1643 CZ2 TRP A 102 -4.335 -10.073 1.115 1.00 0.00 C ATOM 1644 CZ3 TRP A 102 -5.573 -8.106 0.404 1.00 0.00 C ATOM 1645 CH2 TRP A 102 -4.610 -8.700 1.229 1.00 0.00 C ATOM 0 H TRP A 102 -9.725 -12.194 -3.612 1.00 0.00 H new ATOM 0 HA TRP A 102 -8.857 -12.031 -0.956 1.00 0.00 H new ATOM 0 HB2 TRP A 102 -7.561 -11.934 -3.318 1.00 0.00 H new ATOM 0 HB3 TRP A 102 -7.645 -10.204 -3.049 1.00 0.00 H new ATOM 0 HD1 TRP A 102 -6.115 -13.374 -1.661 1.00 0.00 H new ATOM 0 HE1 TRP A 102 -4.428 -12.862 0.227 1.00 0.00 H new ATOM 0 HE3 TRP A 102 -7.011 -8.399 -1.174 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 -3.594 -10.538 1.748 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 -5.779 -7.050 0.497 1.00 0.00 H new ATOM 0 HH2 TRP A 102 -4.078 -8.102 1.954 1.00 0.00 H new ATOM 1656 N LEU A 103 -9.911 -9.131 -2.191 1.00 0.00 N ATOM 1657 CA LEU A 103 -10.364 -7.746 -1.855 1.00 0.00 C ATOM 1658 C LEU A 103 -11.546 -7.795 -0.876 1.00 0.00 C ATOM 1659 O LEU A 103 -11.595 -7.052 0.087 1.00 0.00 O ATOM 1660 CB LEU A 103 -10.834 -7.050 -3.150 1.00 0.00 C ATOM 1661 CG LEU A 103 -11.569 -5.715 -2.837 1.00 0.00 C ATOM 1662 CD1 LEU A 103 -10.657 -4.774 -2.043 1.00 0.00 C ATOM 1663 CD2 LEU A 103 -11.967 -5.027 -4.149 1.00 0.00 C ATOM 0 H LEU A 103 -9.986 -9.363 -3.181 1.00 0.00 H new ATOM 0 HA LEU A 103 -9.537 -7.202 -1.398 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -9.976 -6.854 -3.792 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -11.500 -7.714 -3.702 1.00 0.00 H new ATOM 0 HG LEU A 103 -12.457 -5.940 -2.246 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -11.187 -3.845 -1.833 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -10.372 -5.250 -1.105 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -9.762 -4.557 -2.626 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -12.482 -4.092 -3.928 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -11.073 -4.819 -4.736 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -12.630 -5.681 -4.716 1.00 0.00 H new ATOM 1675 N HIS A 104 -12.510 -8.641 -1.117 1.00 0.00 N ATOM 1676 CA HIS A 104 -13.688 -8.716 -0.199 1.00 0.00 C ATOM 1677 C HIS A 104 -13.483 -9.664 1.000 1.00 0.00 C ATOM 1678 O HIS A 104 -14.270 -9.636 1.927 1.00 0.00 O ATOM 1679 CB HIS A 104 -14.903 -9.200 -0.996 1.00 0.00 C ATOM 1680 CG HIS A 104 -15.337 -8.133 -1.968 1.00 0.00 C ATOM 1681 ND1 HIS A 104 -16.416 -7.295 -1.717 1.00 0.00 N ATOM 1682 CD2 HIS A 104 -14.847 -7.758 -3.197 1.00 0.00 C ATOM 1683 CE1 HIS A 104 -16.541 -6.466 -2.775 1.00 0.00 C ATOM 1684 NE2 HIS A 104 -15.609 -6.708 -3.700 1.00 0.00 N ATOM 0 H HIS A 104 -12.535 -9.284 -1.908 1.00 0.00 H new ATOM 0 HA HIS A 104 -13.833 -7.715 0.207 1.00 0.00 H new ATOM 0 HB2 HIS A 104 -14.655 -10.115 -1.534 1.00 0.00 H new ATOM 0 HB3 HIS A 104 -15.721 -9.441 -0.318 1.00 0.00 H new ATOM 0 HD2 HIS A 104 -14.001 -8.209 -3.695 1.00 0.00 H new ATOM 0 HE1 HIS A 104 -17.300 -5.703 -2.862 1.00 0.00 H new ATOM 0 HE2 HIS A 104 -15.482 -6.224 -4.589 1.00 0.00 H new ATOM 1693 N LYS A 105 -12.495 -10.549 0.997 1.00 0.00 N ATOM 1694 CA LYS A 105 -12.340 -11.495 2.161 1.00 0.00 C ATOM 1695 C LYS A 105 -11.371 -10.967 3.223 1.00 0.00 C ATOM 1696 O LYS A 105 -11.693 -10.976 4.392 1.00 0.00 O ATOM 1697 CB LYS A 105 -11.893 -12.886 1.640 1.00 0.00 C ATOM 1698 CG LYS A 105 -11.825 -13.919 2.781 1.00 0.00 C ATOM 1699 CD LYS A 105 -11.413 -15.283 2.224 1.00 0.00 C ATOM 1700 CE LYS A 105 -11.399 -16.307 3.356 1.00 0.00 C ATOM 1701 NZ LYS A 105 -10.453 -15.854 4.415 1.00 0.00 N ATOM 0 H LYS A 105 -11.805 -10.653 0.253 1.00 0.00 H new ATOM 0 HA LYS A 105 -13.309 -11.584 2.652 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -12.590 -13.231 0.876 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -10.916 -12.801 1.165 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -11.109 -13.593 3.536 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -12.795 -13.995 3.273 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -12.108 -15.595 1.444 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -10.427 -15.218 1.765 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -12.400 -16.422 3.771 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -11.098 -17.283 2.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -10.152 -16.671 4.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -9.621 -15.414 3.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -10.926 -15.160 5.029 1.00 0.00 H new ATOM 1715 N ALA A 106 -10.182 -10.552 2.858 1.00 0.00 N ATOM 1716 CA ALA A 106 -9.232 -10.052 3.956 1.00 0.00 C ATOM 1717 C ALA A 106 -9.518 -8.590 4.299 1.00 0.00 C ATOM 1718 O ALA A 106 -8.808 -7.959 5.057 1.00 0.00 O ATOM 1719 CB ALA A 106 -7.757 -10.142 3.529 1.00 0.00 C ATOM 0 H ALA A 106 -9.822 -10.529 1.904 1.00 0.00 H new ATOM 0 HA ALA A 106 -9.404 -10.695 4.819 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -7.122 -9.778 4.336 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -7.505 -11.179 3.308 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -7.598 -9.533 2.639 1.00 0.00 H new ATOM 1725 N ASN A 107 -10.517 -8.055 3.711 1.00 0.00 N ATOM 1726 CA ASN A 107 -10.872 -6.625 3.933 1.00 0.00 C ATOM 1727 C ASN A 107 -10.855 -6.265 5.431 1.00 0.00 C ATOM 1728 O ASN A 107 -10.538 -5.148 5.787 1.00 0.00 O ATOM 1729 CB ASN A 107 -12.273 -6.365 3.363 1.00 0.00 C ATOM 1730 CG ASN A 107 -12.655 -4.894 3.580 1.00 0.00 C ATOM 1731 OD1 ASN A 107 -11.907 -4.145 4.178 1.00 0.00 O ATOM 1732 ND2 ASN A 107 -13.793 -4.448 3.125 1.00 0.00 N ATOM 0 H ASN A 107 -11.131 -8.549 3.063 1.00 0.00 H new ATOM 0 HA ASN A 107 -10.132 -6.004 3.429 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -12.293 -6.603 2.299 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -13.000 -7.015 3.849 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -14.054 -3.473 3.271 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -14.422 -5.074 2.623 1.00 0.00 H new ATOM 1739 N THR A 108 -11.175 -7.179 6.321 1.00 0.00 N ATOM 1740 CA THR A 108 -11.135 -6.818 7.779 1.00 0.00 C ATOM 1741 C THR A 108 -9.693 -6.457 8.187 1.00 0.00 C ATOM 1742 O THR A 108 -9.265 -5.332 8.023 1.00 0.00 O ATOM 1743 CB THR A 108 -11.611 -8.014 8.601 1.00 0.00 C ATOM 1744 OG1 THR A 108 -10.788 -9.138 8.319 1.00 0.00 O ATOM 1745 CG2 THR A 108 -13.063 -8.336 8.239 1.00 0.00 C ATOM 0 H THR A 108 -11.456 -8.137 6.109 1.00 0.00 H new ATOM 0 HA THR A 108 -11.784 -5.961 7.961 1.00 0.00 H new ATOM 0 HB THR A 108 -11.548 -7.776 9.663 1.00 0.00 H new ATOM 0 HG1 THR A 108 -10.583 -9.611 9.153 1.00 0.00 H new ATOM 0 HG21 THR A 108 -13.403 -9.190 8.825 1.00 0.00 H new ATOM 0 HG22 THR A 108 -13.692 -7.473 8.456 1.00 0.00 H new ATOM 0 HG23 THR A 108 -13.129 -8.575 7.178 1.00 0.00 H new ATOM 1753 N GLU A 109 -8.932 -7.398 8.694 1.00 0.00 N ATOM 1754 CA GLU A 109 -7.552 -7.114 9.083 1.00 0.00 C ATOM 1755 C GLU A 109 -6.686 -8.342 8.766 1.00 0.00 C ATOM 1756 O GLU A 109 -6.227 -9.034 9.652 1.00 0.00 O ATOM 1757 CB GLU A 109 -7.574 -6.858 10.593 1.00 0.00 C ATOM 1758 CG GLU A 109 -8.309 -5.541 10.901 1.00 0.00 C ATOM 1759 CD GLU A 109 -8.260 -5.232 12.402 1.00 0.00 C ATOM 1760 OE1 GLU A 109 -7.686 -6.019 13.133 1.00 0.00 O ATOM 1761 OE2 GLU A 109 -8.783 -4.200 12.791 1.00 0.00 O ATOM 0 H GLU A 109 -9.232 -8.360 8.850 1.00 0.00 H new ATOM 0 HA GLU A 109 -7.142 -6.256 8.550 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -8.068 -7.686 11.102 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -6.554 -6.811 10.976 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -7.853 -4.724 10.341 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -9.346 -5.612 10.573 1.00 0.00 H new ATOM 1768 N SER A 110 -6.449 -8.620 7.512 1.00 0.00 N ATOM 1769 CA SER A 110 -5.603 -9.802 7.179 1.00 0.00 C ATOM 1770 C SER A 110 -4.645 -9.388 6.067 1.00 0.00 C ATOM 1771 O SER A 110 -5.061 -8.996 5.006 1.00 0.00 O ATOM 1772 CB SER A 110 -6.493 -10.948 6.688 1.00 0.00 C ATOM 1773 OG SER A 110 -7.133 -11.555 7.801 1.00 0.00 O ATOM 0 H SER A 110 -6.799 -8.089 6.715 1.00 0.00 H new ATOM 0 HA SER A 110 -5.051 -10.138 8.057 1.00 0.00 H new ATOM 0 HB2 SER A 110 -7.238 -10.571 5.987 1.00 0.00 H new ATOM 0 HB3 SER A 110 -5.895 -11.684 6.152 1.00 0.00 H new ATOM 0 HG SER A 110 -7.705 -12.288 7.490 1.00 0.00 H new ATOM 1779 N GLN A 111 -3.362 -9.442 6.328 1.00 0.00 N ATOM 1780 CA GLN A 111 -2.345 -9.025 5.305 1.00 0.00 C ATOM 1781 C GLN A 111 -1.393 -10.191 5.056 1.00 0.00 C ATOM 1782 O GLN A 111 -0.474 -10.352 5.815 1.00 0.00 O ATOM 1783 CB GLN A 111 -1.531 -7.871 5.890 1.00 0.00 C ATOM 1784 CG GLN A 111 -1.347 -8.045 7.408 1.00 0.00 C ATOM 1785 CD GLN A 111 -2.627 -7.662 8.154 1.00 0.00 C ATOM 1786 OE1 GLN A 111 -3.218 -6.635 7.883 1.00 0.00 O ATOM 1787 NE2 GLN A 111 -3.088 -8.450 9.082 1.00 0.00 N ATOM 0 H GLN A 111 -2.969 -9.760 7.214 1.00 0.00 H new ATOM 0 HA GLN A 111 -2.838 -8.730 4.379 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -0.556 -7.825 5.404 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -2.034 -6.926 5.686 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -1.085 -9.079 7.632 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -0.520 -7.425 7.753 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -2.594 -9.312 9.311 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -3.944 -8.205 9.580 1.00 0.00 H new ATOM 1796 N SER A 112 -1.550 -10.990 3.999 1.00 0.00 N ATOM 1797 CA SER A 112 -0.555 -12.113 3.817 1.00 0.00 C ATOM 1798 C SER A 112 -0.375 -12.389 2.310 1.00 0.00 C ATOM 1799 O SER A 112 -1.297 -12.651 1.567 1.00 0.00 O ATOM 1800 CB SER A 112 -1.119 -13.361 4.511 1.00 0.00 C ATOM 1801 OG SER A 112 -1.545 -13.036 5.822 1.00 0.00 O ATOM 0 H SER A 112 -2.284 -10.916 3.294 1.00 0.00 H new ATOM 0 HA SER A 112 0.411 -11.849 4.247 1.00 0.00 H new ATOM 0 HB2 SER A 112 -1.955 -13.760 3.937 1.00 0.00 H new ATOM 0 HB3 SER A 112 -0.358 -14.141 4.550 1.00 0.00 H new ATOM 0 HG SER A 112 -1.905 -13.837 6.257 1.00 0.00 H new ATOM 1807 N LEU A 113 0.860 -12.377 1.913 1.00 0.00 N ATOM 1808 CA LEU A 113 1.311 -12.658 0.520 1.00 0.00 C ATOM 1809 C LEU A 113 2.836 -12.632 0.656 1.00 0.00 C ATOM 1810 O LEU A 113 3.389 -11.553 0.725 1.00 0.00 O ATOM 1811 CB LEU A 113 0.864 -11.512 -0.440 1.00 0.00 C ATOM 1812 CG LEU A 113 1.267 -11.740 -1.906 1.00 0.00 C ATOM 1813 CD1 LEU A 113 0.850 -13.138 -2.373 1.00 0.00 C ATOM 1814 CD2 LEU A 113 0.613 -10.680 -2.804 1.00 0.00 C ATOM 0 H LEU A 113 1.633 -12.168 2.545 1.00 0.00 H new ATOM 0 HA LEU A 113 0.909 -13.587 0.117 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -0.219 -11.404 -0.383 1.00 0.00 H new ATOM 0 HB3 LEU A 113 1.296 -10.573 -0.096 1.00 0.00 H new ATOM 0 HG LEU A 113 2.351 -11.656 -1.978 1.00 0.00 H new ATOM 0 HD11 LEU A 113 1.145 -13.277 -3.413 1.00 0.00 H new ATOM 0 HD12 LEU A 113 1.339 -13.890 -1.753 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -0.231 -13.243 -2.286 1.00 0.00 H new ATOM 0 HD21 LEU A 113 0.905 -10.851 -3.840 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -0.471 -10.748 -2.717 1.00 0.00 H new ATOM 0 HD23 LEU A 113 0.940 -9.688 -2.493 1.00 0.00 H new ATOM 1826 N ILE A 114 3.563 -13.706 0.490 1.00 0.00 N ATOM 1827 CA ILE A 114 5.038 -13.484 0.529 1.00 0.00 C ATOM 1828 C ILE A 114 5.109 -13.242 -0.983 1.00 0.00 C ATOM 1829 O ILE A 114 4.462 -13.959 -1.714 1.00 0.00 O ATOM 1830 CB ILE A 114 5.784 -14.747 1.072 1.00 0.00 C ATOM 1831 CG1 ILE A 114 5.331 -15.053 2.510 1.00 0.00 C ATOM 1832 CG2 ILE A 114 7.290 -14.549 1.069 1.00 0.00 C ATOM 1833 CD1 ILE A 114 5.851 -16.426 2.958 1.00 0.00 C ATOM 0 H ILE A 114 3.233 -14.659 0.340 1.00 0.00 H new ATOM 0 HA ILE A 114 5.483 -12.720 1.166 1.00 0.00 H new ATOM 0 HB ILE A 114 5.536 -15.579 0.413 1.00 0.00 H new ATOM 0 HG12 ILE A 114 5.699 -14.280 3.185 1.00 0.00 H new ATOM 0 HG13 ILE A 114 4.243 -15.034 2.566 1.00 0.00 H new ATOM 0 HG21 ILE A 114 7.776 -15.446 1.453 1.00 0.00 H new ATOM 0 HG22 ILE A 114 7.630 -14.359 0.051 1.00 0.00 H new ATOM 0 HG23 ILE A 114 7.546 -13.699 1.701 1.00 0.00 H new ATOM 0 HD11 ILE A 114 5.521 -16.625 3.977 1.00 0.00 H new ATOM 0 HD12 ILE A 114 5.462 -17.197 2.293 1.00 0.00 H new ATOM 0 HD13 ILE A 114 6.940 -16.432 2.922 1.00 0.00 H new ATOM 1845 N LEU A 115 5.657 -12.133 -1.467 1.00 0.00 N ATOM 1846 CA LEU A 115 5.547 -11.899 -2.972 1.00 0.00 C ATOM 1847 C LEU A 115 6.758 -12.191 -3.842 1.00 0.00 C ATOM 1848 O LEU A 115 7.875 -12.453 -3.399 1.00 0.00 O ATOM 1849 CB LEU A 115 5.305 -10.396 -3.146 1.00 0.00 C ATOM 1850 CG LEU A 115 4.167 -9.862 -2.196 1.00 0.00 C ATOM 1851 CD1 LEU A 115 3.301 -8.706 -1.620 1.00 0.00 C ATOM 1852 CD2 LEU A 115 4.731 -9.396 -3.549 1.00 0.00 C ATOM 0 H LEU A 115 6.147 -11.418 -0.929 1.00 0.00 H new ATOM 0 HA LEU A 115 4.772 -12.592 -3.299 1.00 0.00 H new ATOM 0 HB2 LEU A 115 6.229 -9.855 -2.943 1.00 0.00 H new ATOM 0 HB3 LEU A 115 5.037 -10.191 -4.182 1.00 0.00 H new ATOM 0 HG LEU A 115 3.759 -10.405 -1.343 1.00 0.00 H new ATOM 0 HD11 LEU A 115 2.598 -9.107 -0.890 1.00 0.00 H new ATOM 0 HD12 LEU A 115 3.947 -7.973 -1.137 1.00 0.00 H new ATOM 0 HD13 LEU A 115 2.750 -8.226 -2.429 1.00 0.00 H new ATOM 0 HD21 LEU A 115 4.197 -8.504 -3.878 1.00 0.00 H new ATOM 0 HD22 LEU A 115 5.791 -9.166 -3.441 1.00 0.00 H new ATOM 0 HD23 LEU A 115 4.605 -10.187 -4.288 1.00 0.00 H new ATOM 1864 N GLN A 116 6.526 -11.941 -5.080 1.00 0.00 N ATOM 1865 CA GLN A 116 7.562 -12.052 -6.087 1.00 0.00 C ATOM 1866 C GLN A 116 8.427 -10.849 -5.801 1.00 0.00 C ATOM 1867 O GLN A 116 7.833 -9.822 -5.699 1.00 0.00 O ATOM 1868 CB GLN A 116 6.919 -11.772 -7.444 1.00 0.00 C ATOM 1869 CG GLN A 116 7.978 -11.761 -8.553 1.00 0.00 C ATOM 1870 CD GLN A 116 7.299 -11.678 -9.922 1.00 0.00 C ATOM 1871 OE1 GLN A 116 7.200 -10.523 -10.517 1.00 0.00 O flip ATOM 1872 NE2 GLN A 116 6.848 -12.673 -10.450 1.00 0.00 N flip ATOM 0 H GLN A 116 5.617 -11.652 -5.441 1.00 0.00 H new ATOM 0 HA GLN A 116 8.074 -13.014 -6.083 1.00 0.00 H new ATOM 0 HB2 GLN A 116 6.167 -12.531 -7.660 1.00 0.00 H new ATOM 0 HB3 GLN A 116 6.404 -10.812 -7.417 1.00 0.00 H new ATOM 0 HG2 GLN A 116 8.649 -10.913 -8.418 1.00 0.00 H new ATOM 0 HG3 GLN A 116 8.588 -12.662 -8.494 1.00 0.00 H new ATOM 0 HE21 GLN A 116 6.925 -13.577 -9.984 1.00 0.00 H new ATOM 0 HE22 GLN A 116 6.391 -12.605 -11.360 1.00 0.00 H new ATOM 1881 N ALA A 117 9.727 -10.907 -5.679 1.00 0.00 N ATOM 1882 CA ALA A 117 10.488 -9.629 -5.419 1.00 0.00 C ATOM 1883 C ALA A 117 10.478 -8.709 -6.669 1.00 0.00 C ATOM 1884 O ALA A 117 10.390 -9.195 -7.779 1.00 0.00 O ATOM 1885 CB ALA A 117 11.944 -9.939 -5.072 1.00 0.00 C ATOM 0 H ALA A 117 10.291 -11.755 -5.744 1.00 0.00 H new ATOM 0 HA ALA A 117 9.998 -9.123 -4.587 1.00 0.00 H new ATOM 0 HB1 ALA A 117 12.480 -9.008 -4.887 1.00 0.00 H new ATOM 0 HB2 ALA A 117 11.980 -10.562 -4.178 1.00 0.00 H new ATOM 0 HB3 ALA A 117 12.411 -10.468 -5.903 1.00 0.00 H new ATOM 1891 N ASN A 118 10.534 -7.399 -6.513 1.00 0.00 N ATOM 1892 CA ASN A 118 10.511 -6.488 -7.695 1.00 0.00 C ATOM 1893 C ASN A 118 11.696 -6.818 -8.596 1.00 0.00 C ATOM 1894 O ASN A 118 12.629 -7.492 -8.208 1.00 0.00 O ATOM 1895 CB ASN A 118 10.637 -5.013 -7.265 1.00 0.00 C ATOM 1896 CG ASN A 118 10.115 -4.781 -5.843 1.00 0.00 C ATOM 1897 OD1 ASN A 118 10.884 -4.620 -4.917 1.00 0.00 O ATOM 1898 ND2 ASN A 118 8.817 -4.760 -5.628 1.00 0.00 N ATOM 0 H ASN A 118 10.595 -6.928 -5.610 1.00 0.00 H new ATOM 0 HA ASN A 118 9.564 -6.629 -8.215 1.00 0.00 H new ATOM 0 HB2 ASN A 118 11.682 -4.707 -7.322 1.00 0.00 H new ATOM 0 HB3 ASN A 118 10.083 -4.384 -7.961 1.00 0.00 H new ATOM 0 HD21 ASN A 118 8.459 -4.609 -4.685 1.00 0.00 H new ATOM 0 HD22 ASN A 118 8.169 -4.895 -6.404 1.00 0.00 H new ATOM 1905 N GLU A 119 11.654 -6.356 -9.800 1.00 0.00 N ATOM 1906 CA GLU A 119 12.760 -6.641 -10.746 1.00 0.00 C ATOM 1907 C GLU A 119 13.985 -5.739 -10.486 1.00 0.00 C ATOM 1908 O GLU A 119 15.094 -6.233 -10.419 1.00 0.00 O ATOM 1909 CB GLU A 119 12.252 -6.437 -12.174 1.00 0.00 C ATOM 1910 CG GLU A 119 11.610 -5.046 -12.321 1.00 0.00 C ATOM 1911 CD GLU A 119 11.017 -4.889 -13.727 1.00 0.00 C ATOM 1912 OE1 GLU A 119 11.248 -5.761 -14.547 1.00 0.00 O ATOM 1913 OE2 GLU A 119 10.343 -3.898 -13.955 1.00 0.00 O ATOM 0 H GLU A 119 10.896 -5.787 -10.178 1.00 0.00 H new ATOM 0 HA GLU A 119 13.082 -7.672 -10.602 1.00 0.00 H new ATOM 0 HB2 GLU A 119 13.077 -6.540 -12.879 1.00 0.00 H new ATOM 0 HB3 GLU A 119 11.523 -7.209 -12.421 1.00 0.00 H new ATOM 0 HG2 GLU A 119 10.830 -4.915 -11.571 1.00 0.00 H new ATOM 0 HG3 GLU A 119 12.356 -4.271 -12.143 1.00 0.00 H new ATOM 1920 N GLU A 120 13.839 -4.436 -10.367 1.00 0.00 N ATOM 1921 CA GLU A 120 15.077 -3.605 -10.147 1.00 0.00 C ATOM 1922 C GLU A 120 15.263 -3.379 -8.651 1.00 0.00 C ATOM 1923 O GLU A 120 14.797 -2.399 -8.108 1.00 0.00 O ATOM 1924 CB GLU A 120 14.962 -2.220 -10.867 1.00 0.00 C ATOM 1925 CG GLU A 120 14.983 -2.337 -12.431 1.00 0.00 C ATOM 1926 CD GLU A 120 14.836 -0.975 -13.058 1.00 0.00 C ATOM 1927 OE1 GLU A 120 14.812 -0.037 -12.309 1.00 0.00 O ATOM 1928 OE2 GLU A 120 14.743 -0.893 -14.272 1.00 0.00 O ATOM 0 H GLU A 120 12.956 -3.927 -10.410 1.00 0.00 H new ATOM 0 HA GLU A 120 15.932 -4.138 -10.562 1.00 0.00 H new ATOM 0 HB2 GLU A 120 14.038 -1.732 -10.557 1.00 0.00 H new ATOM 0 HB3 GLU A 120 15.784 -1.580 -10.545 1.00 0.00 H new ATOM 0 HG2 GLU A 120 15.917 -2.796 -12.756 1.00 0.00 H new ATOM 0 HG3 GLU A 120 14.175 -2.988 -12.765 1.00 0.00 H new ATOM 1935 N LEU A 121 15.950 -4.260 -7.964 1.00 0.00 N ATOM 1936 CA LEU A 121 16.136 -4.027 -6.480 1.00 0.00 C ATOM 1937 C LEU A 121 17.592 -3.681 -6.121 1.00 0.00 C ATOM 1938 O LEU A 121 17.984 -3.761 -4.972 1.00 0.00 O ATOM 1939 CB LEU A 121 15.648 -5.279 -5.705 1.00 0.00 C ATOM 1940 CG LEU A 121 14.139 -5.180 -5.389 1.00 0.00 C ATOM 1941 CD1 LEU A 121 13.546 -6.578 -5.227 1.00 0.00 C ATOM 1942 CD2 LEU A 121 13.942 -4.396 -4.089 1.00 0.00 C ATOM 0 H LEU A 121 16.380 -5.105 -8.341 1.00 0.00 H new ATOM 0 HA LEU A 121 15.539 -3.163 -6.189 1.00 0.00 H new ATOM 0 HB2 LEU A 121 15.842 -6.175 -6.295 1.00 0.00 H new ATOM 0 HB3 LEU A 121 16.212 -5.380 -4.778 1.00 0.00 H new ATOM 0 HG LEU A 121 13.636 -4.669 -6.210 1.00 0.00 H new ATOM 0 HD11 LEU A 121 12.482 -6.498 -5.004 1.00 0.00 H new ATOM 0 HD12 LEU A 121 13.682 -7.140 -6.151 1.00 0.00 H new ATOM 0 HD13 LEU A 121 14.050 -7.095 -4.410 1.00 0.00 H new ATOM 0 HD21 LEU A 121 12.878 -4.325 -3.865 1.00 0.00 H new ATOM 0 HD22 LEU A 121 14.451 -4.910 -3.274 1.00 0.00 H new ATOM 0 HD23 LEU A 121 14.356 -3.394 -4.202 1.00 0.00 H new ATOM 1954 N CYS A 122 18.388 -3.249 -7.065 1.00 0.00 N ATOM 1955 CA CYS A 122 19.794 -2.873 -6.721 1.00 0.00 C ATOM 1956 C CYS A 122 20.284 -1.847 -7.770 1.00 0.00 C ATOM 1957 O CYS A 122 21.179 -2.139 -8.538 1.00 0.00 O ATOM 1958 CB CYS A 122 20.687 -4.122 -6.758 1.00 0.00 C ATOM 1959 SG CYS A 122 20.134 -5.324 -5.519 1.00 0.00 S ATOM 0 H CYS A 122 18.131 -3.141 -8.046 1.00 0.00 H new ATOM 0 HA CYS A 122 19.839 -2.442 -5.721 1.00 0.00 H new ATOM 0 HB2 CYS A 122 20.655 -4.571 -7.751 1.00 0.00 H new ATOM 0 HB3 CYS A 122 21.723 -3.843 -6.567 1.00 0.00 H new ATOM 0 HG CYS A 122 19.187 -4.800 -4.799 1.00 0.00 H new ATOM 1965 N PRO A 123 19.701 -0.662 -7.859 1.00 0.00 N ATOM 1966 CA PRO A 123 20.140 0.345 -8.874 1.00 0.00 C ATOM 1967 C PRO A 123 21.623 0.752 -8.737 1.00 0.00 C ATOM 1968 O PRO A 123 22.067 1.700 -9.350 1.00 0.00 O ATOM 1969 CB PRO A 123 19.206 1.542 -8.632 1.00 0.00 C ATOM 1970 CG PRO A 123 18.043 0.977 -7.880 1.00 0.00 C ATOM 1971 CD PRO A 123 18.598 -0.175 -7.035 1.00 0.00 C ATOM 0 HA PRO A 123 20.075 -0.058 -9.885 1.00 0.00 H new ATOM 0 HB2 PRO A 123 19.705 2.323 -8.059 1.00 0.00 H new ATOM 0 HB3 PRO A 123 18.888 1.991 -9.573 1.00 0.00 H new ATOM 0 HG2 PRO A 123 17.582 1.736 -7.248 1.00 0.00 H new ATOM 0 HG3 PRO A 123 17.273 0.622 -8.564 1.00 0.00 H new ATOM 0 HD2 PRO A 123 18.940 0.166 -6.058 1.00 0.00 H new ATOM 0 HD3 PRO A 123 17.850 -0.948 -6.859 1.00 0.00 H new ATOM 1979 N LYS A 124 22.383 0.052 -7.931 1.00 0.00 N ATOM 1980 CA LYS A 124 23.827 0.411 -7.745 1.00 0.00 C ATOM 1981 C LYS A 124 24.711 -0.424 -8.675 1.00 0.00 C ATOM 1982 O LYS A 124 25.924 -0.322 -8.651 1.00 0.00 O ATOM 1983 CB LYS A 124 24.234 0.155 -6.288 1.00 0.00 C ATOM 1984 CG LYS A 124 23.418 1.067 -5.354 1.00 0.00 C ATOM 1985 CD LYS A 124 23.821 0.830 -3.884 1.00 0.00 C ATOM 1986 CE LYS A 124 22.972 1.699 -2.950 1.00 0.00 C ATOM 1987 NZ LYS A 124 23.282 3.137 -3.191 1.00 0.00 N ATOM 0 H LYS A 124 22.067 -0.754 -7.392 1.00 0.00 H new ATOM 0 HA LYS A 124 23.960 1.465 -7.987 1.00 0.00 H new ATOM 0 HB2 LYS A 124 24.064 -0.891 -6.031 1.00 0.00 H new ATOM 0 HB3 LYS A 124 25.299 0.346 -6.159 1.00 0.00 H new ATOM 0 HG2 LYS A 124 23.583 2.111 -5.619 1.00 0.00 H new ATOM 0 HG3 LYS A 124 22.354 0.870 -5.482 1.00 0.00 H new ATOM 0 HD2 LYS A 124 23.691 -0.222 -3.630 1.00 0.00 H new ATOM 0 HD3 LYS A 124 24.877 1.063 -3.748 1.00 0.00 H new ATOM 0 HE2 LYS A 124 21.913 1.510 -3.123 1.00 0.00 H new ATOM 0 HE3 LYS A 124 23.176 1.441 -1.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 22.926 3.707 -2.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 24.311 3.261 -3.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 22.825 3.448 -4.072 1.00 0.00 H new ATOM 2001 N LYS A 125 24.123 -1.257 -9.489 1.00 0.00 N ATOM 2002 CA LYS A 125 24.934 -2.094 -10.418 1.00 0.00 C ATOM 2003 C LYS A 125 25.558 -1.200 -11.506 1.00 0.00 C ATOM 2004 O LYS A 125 25.665 -1.580 -12.651 1.00 0.00 O ATOM 2005 CB LYS A 125 24.018 -3.180 -11.044 1.00 0.00 C ATOM 2006 CG LYS A 125 24.858 -4.294 -11.687 1.00 0.00 C ATOM 2007 CD LYS A 125 23.951 -5.454 -12.101 1.00 0.00 C ATOM 2008 CE LYS A 125 23.075 -5.015 -13.278 1.00 0.00 C ATOM 2009 NZ LYS A 125 22.500 -6.218 -13.947 1.00 0.00 N ATOM 0 H LYS A 125 23.114 -1.394 -9.551 1.00 0.00 H new ATOM 0 HA LYS A 125 25.743 -2.585 -9.878 1.00 0.00 H new ATOM 0 HB2 LYS A 125 23.370 -3.603 -10.276 1.00 0.00 H new ATOM 0 HB3 LYS A 125 23.370 -2.728 -11.794 1.00 0.00 H new ATOM 0 HG2 LYS A 125 25.388 -3.906 -12.557 1.00 0.00 H new ATOM 0 HG3 LYS A 125 25.614 -4.644 -10.984 1.00 0.00 H new ATOM 0 HD2 LYS A 125 24.552 -6.318 -12.383 1.00 0.00 H new ATOM 0 HD3 LYS A 125 23.326 -5.760 -11.262 1.00 0.00 H new ATOM 0 HE2 LYS A 125 22.275 -4.364 -12.926 1.00 0.00 H new ATOM 0 HE3 LYS A 125 23.666 -4.438 -13.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 21.905 -5.920 -14.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 23.271 -6.823 -14.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 21.923 -6.751 -13.266 1.00 0.00 H new ATOM 2023 N LEU A 126 25.975 -0.010 -11.150 1.00 0.00 N ATOM 2024 CA LEU A 126 26.594 0.898 -12.166 1.00 0.00 C ATOM 2025 C LEU A 126 28.105 0.658 -12.230 1.00 0.00 C ATOM 2026 O LEU A 126 28.786 0.639 -11.223 1.00 0.00 O ATOM 2027 CB LEU A 126 26.281 2.375 -11.829 1.00 0.00 C ATOM 2028 CG LEU A 126 26.943 3.379 -12.810 1.00 0.00 C ATOM 2029 CD1 LEU A 126 26.505 3.097 -14.253 1.00 0.00 C ATOM 2030 CD2 LEU A 126 26.609 4.850 -12.428 1.00 0.00 C ATOM 0 H LEU A 126 25.914 0.371 -10.206 1.00 0.00 H new ATOM 0 HA LEU A 126 26.169 0.679 -13.146 1.00 0.00 H new ATOM 0 HB2 LEU A 126 25.201 2.523 -11.842 1.00 0.00 H new ATOM 0 HB3 LEU A 126 26.620 2.590 -10.816 1.00 0.00 H new ATOM 0 HG LEU A 126 28.022 3.246 -12.737 1.00 0.00 H new ATOM 0 HD11 LEU A 126 26.981 3.812 -14.924 1.00 0.00 H new ATOM 0 HD12 LEU A 126 26.801 2.086 -14.532 1.00 0.00 H new ATOM 0 HD13 LEU A 126 25.422 3.192 -14.330 1.00 0.00 H new ATOM 0 HD21 LEU A 126 27.088 5.527 -13.135 1.00 0.00 H new ATOM 0 HD22 LEU A 126 25.529 4.998 -12.459 1.00 0.00 H new ATOM 0 HD23 LEU A 126 26.975 5.057 -11.422 1.00 0.00 H new ATOM 2042 N LEU A 127 28.631 0.477 -13.415 1.00 0.00 N ATOM 2043 CA LEU A 127 30.103 0.239 -13.583 1.00 0.00 C ATOM 2044 C LEU A 127 30.782 1.563 -13.923 1.00 0.00 C ATOM 2045 O LEU A 127 30.384 2.257 -14.839 1.00 0.00 O ATOM 2046 CB LEU A 127 30.333 -0.763 -14.724 1.00 0.00 C ATOM 2047 CG LEU A 127 29.206 -0.650 -15.774 1.00 0.00 C ATOM 2048 CD1 LEU A 127 29.744 -1.045 -17.152 1.00 0.00 C ATOM 2049 CD2 LEU A 127 28.046 -1.586 -15.410 1.00 0.00 C ATOM 0 H LEU A 127 28.099 0.484 -14.285 1.00 0.00 H new ATOM 0 HA LEU A 127 30.520 -0.165 -12.661 1.00 0.00 H new ATOM 0 HB2 LEU A 127 31.298 -0.573 -15.195 1.00 0.00 H new ATOM 0 HB3 LEU A 127 30.367 -1.777 -14.325 1.00 0.00 H new ATOM 0 HG LEU A 127 28.850 0.380 -15.793 1.00 0.00 H new ATOM 0 HD11 LEU A 127 28.947 -0.964 -17.891 1.00 0.00 H new ATOM 0 HD12 LEU A 127 30.562 -0.380 -17.427 1.00 0.00 H new ATOM 0 HD13 LEU A 127 30.107 -2.072 -17.120 1.00 0.00 H new ATOM 0 HD21 LEU A 127 27.258 -1.497 -16.158 1.00 0.00 H new ATOM 0 HD22 LEU A 127 28.404 -2.615 -15.381 1.00 0.00 H new ATOM 0 HD23 LEU A 127 27.650 -1.312 -14.432 1.00 0.00 H new ATOM 2061 N LEU A 128 31.807 1.928 -13.200 1.00 0.00 N ATOM 2062 CA LEU A 128 32.500 3.218 -13.491 1.00 0.00 C ATOM 2063 C LEU A 128 34.016 3.024 -13.301 1.00 0.00 C ATOM 2064 O LEU A 128 34.574 3.488 -12.326 1.00 0.00 O ATOM 2065 CB LEU A 128 32.000 4.293 -12.520 1.00 0.00 C ATOM 2066 CG LEU A 128 32.499 5.680 -12.966 1.00 0.00 C ATOM 2067 CD1 LEU A 128 31.532 6.269 -13.996 1.00 0.00 C ATOM 2068 CD2 LEU A 128 32.584 6.625 -11.756 1.00 0.00 C ATOM 0 H LEU A 128 32.194 1.392 -12.423 1.00 0.00 H new ATOM 0 HA LEU A 128 32.291 3.528 -14.515 1.00 0.00 H new ATOM 0 HB2 LEU A 128 30.911 4.284 -12.484 1.00 0.00 H new ATOM 0 HB3 LEU A 128 32.354 4.077 -11.512 1.00 0.00 H new ATOM 0 HG LEU A 128 33.489 5.571 -13.410 1.00 0.00 H new ATOM 0 HD11 LEU A 128 31.888 7.250 -14.310 1.00 0.00 H new ATOM 0 HD12 LEU A 128 31.477 5.609 -14.862 1.00 0.00 H new ATOM 0 HD13 LEU A 128 30.542 6.367 -13.551 1.00 0.00 H new ATOM 0 HD21 LEU A 128 32.938 7.603 -12.082 1.00 0.00 H new ATOM 0 HD22 LEU A 128 31.597 6.728 -11.305 1.00 0.00 H new ATOM 0 HD23 LEU A 128 33.277 6.215 -11.022 1.00 0.00 H new ATOM 2080 N PRO A 129 34.685 2.342 -14.203 1.00 0.00 N ATOM 2081 CA PRO A 129 36.156 2.105 -14.086 1.00 0.00 C ATOM 2082 C PRO A 129 36.955 3.413 -14.037 1.00 0.00 C ATOM 2083 O PRO A 129 36.661 4.359 -14.744 1.00 0.00 O ATOM 2084 CB PRO A 129 36.491 1.310 -15.352 1.00 0.00 C ATOM 2085 CG PRO A 129 35.192 0.707 -15.772 1.00 0.00 C ATOM 2086 CD PRO A 129 34.117 1.731 -15.399 1.00 0.00 C ATOM 0 HA PRO A 129 36.414 1.584 -13.164 1.00 0.00 H new ATOM 0 HB2 PRO A 129 36.898 1.956 -16.130 1.00 0.00 H new ATOM 0 HB3 PRO A 129 37.238 0.542 -15.152 1.00 0.00 H new ATOM 0 HG2 PRO A 129 35.183 0.503 -16.843 1.00 0.00 H new ATOM 0 HG3 PRO A 129 35.020 -0.243 -15.266 1.00 0.00 H new ATOM 0 HD2 PRO A 129 33.955 2.460 -16.193 1.00 0.00 H new ATOM 0 HD3 PRO A 129 33.155 1.259 -15.199 1.00 0.00 H new ATOM 2094 N SER A 130 37.974 3.468 -13.216 1.00 0.00 N ATOM 2095 CA SER A 130 38.812 4.704 -13.125 1.00 0.00 C ATOM 2096 C SER A 130 39.909 4.641 -14.191 1.00 0.00 C ATOM 2097 O SER A 130 40.592 3.648 -14.331 1.00 0.00 O ATOM 2098 CB SER A 130 39.453 4.778 -11.739 1.00 0.00 C ATOM 2099 OG SER A 130 40.437 3.759 -11.619 1.00 0.00 O ATOM 0 H SER A 130 38.263 2.707 -12.602 1.00 0.00 H new ATOM 0 HA SER A 130 38.192 5.586 -13.286 1.00 0.00 H new ATOM 0 HB2 SER A 130 39.907 5.757 -11.588 1.00 0.00 H new ATOM 0 HB3 SER A 130 38.693 4.657 -10.968 1.00 0.00 H new ATOM 0 HG SER A 130 40.736 3.487 -12.512 1.00 0.00 H new ATOM 2105 N SER A 131 40.090 5.696 -14.940 1.00 0.00 N ATOM 2106 CA SER A 131 41.147 5.682 -15.992 1.00 0.00 C ATOM 2107 C SER A 131 42.435 6.270 -15.414 1.00 0.00 C ATOM 2108 O SER A 131 42.477 7.420 -15.019 1.00 0.00 O ATOM 2109 CB SER A 131 40.693 6.519 -17.190 1.00 0.00 C ATOM 2110 OG SER A 131 39.490 5.971 -17.710 1.00 0.00 O ATOM 0 H SER A 131 39.555 6.562 -14.870 1.00 0.00 H new ATOM 0 HA SER A 131 41.325 4.658 -16.319 1.00 0.00 H new ATOM 0 HB2 SER A 131 40.535 7.554 -16.887 1.00 0.00 H new ATOM 0 HB3 SER A 131 41.466 6.526 -17.958 1.00 0.00 H new ATOM 0 HG SER A 131 39.193 6.504 -18.477 1.00 0.00 H new ATOM 2116 N LYS A 132 43.483 5.479 -15.344 1.00 0.00 N ATOM 2117 CA LYS A 132 44.784 5.976 -14.784 1.00 0.00 C ATOM 2118 C LYS A 132 45.674 6.485 -15.921 1.00 0.00 C ATOM 2119 O LYS A 132 45.780 5.875 -16.966 1.00 0.00 O ATOM 2120 CB LYS A 132 45.495 4.821 -14.075 1.00 0.00 C ATOM 2121 CG LYS A 132 44.684 4.396 -12.843 1.00 0.00 C ATOM 2122 CD LYS A 132 45.408 3.253 -12.125 1.00 0.00 C ATOM 2123 CE LYS A 132 44.605 2.842 -10.886 1.00 0.00 C ATOM 2124 NZ LYS A 132 45.314 1.739 -10.179 1.00 0.00 N ATOM 0 H LYS A 132 43.493 4.507 -15.652 1.00 0.00 H new ATOM 0 HA LYS A 132 44.591 6.787 -14.082 1.00 0.00 H new ATOM 0 HB2 LYS A 132 45.609 3.978 -14.756 1.00 0.00 H new ATOM 0 HB3 LYS A 132 46.497 5.127 -13.775 1.00 0.00 H new ATOM 0 HG2 LYS A 132 44.558 5.242 -12.168 1.00 0.00 H new ATOM 0 HG3 LYS A 132 43.686 4.077 -13.144 1.00 0.00 H new ATOM 0 HD2 LYS A 132 45.523 2.402 -12.796 1.00 0.00 H new ATOM 0 HD3 LYS A 132 46.410 3.568 -11.835 1.00 0.00 H new ATOM 0 HE2 LYS A 132 44.482 3.696 -10.220 1.00 0.00 H new ATOM 0 HE3 LYS A 132 43.606 2.518 -11.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 44.770 1.459 -9.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 45.410 0.923 -10.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 46.258 2.064 -9.888 1.00 0.00 H new ATOM 2138 N THR A 133 46.323 7.607 -15.716 1.00 0.00 N ATOM 2139 CA THR A 133 47.224 8.177 -16.766 1.00 0.00 C ATOM 2140 C THR A 133 48.591 7.495 -16.682 1.00 0.00 C ATOM 2141 O THR A 133 49.124 7.277 -15.612 1.00 0.00 O ATOM 2142 CB THR A 133 47.383 9.684 -16.523 1.00 0.00 C ATOM 2143 OG1 THR A 133 46.098 10.281 -16.403 1.00 0.00 O ATOM 2144 CG2 THR A 133 48.133 10.321 -17.696 1.00 0.00 C ATOM 0 H THR A 133 46.266 8.156 -14.858 1.00 0.00 H new ATOM 0 HA THR A 133 46.797 8.009 -17.755 1.00 0.00 H new ATOM 0 HB THR A 133 47.948 9.844 -15.605 1.00 0.00 H new ATOM 0 HG1 THR A 133 46.198 11.243 -16.246 1.00 0.00 H new ATOM 0 HG21 THR A 133 48.244 11.391 -17.519 1.00 0.00 H new ATOM 0 HG22 THR A 133 49.119 9.865 -17.789 1.00 0.00 H new ATOM 0 HG23 THR A 133 47.572 10.162 -18.617 1.00 0.00 H new ATOM 2152 N VAL A 134 49.163 7.142 -17.811 1.00 0.00 N ATOM 2153 CA VAL A 134 50.500 6.464 -17.806 1.00 0.00 C ATOM 2154 C VAL A 134 51.593 7.482 -17.455 1.00 0.00 C ATOM 2155 O VAL A 134 51.762 8.482 -18.124 1.00 0.00 O ATOM 2156 CB VAL A 134 50.781 5.884 -19.194 1.00 0.00 C ATOM 2157 CG1 VAL A 134 50.825 7.015 -20.221 1.00 0.00 C ATOM 2158 CG2 VAL A 134 52.128 5.159 -19.184 1.00 0.00 C ATOM 0 H VAL A 134 48.761 7.295 -18.736 1.00 0.00 H new ATOM 0 HA VAL A 134 50.496 5.664 -17.066 1.00 0.00 H new ATOM 0 HB VAL A 134 49.990 5.181 -19.457 1.00 0.00 H new ATOM 0 HG11 VAL A 134 51.025 6.601 -21.209 1.00 0.00 H new ATOM 0 HG12 VAL A 134 49.866 7.534 -20.232 1.00 0.00 H new ATOM 0 HG13 VAL A 134 51.615 7.718 -19.955 1.00 0.00 H new ATOM 0 HG21 VAL A 134 52.327 4.747 -20.173 1.00 0.00 H new ATOM 0 HG22 VAL A 134 52.918 5.862 -18.919 1.00 0.00 H new ATOM 0 HG23 VAL A 134 52.101 4.351 -18.453 1.00 0.00 H new ATOM 2168 N SER A 135 52.328 7.236 -16.404 1.00 0.00 N ATOM 2169 CA SER A 135 53.407 8.186 -15.995 1.00 0.00 C ATOM 2170 C SER A 135 54.478 8.274 -17.085 1.00 0.00 C ATOM 2171 O SER A 135 54.978 9.340 -17.387 1.00 0.00 O ATOM 2172 CB SER A 135 54.043 7.695 -14.691 1.00 0.00 C ATOM 2173 OG SER A 135 53.023 7.485 -13.725 1.00 0.00 O ATOM 0 H SER A 135 52.228 6.415 -15.807 1.00 0.00 H new ATOM 0 HA SER A 135 52.974 9.175 -15.847 1.00 0.00 H new ATOM 0 HB2 SER A 135 54.591 6.769 -14.866 1.00 0.00 H new ATOM 0 HB3 SER A 135 54.762 8.427 -14.325 1.00 0.00 H new ATOM 0 HG SER A 135 53.424 7.169 -12.889 1.00 0.00 H new ATOM 2179 N SER A 136 54.843 7.168 -17.681 1.00 0.00 N ATOM 2180 CA SER A 136 55.890 7.208 -18.745 1.00 0.00 C ATOM 2181 C SER A 136 55.440 8.139 -19.873 1.00 0.00 C ATOM 2182 O SER A 136 54.341 8.653 -19.869 1.00 0.00 O ATOM 2183 CB SER A 136 56.104 5.800 -19.299 1.00 0.00 C ATOM 2184 OG SER A 136 57.135 5.838 -20.280 1.00 0.00 O ATOM 0 H SER A 136 54.463 6.243 -17.478 1.00 0.00 H new ATOM 0 HA SER A 136 56.824 7.579 -18.322 1.00 0.00 H new ATOM 0 HB2 SER A 136 56.375 5.116 -18.494 1.00 0.00 H new ATOM 0 HB3 SER A 136 55.180 5.424 -19.739 1.00 0.00 H new ATOM 0 HG SER A 136 57.279 4.937 -20.639 1.00 0.00 H new ATOM 2190 N GLY A 137 56.291 8.360 -20.840 1.00 0.00 N ATOM 2191 CA GLY A 137 55.918 9.253 -21.974 1.00 0.00 C ATOM 2192 C GLY A 137 56.142 10.717 -21.574 1.00 0.00 C ATOM 2193 O GLY A 137 55.580 11.621 -22.163 1.00 0.00 O ATOM 0 H GLY A 137 57.228 7.960 -20.893 1.00 0.00 H new ATOM 0 HA2 GLY A 137 56.516 9.010 -22.853 1.00 0.00 H new ATOM 0 HA3 GLY A 137 54.874 9.096 -22.245 1.00 0.00 H new ATOM 2197 N THR A 138 56.957 10.956 -20.580 1.00 0.00 N ATOM 2198 CA THR A 138 57.218 12.362 -20.152 1.00 0.00 C ATOM 2199 C THR A 138 58.291 12.985 -21.054 1.00 0.00 C ATOM 2200 O THR A 138 59.008 12.295 -21.747 1.00 0.00 O ATOM 2201 CB THR A 138 57.714 12.372 -18.703 1.00 0.00 C ATOM 2202 OG1 THR A 138 59.085 12.003 -18.674 1.00 0.00 O ATOM 2203 CG2 THR A 138 56.902 11.376 -17.871 1.00 0.00 C ATOM 0 H THR A 138 57.452 10.241 -20.047 1.00 0.00 H new ATOM 0 HA THR A 138 56.296 12.937 -20.230 1.00 0.00 H new ATOM 0 HB THR A 138 57.593 13.372 -18.286 1.00 0.00 H new ATOM 0 HG1 THR A 138 59.406 12.010 -17.748 1.00 0.00 H new ATOM 0 HG21 THR A 138 57.258 11.387 -16.841 1.00 0.00 H new ATOM 0 HG22 THR A 138 55.849 11.656 -17.893 1.00 0.00 H new ATOM 0 HG23 THR A 138 57.020 10.375 -18.285 1.00 0.00 H new ATOM 2211 N LYS A 139 58.422 14.288 -21.022 1.00 0.00 N ATOM 2212 CA LYS A 139 59.461 14.961 -21.846 1.00 0.00 C ATOM 2213 C LYS A 139 59.528 16.424 -21.408 1.00 0.00 C ATOM 2214 O LYS A 139 58.630 17.204 -21.655 1.00 0.00 O ATOM 2215 CB LYS A 139 59.078 14.870 -23.329 1.00 0.00 C ATOM 2216 CG LYS A 139 57.557 14.988 -23.474 1.00 0.00 C ATOM 2217 CD LYS A 139 57.195 15.140 -24.952 1.00 0.00 C ATOM 2218 CE LYS A 139 57.573 13.861 -25.703 1.00 0.00 C ATOM 2219 NZ LYS A 139 59.005 13.927 -26.106 1.00 0.00 N ATOM 0 H LYS A 139 57.849 14.914 -20.456 1.00 0.00 H new ATOM 0 HA LYS A 139 60.431 14.483 -21.711 1.00 0.00 H new ATOM 0 HB2 LYS A 139 59.570 15.663 -23.892 1.00 0.00 H new ATOM 0 HB3 LYS A 139 59.421 13.923 -23.746 1.00 0.00 H new ATOM 0 HG2 LYS A 139 57.072 14.104 -23.059 1.00 0.00 H new ATOM 0 HG3 LYS A 139 57.193 15.846 -22.909 1.00 0.00 H new ATOM 0 HD2 LYS A 139 56.128 15.335 -25.058 1.00 0.00 H new ATOM 0 HD3 LYS A 139 57.719 15.994 -25.380 1.00 0.00 H new ATOM 0 HE2 LYS A 139 57.402 12.991 -25.070 1.00 0.00 H new ATOM 0 HE3 LYS A 139 56.941 13.743 -26.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 59.090 13.713 -27.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 59.374 14.882 -25.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 59.552 13.232 -25.559 1.00 0.00 H new ATOM 2233 N GLU A 140 60.590 16.785 -20.759 1.00 0.00 N ATOM 2234 CA GLU A 140 60.764 18.193 -20.276 1.00 0.00 C ATOM 2235 C GLU A 140 61.185 19.100 -21.438 1.00 0.00 C ATOM 2236 O GLU A 140 61.341 20.293 -21.287 1.00 0.00 O ATOM 2237 CB GLU A 140 61.845 18.222 -19.190 1.00 0.00 C ATOM 2238 CG GLU A 140 61.813 19.571 -18.470 1.00 0.00 C ATOM 2239 CD GLU A 140 62.737 19.521 -17.250 1.00 0.00 C ATOM 2240 OE1 GLU A 140 63.939 19.628 -17.438 1.00 0.00 O ATOM 2241 OE2 GLU A 140 62.228 19.377 -16.152 1.00 0.00 O ATOM 0 H GLU A 140 61.364 16.160 -20.534 1.00 0.00 H new ATOM 0 HA GLU A 140 59.819 18.553 -19.869 1.00 0.00 H new ATOM 0 HB2 GLU A 140 61.680 17.414 -18.477 1.00 0.00 H new ATOM 0 HB3 GLU A 140 62.827 18.059 -19.635 1.00 0.00 H new ATOM 0 HG2 GLU A 140 62.130 20.364 -19.147 1.00 0.00 H new ATOM 0 HG3 GLU A 140 60.795 19.805 -18.159 1.00 0.00 H new ATOM 2248 N HIS A 141 61.391 18.527 -22.594 1.00 0.00 N ATOM 2249 CA HIS A 141 61.819 19.331 -23.775 1.00 0.00 C ATOM 2250 C HIS A 141 60.790 20.425 -24.074 1.00 0.00 C ATOM 2251 O HIS A 141 61.139 21.556 -24.333 1.00 0.00 O ATOM 2252 CB HIS A 141 61.949 18.410 -24.991 1.00 0.00 C ATOM 2253 CG HIS A 141 62.428 19.207 -26.174 1.00 0.00 C ATOM 2254 ND1 HIS A 141 61.559 19.891 -27.010 1.00 0.00 N ATOM 2255 CD2 HIS A 141 63.688 19.437 -26.677 1.00 0.00 C ATOM 2256 CE1 HIS A 141 62.298 20.496 -27.960 1.00 0.00 C ATOM 2257 NE2 HIS A 141 63.598 20.250 -27.800 1.00 0.00 N ATOM 0 H HIS A 141 61.280 17.529 -22.772 1.00 0.00 H new ATOM 0 HA HIS A 141 62.779 19.799 -23.558 1.00 0.00 H new ATOM 0 HB2 HIS A 141 62.648 17.602 -24.776 1.00 0.00 H new ATOM 0 HB3 HIS A 141 60.988 17.948 -25.215 1.00 0.00 H new ATOM 0 HD2 HIS A 141 64.605 19.046 -26.263 1.00 0.00 H new ATOM 0 HE1 HIS A 141 61.888 21.105 -28.753 1.00 0.00 H new ATOM 0 HE2 HIS A 141 64.366 20.588 -28.380 1.00 0.00 H new ATOM 2266 N CYS A 142 59.530 20.097 -24.053 1.00 0.00 N ATOM 2267 CA CYS A 142 58.496 21.128 -24.342 1.00 0.00 C ATOM 2268 C CYS A 142 58.530 22.204 -23.253 1.00 0.00 C ATOM 2269 O CYS A 142 58.463 23.384 -23.528 1.00 0.00 O ATOM 2270 CB CYS A 142 57.114 20.474 -24.370 1.00 0.00 C ATOM 2271 SG CYS A 142 57.010 19.336 -25.774 1.00 0.00 S ATOM 0 H CYS A 142 59.172 19.164 -23.849 1.00 0.00 H new ATOM 0 HA CYS A 142 58.700 21.584 -25.311 1.00 0.00 H new ATOM 0 HB2 CYS A 142 56.936 19.936 -23.439 1.00 0.00 H new ATOM 0 HB3 CYS A 142 56.340 21.238 -24.450 1.00 0.00 H new ATOM 0 HG CYS A 142 55.836 18.779 -25.795 1.00 0.00 H new ATOM 2277 N TYR A 143 58.642 21.805 -22.012 1.00 0.00 N ATOM 2278 CA TYR A 143 58.682 22.801 -20.902 1.00 0.00 C ATOM 2279 C TYR A 143 60.117 23.322 -20.744 1.00 0.00 C ATOM 2280 O TYR A 143 61.052 22.557 -20.644 1.00 0.00 O ATOM 2281 CB TYR A 143 58.231 22.133 -19.599 1.00 0.00 C ATOM 2282 CG TYR A 143 57.962 23.188 -18.549 1.00 0.00 C ATOM 2283 CD1 TYR A 143 59.006 23.640 -17.717 1.00 0.00 C ATOM 2284 CD2 TYR A 143 56.665 23.720 -18.401 1.00 0.00 C ATOM 2285 CE1 TYR A 143 58.758 24.623 -16.740 1.00 0.00 C ATOM 2286 CE2 TYR A 143 56.418 24.706 -17.423 1.00 0.00 C ATOM 2287 CZ TYR A 143 57.464 25.157 -16.596 1.00 0.00 C ATOM 2288 OH TYR A 143 57.219 26.118 -15.639 1.00 0.00 O ATOM 0 H TYR A 143 58.708 20.830 -21.720 1.00 0.00 H new ATOM 0 HA TYR A 143 58.014 23.632 -21.130 1.00 0.00 H new ATOM 0 HB2 TYR A 143 57.331 21.544 -19.774 1.00 0.00 H new ATOM 0 HB3 TYR A 143 59.000 21.445 -19.248 1.00 0.00 H new ATOM 0 HD1 TYR A 143 59.999 23.231 -17.829 1.00 0.00 H new ATOM 0 HD2 TYR A 143 55.862 23.373 -19.035 1.00 0.00 H new ATOM 0 HE1 TYR A 143 59.559 24.966 -16.102 1.00 0.00 H new ATOM 0 HE2 TYR A 143 55.425 25.115 -17.309 1.00 0.00 H new ATOM 0 HH TYR A 143 56.275 26.380 -15.673 1.00 0.00 H new ATOM 2298 N ASN A 144 60.291 24.612 -20.725 1.00 0.00 N ATOM 2299 CA ASN A 144 61.663 25.179 -20.575 1.00 0.00 C ATOM 2300 C ASN A 144 62.127 25.006 -19.130 1.00 0.00 C ATOM 2301 O ASN A 144 63.283 24.668 -18.931 1.00 0.00 O ATOM 2302 CB ASN A 144 61.645 26.667 -20.932 1.00 0.00 C ATOM 2303 CG ASN A 144 60.793 27.425 -19.915 1.00 0.00 C ATOM 2304 OD1 ASN A 144 59.625 26.949 -19.581 1.00 0.00 O flip ATOM 2305 ND2 ASN A 144 61.190 28.459 -19.421 1.00 0.00 N flip ATOM 2306 OXT ASN A 144 61.317 25.216 -18.236 1.00 0.00 O ATOM 0 H ASN A 144 59.543 25.301 -20.807 1.00 0.00 H new ATOM 0 HA ASN A 144 62.348 24.656 -21.243 1.00 0.00 H new ATOM 0 HB2 ASN A 144 62.661 27.063 -20.938 1.00 0.00 H new ATOM 0 HB3 ASN A 144 61.242 26.806 -21.935 1.00 0.00 H new ATOM 0 HD21 ASN A 144 62.103 28.831 -19.682 1.00 0.00 H new ATOM 0 HD22 ASN A 144 60.611 28.956 -18.745 1.00 0.00 H new TER 2313 ASN A 144