USER MOD reduce.3.24.130724 H: found=0, std=0, add=995, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 0 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 28 SER OG : rot 155:sc= 0.741 USER MOD Set 1.2: A 77 TYR OH : rot -150:sc= -2.76! USER MOD Set 2.1: A 12 TYR OH : rot 180:sc= -0.144 USER MOD Set 2.2: A 14 ASN : amide:sc= -5.46! C(o=-13!,f=-22!) USER MOD Set 2.3: A 53 GLN : amide:sc= -6.99! C(o=-13!,f=-15!) USER MOD Set 3.1: A 9 HIS : no HE2:sc= -8.08! C(o=-8.2!,f=-11!) USER MOD Set 3.2: A 10 THR OG1 : rot -15:sc= -0.146 USER MOD Set 4.1: A 8 ASN : amide:sc= -1.43! C(o=-1.6!,f=-3.1!) USER MOD Set 4.2: A 88 THR OG1 : rot 180:sc= -0.183 USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= -6.59! C(o=-6.6!,f=-9!) USER MOD Single : A 17 ASN : amide:sc= -3.95! C(o=-4!,f=-5.1!) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 LYS NZ :NH3+ -149:sc= -0.28 (180deg=-1.09) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot -108:sc=0.000733 USER MOD Single : A 35 GLN : amide:sc= -0.826 K(o=-0.83,f=0) USER MOD Single : A 38 GLN : amide:sc= -0.0369 X(o=-0.037,f=0) USER MOD Single : A 45 SER OG : rot 180:sc= -0.585 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -175:sc= -7.78! (180deg=-8.28!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 150:sc= -0.0529 USER MOD Single : A 65 THR OG1 : rot 78:sc= -0.71 USER MOD Single : A 66 ASN : amide:sc= -0.328 X(o=-0.33,f=0) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 71 MET CE :methyl -170:sc= -0.0826 (180deg=-0.258) USER MOD Single : A 72 GLN : amide:sc= -3.02 K(o=-3,f=-0.3) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 MET CE :methyl -132:sc= -6.17! (180deg=-12.3!) USER MOD Single : A 84 GLN : amide:sc= 0.102 X(o=0.1,f=0) USER MOD Single : A 85 TYR OH : rot -130:sc= -5.63! USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 MET CE :methyl 157:sc= -1.77 (180deg=-3.33) USER MOD Single : A 97 LYS NZ :NH3+ 142:sc= -3.77! (180deg=-7.12!) USER MOD Single : A 99 THR OG1 : rot -54:sc= 0.715 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.287) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 SER OG : rot -15:sc= 0.656! USER MOD Single : A 115 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -22.146 13.470 -32.037 1.00 0.00 N ATOM 2 CA ALA A 1 -23.259 12.779 -32.749 1.00 0.00 C ATOM 3 C ALA A 1 -23.668 11.530 -31.966 1.00 0.00 C ATOM 4 O ALA A 1 -24.761 11.442 -31.445 1.00 0.00 O ATOM 5 CB ALA A 1 -22.795 12.376 -34.150 1.00 0.00 C ATOM 0 H1 ALA A 1 -21.868 14.319 -32.569 1.00 0.00 H new ATOM 0 H2 ALA A 1 -22.461 13.746 -31.085 1.00 0.00 H new ATOM 0 H3 ALA A 1 -21.332 12.828 -31.960 1.00 0.00 H new ATOM 0 HA ALA A 1 -24.113 13.452 -32.829 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -23.608 11.871 -34.671 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -22.505 13.267 -34.707 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -21.941 11.703 -34.071 1.00 0.00 H new ATOM 6 N VAL A 2 -22.797 10.561 -31.881 1.00 0.00 N ATOM 7 CA VAL A 2 -23.138 9.319 -31.133 1.00 0.00 C ATOM 8 C VAL A 2 -21.960 8.919 -30.241 1.00 0.00 C ATOM 9 O VAL A 2 -21.171 8.070 -30.604 1.00 0.00 O ATOM 10 CB VAL A 2 -23.431 8.191 -32.123 1.00 0.00 C ATOM 11 CG1 VAL A 2 -24.361 7.167 -31.469 1.00 0.00 C ATOM 12 CG2 VAL A 2 -24.106 8.768 -33.369 1.00 0.00 C ATOM 0 H VAL A 2 -21.866 10.576 -32.297 1.00 0.00 H new ATOM 0 HA VAL A 2 -24.018 9.499 -30.515 1.00 0.00 H new ATOM 0 HB VAL A 2 -22.497 7.706 -32.407 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -24.570 6.363 -32.174 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -23.882 6.755 -30.581 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -25.295 7.653 -31.185 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -24.315 7.964 -34.075 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -25.040 9.253 -33.085 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -23.445 9.498 -33.836 1.00 0.00 H new ATOM 13 N PRO A 3 -21.880 9.542 -29.094 1.00 0.00 N ATOM 14 CA PRO A 3 -20.811 9.271 -28.120 1.00 0.00 C ATOM 15 C PRO A 3 -21.104 7.971 -27.372 1.00 0.00 C ATOM 16 O PRO A 3 -21.652 7.971 -26.288 1.00 0.00 O ATOM 17 CB PRO A 3 -20.866 10.478 -27.179 1.00 0.00 C ATOM 18 CG PRO A 3 -22.290 11.071 -27.314 1.00 0.00 C ATOM 19 CD PRO A 3 -22.847 10.573 -28.663 1.00 0.00 C ATOM 0 HA PRO A 3 -19.828 9.146 -28.575 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -20.666 10.178 -26.150 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -20.111 11.216 -27.449 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -22.925 10.747 -26.489 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -22.261 12.160 -27.285 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -23.849 10.158 -28.552 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -22.916 11.383 -29.389 1.00 0.00 H new ATOM 20 N GLU A 4 -20.742 6.865 -27.954 1.00 0.00 N ATOM 21 CA GLU A 4 -20.995 5.554 -27.294 1.00 0.00 C ATOM 22 C GLU A 4 -20.161 5.454 -26.018 1.00 0.00 C ATOM 23 O GLU A 4 -19.466 6.378 -25.643 1.00 0.00 O ATOM 24 CB GLU A 4 -20.604 4.420 -28.244 1.00 0.00 C ATOM 25 CG GLU A 4 -21.868 3.754 -28.791 1.00 0.00 C ATOM 26 CD GLU A 4 -21.660 3.393 -30.263 1.00 0.00 C ATOM 27 OE1 GLU A 4 -21.301 4.276 -31.023 1.00 0.00 O ATOM 28 OE2 GLU A 4 -21.863 2.239 -30.604 1.00 0.00 O ATOM 0 H GLU A 4 -20.280 6.811 -28.862 1.00 0.00 H new ATOM 0 HA GLU A 4 -22.053 5.474 -27.045 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -20.002 4.810 -29.064 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -19.992 3.687 -27.719 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -22.098 2.858 -28.215 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -22.720 4.426 -28.688 1.00 0.00 H new ATOM 29 N THR A 5 -20.222 4.336 -25.349 1.00 0.00 N ATOM 30 CA THR A 5 -19.437 4.169 -24.105 1.00 0.00 C ATOM 31 C THR A 5 -18.023 3.705 -24.471 1.00 0.00 C ATOM 32 O THR A 5 -17.091 4.482 -24.469 1.00 0.00 O ATOM 33 CB THR A 5 -20.136 3.123 -23.227 1.00 0.00 C ATOM 34 OG1 THR A 5 -21.189 3.743 -22.504 1.00 0.00 O ATOM 35 CG2 THR A 5 -19.139 2.510 -22.249 1.00 0.00 C ATOM 0 H THR A 5 -20.786 3.529 -25.616 1.00 0.00 H new ATOM 0 HA THR A 5 -19.369 5.109 -23.558 1.00 0.00 H new ATOM 0 HB THR A 5 -20.540 2.335 -23.863 1.00 0.00 H new ATOM 0 HG1 THR A 5 -21.638 3.076 -21.944 1.00 0.00 H new ATOM 0 HG21 THR A 5 -19.645 1.769 -21.630 1.00 0.00 H new ATOM 0 HG22 THR A 5 -18.333 2.030 -22.804 1.00 0.00 H new ATOM 0 HG23 THR A 5 -18.726 3.292 -21.613 1.00 0.00 H new ATOM 36 N ARG A 6 -17.869 2.445 -24.785 1.00 0.00 N ATOM 37 CA ARG A 6 -16.529 1.907 -25.155 1.00 0.00 C ATOM 38 C ARG A 6 -16.530 0.387 -24.944 1.00 0.00 C ATOM 39 O ARG A 6 -16.950 -0.086 -23.907 1.00 0.00 O ATOM 40 CB ARG A 6 -15.455 2.541 -24.269 1.00 0.00 C ATOM 41 CG ARG A 6 -14.748 3.656 -25.043 1.00 0.00 C ATOM 42 CD ARG A 6 -13.335 3.206 -25.407 1.00 0.00 C ATOM 43 NE ARG A 6 -12.349 4.162 -24.832 1.00 0.00 N ATOM 44 CZ ARG A 6 -11.279 3.717 -24.236 1.00 0.00 C ATOM 45 NH1 ARG A 6 -11.379 3.085 -23.099 1.00 0.00 N ATOM 46 NH2 ARG A 6 -10.106 3.907 -24.776 1.00 0.00 N ATOM 0 H ARG A 6 -18.624 1.759 -24.801 1.00 0.00 H new ATOM 0 HA ARG A 6 -16.315 2.140 -26.198 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -15.907 2.943 -23.362 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -14.733 1.786 -23.957 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -15.308 3.898 -25.946 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -14.708 4.563 -24.440 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -13.151 2.202 -25.024 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -13.224 3.159 -26.490 1.00 0.00 H new ATOM 0 HE ARG A 6 -12.511 5.166 -24.905 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -12.295 2.939 -22.676 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -10.541 2.737 -22.633 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -10.028 4.403 -25.664 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -9.268 3.559 -24.310 1.00 0.00 H new ATOM 47 N PRO A 7 -16.066 -0.337 -25.932 1.00 0.00 N ATOM 48 CA PRO A 7 -16.011 -1.808 -25.874 1.00 0.00 C ATOM 49 C PRO A 7 -14.841 -2.266 -25.003 1.00 0.00 C ATOM 50 O PRO A 7 -13.788 -1.661 -24.988 1.00 0.00 O ATOM 51 CB PRO A 7 -15.830 -2.222 -27.334 1.00 0.00 C ATOM 52 CG PRO A 7 -15.242 -0.995 -28.067 1.00 0.00 C ATOM 53 CD PRO A 7 -15.552 0.234 -27.193 1.00 0.00 C ATOM 0 HA PRO A 7 -16.899 -2.257 -25.428 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -15.162 -3.079 -27.414 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -16.782 -2.518 -27.774 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -14.167 -1.108 -28.209 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -15.685 -0.887 -29.057 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -14.660 0.836 -27.023 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -16.289 0.883 -27.666 1.00 0.00 H new ATOM 54 N ASN A 8 -15.027 -3.325 -24.262 1.00 0.00 N ATOM 55 CA ASN A 8 -13.937 -3.813 -23.374 1.00 0.00 C ATOM 56 C ASN A 8 -13.934 -5.345 -23.346 1.00 0.00 C ATOM 57 O ASN A 8 -13.558 -5.959 -22.369 1.00 0.00 O ATOM 58 CB ASN A 8 -14.174 -3.261 -21.968 1.00 0.00 C ATOM 59 CG ASN A 8 -13.152 -3.844 -20.993 1.00 0.00 C ATOM 60 OD1 ASN A 8 -12.064 -4.219 -21.383 1.00 0.00 O ATOM 61 ND2 ASN A 8 -13.464 -3.936 -19.731 1.00 0.00 N ATOM 0 H ASN A 8 -15.887 -3.872 -24.234 1.00 0.00 H new ATOM 0 HA ASN A 8 -12.970 -3.474 -23.746 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -14.098 -2.174 -21.979 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -15.183 -3.507 -21.638 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -12.794 -4.324 -19.067 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -14.378 -3.620 -19.407 1.00 0.00 H new ATOM 62 N HIS A 9 -14.345 -5.959 -24.422 1.00 0.00 N ATOM 63 CA HIS A 9 -14.360 -7.452 -24.491 1.00 0.00 C ATOM 64 C HIS A 9 -15.426 -8.022 -23.537 1.00 0.00 C ATOM 65 O HIS A 9 -15.588 -9.222 -23.426 1.00 0.00 O ATOM 66 CB HIS A 9 -12.952 -7.983 -24.135 1.00 0.00 C ATOM 67 CG HIS A 9 -13.033 -9.295 -23.393 1.00 0.00 C ATOM 68 ND1 HIS A 9 -12.882 -9.374 -22.017 1.00 0.00 N ATOM 69 CD2 HIS A 9 -13.246 -10.583 -23.821 1.00 0.00 C ATOM 70 CE1 HIS A 9 -13.006 -10.669 -21.669 1.00 0.00 C ATOM 71 NE2 HIS A 9 -13.229 -11.448 -22.730 1.00 0.00 N ATOM 0 H HIS A 9 -14.674 -5.488 -25.265 1.00 0.00 H new ATOM 0 HA HIS A 9 -14.617 -7.773 -25.500 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -12.369 -8.114 -25.047 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -12.428 -7.249 -23.524 1.00 0.00 H new ATOM 0 HD1 HIS A 9 -12.709 -8.593 -21.384 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -13.403 -10.880 -24.848 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -12.934 -11.033 -20.655 1.00 0.00 H new ATOM 72 N THR A 10 -16.164 -7.186 -22.858 1.00 0.00 N ATOM 73 CA THR A 10 -17.205 -7.718 -21.937 1.00 0.00 C ATOM 74 C THR A 10 -18.286 -6.663 -21.703 1.00 0.00 C ATOM 75 O THR A 10 -18.038 -5.477 -21.778 1.00 0.00 O ATOM 76 CB THR A 10 -16.561 -8.091 -20.599 1.00 0.00 C ATOM 77 OG1 THR A 10 -15.607 -9.123 -20.804 1.00 0.00 O ATOM 78 CG2 THR A 10 -17.642 -8.576 -19.630 1.00 0.00 C ATOM 0 H THR A 10 -16.092 -6.169 -22.901 1.00 0.00 H new ATOM 0 HA THR A 10 -17.659 -8.602 -22.386 1.00 0.00 H new ATOM 0 HB THR A 10 -16.064 -7.217 -20.178 1.00 0.00 H new ATOM 0 HG1 THR A 10 -15.749 -9.529 -21.685 1.00 0.00 H new ATOM 0 HG21 THR A 10 -17.184 -8.842 -18.677 1.00 0.00 H new ATOM 0 HG22 THR A 10 -18.372 -7.782 -19.473 1.00 0.00 H new ATOM 0 HG23 THR A 10 -18.141 -9.450 -20.049 1.00 0.00 H new ATOM 79 N ILE A 11 -19.484 -7.091 -21.415 1.00 0.00 N ATOM 80 CA ILE A 11 -20.582 -6.117 -21.170 1.00 0.00 C ATOM 81 C ILE A 11 -21.157 -6.340 -19.771 1.00 0.00 C ATOM 82 O ILE A 11 -20.846 -7.310 -19.110 1.00 0.00 O ATOM 83 CB ILE A 11 -21.675 -6.292 -22.229 1.00 0.00 C ATOM 84 CG1 ILE A 11 -22.548 -7.502 -21.873 1.00 0.00 C ATOM 85 CG2 ILE A 11 -21.021 -6.509 -23.595 1.00 0.00 C ATOM 86 CD1 ILE A 11 -23.361 -7.938 -23.096 1.00 0.00 C ATOM 0 H ILE A 11 -19.749 -8.073 -21.339 1.00 0.00 H new ATOM 0 HA ILE A 11 -20.192 -5.101 -21.236 1.00 0.00 H new ATOM 0 HB ILE A 11 -22.300 -5.400 -22.262 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -21.921 -8.325 -21.530 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -23.218 -7.248 -21.052 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -21.794 -6.634 -24.353 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -20.405 -5.645 -23.845 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -20.397 -7.402 -23.562 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -23.978 -8.798 -22.835 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -24.001 -7.117 -23.419 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -22.683 -8.210 -23.905 1.00 0.00 H new ATOM 87 N TYR A 12 -21.991 -5.447 -19.312 1.00 0.00 N ATOM 88 CA TYR A 12 -22.577 -5.612 -17.953 1.00 0.00 C ATOM 89 C TYR A 12 -24.071 -5.298 -17.991 1.00 0.00 C ATOM 90 O TYR A 12 -24.483 -4.245 -18.435 1.00 0.00 O ATOM 91 CB TYR A 12 -21.887 -4.653 -16.981 1.00 0.00 C ATOM 92 CG TYR A 12 -22.143 -5.104 -15.563 1.00 0.00 C ATOM 93 CD1 TYR A 12 -23.455 -5.180 -15.075 1.00 0.00 C ATOM 94 CD2 TYR A 12 -21.069 -5.447 -14.736 1.00 0.00 C ATOM 95 CE1 TYR A 12 -23.690 -5.598 -13.762 1.00 0.00 C ATOM 96 CE2 TYR A 12 -21.304 -5.866 -13.422 1.00 0.00 C ATOM 97 CZ TYR A 12 -22.615 -5.942 -12.935 1.00 0.00 C ATOM 98 OH TYR A 12 -22.846 -6.354 -11.638 1.00 0.00 O ATOM 0 H TYR A 12 -22.291 -4.613 -19.818 1.00 0.00 H new ATOM 0 HA TYR A 12 -22.431 -6.641 -17.623 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -20.815 -4.627 -17.178 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -22.262 -3.640 -17.125 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -24.285 -4.915 -15.714 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -20.058 -5.388 -15.112 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -24.701 -5.655 -13.386 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -20.474 -6.131 -12.783 1.00 0.00 H new ATOM 0 HH TYR A 12 -21.992 -6.556 -11.202 1.00 0.00 H new ATOM 99 N ILE A 13 -24.887 -6.195 -17.515 1.00 0.00 N ATOM 100 CA ILE A 13 -26.351 -5.938 -17.513 1.00 0.00 C ATOM 101 C ILE A 13 -26.839 -5.839 -16.066 1.00 0.00 C ATOM 102 O ILE A 13 -26.424 -6.594 -15.209 1.00 0.00 O ATOM 103 CB ILE A 13 -27.074 -7.083 -18.227 1.00 0.00 C ATOM 104 CG1 ILE A 13 -26.881 -6.940 -19.738 1.00 0.00 C ATOM 105 CG2 ILE A 13 -28.567 -7.031 -17.899 1.00 0.00 C ATOM 106 CD1 ILE A 13 -26.241 -8.213 -20.293 1.00 0.00 C ATOM 0 H ILE A 13 -24.603 -7.095 -17.127 1.00 0.00 H new ATOM 0 HA ILE A 13 -26.562 -5.004 -18.034 1.00 0.00 H new ATOM 0 HB ILE A 13 -26.663 -8.036 -17.893 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -27.841 -6.762 -20.223 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -26.250 -6.078 -19.955 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -29.080 -7.847 -18.408 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -28.707 -7.130 -16.823 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -28.980 -6.079 -18.232 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -26.103 -8.112 -21.370 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -25.273 -8.371 -19.817 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -26.889 -9.065 -20.089 1.00 0.00 H new ATOM 107 N ASN A 14 -27.718 -4.915 -15.790 1.00 0.00 N ATOM 108 CA ASN A 14 -28.237 -4.763 -14.400 1.00 0.00 C ATOM 109 C ASN A 14 -29.708 -4.350 -14.454 1.00 0.00 C ATOM 110 O ASN A 14 -30.047 -3.201 -14.253 1.00 0.00 O ATOM 111 CB ASN A 14 -27.435 -3.682 -13.670 1.00 0.00 C ATOM 112 CG ASN A 14 -28.035 -3.450 -12.281 1.00 0.00 C ATOM 113 OD1 ASN A 14 -28.347 -4.389 -11.576 1.00 0.00 O ATOM 114 ND2 ASN A 14 -28.212 -2.228 -11.854 1.00 0.00 N ATOM 0 H ASN A 14 -28.101 -4.257 -16.469 1.00 0.00 H new ATOM 0 HA ASN A 14 -28.139 -5.710 -13.869 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -26.392 -3.986 -13.581 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -27.449 -2.755 -14.243 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -28.612 -2.063 -10.930 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -27.951 -1.439 -12.445 1.00 0.00 H new ATOM 115 N ASN A 15 -30.587 -5.275 -14.729 1.00 0.00 N ATOM 116 CA ASN A 15 -32.032 -4.922 -14.798 1.00 0.00 C ATOM 117 C ASN A 15 -32.866 -6.184 -15.030 1.00 0.00 C ATOM 118 O ASN A 15 -33.906 -6.143 -15.655 1.00 0.00 O ATOM 119 CB ASN A 15 -32.261 -3.945 -15.953 1.00 0.00 C ATOM 120 CG ASN A 15 -31.956 -4.643 -17.278 1.00 0.00 C ATOM 121 OD1 ASN A 15 -30.829 -4.643 -17.734 1.00 0.00 O ATOM 122 ND2 ASN A 15 -32.920 -5.243 -17.922 1.00 0.00 N ATOM 0 H ASN A 15 -30.368 -6.255 -14.908 1.00 0.00 H new ATOM 0 HA ASN A 15 -32.333 -4.460 -13.858 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -33.292 -3.591 -15.945 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -31.622 -3.070 -15.835 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -32.728 -5.712 -18.807 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -33.866 -5.243 -17.540 1.00 0.00 H new ATOM 123 N LEU A 16 -32.424 -7.306 -14.530 1.00 0.00 N ATOM 124 CA LEU A 16 -33.201 -8.558 -14.723 1.00 0.00 C ATOM 125 C LEU A 16 -34.231 -8.682 -13.603 1.00 0.00 C ATOM 126 O LEU A 16 -34.269 -7.881 -12.690 1.00 0.00 O ATOM 127 CB LEU A 16 -32.252 -9.757 -14.678 1.00 0.00 C ATOM 128 CG LEU A 16 -31.429 -9.805 -15.964 1.00 0.00 C ATOM 129 CD1 LEU A 16 -32.366 -9.973 -17.160 1.00 0.00 C ATOM 130 CD2 LEU A 16 -30.641 -8.500 -16.116 1.00 0.00 C ATOM 0 H LEU A 16 -31.560 -7.407 -13.998 1.00 0.00 H new ATOM 0 HA LEU A 16 -33.707 -8.534 -15.688 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -31.592 -9.679 -13.814 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -32.820 -10.680 -14.563 1.00 0.00 H new ATOM 0 HG LEU A 16 -30.736 -10.645 -15.921 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -31.781 -10.007 -18.079 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -32.929 -10.900 -17.054 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -33.057 -9.131 -17.202 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -30.054 -8.534 -17.034 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -31.334 -7.660 -16.160 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -29.974 -8.376 -15.263 1.00 0.00 H new ATOM 131 N ASN A 17 -35.064 -9.681 -13.656 1.00 0.00 N ATOM 132 CA ASN A 17 -36.081 -9.850 -12.586 1.00 0.00 C ATOM 133 C ASN A 17 -35.404 -10.439 -11.351 1.00 0.00 C ATOM 134 O ASN A 17 -34.430 -11.157 -11.449 1.00 0.00 O ATOM 135 CB ASN A 17 -37.185 -10.792 -13.068 1.00 0.00 C ATOM 136 CG ASN A 17 -37.613 -10.396 -14.482 1.00 0.00 C ATOM 137 OD1 ASN A 17 -37.285 -9.324 -14.952 1.00 0.00 O ATOM 138 ND2 ASN A 17 -38.337 -11.221 -15.186 1.00 0.00 N ATOM 0 H ASN A 17 -35.084 -10.386 -14.393 1.00 0.00 H new ATOM 0 HA ASN A 17 -36.522 -8.884 -12.340 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -36.828 -11.822 -13.060 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -38.039 -10.745 -12.392 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -38.628 -10.967 -16.130 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -38.613 -12.121 -14.793 1.00 0.00 H new ATOM 139 N GLU A 18 -35.906 -10.143 -10.191 1.00 0.00 N ATOM 140 CA GLU A 18 -35.284 -10.689 -8.957 1.00 0.00 C ATOM 141 C GLU A 18 -35.968 -12.005 -8.594 1.00 0.00 C ATOM 142 O GLU A 18 -36.282 -12.263 -7.449 1.00 0.00 O ATOM 143 CB GLU A 18 -35.450 -9.683 -7.820 1.00 0.00 C ATOM 144 CG GLU A 18 -34.310 -8.663 -7.881 1.00 0.00 C ATOM 145 CD GLU A 18 -34.813 -7.302 -7.394 1.00 0.00 C ATOM 146 OE1 GLU A 18 -35.220 -7.218 -6.247 1.00 0.00 O ATOM 147 OE2 GLU A 18 -34.782 -6.367 -8.177 1.00 0.00 O ATOM 0 H GLU A 18 -36.720 -9.547 -10.042 1.00 0.00 H new ATOM 0 HA GLU A 18 -34.222 -10.868 -9.122 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -36.412 -9.177 -7.904 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -35.443 -10.197 -6.859 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -33.477 -8.997 -7.263 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -33.937 -8.580 -8.902 1.00 0.00 H new ATOM 148 N LYS A 19 -36.199 -12.841 -9.567 1.00 0.00 N ATOM 149 CA LYS A 19 -36.861 -14.141 -9.293 1.00 0.00 C ATOM 150 C LYS A 19 -36.207 -15.233 -10.140 1.00 0.00 C ATOM 151 O LYS A 19 -36.760 -16.296 -10.335 1.00 0.00 O ATOM 152 CB LYS A 19 -38.349 -14.042 -9.636 1.00 0.00 C ATOM 153 CG LYS A 19 -39.017 -13.012 -8.722 1.00 0.00 C ATOM 154 CD LYS A 19 -39.948 -13.723 -7.738 1.00 0.00 C ATOM 155 CE LYS A 19 -40.172 -12.833 -6.514 1.00 0.00 C ATOM 156 NZ LYS A 19 -41.071 -11.702 -6.878 1.00 0.00 N ATOM 0 H LYS A 19 -35.956 -12.677 -10.544 1.00 0.00 H new ATOM 0 HA LYS A 19 -36.753 -14.389 -8.237 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -38.474 -13.753 -10.680 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -38.826 -15.015 -9.515 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -38.259 -12.448 -8.178 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -39.581 -12.295 -9.318 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -40.901 -13.946 -8.218 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -39.514 -14.676 -7.434 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -40.612 -13.415 -5.704 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -39.218 -12.451 -6.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -41.223 -11.097 -6.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -40.634 -11.142 -7.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -41.984 -12.076 -7.205 1.00 0.00 H new ATOM 157 N ILE A 20 -35.031 -14.976 -10.644 1.00 0.00 N ATOM 158 CA ILE A 20 -34.341 -15.998 -11.476 1.00 0.00 C ATOM 159 C ILE A 20 -33.150 -16.565 -10.706 1.00 0.00 C ATOM 160 O ILE A 20 -32.610 -15.935 -9.818 1.00 0.00 O ATOM 161 CB ILE A 20 -33.838 -15.361 -12.771 1.00 0.00 C ATOM 162 CG1 ILE A 20 -34.892 -14.401 -13.324 1.00 0.00 C ATOM 163 CG2 ILE A 20 -33.560 -16.456 -13.800 1.00 0.00 C ATOM 164 CD1 ILE A 20 -34.256 -13.028 -13.545 1.00 0.00 C ATOM 0 H ILE A 20 -34.520 -14.103 -10.515 1.00 0.00 H new ATOM 0 HA ILE A 20 -35.044 -16.797 -11.712 1.00 0.00 H new ATOM 0 HB ILE A 20 -32.922 -14.807 -12.565 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -35.293 -14.784 -14.262 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -35.728 -14.320 -12.629 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -33.201 -16.004 -14.725 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -32.803 -17.137 -13.411 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -34.478 -17.010 -13.999 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -35.004 -12.340 -13.939 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -33.876 -12.646 -12.597 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -33.435 -13.118 -14.256 1.00 0.00 H new ATOM 165 N LYS A 21 -32.733 -17.749 -11.049 1.00 0.00 N ATOM 166 CA LYS A 21 -31.574 -18.365 -10.355 1.00 0.00 C ATOM 167 C LYS A 21 -30.517 -18.750 -11.390 1.00 0.00 C ATOM 168 O LYS A 21 -30.824 -18.985 -12.542 1.00 0.00 O ATOM 169 CB LYS A 21 -32.034 -19.614 -9.598 1.00 0.00 C ATOM 170 CG LYS A 21 -33.032 -20.392 -10.458 1.00 0.00 C ATOM 171 CD LYS A 21 -33.407 -21.698 -9.754 1.00 0.00 C ATOM 172 CE LYS A 21 -34.794 -21.559 -9.123 1.00 0.00 C ATOM 173 NZ LYS A 21 -35.065 -22.740 -8.255 1.00 0.00 N ATOM 0 H LYS A 21 -33.149 -18.319 -11.785 1.00 0.00 H new ATOM 0 HA LYS A 21 -31.149 -17.654 -9.646 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -31.177 -20.243 -9.358 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -32.496 -19.330 -8.653 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -33.925 -19.791 -10.631 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -32.597 -20.605 -11.435 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -33.401 -22.522 -10.467 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -32.669 -21.935 -8.987 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -34.848 -20.642 -8.536 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -35.554 -21.484 -9.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -36.008 -22.646 -7.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -35.030 -23.607 -8.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -34.347 -22.792 -7.505 1.00 0.00 H new ATOM 174 N LYS A 22 -29.275 -18.810 -10.990 1.00 0.00 N ATOM 175 CA LYS A 22 -28.196 -19.176 -11.952 1.00 0.00 C ATOM 176 C LYS A 22 -28.668 -20.331 -12.837 1.00 0.00 C ATOM 177 O LYS A 22 -29.649 -20.986 -12.546 1.00 0.00 O ATOM 178 CB LYS A 22 -26.946 -19.597 -11.179 1.00 0.00 C ATOM 179 CG LYS A 22 -26.034 -18.384 -10.995 1.00 0.00 C ATOM 180 CD LYS A 22 -24.810 -18.783 -10.172 1.00 0.00 C ATOM 181 CE LYS A 22 -23.654 -17.832 -10.489 1.00 0.00 C ATOM 182 NZ LYS A 22 -22.365 -18.468 -10.097 1.00 0.00 N ATOM 0 H LYS A 22 -28.961 -18.621 -10.038 1.00 0.00 H new ATOM 0 HA LYS A 22 -27.961 -18.316 -12.579 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -27.225 -20.007 -10.208 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -26.419 -20.384 -11.718 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -25.722 -18.000 -11.966 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -26.576 -17.582 -10.494 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -25.045 -18.746 -9.108 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -24.524 -19.810 -10.399 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -23.646 -17.595 -11.553 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -23.785 -16.892 -9.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -21.689 -17.733 -9.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -22.527 -19.121 -9.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -21.978 -18.995 -10.906 1.00 0.00 H new ATOM 183 N ASP A 23 -27.982 -20.577 -13.922 1.00 0.00 N ATOM 184 CA ASP A 23 -28.393 -21.678 -14.838 1.00 0.00 C ATOM 185 C ASP A 23 -29.552 -21.197 -15.716 1.00 0.00 C ATOM 186 O ASP A 23 -29.998 -21.892 -16.608 1.00 0.00 O ATOM 187 CB ASP A 23 -28.832 -22.897 -14.024 1.00 0.00 C ATOM 188 CG ASP A 23 -28.192 -24.158 -14.607 1.00 0.00 C ATOM 189 OD1 ASP A 23 -28.786 -24.742 -15.499 1.00 0.00 O ATOM 190 OD2 ASP A 23 -27.120 -24.520 -14.151 1.00 0.00 O ATOM 0 H ASP A 23 -27.152 -20.060 -14.213 1.00 0.00 H new ATOM 0 HA ASP A 23 -27.549 -21.960 -15.468 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -28.538 -22.776 -12.981 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -29.918 -22.987 -14.041 1.00 0.00 H new ATOM 191 N GLU A 24 -30.038 -20.008 -15.476 1.00 0.00 N ATOM 192 CA GLU A 24 -31.158 -19.474 -16.299 1.00 0.00 C ATOM 193 C GLU A 24 -30.793 -18.071 -16.784 1.00 0.00 C ATOM 194 O GLU A 24 -30.875 -17.769 -17.958 1.00 0.00 O ATOM 195 CB GLU A 24 -32.431 -19.408 -15.453 1.00 0.00 C ATOM 196 CG GLU A 24 -33.253 -20.679 -15.666 1.00 0.00 C ATOM 197 CD GLU A 24 -34.401 -20.389 -16.633 1.00 0.00 C ATOM 198 OE1 GLU A 24 -34.207 -19.580 -17.526 1.00 0.00 O ATOM 199 OE2 GLU A 24 -35.456 -20.978 -16.465 1.00 0.00 O ATOM 0 H GLU A 24 -29.705 -19.383 -14.742 1.00 0.00 H new ATOM 0 HA GLU A 24 -31.330 -20.127 -17.154 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -32.174 -19.301 -14.399 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -33.018 -18.532 -15.729 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -32.620 -21.472 -16.064 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -33.647 -21.034 -14.714 1.00 0.00 H new ATOM 200 N LEU A 25 -30.387 -17.214 -15.887 1.00 0.00 N ATOM 201 CA LEU A 25 -30.011 -15.832 -16.289 1.00 0.00 C ATOM 202 C LEU A 25 -29.039 -15.883 -17.469 1.00 0.00 C ATOM 203 O LEU A 25 -29.282 -15.304 -18.510 1.00 0.00 O ATOM 204 CB LEU A 25 -29.332 -15.127 -15.110 1.00 0.00 C ATOM 205 CG LEU A 25 -30.046 -13.806 -14.815 1.00 0.00 C ATOM 206 CD1 LEU A 25 -30.225 -13.011 -16.110 1.00 0.00 C ATOM 207 CD2 LEU A 25 -31.417 -14.095 -14.202 1.00 0.00 C ATOM 0 H LEU A 25 -30.300 -17.414 -14.891 1.00 0.00 H new ATOM 0 HA LEU A 25 -30.908 -15.286 -16.580 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -29.355 -15.768 -14.229 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -28.283 -14.940 -15.341 1.00 0.00 H new ATOM 0 HG LEU A 25 -29.447 -13.223 -14.116 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -30.734 -12.072 -15.893 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -29.248 -12.802 -16.547 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -30.820 -13.592 -16.814 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -31.927 -13.155 -13.991 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -32.012 -14.682 -14.902 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -31.291 -14.655 -13.275 1.00 0.00 H new ATOM 208 N LYS A 26 -27.934 -16.563 -17.317 1.00 0.00 N ATOM 209 CA LYS A 26 -26.944 -16.637 -18.430 1.00 0.00 C ATOM 210 C LYS A 26 -27.535 -17.415 -19.606 1.00 0.00 C ATOM 211 O LYS A 26 -27.272 -17.115 -20.754 1.00 0.00 O ATOM 212 CB LYS A 26 -25.677 -17.341 -17.949 1.00 0.00 C ATOM 213 CG LYS A 26 -26.055 -18.572 -17.122 1.00 0.00 C ATOM 214 CD LYS A 26 -24.874 -19.543 -17.077 1.00 0.00 C ATOM 215 CE LYS A 26 -24.724 -20.101 -15.659 1.00 0.00 C ATOM 216 NZ LYS A 26 -23.894 -21.339 -15.698 1.00 0.00 N ATOM 0 H LYS A 26 -27.674 -17.070 -16.471 1.00 0.00 H new ATOM 0 HA LYS A 26 -26.701 -15.624 -18.751 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -25.067 -17.637 -18.803 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -25.075 -16.658 -17.349 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -26.331 -18.272 -16.111 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -26.925 -19.062 -17.558 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -25.032 -20.357 -17.785 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -23.959 -19.033 -17.377 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -24.258 -19.358 -15.012 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -25.705 -20.321 -15.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -23.792 -21.719 -14.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -24.356 -22.048 -16.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -22.954 -21.115 -16.084 1.00 0.00 H new ATOM 217 N LYS A 27 -28.324 -18.412 -19.332 1.00 0.00 N ATOM 218 CA LYS A 27 -28.922 -19.207 -20.440 1.00 0.00 C ATOM 219 C LYS A 27 -29.824 -18.308 -21.287 1.00 0.00 C ATOM 220 O LYS A 27 -30.252 -18.680 -22.362 1.00 0.00 O ATOM 221 CB LYS A 27 -29.750 -20.349 -19.853 1.00 0.00 C ATOM 222 CG LYS A 27 -29.055 -21.682 -20.131 1.00 0.00 C ATOM 223 CD LYS A 27 -30.097 -22.801 -20.142 1.00 0.00 C ATOM 224 CE LYS A 27 -29.424 -24.130 -20.490 1.00 0.00 C ATOM 225 NZ LYS A 27 -30.274 -24.879 -21.457 1.00 0.00 N ATOM 0 H LYS A 27 -28.581 -18.712 -18.392 1.00 0.00 H new ATOM 0 HA LYS A 27 -28.127 -19.614 -21.065 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -29.872 -20.208 -18.779 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -30.748 -20.350 -20.290 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -28.537 -21.642 -21.089 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -28.301 -21.878 -19.369 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -30.579 -22.871 -19.167 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -30.878 -22.577 -20.869 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -28.439 -23.949 -20.920 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -29.274 -24.722 -19.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -29.817 -25.783 -21.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -31.205 -25.063 -21.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -30.395 -24.315 -22.322 1.00 0.00 H new ATOM 226 N SER A 28 -30.121 -17.128 -20.813 1.00 0.00 N ATOM 227 CA SER A 28 -31.001 -16.216 -21.593 1.00 0.00 C ATOM 228 C SER A 28 -30.152 -15.221 -22.387 1.00 0.00 C ATOM 229 O SER A 28 -30.523 -14.805 -23.467 1.00 0.00 O ATOM 230 CB SER A 28 -31.924 -15.458 -20.640 1.00 0.00 C ATOM 231 OG SER A 28 -32.924 -16.343 -20.152 1.00 0.00 O ATOM 0 H SER A 28 -29.792 -16.758 -19.921 1.00 0.00 H new ATOM 0 HA SER A 28 -31.600 -16.805 -22.288 1.00 0.00 H new ATOM 0 HB2 SER A 28 -31.350 -15.046 -19.810 1.00 0.00 H new ATOM 0 HB3 SER A 28 -32.387 -14.617 -21.156 1.00 0.00 H new ATOM 0 HG SER A 28 -33.248 -16.024 -19.284 1.00 0.00 H new ATOM 232 N LEU A 29 -29.011 -14.843 -21.877 1.00 0.00 N ATOM 233 CA LEU A 29 -28.153 -13.887 -22.637 1.00 0.00 C ATOM 234 C LEU A 29 -27.274 -14.685 -23.598 1.00 0.00 C ATOM 235 O LEU A 29 -26.628 -14.141 -24.472 1.00 0.00 O ATOM 236 CB LEU A 29 -27.260 -13.096 -21.682 1.00 0.00 C ATOM 237 CG LEU A 29 -28.028 -12.745 -20.409 1.00 0.00 C ATOM 238 CD1 LEU A 29 -27.250 -13.261 -19.200 1.00 0.00 C ATOM 239 CD2 LEU A 29 -28.173 -11.226 -20.308 1.00 0.00 C ATOM 0 H LEU A 29 -28.639 -15.150 -20.978 1.00 0.00 H new ATOM 0 HA LEU A 29 -28.786 -13.188 -23.184 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -26.375 -13.681 -21.432 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -26.912 -12.185 -22.169 1.00 0.00 H new ATOM 0 HG LEU A 29 -29.016 -13.204 -20.435 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -27.791 -13.015 -18.287 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -27.137 -14.343 -19.274 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -26.265 -12.795 -19.175 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -28.721 -10.972 -19.400 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -27.185 -10.768 -20.275 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -28.717 -10.854 -21.176 1.00 0.00 H new ATOM 240 N TYR A 30 -27.250 -15.977 -23.432 1.00 0.00 N ATOM 241 CA TYR A 30 -26.427 -16.840 -24.311 1.00 0.00 C ATOM 242 C TYR A 30 -27.194 -17.124 -25.602 1.00 0.00 C ATOM 243 O TYR A 30 -26.616 -17.258 -26.663 1.00 0.00 O ATOM 244 CB TYR A 30 -26.152 -18.148 -23.570 1.00 0.00 C ATOM 245 CG TYR A 30 -24.681 -18.479 -23.630 1.00 0.00 C ATOM 246 CD1 TYR A 30 -24.143 -19.080 -24.773 1.00 0.00 C ATOM 247 CD2 TYR A 30 -23.857 -18.192 -22.535 1.00 0.00 C ATOM 248 CE1 TYR A 30 -22.779 -19.394 -24.822 1.00 0.00 C ATOM 249 CE2 TYR A 30 -22.493 -18.506 -22.583 1.00 0.00 C ATOM 250 CZ TYR A 30 -21.954 -19.107 -23.727 1.00 0.00 C ATOM 251 OH TYR A 30 -20.611 -19.419 -23.775 1.00 0.00 O ATOM 0 H TYR A 30 -27.775 -16.475 -22.713 1.00 0.00 H new ATOM 0 HA TYR A 30 -25.487 -16.348 -24.561 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -26.471 -18.060 -22.531 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -26.733 -18.956 -24.015 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -24.779 -19.302 -25.617 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -24.273 -17.728 -21.653 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -22.363 -19.858 -25.704 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -21.857 -18.285 -21.738 1.00 0.00 H new ATOM 0 HH TYR A 30 -20.183 -19.153 -22.934 1.00 0.00 H new ATOM 252 N ALA A 31 -28.492 -17.218 -25.521 1.00 0.00 N ATOM 253 CA ALA A 31 -29.294 -17.496 -26.745 1.00 0.00 C ATOM 254 C ALA A 31 -29.652 -16.184 -27.450 1.00 0.00 C ATOM 255 O ALA A 31 -30.446 -16.166 -28.370 1.00 0.00 O ATOM 256 CB ALA A 31 -30.580 -18.228 -26.357 1.00 0.00 C ATOM 0 H ALA A 31 -29.031 -17.115 -24.662 1.00 0.00 H new ATOM 0 HA ALA A 31 -28.705 -18.116 -27.421 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -31.167 -18.432 -27.253 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -30.329 -19.168 -25.866 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -31.161 -17.606 -25.676 1.00 0.00 H new ATOM 257 N ILE A 32 -29.081 -15.083 -27.034 1.00 0.00 N ATOM 258 CA ILE A 32 -29.412 -13.790 -27.702 1.00 0.00 C ATOM 259 C ILE A 32 -28.135 -13.076 -28.159 1.00 0.00 C ATOM 260 O ILE A 32 -28.049 -12.621 -29.280 1.00 0.00 O ATOM 261 CB ILE A 32 -30.189 -12.886 -26.741 1.00 0.00 C ATOM 262 CG1 ILE A 32 -29.460 -12.799 -25.400 1.00 0.00 C ATOM 263 CG2 ILE A 32 -31.589 -13.462 -26.520 1.00 0.00 C ATOM 264 CD1 ILE A 32 -30.299 -11.972 -24.423 1.00 0.00 C ATOM 0 H ILE A 32 -28.408 -15.023 -26.270 1.00 0.00 H new ATOM 0 HA ILE A 32 -30.028 -14.004 -28.576 1.00 0.00 H new ATOM 0 HB ILE A 32 -30.265 -11.888 -27.173 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -29.292 -13.798 -24.998 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -28.480 -12.341 -25.534 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -32.143 -12.819 -25.836 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -32.115 -13.516 -27.473 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -31.508 -14.462 -26.093 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -29.783 -11.907 -23.465 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -30.444 -10.970 -24.826 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -31.269 -12.450 -24.281 1.00 0.00 H new ATOM 265 N PHE A 33 -27.144 -12.965 -27.313 1.00 0.00 N ATOM 266 CA PHE A 33 -25.891 -12.268 -27.728 1.00 0.00 C ATOM 267 C PHE A 33 -25.054 -13.190 -28.616 1.00 0.00 C ATOM 268 O PHE A 33 -24.240 -12.744 -29.399 1.00 0.00 O ATOM 269 CB PHE A 33 -25.064 -11.947 -26.492 1.00 0.00 C ATOM 270 CG PHE A 33 -25.651 -10.810 -25.690 1.00 0.00 C ATOM 271 CD1 PHE A 33 -26.490 -9.849 -26.278 1.00 0.00 C ATOM 272 CD2 PHE A 33 -25.333 -10.722 -24.333 1.00 0.00 C ATOM 273 CE1 PHE A 33 -27.005 -8.807 -25.497 1.00 0.00 C ATOM 274 CE2 PHE A 33 -25.847 -9.684 -23.557 1.00 0.00 C ATOM 275 CZ PHE A 33 -26.685 -8.724 -24.137 1.00 0.00 C ATOM 0 H PHE A 33 -27.148 -13.324 -26.358 1.00 0.00 H new ATOM 0 HA PHE A 33 -26.157 -11.359 -28.268 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -24.995 -12.835 -25.863 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -24.049 -11.690 -26.793 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -26.737 -9.913 -27.327 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -24.686 -11.461 -23.883 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -27.650 -8.066 -25.945 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -25.599 -9.620 -22.508 1.00 0.00 H new ATOM 0 HZ PHE A 33 -27.084 -7.920 -23.536 1.00 0.00 H new ATOM 276 N SER A 34 -25.223 -14.474 -28.477 1.00 0.00 N ATOM 277 CA SER A 34 -24.418 -15.425 -29.291 1.00 0.00 C ATOM 278 C SER A 34 -24.371 -14.962 -30.749 1.00 0.00 C ATOM 279 O SER A 34 -23.419 -15.222 -31.460 1.00 0.00 O ATOM 280 CB SER A 34 -25.041 -16.817 -29.207 1.00 0.00 C ATOM 281 OG SER A 34 -26.366 -16.769 -29.719 1.00 0.00 O ATOM 0 H SER A 34 -25.885 -14.907 -27.833 1.00 0.00 H new ATOM 0 HA SER A 34 -23.400 -15.458 -28.902 1.00 0.00 H new ATOM 0 HB2 SER A 34 -24.444 -17.530 -29.776 1.00 0.00 H new ATOM 0 HB3 SER A 34 -25.050 -17.162 -28.173 1.00 0.00 H new ATOM 0 HG SER A 34 -27.005 -16.854 -28.981 1.00 0.00 H new ATOM 282 N GLN A 35 -25.381 -14.275 -31.204 1.00 0.00 N ATOM 283 CA GLN A 35 -25.378 -13.798 -32.616 1.00 0.00 C ATOM 284 C GLN A 35 -24.885 -12.351 -32.655 1.00 0.00 C ATOM 285 O GLN A 35 -24.319 -11.901 -33.631 1.00 0.00 O ATOM 286 CB GLN A 35 -26.793 -13.857 -33.208 1.00 0.00 C ATOM 287 CG GLN A 35 -27.742 -14.596 -32.259 1.00 0.00 C ATOM 288 CD GLN A 35 -29.080 -14.838 -32.961 1.00 0.00 C ATOM 289 OE1 GLN A 35 -29.807 -15.746 -32.611 1.00 0.00 O ATOM 290 NE2 GLN A 35 -29.436 -14.057 -33.943 1.00 0.00 N ATOM 0 H GLN A 35 -26.207 -14.023 -30.661 1.00 0.00 H new ATOM 0 HA GLN A 35 -24.721 -14.440 -33.202 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -27.161 -12.847 -33.386 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -26.769 -14.362 -34.174 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -27.302 -15.546 -31.954 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -27.896 -14.011 -31.352 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -28.825 -13.295 -34.236 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -30.326 -14.208 -34.418 1.00 0.00 H new ATOM 291 N PHE A 36 -25.090 -11.627 -31.592 1.00 0.00 N ATOM 292 CA PHE A 36 -24.631 -10.214 -31.547 1.00 0.00 C ATOM 293 C PHE A 36 -23.155 -10.155 -31.924 1.00 0.00 C ATOM 294 O PHE A 36 -22.667 -9.163 -32.428 1.00 0.00 O ATOM 295 CB PHE A 36 -24.823 -9.673 -30.148 1.00 0.00 C ATOM 296 CG PHE A 36 -26.276 -9.300 -29.948 1.00 0.00 C ATOM 297 CD1 PHE A 36 -27.289 -10.251 -30.136 1.00 0.00 C ATOM 298 CD2 PHE A 36 -26.609 -8.001 -29.561 1.00 0.00 C ATOM 299 CE1 PHE A 36 -28.628 -9.898 -29.938 1.00 0.00 C ATOM 300 CE2 PHE A 36 -27.945 -7.650 -29.359 1.00 0.00 C ATOM 301 CZ PHE A 36 -28.956 -8.596 -29.548 1.00 0.00 C ATOM 0 H PHE A 36 -25.559 -11.956 -30.748 1.00 0.00 H new ATOM 0 HA PHE A 36 -25.208 -9.613 -32.249 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -24.524 -10.420 -29.413 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -24.188 -8.801 -29.993 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -27.035 -11.258 -30.434 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -25.831 -7.266 -29.417 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -29.408 -10.630 -30.086 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -28.198 -6.645 -29.056 1.00 0.00 H new ATOM 0 HZ PHE A 36 -29.989 -8.322 -29.393 1.00 0.00 H new ATOM 302 N GLY A 37 -22.439 -11.219 -31.687 1.00 0.00 N ATOM 303 CA GLY A 37 -20.992 -11.234 -32.036 1.00 0.00 C ATOM 304 C GLY A 37 -20.400 -12.606 -31.707 1.00 0.00 C ATOM 305 O GLY A 37 -19.959 -13.324 -32.581 1.00 0.00 O ATOM 0 H GLY A 37 -22.794 -12.078 -31.267 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -20.861 -11.014 -33.096 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -20.466 -10.457 -31.482 1.00 0.00 H new ATOM 306 N GLN A 38 -20.391 -12.980 -30.455 1.00 0.00 N ATOM 307 CA GLN A 38 -19.828 -14.310 -30.090 1.00 0.00 C ATOM 308 C GLN A 38 -19.787 -14.466 -28.570 1.00 0.00 C ATOM 309 O GLN A 38 -18.753 -14.318 -27.945 1.00 0.00 O ATOM 310 CB GLN A 38 -18.413 -14.438 -30.656 1.00 0.00 C ATOM 311 CG GLN A 38 -18.405 -15.468 -31.789 1.00 0.00 C ATOM 312 CD GLN A 38 -17.030 -16.134 -31.862 1.00 0.00 C ATOM 313 OE1 GLN A 38 -16.927 -17.344 -31.831 1.00 0.00 O ATOM 314 NE2 GLN A 38 -15.963 -15.389 -31.960 1.00 0.00 N ATOM 0 H GLN A 38 -20.746 -12.426 -29.676 1.00 0.00 H new ATOM 0 HA GLN A 38 -20.462 -15.091 -30.509 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -18.070 -13.472 -31.026 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -17.722 -14.742 -29.870 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -19.176 -16.219 -31.618 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -18.637 -14.983 -32.737 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -16.051 -14.373 -31.986 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -15.041 -15.823 -32.011 1.00 0.00 H new ATOM 315 N ILE A 39 -20.902 -14.792 -27.975 1.00 0.00 N ATOM 316 CA ILE A 39 -20.932 -14.989 -26.497 1.00 0.00 C ATOM 317 C ILE A 39 -19.803 -15.952 -26.129 1.00 0.00 C ATOM 318 O ILE A 39 -19.534 -16.895 -26.847 1.00 0.00 O ATOM 319 CB ILE A 39 -22.277 -15.598 -26.094 1.00 0.00 C ATOM 320 CG1 ILE A 39 -23.352 -14.523 -26.156 1.00 0.00 C ATOM 321 CG2 ILE A 39 -22.198 -16.139 -24.667 1.00 0.00 C ATOM 322 CD1 ILE A 39 -22.921 -13.355 -25.280 1.00 0.00 C ATOM 0 H ILE A 39 -21.795 -14.931 -28.449 1.00 0.00 H new ATOM 0 HA ILE A 39 -20.804 -14.038 -25.980 1.00 0.00 H new ATOM 0 HB ILE A 39 -22.520 -16.412 -26.777 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -23.497 -14.192 -27.184 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -24.306 -14.922 -25.812 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -23.159 -16.571 -24.388 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -21.426 -16.906 -24.611 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -21.953 -15.327 -23.983 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -23.682 -12.575 -25.314 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -22.797 -13.697 -24.253 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -21.975 -12.955 -25.646 1.00 0.00 H new ATOM 323 N LEU A 40 -19.126 -15.733 -25.038 1.00 0.00 N ATOM 324 CA LEU A 40 -18.013 -16.657 -24.684 1.00 0.00 C ATOM 325 C LEU A 40 -18.009 -16.955 -23.184 1.00 0.00 C ATOM 326 O LEU A 40 -17.174 -17.693 -22.700 1.00 0.00 O ATOM 327 CB LEU A 40 -16.680 -16.021 -25.077 1.00 0.00 C ATOM 328 CG LEU A 40 -15.983 -16.905 -26.110 1.00 0.00 C ATOM 329 CD1 LEU A 40 -15.763 -18.301 -25.525 1.00 0.00 C ATOM 330 CD2 LEU A 40 -16.860 -17.012 -27.361 1.00 0.00 C ATOM 0 H LEU A 40 -19.290 -14.967 -24.385 1.00 0.00 H new ATOM 0 HA LEU A 40 -18.155 -17.593 -25.224 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -16.846 -15.025 -25.487 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -16.047 -15.902 -24.197 1.00 0.00 H new ATOM 0 HG LEU A 40 -15.021 -16.466 -26.373 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -15.266 -18.931 -26.263 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -15.141 -18.228 -24.633 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -16.725 -18.741 -25.262 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -16.365 -17.642 -28.100 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -17.821 -17.452 -27.095 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -17.019 -16.018 -27.780 1.00 0.00 H new ATOM 331 N ASP A 41 -18.924 -16.399 -22.438 1.00 0.00 N ATOM 332 CA ASP A 41 -18.937 -16.677 -20.978 1.00 0.00 C ATOM 333 C ASP A 41 -19.833 -15.666 -20.271 1.00 0.00 C ATOM 334 O ASP A 41 -19.380 -14.635 -19.815 1.00 0.00 O ATOM 335 CB ASP A 41 -17.516 -16.570 -20.423 1.00 0.00 C ATOM 336 CG ASP A 41 -17.029 -17.955 -19.994 1.00 0.00 C ATOM 337 OD1 ASP A 41 -17.543 -18.465 -19.012 1.00 0.00 O ATOM 338 OD2 ASP A 41 -16.152 -18.483 -20.658 1.00 0.00 O ATOM 0 H ASP A 41 -19.655 -15.771 -22.773 1.00 0.00 H new ATOM 0 HA ASP A 41 -19.320 -17.683 -20.808 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -16.849 -16.157 -21.180 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -17.497 -15.887 -19.574 1.00 0.00 H new ATOM 339 N ILE A 42 -21.095 -15.960 -20.156 1.00 0.00 N ATOM 340 CA ILE A 42 -22.008 -15.028 -19.459 1.00 0.00 C ATOM 341 C ILE A 42 -22.055 -15.446 -18.001 1.00 0.00 C ATOM 342 O ILE A 42 -22.785 -16.341 -17.621 1.00 0.00 O ATOM 343 CB ILE A 42 -23.395 -15.119 -20.078 1.00 0.00 C ATOM 344 CG1 ILE A 42 -23.257 -15.291 -21.589 1.00 0.00 C ATOM 345 CG2 ILE A 42 -24.156 -13.834 -19.780 1.00 0.00 C ATOM 346 CD1 ILE A 42 -24.638 -15.237 -22.236 1.00 0.00 C ATOM 0 H ILE A 42 -21.531 -16.808 -20.517 1.00 0.00 H new ATOM 0 HA ILE A 42 -21.661 -13.998 -19.547 1.00 0.00 H new ATOM 0 HB ILE A 42 -23.935 -15.969 -19.662 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -22.621 -14.506 -21.998 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -22.775 -16.242 -21.815 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -25.152 -13.890 -20.220 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -24.243 -13.704 -18.701 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -23.619 -12.986 -20.205 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -24.540 -15.360 -23.315 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -25.259 -16.038 -21.835 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -25.103 -14.275 -22.021 1.00 0.00 H new ATOM 347 N LEU A 43 -21.252 -14.835 -17.186 1.00 0.00 N ATOM 348 CA LEU A 43 -21.217 -15.232 -15.759 1.00 0.00 C ATOM 349 C LEU A 43 -21.781 -14.116 -14.896 1.00 0.00 C ATOM 350 O LEU A 43 -21.423 -12.964 -15.030 1.00 0.00 O ATOM 351 CB LEU A 43 -19.776 -15.532 -15.322 1.00 0.00 C ATOM 352 CG LEU A 43 -18.813 -15.469 -16.517 1.00 0.00 C ATOM 353 CD1 LEU A 43 -18.160 -14.088 -16.572 1.00 0.00 C ATOM 354 CD2 LEU A 43 -17.734 -16.537 -16.341 1.00 0.00 C ATOM 0 H LEU A 43 -20.619 -14.079 -17.445 1.00 0.00 H new ATOM 0 HA LEU A 43 -21.822 -16.130 -15.636 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -19.466 -14.814 -14.562 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -19.729 -16.520 -14.865 1.00 0.00 H new ATOM 0 HG LEU A 43 -19.360 -15.646 -17.443 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -17.476 -14.042 -17.420 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -18.931 -13.325 -16.686 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -17.607 -13.910 -15.650 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -17.045 -16.501 -17.185 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -17.186 -16.352 -15.417 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -18.200 -17.521 -16.296 1.00 0.00 H new ATOM 355 N VAL A 44 -22.660 -14.458 -14.007 1.00 0.00 N ATOM 356 CA VAL A 44 -23.263 -13.436 -13.116 1.00 0.00 C ATOM 357 C VAL A 44 -22.255 -13.060 -12.025 1.00 0.00 C ATOM 358 O VAL A 44 -21.162 -13.586 -11.973 1.00 0.00 O ATOM 359 CB VAL A 44 -24.532 -14.016 -12.497 1.00 0.00 C ATOM 360 CG1 VAL A 44 -25.576 -14.211 -13.601 1.00 0.00 C ATOM 361 CG2 VAL A 44 -24.207 -15.368 -11.860 1.00 0.00 C ATOM 0 H VAL A 44 -22.991 -15.411 -13.856 1.00 0.00 H new ATOM 0 HA VAL A 44 -23.517 -12.538 -13.680 1.00 0.00 H new ATOM 0 HB VAL A 44 -24.921 -13.339 -11.736 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -26.488 -14.625 -13.171 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -25.798 -13.250 -14.066 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -25.186 -14.896 -14.353 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -25.110 -15.787 -11.416 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -23.828 -16.048 -12.623 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -23.451 -15.233 -11.086 1.00 0.00 H new ATOM 362 N SER A 45 -22.606 -12.142 -11.164 1.00 0.00 N ATOM 363 CA SER A 45 -21.653 -11.723 -10.094 1.00 0.00 C ATOM 364 C SER A 45 -21.827 -12.600 -8.848 1.00 0.00 C ATOM 365 O SER A 45 -21.092 -12.470 -7.889 1.00 0.00 O ATOM 366 CB SER A 45 -21.919 -10.263 -9.728 1.00 0.00 C ATOM 367 OG SER A 45 -20.695 -9.540 -9.758 1.00 0.00 O ATOM 0 H SER A 45 -23.508 -11.665 -11.155 1.00 0.00 H new ATOM 0 HA SER A 45 -20.634 -11.836 -10.463 1.00 0.00 H new ATOM 0 HB2 SER A 45 -22.631 -9.825 -10.428 1.00 0.00 H new ATOM 0 HB3 SER A 45 -22.367 -10.201 -8.736 1.00 0.00 H new ATOM 0 HG SER A 45 -20.863 -8.603 -9.525 1.00 0.00 H new ATOM 368 N ARG A 46 -22.790 -13.485 -8.847 1.00 0.00 N ATOM 369 CA ARG A 46 -23.004 -14.356 -7.653 1.00 0.00 C ATOM 370 C ARG A 46 -22.848 -13.521 -6.378 1.00 0.00 C ATOM 371 O ARG A 46 -21.881 -13.654 -5.654 1.00 0.00 O ATOM 372 CB ARG A 46 -21.968 -15.485 -7.652 1.00 0.00 C ATOM 373 CG ARG A 46 -22.044 -16.253 -6.330 1.00 0.00 C ATOM 374 CD ARG A 46 -22.608 -17.653 -6.583 1.00 0.00 C ATOM 375 NE ARG A 46 -21.604 -18.673 -6.170 1.00 0.00 N ATOM 376 CZ ARG A 46 -21.894 -19.944 -6.234 1.00 0.00 C ATOM 377 NH1 ARG A 46 -22.799 -20.365 -7.075 1.00 0.00 N ATOM 378 NH2 ARG A 46 -21.281 -20.793 -5.456 1.00 0.00 N ATOM 0 H ARG A 46 -23.437 -13.642 -9.620 1.00 0.00 H new ATOM 0 HA ARG A 46 -24.007 -14.782 -7.689 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -22.151 -16.161 -8.487 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -20.968 -15.074 -7.788 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -21.053 -16.324 -5.881 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -22.676 -15.717 -5.622 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -23.534 -17.791 -6.024 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -22.852 -17.773 -7.638 1.00 0.00 H new ATOM 0 HE ARG A 46 -20.687 -18.377 -5.836 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -23.279 -19.701 -7.682 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -23.026 -21.358 -7.125 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -20.575 -20.464 -4.798 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -21.508 -21.786 -5.506 1.00 0.00 H new ATOM 379 N SER A 47 -23.786 -12.656 -6.097 1.00 0.00 N ATOM 380 CA SER A 47 -23.673 -11.815 -4.870 1.00 0.00 C ATOM 381 C SER A 47 -25.044 -11.240 -4.501 1.00 0.00 C ATOM 382 O SER A 47 -26.072 -11.800 -4.822 1.00 0.00 O ATOM 383 CB SER A 47 -22.702 -10.665 -5.135 1.00 0.00 C ATOM 384 OG SER A 47 -21.930 -10.421 -3.967 1.00 0.00 O ATOM 0 H SER A 47 -24.621 -12.496 -6.660 1.00 0.00 H new ATOM 0 HA SER A 47 -23.308 -12.430 -4.047 1.00 0.00 H new ATOM 0 HB2 SER A 47 -22.048 -10.912 -5.972 1.00 0.00 H new ATOM 0 HB3 SER A 47 -23.252 -9.767 -5.415 1.00 0.00 H new ATOM 0 HG SER A 47 -21.305 -9.685 -4.136 1.00 0.00 H new ATOM 385 N LEU A 48 -25.060 -10.121 -3.825 1.00 0.00 N ATOM 386 CA LEU A 48 -26.358 -9.502 -3.430 1.00 0.00 C ATOM 387 C LEU A 48 -26.462 -8.101 -4.041 1.00 0.00 C ATOM 388 O LEU A 48 -27.531 -7.647 -4.397 1.00 0.00 O ATOM 389 CB LEU A 48 -26.432 -9.402 -1.905 1.00 0.00 C ATOM 390 CG LEU A 48 -27.689 -10.117 -1.405 1.00 0.00 C ATOM 391 CD1 LEU A 48 -28.916 -9.562 -2.129 1.00 0.00 C ATOM 392 CD2 LEU A 48 -27.570 -11.618 -1.685 1.00 0.00 C ATOM 0 H LEU A 48 -24.229 -9.609 -3.529 1.00 0.00 H new ATOM 0 HA LEU A 48 -27.181 -10.118 -3.793 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -25.544 -9.849 -1.457 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -26.450 -8.356 -1.599 1.00 0.00 H new ATOM 0 HG LEU A 48 -27.794 -9.954 -0.332 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -29.811 -10.072 -1.772 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -29.004 -8.494 -1.930 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -28.810 -9.724 -3.202 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -28.466 -12.127 -1.329 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -27.463 -11.781 -2.757 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -26.697 -12.016 -1.169 1.00 0.00 H new ATOM 393 N LYS A 49 -25.358 -7.416 -4.173 1.00 0.00 N ATOM 394 CA LYS A 49 -25.397 -6.050 -4.770 1.00 0.00 C ATOM 395 C LYS A 49 -25.470 -6.173 -6.293 1.00 0.00 C ATOM 396 O LYS A 49 -25.466 -5.190 -7.008 1.00 0.00 O ATOM 397 CB LYS A 49 -24.129 -5.284 -4.383 1.00 0.00 C ATOM 398 CG LYS A 49 -23.903 -5.397 -2.875 1.00 0.00 C ATOM 399 CD LYS A 49 -22.439 -5.748 -2.603 1.00 0.00 C ATOM 400 CE LYS A 49 -21.807 -4.662 -1.730 1.00 0.00 C ATOM 401 NZ LYS A 49 -20.723 -3.982 -2.493 1.00 0.00 N ATOM 0 H LYS A 49 -24.433 -7.742 -3.894 1.00 0.00 H new ATOM 0 HA LYS A 49 -26.270 -5.513 -4.399 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -23.270 -5.686 -4.921 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -24.223 -4.237 -4.670 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -24.159 -4.457 -2.387 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -24.556 -6.162 -2.455 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -22.373 -6.715 -2.104 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -21.894 -5.836 -3.543 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -22.563 -3.938 -1.427 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -21.404 -5.102 -0.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -20.292 -3.243 -1.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -19.998 -4.678 -2.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -21.121 -3.549 -3.351 1.00 0.00 H new ATOM 402 N MET A 50 -25.535 -7.377 -6.792 1.00 0.00 N ATOM 403 CA MET A 50 -25.604 -7.577 -8.264 1.00 0.00 C ATOM 404 C MET A 50 -27.005 -8.063 -8.640 1.00 0.00 C ATOM 405 O MET A 50 -27.166 -8.903 -9.498 1.00 0.00 O ATOM 406 CB MET A 50 -24.576 -8.635 -8.668 1.00 0.00 C ATOM 407 CG MET A 50 -24.869 -9.934 -7.915 1.00 0.00 C ATOM 408 SD MET A 50 -24.595 -11.347 -9.009 1.00 0.00 S ATOM 409 CE MET A 50 -26.021 -11.094 -10.088 1.00 0.00 C ATOM 0 H MET A 50 -25.543 -8.234 -6.239 1.00 0.00 H new ATOM 0 HA MET A 50 -25.393 -6.639 -8.778 1.00 0.00 H new ATOM 0 HB2 MET A 50 -24.617 -8.807 -9.744 1.00 0.00 H new ATOM 0 HB3 MET A 50 -23.569 -8.287 -8.439 1.00 0.00 H new ATOM 0 HG2 MET A 50 -24.226 -10.010 -7.038 1.00 0.00 H new ATOM 0 HG3 MET A 50 -25.898 -9.934 -7.556 1.00 0.00 H new ATOM 0 HE1 MET A 50 -26.094 -11.921 -10.795 1.00 0.00 H new ATOM 0 HE2 MET A 50 -26.929 -11.050 -9.487 1.00 0.00 H new ATOM 0 HE3 MET A 50 -25.902 -10.159 -10.635 1.00 0.00 H new ATOM 410 N ARG A 51 -28.017 -7.546 -7.996 1.00 0.00 N ATOM 411 CA ARG A 51 -29.412 -7.986 -8.304 1.00 0.00 C ATOM 412 C ARG A 51 -29.574 -8.209 -9.806 1.00 0.00 C ATOM 413 O ARG A 51 -29.492 -7.288 -10.593 1.00 0.00 O ATOM 414 CB ARG A 51 -30.402 -6.914 -7.856 1.00 0.00 C ATOM 415 CG ARG A 51 -31.385 -7.516 -6.850 1.00 0.00 C ATOM 416 CD ARG A 51 -31.325 -6.726 -5.542 1.00 0.00 C ATOM 417 NE ARG A 51 -32.364 -7.239 -4.605 1.00 0.00 N ATOM 418 CZ ARG A 51 -32.069 -7.435 -3.349 1.00 0.00 C ATOM 419 NH1 ARG A 51 -32.080 -6.432 -2.513 1.00 0.00 N ATOM 420 NH2 ARG A 51 -31.763 -8.632 -2.929 1.00 0.00 N ATOM 0 H ARG A 51 -27.939 -6.836 -7.268 1.00 0.00 H new ATOM 0 HA ARG A 51 -29.608 -8.918 -7.774 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -29.869 -6.078 -7.404 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -30.942 -6.520 -8.717 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -32.397 -7.492 -7.255 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -31.139 -8.562 -6.667 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -30.336 -6.820 -5.093 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -31.487 -5.666 -5.737 1.00 0.00 H new ATOM 0 HE ARG A 51 -33.305 -7.437 -4.945 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -32.319 -5.497 -2.842 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -31.850 -6.584 -1.531 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -31.754 -9.415 -3.583 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -31.532 -8.785 -1.947 1.00 0.00 H new ATOM 421 N GLY A 52 -29.809 -9.428 -10.206 1.00 0.00 N ATOM 422 CA GLY A 52 -29.985 -9.716 -11.655 1.00 0.00 C ATOM 423 C GLY A 52 -28.941 -8.954 -12.462 1.00 0.00 C ATOM 424 O GLY A 52 -29.257 -8.092 -13.257 1.00 0.00 O ATOM 0 H GLY A 52 -29.887 -10.237 -9.590 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -29.889 -10.786 -11.837 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -30.987 -9.427 -11.974 1.00 0.00 H new ATOM 425 N GLN A 53 -27.697 -9.276 -12.266 1.00 0.00 N ATOM 426 CA GLN A 53 -26.619 -8.589 -13.020 1.00 0.00 C ATOM 427 C GLN A 53 -25.645 -9.634 -13.544 1.00 0.00 C ATOM 428 O GLN A 53 -25.319 -10.583 -12.860 1.00 0.00 O ATOM 429 CB GLN A 53 -25.872 -7.633 -12.096 1.00 0.00 C ATOM 430 CG GLN A 53 -26.662 -6.329 -11.964 1.00 0.00 C ATOM 431 CD GLN A 53 -26.224 -5.591 -10.699 1.00 0.00 C ATOM 432 OE1 GLN A 53 -26.928 -5.588 -9.709 1.00 0.00 O ATOM 433 NE2 GLN A 53 -25.085 -4.955 -10.691 1.00 0.00 N ATOM 0 H GLN A 53 -27.379 -9.991 -11.611 1.00 0.00 H new ATOM 0 HA GLN A 53 -27.053 -8.027 -13.847 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -25.737 -8.089 -11.115 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -24.877 -7.430 -12.493 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -26.496 -5.701 -12.839 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -27.730 -6.542 -11.922 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -24.494 -4.957 -11.522 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -24.786 -4.455 -9.854 1.00 0.00 H new ATOM 434 N ALA A 54 -25.171 -9.481 -14.745 1.00 0.00 N ATOM 435 CA ALA A 54 -24.221 -10.491 -15.268 1.00 0.00 C ATOM 436 C ALA A 54 -23.309 -9.872 -16.337 1.00 0.00 C ATOM 437 O ALA A 54 -23.695 -8.963 -17.046 1.00 0.00 O ATOM 438 CB ALA A 54 -25.004 -11.655 -15.879 1.00 0.00 C ATOM 0 H ALA A 54 -25.396 -8.713 -15.377 1.00 0.00 H new ATOM 0 HA ALA A 54 -23.602 -10.850 -14.446 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -24.307 -12.399 -16.265 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -25.635 -12.110 -15.115 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -25.628 -11.286 -16.693 1.00 0.00 H new ATOM 439 N PHE A 55 -22.104 -10.370 -16.466 1.00 0.00 N ATOM 440 CA PHE A 55 -21.171 -9.821 -17.500 1.00 0.00 C ATOM 441 C PHE A 55 -21.062 -10.813 -18.663 1.00 0.00 C ATOM 442 O PHE A 55 -21.036 -12.015 -18.469 1.00 0.00 O ATOM 443 CB PHE A 55 -19.767 -9.588 -16.908 1.00 0.00 C ATOM 444 CG PHE A 55 -19.779 -9.762 -15.409 1.00 0.00 C ATOM 445 CD1 PHE A 55 -19.652 -11.042 -14.857 1.00 0.00 C ATOM 446 CD2 PHE A 55 -19.909 -8.646 -14.574 1.00 0.00 C ATOM 447 CE1 PHE A 55 -19.660 -11.210 -13.472 1.00 0.00 C ATOM 448 CE2 PHE A 55 -19.916 -8.815 -13.185 1.00 0.00 C ATOM 449 CZ PHE A 55 -19.793 -10.098 -12.635 1.00 0.00 C ATOM 0 H PHE A 55 -21.726 -11.131 -15.902 1.00 0.00 H new ATOM 0 HA PHE A 55 -21.567 -8.868 -17.849 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -19.059 -10.287 -17.354 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -19.424 -8.584 -17.159 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -19.548 -11.901 -15.504 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -20.004 -7.658 -15.000 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -19.564 -12.198 -13.047 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -20.016 -7.957 -12.537 1.00 0.00 H new ATOM 0 HZ PHE A 55 -19.801 -10.228 -11.563 1.00 0.00 H new ATOM 450 N VAL A 56 -20.995 -10.318 -19.871 1.00 0.00 N ATOM 451 CA VAL A 56 -20.884 -11.224 -21.052 1.00 0.00 C ATOM 452 C VAL A 56 -19.449 -11.193 -21.579 1.00 0.00 C ATOM 453 O VAL A 56 -18.956 -10.161 -21.982 1.00 0.00 O ATOM 454 CB VAL A 56 -21.823 -10.733 -22.156 1.00 0.00 C ATOM 455 CG1 VAL A 56 -21.865 -11.748 -23.298 1.00 0.00 C ATOM 456 CG2 VAL A 56 -23.227 -10.553 -21.589 1.00 0.00 C ATOM 0 H VAL A 56 -21.012 -9.322 -20.091 1.00 0.00 H new ATOM 0 HA VAL A 56 -21.152 -12.239 -20.758 1.00 0.00 H new ATOM 0 HB VAL A 56 -21.455 -9.780 -22.536 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -22.536 -11.390 -24.079 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -20.864 -11.874 -23.710 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -22.225 -12.705 -22.921 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -23.895 -10.203 -22.376 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -23.589 -11.506 -21.203 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -23.202 -9.821 -20.782 1.00 0.00 H new ATOM 457 N ILE A 57 -18.777 -12.310 -21.591 1.00 0.00 N ATOM 458 CA ILE A 57 -17.380 -12.323 -22.107 1.00 0.00 C ATOM 459 C ILE A 57 -17.394 -12.756 -23.573 1.00 0.00 C ATOM 460 O ILE A 57 -17.599 -13.912 -23.886 1.00 0.00 O ATOM 461 CB ILE A 57 -16.538 -13.305 -21.291 1.00 0.00 C ATOM 462 CG1 ILE A 57 -16.723 -13.020 -19.799 1.00 0.00 C ATOM 463 CG2 ILE A 57 -15.064 -13.138 -21.660 1.00 0.00 C ATOM 464 CD1 ILE A 57 -16.503 -11.530 -19.534 1.00 0.00 C ATOM 0 H ILE A 57 -19.132 -13.210 -21.268 1.00 0.00 H new ATOM 0 HA ILE A 57 -16.948 -11.326 -22.021 1.00 0.00 H new ATOM 0 HB ILE A 57 -16.856 -14.324 -21.509 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -17.724 -13.313 -19.483 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -16.019 -13.612 -19.215 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -14.462 -13.837 -21.079 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -14.930 -13.339 -22.723 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -14.747 -12.118 -21.441 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -16.635 -11.326 -18.471 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -15.493 -11.252 -19.834 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -17.225 -10.948 -20.107 1.00 0.00 H new ATOM 465 N PHE A 58 -17.181 -11.840 -24.479 1.00 0.00 N ATOM 466 CA PHE A 58 -17.189 -12.214 -25.921 1.00 0.00 C ATOM 467 C PHE A 58 -15.779 -12.607 -26.354 1.00 0.00 C ATOM 468 O PHE A 58 -14.803 -12.035 -25.911 1.00 0.00 O ATOM 469 CB PHE A 58 -17.637 -11.019 -26.765 1.00 0.00 C ATOM 470 CG PHE A 58 -19.121 -10.783 -26.599 1.00 0.00 C ATOM 471 CD1 PHE A 58 -20.034 -11.423 -27.447 1.00 0.00 C ATOM 472 CD2 PHE A 58 -19.581 -9.912 -25.605 1.00 0.00 C ATOM 473 CE1 PHE A 58 -21.406 -11.192 -27.298 1.00 0.00 C ATOM 474 CE2 PHE A 58 -20.954 -9.681 -25.457 1.00 0.00 C ATOM 475 CZ PHE A 58 -21.867 -10.322 -26.304 1.00 0.00 C ATOM 0 H PHE A 58 -17.003 -10.855 -24.284 1.00 0.00 H new ATOM 0 HA PHE A 58 -17.875 -13.049 -26.064 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -17.085 -10.128 -26.467 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -17.406 -11.200 -27.815 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -19.679 -12.094 -28.215 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -18.877 -9.418 -24.952 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -22.110 -11.686 -27.951 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -21.309 -9.009 -24.690 1.00 0.00 H new ATOM 0 HZ PHE A 58 -22.926 -10.145 -26.190 1.00 0.00 H new ATOM 476 N LYS A 59 -15.657 -13.564 -27.232 1.00 0.00 N ATOM 477 CA LYS A 59 -14.300 -13.958 -27.696 1.00 0.00 C ATOM 478 C LYS A 59 -13.662 -12.757 -28.397 1.00 0.00 C ATOM 479 O LYS A 59 -12.464 -12.698 -28.592 1.00 0.00 O ATOM 480 CB LYS A 59 -14.405 -15.127 -28.677 1.00 0.00 C ATOM 481 CG LYS A 59 -13.000 -15.619 -29.032 1.00 0.00 C ATOM 482 CD LYS A 59 -13.088 -17.011 -29.658 1.00 0.00 C ATOM 483 CE LYS A 59 -13.002 -18.071 -28.560 1.00 0.00 C ATOM 484 NZ LYS A 59 -12.643 -19.384 -29.166 1.00 0.00 N ATOM 0 H LYS A 59 -16.431 -14.085 -27.644 1.00 0.00 H new ATOM 0 HA LYS A 59 -13.691 -14.266 -26.846 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -14.985 -15.937 -28.234 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -14.931 -14.814 -29.579 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -12.526 -14.926 -29.727 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -12.378 -15.650 -28.138 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -14.024 -17.116 -30.207 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -12.280 -17.150 -30.376 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -12.255 -17.784 -27.820 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -13.956 -18.148 -28.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -12.584 -20.106 -28.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -13.371 -19.658 -29.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -11.723 -19.305 -29.645 1.00 0.00 H new ATOM 485 N GLU A 60 -14.463 -11.792 -28.770 1.00 0.00 N ATOM 486 CA GLU A 60 -13.923 -10.584 -29.453 1.00 0.00 C ATOM 487 C GLU A 60 -14.526 -9.329 -28.811 1.00 0.00 C ATOM 488 O GLU A 60 -15.616 -9.357 -28.275 1.00 0.00 O ATOM 489 CB GLU A 60 -14.292 -10.626 -30.936 1.00 0.00 C ATOM 490 CG GLU A 60 -13.049 -10.343 -31.782 1.00 0.00 C ATOM 491 CD GLU A 60 -12.003 -11.432 -31.536 1.00 0.00 C ATOM 492 OE1 GLU A 60 -12.343 -12.420 -30.905 1.00 0.00 O ATOM 493 OE2 GLU A 60 -10.882 -11.261 -31.983 1.00 0.00 O ATOM 0 H GLU A 60 -15.473 -11.791 -28.629 1.00 0.00 H new ATOM 0 HA GLU A 60 -12.838 -10.562 -29.352 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -14.703 -11.603 -31.191 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -15.066 -9.888 -31.150 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -13.315 -10.312 -32.839 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -12.638 -9.366 -31.528 1.00 0.00 H new ATOM 494 N VAL A 61 -13.819 -8.236 -28.853 1.00 0.00 N ATOM 495 CA VAL A 61 -14.339 -6.980 -28.239 1.00 0.00 C ATOM 496 C VAL A 61 -15.417 -6.358 -29.131 1.00 0.00 C ATOM 497 O VAL A 61 -16.191 -5.530 -28.695 1.00 0.00 O ATOM 498 CB VAL A 61 -13.190 -5.986 -28.082 1.00 0.00 C ATOM 499 CG1 VAL A 61 -13.639 -4.819 -27.203 1.00 0.00 C ATOM 500 CG2 VAL A 61 -11.996 -6.687 -27.431 1.00 0.00 C ATOM 0 H VAL A 61 -12.900 -8.156 -29.287 1.00 0.00 H new ATOM 0 HA VAL A 61 -14.772 -7.215 -27.267 1.00 0.00 H new ATOM 0 HB VAL A 61 -12.900 -5.609 -29.063 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -12.818 -4.110 -27.092 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -14.489 -4.320 -27.668 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -13.930 -5.194 -26.222 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -11.175 -5.979 -27.318 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -12.286 -7.065 -26.451 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -11.675 -7.518 -28.060 1.00 0.00 H new ATOM 501 N SER A 62 -15.468 -6.736 -30.377 1.00 0.00 N ATOM 502 CA SER A 62 -16.488 -6.149 -31.290 1.00 0.00 C ATOM 503 C SER A 62 -17.848 -6.813 -31.058 1.00 0.00 C ATOM 504 O SER A 62 -18.865 -6.333 -31.516 1.00 0.00 O ATOM 505 CB SER A 62 -16.052 -6.367 -32.737 1.00 0.00 C ATOM 506 OG SER A 62 -15.999 -5.114 -33.406 1.00 0.00 O ATOM 0 H SER A 62 -14.848 -7.425 -30.803 1.00 0.00 H new ATOM 0 HA SER A 62 -16.578 -5.082 -31.089 1.00 0.00 H new ATOM 0 HB2 SER A 62 -15.075 -6.849 -32.766 1.00 0.00 H new ATOM 0 HB3 SER A 62 -16.751 -7.033 -33.243 1.00 0.00 H new ATOM 0 HG SER A 62 -15.718 -5.251 -34.335 1.00 0.00 H new ATOM 507 N SER A 63 -17.881 -7.911 -30.353 1.00 0.00 N ATOM 508 CA SER A 63 -19.187 -8.591 -30.104 1.00 0.00 C ATOM 509 C SER A 63 -19.893 -7.919 -28.928 1.00 0.00 C ATOM 510 O SER A 63 -21.097 -7.758 -28.923 1.00 0.00 O ATOM 511 CB SER A 63 -18.955 -10.061 -29.769 1.00 0.00 C ATOM 512 OG SER A 63 -18.157 -10.655 -30.783 1.00 0.00 O ATOM 0 H SER A 63 -17.066 -8.365 -29.940 1.00 0.00 H new ATOM 0 HA SER A 63 -19.802 -8.517 -31.001 1.00 0.00 H new ATOM 0 HB2 SER A 63 -18.461 -10.151 -28.802 1.00 0.00 H new ATOM 0 HB3 SER A 63 -19.909 -10.582 -29.689 1.00 0.00 H new ATOM 0 HG SER A 63 -17.619 -11.377 -30.395 1.00 0.00 H new ATOM 513 N ALA A 64 -19.152 -7.511 -27.936 1.00 0.00 N ATOM 514 CA ALA A 64 -19.781 -6.835 -26.775 1.00 0.00 C ATOM 515 C ALA A 64 -20.350 -5.524 -27.270 1.00 0.00 C ATOM 516 O ALA A 64 -21.351 -5.049 -26.798 1.00 0.00 O ATOM 517 CB ALA A 64 -18.727 -6.541 -25.707 1.00 0.00 C ATOM 0 H ALA A 64 -18.139 -7.618 -27.882 1.00 0.00 H new ATOM 0 HA ALA A 64 -20.555 -7.469 -26.343 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -19.198 -6.045 -24.858 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -18.274 -7.476 -25.376 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -17.957 -5.893 -26.125 1.00 0.00 H new ATOM 518 N THR A 65 -19.696 -4.950 -28.231 1.00 0.00 N ATOM 519 CA THR A 65 -20.143 -3.672 -28.798 1.00 0.00 C ATOM 520 C THR A 65 -21.587 -3.791 -29.259 1.00 0.00 C ATOM 521 O THR A 65 -22.380 -2.887 -29.101 1.00 0.00 O ATOM 522 CB THR A 65 -19.255 -3.356 -29.992 1.00 0.00 C ATOM 523 OG1 THR A 65 -17.909 -3.208 -29.559 1.00 0.00 O ATOM 524 CG2 THR A 65 -19.727 -2.070 -30.643 1.00 0.00 C ATOM 0 H THR A 65 -18.849 -5.329 -28.654 1.00 0.00 H new ATOM 0 HA THR A 65 -20.078 -2.882 -28.050 1.00 0.00 H new ATOM 0 HB THR A 65 -19.312 -4.170 -30.714 1.00 0.00 H new ATOM 0 HG1 THR A 65 -17.517 -4.092 -29.402 1.00 0.00 H new ATOM 0 HG21 THR A 65 -19.092 -1.841 -31.499 1.00 0.00 H new ATOM 0 HG22 THR A 65 -20.758 -2.188 -30.977 1.00 0.00 H new ATOM 0 HG23 THR A 65 -19.671 -1.255 -29.921 1.00 0.00 H new ATOM 525 N ASN A 66 -21.929 -4.901 -29.833 1.00 0.00 N ATOM 526 CA ASN A 66 -23.316 -5.090 -30.316 1.00 0.00 C ATOM 527 C ASN A 66 -24.214 -5.461 -29.142 1.00 0.00 C ATOM 528 O ASN A 66 -25.214 -4.830 -28.885 1.00 0.00 O ATOM 529 CB ASN A 66 -23.328 -6.223 -31.338 1.00 0.00 C ATOM 530 CG ASN A 66 -23.057 -5.650 -32.726 1.00 0.00 C ATOM 531 OD1 ASN A 66 -23.806 -5.883 -33.654 1.00 0.00 O ATOM 532 ND2 ASN A 66 -22.007 -4.902 -32.902 1.00 0.00 N ATOM 0 H ASN A 66 -21.304 -5.691 -29.990 1.00 0.00 H new ATOM 0 HA ASN A 66 -23.680 -4.170 -30.773 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -22.572 -6.966 -31.084 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -24.292 -6.732 -31.323 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -21.810 -4.508 -33.822 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -21.381 -4.709 -32.120 1.00 0.00 H new ATOM 533 N ALA A 67 -23.855 -6.486 -28.437 1.00 0.00 N ATOM 534 CA ALA A 67 -24.673 -6.934 -27.277 1.00 0.00 C ATOM 535 C ALA A 67 -24.950 -5.764 -26.336 1.00 0.00 C ATOM 536 O ALA A 67 -25.863 -5.794 -25.537 1.00 0.00 O ATOM 537 CB ALA A 67 -23.896 -7.994 -26.509 1.00 0.00 C ATOM 0 H ALA A 67 -23.019 -7.043 -28.613 1.00 0.00 H new ATOM 0 HA ALA A 67 -25.618 -7.333 -27.644 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -24.485 -8.330 -25.656 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -23.690 -8.840 -27.164 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -22.955 -7.571 -26.156 1.00 0.00 H new ATOM 538 N LEU A 68 -24.133 -4.765 -26.396 1.00 0.00 N ATOM 539 CA LEU A 68 -24.276 -3.605 -25.491 1.00 0.00 C ATOM 540 C LEU A 68 -24.991 -2.454 -26.207 1.00 0.00 C ATOM 541 O LEU A 68 -25.771 -1.735 -25.615 1.00 0.00 O ATOM 542 CB LEU A 68 -22.846 -3.246 -25.083 1.00 0.00 C ATOM 543 CG LEU A 68 -22.627 -1.768 -24.773 1.00 0.00 C ATOM 544 CD1 LEU A 68 -22.833 -0.904 -26.020 1.00 0.00 C ATOM 545 CD2 LEU A 68 -23.522 -1.286 -23.654 1.00 0.00 C ATOM 0 H LEU A 68 -23.353 -4.701 -27.050 1.00 0.00 H new ATOM 0 HA LEU A 68 -24.886 -3.822 -24.614 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -22.574 -3.832 -24.205 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -22.169 -3.540 -25.885 1.00 0.00 H new ATOM 0 HG LEU A 68 -21.593 -1.667 -24.443 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -22.670 0.144 -25.768 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -22.125 -1.205 -26.792 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -23.850 -1.034 -26.389 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -23.333 -0.229 -23.466 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -24.565 -1.423 -23.938 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -23.314 -1.858 -22.750 1.00 0.00 H new ATOM 546 N ARG A 69 -24.721 -2.259 -27.470 1.00 0.00 N ATOM 547 CA ARG A 69 -25.377 -1.139 -28.204 1.00 0.00 C ATOM 548 C ARG A 69 -26.555 -1.667 -29.028 1.00 0.00 C ATOM 549 O ARG A 69 -27.101 -0.972 -29.860 1.00 0.00 O ATOM 550 CB ARG A 69 -24.361 -0.465 -29.132 1.00 0.00 C ATOM 551 CG ARG A 69 -24.081 -1.368 -30.336 1.00 0.00 C ATOM 552 CD ARG A 69 -24.724 -0.772 -31.590 1.00 0.00 C ATOM 553 NE ARG A 69 -23.978 0.452 -32.002 1.00 0.00 N ATOM 554 CZ ARG A 69 -24.029 0.859 -33.242 1.00 0.00 C ATOM 555 NH1 ARG A 69 -23.219 0.348 -34.130 1.00 0.00 N ATOM 556 NH2 ARG A 69 -24.889 1.776 -33.593 1.00 0.00 N ATOM 0 H ARG A 69 -24.077 -2.825 -28.023 1.00 0.00 H new ATOM 0 HA ARG A 69 -25.747 -0.412 -27.482 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -24.745 0.498 -29.469 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -23.436 -0.267 -28.591 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -23.006 -1.473 -30.482 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -24.476 -2.367 -30.153 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -24.716 -1.504 -32.398 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -25.767 -0.525 -31.394 1.00 0.00 H new ATOM 0 HE ARG A 69 -23.429 0.970 -31.316 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -22.547 -0.368 -33.855 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -23.258 0.665 -35.099 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -25.521 2.175 -32.899 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -24.929 2.094 -34.561 1.00 0.00 H new ATOM 557 N SER A 70 -26.962 -2.884 -28.795 1.00 0.00 N ATOM 558 CA SER A 70 -28.112 -3.444 -29.561 1.00 0.00 C ATOM 559 C SER A 70 -29.258 -3.722 -28.591 1.00 0.00 C ATOM 560 O SER A 70 -30.327 -3.152 -28.693 1.00 0.00 O ATOM 561 CB SER A 70 -27.694 -4.740 -30.254 1.00 0.00 C ATOM 562 OG SER A 70 -26.977 -4.428 -31.442 1.00 0.00 O ATOM 0 H SER A 70 -26.549 -3.515 -28.108 1.00 0.00 H new ATOM 0 HA SER A 70 -28.433 -2.730 -30.319 1.00 0.00 H new ATOM 0 HB2 SER A 70 -27.073 -5.338 -29.587 1.00 0.00 H new ATOM 0 HB3 SER A 70 -28.573 -5.338 -30.493 1.00 0.00 H new ATOM 0 HG SER A 70 -26.706 -5.258 -31.888 1.00 0.00 H new ATOM 563 N MET A 71 -29.038 -4.584 -27.640 1.00 0.00 N ATOM 564 CA MET A 71 -30.100 -4.892 -26.648 1.00 0.00 C ATOM 565 C MET A 71 -30.387 -3.643 -25.806 1.00 0.00 C ATOM 566 O MET A 71 -31.297 -3.627 -25.002 1.00 0.00 O ATOM 567 CB MET A 71 -29.635 -6.027 -25.734 1.00 0.00 C ATOM 568 CG MET A 71 -30.773 -7.032 -25.552 1.00 0.00 C ATOM 569 SD MET A 71 -30.229 -8.669 -26.093 1.00 0.00 S ATOM 570 CE MET A 71 -31.639 -9.008 -27.174 1.00 0.00 C ATOM 0 H MET A 71 -28.163 -5.091 -27.507 1.00 0.00 H new ATOM 0 HA MET A 71 -31.007 -5.197 -27.170 1.00 0.00 H new ATOM 0 HB2 MET A 71 -28.764 -6.521 -26.164 1.00 0.00 H new ATOM 0 HB3 MET A 71 -29.330 -5.628 -24.767 1.00 0.00 H new ATOM 0 HG2 MET A 71 -31.078 -7.066 -24.506 1.00 0.00 H new ATOM 0 HG3 MET A 71 -31.644 -6.719 -26.128 1.00 0.00 H new ATOM 0 HE1 MET A 71 -31.613 -10.051 -27.490 1.00 0.00 H new ATOM 0 HE2 MET A 71 -32.566 -8.816 -26.634 1.00 0.00 H new ATOM 0 HE3 MET A 71 -31.589 -8.362 -28.051 1.00 0.00 H new ATOM 571 N GLN A 72 -29.617 -2.596 -25.972 1.00 0.00 N ATOM 572 CA GLN A 72 -29.862 -1.364 -25.172 1.00 0.00 C ATOM 573 C GLN A 72 -31.334 -0.968 -25.297 1.00 0.00 C ATOM 574 O GLN A 72 -31.720 -0.251 -26.199 1.00 0.00 O ATOM 575 CB GLN A 72 -28.982 -0.229 -25.698 1.00 0.00 C ATOM 576 CG GLN A 72 -28.833 0.841 -24.617 1.00 0.00 C ATOM 577 CD GLN A 72 -27.468 0.698 -23.942 1.00 0.00 C ATOM 578 OE1 GLN A 72 -26.807 1.680 -23.666 1.00 0.00 O ATOM 579 NE2 GLN A 72 -27.014 -0.493 -23.661 1.00 0.00 N ATOM 0 H GLN A 72 -28.834 -2.544 -26.624 1.00 0.00 H new ATOM 0 HA GLN A 72 -29.620 -1.553 -24.126 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -28.003 -0.615 -25.981 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -29.425 0.204 -26.595 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -28.931 1.833 -25.057 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -29.628 0.740 -23.878 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -27.568 -1.318 -23.892 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -26.105 -0.599 -23.210 1.00 0.00 H new ATOM 580 N GLY A 73 -32.161 -1.433 -24.402 1.00 0.00 N ATOM 581 CA GLY A 73 -33.608 -1.087 -24.472 1.00 0.00 C ATOM 582 C GLY A 73 -34.405 -2.325 -24.888 1.00 0.00 C ATOM 583 O GLY A 73 -35.522 -2.528 -24.455 1.00 0.00 O ATOM 0 H GLY A 73 -31.897 -2.038 -23.625 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -33.954 -0.726 -23.504 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -33.767 -0.281 -25.188 1.00 0.00 H new ATOM 584 N PHE A 74 -33.835 -3.151 -25.726 1.00 0.00 N ATOM 585 CA PHE A 74 -34.545 -4.381 -26.176 1.00 0.00 C ATOM 586 C PHE A 74 -35.301 -5.005 -24.997 1.00 0.00 C ATOM 587 O PHE A 74 -35.002 -4.721 -23.853 1.00 0.00 O ATOM 588 CB PHE A 74 -33.521 -5.383 -26.701 1.00 0.00 C ATOM 589 CG PHE A 74 -33.382 -5.224 -28.196 1.00 0.00 C ATOM 590 CD1 PHE A 74 -33.236 -3.948 -28.754 1.00 0.00 C ATOM 591 CD2 PHE A 74 -33.396 -6.353 -29.025 1.00 0.00 C ATOM 592 CE1 PHE A 74 -33.105 -3.801 -30.140 1.00 0.00 C ATOM 593 CE2 PHE A 74 -33.264 -6.206 -30.411 1.00 0.00 C ATOM 594 CZ PHE A 74 -33.119 -4.929 -30.969 1.00 0.00 C ATOM 0 H PHE A 74 -32.902 -3.024 -26.119 1.00 0.00 H new ATOM 0 HA PHE A 74 -35.254 -4.123 -26.963 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -32.558 -5.223 -26.216 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -33.834 -6.399 -26.460 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -33.224 -3.077 -28.115 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -33.509 -7.337 -28.595 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -32.993 -2.817 -30.570 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -33.274 -7.077 -31.050 1.00 0.00 H new ATOM 0 HZ PHE A 74 -33.018 -4.815 -32.038 1.00 0.00 H new ATOM 595 N PRO A 75 -36.256 -5.841 -25.310 1.00 0.00 N ATOM 596 CA PRO A 75 -37.074 -6.528 -24.294 1.00 0.00 C ATOM 597 C PRO A 75 -36.293 -7.696 -23.684 1.00 0.00 C ATOM 598 O PRO A 75 -35.721 -8.506 -24.387 1.00 0.00 O ATOM 599 CB PRO A 75 -38.283 -7.032 -25.087 1.00 0.00 C ATOM 600 CG PRO A 75 -37.832 -7.109 -26.566 1.00 0.00 C ATOM 601 CD PRO A 75 -36.611 -6.181 -26.703 1.00 0.00 C ATOM 0 HA PRO A 75 -37.357 -5.884 -23.461 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -38.604 -8.010 -24.727 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -39.131 -6.357 -24.974 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -37.574 -8.132 -26.839 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -38.635 -6.794 -27.233 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -35.787 -6.680 -27.214 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -36.852 -5.289 -27.282 1.00 0.00 H new ATOM 602 N PHE A 76 -36.259 -7.788 -22.383 1.00 0.00 N ATOM 603 CA PHE A 76 -35.510 -8.899 -21.735 1.00 0.00 C ATOM 604 C PHE A 76 -35.996 -9.069 -20.295 1.00 0.00 C ATOM 605 O PHE A 76 -35.780 -8.220 -19.455 1.00 0.00 O ATOM 606 CB PHE A 76 -34.018 -8.565 -21.731 1.00 0.00 C ATOM 607 CG PHE A 76 -33.222 -9.797 -21.368 1.00 0.00 C ATOM 608 CD1 PHE A 76 -33.347 -10.963 -22.133 1.00 0.00 C ATOM 609 CD2 PHE A 76 -32.352 -9.772 -20.271 1.00 0.00 C ATOM 610 CE1 PHE A 76 -32.605 -12.101 -21.797 1.00 0.00 C ATOM 611 CE2 PHE A 76 -31.609 -10.910 -19.939 1.00 0.00 C ATOM 612 CZ PHE A 76 -31.736 -12.075 -20.702 1.00 0.00 C ATOM 0 H PHE A 76 -36.718 -7.141 -21.741 1.00 0.00 H new ATOM 0 HA PHE A 76 -35.678 -9.824 -22.286 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -33.714 -8.200 -22.712 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -33.816 -7.766 -21.017 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -34.015 -10.984 -22.981 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -32.254 -8.873 -19.680 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -32.704 -13.002 -22.385 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -30.937 -10.889 -19.093 1.00 0.00 H new ATOM 0 HZ PHE A 76 -31.163 -12.954 -20.446 1.00 0.00 H new ATOM 613 N TYR A 77 -36.643 -10.164 -20.005 1.00 0.00 N ATOM 614 CA TYR A 77 -37.133 -10.401 -18.619 1.00 0.00 C ATOM 615 C TYR A 77 -38.172 -9.336 -18.254 1.00 0.00 C ATOM 616 O TYR A 77 -38.214 -8.849 -17.141 1.00 0.00 O ATOM 617 CB TYR A 77 -35.952 -10.339 -17.642 1.00 0.00 C ATOM 618 CG TYR A 77 -35.102 -11.582 -17.800 1.00 0.00 C ATOM 619 CD1 TYR A 77 -34.664 -11.981 -19.071 1.00 0.00 C ATOM 620 CD2 TYR A 77 -34.756 -12.341 -16.675 1.00 0.00 C ATOM 621 CE1 TYR A 77 -33.887 -13.134 -19.215 1.00 0.00 C ATOM 622 CE2 TYR A 77 -33.977 -13.493 -16.821 1.00 0.00 C ATOM 623 CZ TYR A 77 -33.543 -13.891 -18.090 1.00 0.00 C ATOM 624 OH TYR A 77 -32.775 -15.028 -18.232 1.00 0.00 O ATOM 0 H TYR A 77 -36.854 -10.907 -20.671 1.00 0.00 H new ATOM 0 HA TYR A 77 -37.596 -11.386 -18.558 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -35.353 -9.449 -17.834 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -36.317 -10.262 -16.618 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -34.927 -11.396 -19.940 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -35.091 -12.036 -15.694 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -33.552 -13.440 -20.195 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -33.710 -14.077 -15.952 1.00 0.00 H new ATOM 0 HH TYR A 77 -33.006 -15.669 -17.527 1.00 0.00 H new ATOM 625 N ASP A 78 -39.020 -8.982 -19.184 1.00 0.00 N ATOM 626 CA ASP A 78 -40.068 -7.961 -18.899 1.00 0.00 C ATOM 627 C ASP A 78 -39.419 -6.601 -18.633 1.00 0.00 C ATOM 628 O ASP A 78 -40.073 -5.663 -18.222 1.00 0.00 O ATOM 629 CB ASP A 78 -40.871 -8.385 -17.671 1.00 0.00 C ATOM 630 CG ASP A 78 -42.290 -7.821 -17.765 1.00 0.00 C ATOM 631 OD1 ASP A 78 -42.425 -6.609 -17.756 1.00 0.00 O ATOM 632 OD2 ASP A 78 -43.216 -8.610 -17.846 1.00 0.00 O ATOM 0 H ASP A 78 -39.031 -9.358 -20.132 1.00 0.00 H new ATOM 0 HA ASP A 78 -40.728 -7.880 -19.763 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -40.905 -9.472 -17.604 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -40.385 -8.025 -16.764 1.00 0.00 H new ATOM 633 N LYS A 79 -38.141 -6.483 -18.860 1.00 0.00 N ATOM 634 CA LYS A 79 -37.463 -5.179 -18.613 1.00 0.00 C ATOM 635 C LYS A 79 -36.447 -4.907 -19.726 1.00 0.00 C ATOM 636 O LYS A 79 -35.979 -5.821 -20.373 1.00 0.00 O ATOM 637 CB LYS A 79 -36.733 -5.231 -17.270 1.00 0.00 C ATOM 638 CG LYS A 79 -37.737 -5.055 -16.129 1.00 0.00 C ATOM 639 CD LYS A 79 -36.982 -4.915 -14.806 1.00 0.00 C ATOM 640 CE LYS A 79 -37.226 -3.520 -14.224 1.00 0.00 C ATOM 641 NZ LYS A 79 -36.375 -3.332 -13.016 1.00 0.00 N ATOM 0 H LYS A 79 -37.538 -7.230 -19.205 1.00 0.00 H new ATOM 0 HA LYS A 79 -38.209 -4.384 -18.597 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -36.212 -6.183 -17.165 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -35.977 -4.447 -17.226 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -38.353 -4.173 -16.304 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -38.411 -5.911 -16.087 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -37.315 -5.678 -14.102 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -35.915 -5.073 -14.965 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -36.994 -2.758 -14.968 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -38.278 -3.401 -13.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -36.540 -2.385 -12.619 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -36.617 -4.052 -12.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -35.373 -3.428 -13.279 1.00 0.00 H new ATOM 642 N PRO A 80 -36.128 -3.650 -19.904 1.00 0.00 N ATOM 643 CA PRO A 80 -35.156 -3.215 -20.921 1.00 0.00 C ATOM 644 C PRO A 80 -33.738 -3.498 -20.423 1.00 0.00 C ATOM 645 O PRO A 80 -33.401 -3.200 -19.294 1.00 0.00 O ATOM 646 CB PRO A 80 -35.409 -1.709 -21.042 1.00 0.00 C ATOM 647 CG PRO A 80 -36.090 -1.275 -19.723 1.00 0.00 C ATOM 648 CD PRO A 80 -36.702 -2.547 -19.106 1.00 0.00 C ATOM 0 HA PRO A 80 -35.260 -3.728 -21.877 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -34.474 -1.169 -21.193 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -36.046 -1.489 -21.899 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -35.367 -0.824 -19.044 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -36.860 -0.527 -19.912 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -36.443 -2.642 -18.051 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -37.790 -2.535 -19.168 1.00 0.00 H new ATOM 649 N MET A 81 -32.910 -4.087 -21.238 1.00 0.00 N ATOM 650 CA MET A 81 -31.530 -4.398 -20.778 1.00 0.00 C ATOM 651 C MET A 81 -30.582 -3.252 -21.104 1.00 0.00 C ATOM 652 O MET A 81 -29.878 -3.283 -22.093 1.00 0.00 O ATOM 653 CB MET A 81 -31.021 -5.668 -21.462 1.00 0.00 C ATOM 654 CG MET A 81 -31.119 -6.838 -20.485 1.00 0.00 C ATOM 655 SD MET A 81 -29.969 -8.142 -20.990 1.00 0.00 S ATOM 656 CE MET A 81 -30.644 -8.396 -22.650 1.00 0.00 C ATOM 0 H MET A 81 -33.127 -4.365 -22.195 1.00 0.00 H new ATOM 0 HA MET A 81 -31.561 -4.544 -19.698 1.00 0.00 H new ATOM 0 HB2 MET A 81 -31.609 -5.875 -22.356 1.00 0.00 H new ATOM 0 HB3 MET A 81 -29.988 -5.533 -21.784 1.00 0.00 H new ATOM 0 HG2 MET A 81 -30.885 -6.503 -19.475 1.00 0.00 H new ATOM 0 HG3 MET A 81 -32.138 -7.225 -20.465 1.00 0.00 H new ATOM 0 HE1 MET A 81 -30.787 -9.462 -22.825 1.00 0.00 H new ATOM 0 HE2 MET A 81 -31.602 -7.883 -22.736 1.00 0.00 H new ATOM 0 HE3 MET A 81 -29.950 -7.996 -23.390 1.00 0.00 H new ATOM 657 N ARG A 82 -30.524 -2.260 -20.263 1.00 0.00 N ATOM 658 CA ARG A 82 -29.577 -1.144 -20.515 1.00 0.00 C ATOM 659 C ARG A 82 -28.172 -1.715 -20.347 1.00 0.00 C ATOM 660 O ARG A 82 -27.611 -1.701 -19.269 1.00 0.00 O ATOM 661 CB ARG A 82 -29.815 -0.022 -19.498 1.00 0.00 C ATOM 662 CG ARG A 82 -28.576 0.874 -19.412 1.00 0.00 C ATOM 663 CD ARG A 82 -28.980 2.258 -18.905 1.00 0.00 C ATOM 664 NE ARG A 82 -28.357 3.301 -19.765 1.00 0.00 N ATOM 665 CZ ARG A 82 -28.844 4.511 -19.777 1.00 0.00 C ATOM 666 NH1 ARG A 82 -30.133 4.693 -19.844 1.00 0.00 N ATOM 667 NH2 ARG A 82 -28.041 5.538 -19.727 1.00 0.00 N ATOM 0 H ARG A 82 -31.088 -2.174 -19.417 1.00 0.00 H new ATOM 0 HA ARG A 82 -29.712 -0.727 -21.513 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -30.682 0.569 -19.792 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -30.036 -0.447 -18.519 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -27.840 0.431 -18.742 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -28.106 0.957 -20.392 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -30.065 2.360 -18.919 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -28.661 2.386 -17.871 1.00 0.00 H new ATOM 0 HE ARG A 82 -27.550 3.070 -20.344 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -30.760 3.890 -19.887 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -30.515 5.639 -19.853 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -27.032 5.395 -19.679 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -28.422 6.484 -19.736 1.00 0.00 H new ATOM 668 N ILE A 83 -27.612 -2.251 -21.393 1.00 0.00 N ATOM 669 CA ILE A 83 -26.268 -2.857 -21.275 1.00 0.00 C ATOM 670 C ILE A 83 -25.233 -1.785 -20.974 1.00 0.00 C ATOM 671 O ILE A 83 -25.402 -0.622 -21.280 1.00 0.00 O ATOM 672 CB ILE A 83 -25.906 -3.568 -22.574 1.00 0.00 C ATOM 673 CG1 ILE A 83 -27.089 -4.417 -23.038 1.00 0.00 C ATOM 674 CG2 ILE A 83 -24.700 -4.473 -22.329 1.00 0.00 C ATOM 675 CD1 ILE A 83 -27.452 -4.036 -24.470 1.00 0.00 C ATOM 0 H ILE A 83 -28.030 -2.294 -22.322 1.00 0.00 H new ATOM 0 HA ILE A 83 -26.279 -3.579 -20.458 1.00 0.00 H new ATOM 0 HB ILE A 83 -25.666 -2.831 -23.340 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -26.835 -5.476 -22.984 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -27.944 -4.261 -22.380 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -24.435 -4.985 -23.254 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -23.856 -3.871 -21.993 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -24.947 -5.210 -21.565 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -28.296 -4.640 -24.804 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -27.723 -2.981 -24.508 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -26.597 -4.215 -25.122 1.00 0.00 H new ATOM 676 N GLN A 84 -24.158 -2.184 -20.372 1.00 0.00 N ATOM 677 CA GLN A 84 -23.082 -1.226 -20.031 1.00 0.00 C ATOM 678 C GLN A 84 -21.779 -2.004 -19.991 1.00 0.00 C ATOM 679 O GLN A 84 -21.572 -2.818 -19.113 1.00 0.00 O ATOM 680 CB GLN A 84 -23.326 -0.593 -18.652 1.00 0.00 C ATOM 681 CG GLN A 84 -24.793 -0.741 -18.223 1.00 0.00 C ATOM 682 CD GLN A 84 -24.860 -0.868 -16.701 1.00 0.00 C ATOM 683 OE1 GLN A 84 -24.802 0.116 -15.992 1.00 0.00 O ATOM 684 NE2 GLN A 84 -24.978 -2.053 -16.166 1.00 0.00 N ATOM 0 H GLN A 84 -23.976 -3.149 -20.097 1.00 0.00 H new ATOM 0 HA GLN A 84 -23.053 -0.427 -20.772 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -22.679 -1.065 -17.913 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -23.058 0.463 -18.682 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -25.370 0.122 -18.554 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -25.235 -1.619 -18.693 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -25.027 -2.879 -16.762 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -25.022 -2.153 -15.152 1.00 0.00 H new ATOM 685 N TYR A 85 -20.912 -1.779 -20.940 1.00 0.00 N ATOM 686 CA TYR A 85 -19.617 -2.523 -20.966 1.00 0.00 C ATOM 687 C TYR A 85 -19.131 -2.742 -19.531 1.00 0.00 C ATOM 688 O TYR A 85 -19.270 -1.882 -18.683 1.00 0.00 O ATOM 689 CB TYR A 85 -18.585 -1.726 -21.756 1.00 0.00 C ATOM 690 CG TYR A 85 -19.061 -1.567 -23.184 1.00 0.00 C ATOM 691 CD1 TYR A 85 -18.794 -2.565 -24.138 1.00 0.00 C ATOM 692 CD2 TYR A 85 -19.748 -0.406 -23.564 1.00 0.00 C ATOM 693 CE1 TYR A 85 -19.216 -2.399 -25.460 1.00 0.00 C ATOM 694 CE2 TYR A 85 -20.154 -0.234 -24.883 1.00 0.00 C ATOM 695 CZ TYR A 85 -19.893 -1.229 -25.838 1.00 0.00 C ATOM 696 OH TYR A 85 -20.297 -1.052 -27.145 1.00 0.00 O ATOM 0 H TYR A 85 -21.043 -1.112 -21.700 1.00 0.00 H new ATOM 0 HA TYR A 85 -19.757 -3.491 -21.447 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -18.437 -0.748 -21.299 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -17.622 -2.236 -21.736 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -18.263 -3.460 -23.849 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -19.963 0.357 -22.831 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -19.021 -3.170 -26.190 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -20.672 0.668 -25.173 1.00 0.00 H new ATOM 0 HH TYR A 85 -20.005 -0.171 -27.461 1.00 0.00 H new ATOM 697 N ALA A 86 -18.582 -3.888 -19.242 1.00 0.00 N ATOM 698 CA ALA A 86 -18.120 -4.155 -17.858 1.00 0.00 C ATOM 699 C ALA A 86 -16.942 -3.265 -17.539 1.00 0.00 C ATOM 700 O ALA A 86 -16.185 -2.879 -18.406 1.00 0.00 O ATOM 701 CB ALA A 86 -17.693 -5.618 -17.739 1.00 0.00 C ATOM 0 H ALA A 86 -18.435 -4.649 -19.905 1.00 0.00 H new ATOM 0 HA ALA A 86 -18.931 -3.951 -17.159 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -17.353 -5.816 -16.723 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -18.540 -6.264 -17.971 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -16.881 -5.818 -18.439 1.00 0.00 H new ATOM 702 N LYS A 87 -16.751 -2.977 -16.290 1.00 0.00 N ATOM 703 CA LYS A 87 -15.581 -2.162 -15.903 1.00 0.00 C ATOM 704 C LYS A 87 -14.439 -3.143 -15.696 1.00 0.00 C ATOM 705 O LYS A 87 -13.699 -3.070 -14.735 1.00 0.00 O ATOM 706 CB LYS A 87 -15.871 -1.407 -14.603 1.00 0.00 C ATOM 707 CG LYS A 87 -16.932 -0.336 -14.860 1.00 0.00 C ATOM 708 CD LYS A 87 -16.506 0.528 -16.049 1.00 0.00 C ATOM 709 CE LYS A 87 -15.053 0.968 -15.863 1.00 0.00 C ATOM 710 NZ LYS A 87 -14.739 2.064 -16.825 1.00 0.00 N ATOM 0 H LYS A 87 -17.354 -3.271 -15.522 1.00 0.00 H new ATOM 0 HA LYS A 87 -15.339 -1.421 -16.665 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -16.218 -2.101 -13.837 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -14.958 -0.946 -14.226 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -17.895 -0.804 -15.063 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -17.060 0.285 -13.973 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -16.611 -0.034 -16.977 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -17.154 1.401 -16.129 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -14.893 1.310 -14.840 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -14.383 0.124 -16.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -13.751 2.364 -16.699 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -14.876 1.722 -17.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -15.371 2.871 -16.650 1.00 0.00 H new ATOM 711 N THR A 88 -14.323 -4.094 -16.587 1.00 0.00 N ATOM 712 CA THR A 88 -13.280 -5.117 -16.455 1.00 0.00 C ATOM 713 C THR A 88 -13.706 -6.094 -15.365 1.00 0.00 C ATOM 714 O THR A 88 -13.567 -5.827 -14.188 1.00 0.00 O ATOM 715 CB THR A 88 -11.975 -4.463 -16.069 1.00 0.00 C ATOM 716 OG1 THR A 88 -11.805 -3.261 -16.811 1.00 0.00 O ATOM 717 CG2 THR A 88 -10.850 -5.435 -16.384 1.00 0.00 C ATOM 0 H THR A 88 -14.922 -4.194 -17.407 1.00 0.00 H new ATOM 0 HA THR A 88 -13.145 -5.643 -17.400 1.00 0.00 H new ATOM 0 HB THR A 88 -11.970 -4.217 -15.007 1.00 0.00 H new ATOM 0 HG1 THR A 88 -10.958 -2.837 -16.558 1.00 0.00 H new ATOM 0 HG21 THR A 88 -9.894 -4.986 -16.114 1.00 0.00 H new ATOM 0 HG22 THR A 88 -10.993 -6.354 -15.815 1.00 0.00 H new ATOM 0 HG23 THR A 88 -10.855 -5.664 -17.450 1.00 0.00 H new ATOM 718 N ASP A 89 -14.249 -7.212 -15.745 1.00 0.00 N ATOM 719 CA ASP A 89 -14.711 -8.188 -14.730 1.00 0.00 C ATOM 720 C ASP A 89 -14.033 -9.537 -14.945 1.00 0.00 C ATOM 721 O ASP A 89 -14.497 -10.557 -14.476 1.00 0.00 O ATOM 722 CB ASP A 89 -16.212 -8.358 -14.870 1.00 0.00 C ATOM 723 CG ASP A 89 -16.887 -6.985 -14.864 1.00 0.00 C ATOM 724 OD1 ASP A 89 -16.265 -6.043 -14.401 1.00 0.00 O ATOM 725 OD2 ASP A 89 -18.014 -6.899 -15.323 1.00 0.00 O ATOM 0 H ASP A 89 -14.392 -7.491 -16.715 1.00 0.00 H new ATOM 0 HA ASP A 89 -14.458 -7.822 -13.735 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -16.444 -8.884 -15.796 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -16.597 -8.967 -14.052 1.00 0.00 H new ATOM 726 N SER A 90 -12.946 -9.556 -15.652 1.00 0.00 N ATOM 727 CA SER A 90 -12.244 -10.847 -15.889 1.00 0.00 C ATOM 728 C SER A 90 -11.917 -11.483 -14.536 1.00 0.00 C ATOM 729 O SER A 90 -12.058 -12.676 -14.348 1.00 0.00 O ATOM 730 CB SER A 90 -10.957 -10.599 -16.674 1.00 0.00 C ATOM 731 OG SER A 90 -10.003 -11.598 -16.341 1.00 0.00 O ATOM 0 H SER A 90 -12.511 -8.737 -16.077 1.00 0.00 H new ATOM 0 HA SER A 90 -12.881 -11.517 -16.466 1.00 0.00 H new ATOM 0 HB2 SER A 90 -11.161 -10.618 -17.745 1.00 0.00 H new ATOM 0 HB3 SER A 90 -10.561 -9.610 -16.442 1.00 0.00 H new ATOM 0 HG SER A 90 -9.177 -11.442 -16.844 1.00 0.00 H new ATOM 732 N ASP A 91 -11.510 -10.698 -13.576 1.00 0.00 N ATOM 733 CA ASP A 91 -11.225 -11.276 -12.237 1.00 0.00 C ATOM 734 C ASP A 91 -12.523 -11.916 -11.756 1.00 0.00 C ATOM 735 O ASP A 91 -12.536 -12.942 -11.105 1.00 0.00 O ATOM 736 CB ASP A 91 -10.801 -10.167 -11.271 1.00 0.00 C ATOM 737 CG ASP A 91 -10.489 -10.772 -9.901 1.00 0.00 C ATOM 738 OD1 ASP A 91 -10.185 -11.952 -9.851 1.00 0.00 O ATOM 739 OD2 ASP A 91 -10.557 -10.042 -8.925 1.00 0.00 O ATOM 0 H ASP A 91 -11.364 -9.692 -13.661 1.00 0.00 H new ATOM 0 HA ASP A 91 -10.418 -12.007 -12.285 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -9.924 -9.648 -11.659 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -11.595 -9.426 -11.180 1.00 0.00 H new ATOM 740 N ILE A 92 -13.620 -11.308 -12.114 1.00 0.00 N ATOM 741 CA ILE A 92 -14.957 -11.842 -11.741 1.00 0.00 C ATOM 742 C ILE A 92 -15.166 -13.175 -12.469 1.00 0.00 C ATOM 743 O ILE A 92 -15.804 -14.077 -11.966 1.00 0.00 O ATOM 744 CB ILE A 92 -16.020 -10.813 -12.163 1.00 0.00 C ATOM 745 CG1 ILE A 92 -16.923 -10.488 -10.976 1.00 0.00 C ATOM 746 CG2 ILE A 92 -16.878 -11.338 -13.322 1.00 0.00 C ATOM 747 CD1 ILE A 92 -17.589 -9.133 -11.217 1.00 0.00 C ATOM 0 H ILE A 92 -13.645 -10.447 -12.660 1.00 0.00 H new ATOM 0 HA ILE A 92 -15.034 -12.012 -10.667 1.00 0.00 H new ATOM 0 HB ILE A 92 -15.502 -9.914 -12.497 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -17.679 -11.263 -10.854 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -16.341 -10.463 -10.055 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -17.619 -10.587 -13.596 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -16.240 -11.548 -14.181 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -17.385 -12.252 -13.014 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -18.237 -8.891 -10.374 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -16.823 -8.364 -11.319 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -18.183 -9.177 -12.130 1.00 0.00 H new ATOM 748 N ILE A 93 -14.615 -13.307 -13.645 1.00 0.00 N ATOM 749 CA ILE A 93 -14.758 -14.577 -14.383 1.00 0.00 C ATOM 750 C ILE A 93 -14.133 -15.636 -13.498 1.00 0.00 C ATOM 751 O ILE A 93 -14.598 -16.755 -13.409 1.00 0.00 O ATOM 752 CB ILE A 93 -14.032 -14.469 -15.735 1.00 0.00 C ATOM 753 CG1 ILE A 93 -15.041 -14.094 -16.821 1.00 0.00 C ATOM 754 CG2 ILE A 93 -13.372 -15.800 -16.104 1.00 0.00 C ATOM 755 CD1 ILE A 93 -15.437 -12.625 -16.662 1.00 0.00 C ATOM 0 H ILE A 93 -14.073 -12.585 -14.120 1.00 0.00 H new ATOM 0 HA ILE A 93 -15.797 -14.822 -14.601 1.00 0.00 H new ATOM 0 HB ILE A 93 -13.260 -13.704 -15.655 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -14.609 -14.261 -17.808 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -15.923 -14.730 -16.748 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -12.864 -15.701 -17.064 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -12.647 -16.072 -15.337 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -14.134 -16.576 -16.175 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -16.156 -12.356 -17.436 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -15.886 -12.473 -15.680 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -14.551 -11.997 -16.756 1.00 0.00 H new ATOM 756 N ALA A 94 -13.094 -15.267 -12.803 1.00 0.00 N ATOM 757 CA ALA A 94 -12.466 -16.231 -11.884 1.00 0.00 C ATOM 758 C ALA A 94 -13.413 -16.405 -10.706 1.00 0.00 C ATOM 759 O ALA A 94 -13.474 -17.445 -10.086 1.00 0.00 O ATOM 760 CB ALA A 94 -11.111 -15.724 -11.400 1.00 0.00 C ATOM 0 H ALA A 94 -12.661 -14.344 -12.837 1.00 0.00 H new ATOM 0 HA ALA A 94 -12.291 -17.179 -12.392 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -10.670 -16.455 -10.723 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -10.451 -15.576 -12.255 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -11.243 -14.777 -10.876 1.00 0.00 H new ATOM 761 N LYS A 95 -14.174 -15.388 -10.404 1.00 0.00 N ATOM 762 CA LYS A 95 -15.131 -15.502 -9.303 1.00 0.00 C ATOM 763 C LYS A 95 -15.903 -16.804 -9.492 1.00 0.00 C ATOM 764 O LYS A 95 -16.231 -17.494 -8.549 1.00 0.00 O ATOM 765 CB LYS A 95 -16.097 -14.322 -9.339 1.00 0.00 C ATOM 766 CG LYS A 95 -16.883 -14.266 -8.028 1.00 0.00 C ATOM 767 CD LYS A 95 -16.216 -13.272 -7.075 1.00 0.00 C ATOM 768 CE LYS A 95 -14.751 -13.660 -6.879 1.00 0.00 C ATOM 769 NZ LYS A 95 -14.141 -12.788 -5.835 1.00 0.00 N ATOM 0 H LYS A 95 -14.163 -14.487 -10.882 1.00 0.00 H new ATOM 0 HA LYS A 95 -14.614 -15.500 -8.344 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -15.547 -13.392 -9.486 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -16.781 -14.424 -10.181 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -17.913 -13.965 -8.222 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -16.920 -15.255 -7.571 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -16.285 -12.262 -7.479 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -16.734 -13.268 -6.116 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -14.677 -14.706 -6.582 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -14.207 -13.556 -7.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -13.144 -13.052 -5.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -14.199 -11.794 -6.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -14.654 -12.909 -4.939 1.00 0.00 H new ATOM 770 N MET A 96 -16.180 -17.151 -10.725 1.00 0.00 N ATOM 771 CA MET A 96 -16.908 -18.416 -11.006 1.00 0.00 C ATOM 772 C MET A 96 -15.928 -19.583 -10.867 1.00 0.00 C ATOM 773 O MET A 96 -16.291 -20.673 -10.474 1.00 0.00 O ATOM 774 CB MET A 96 -17.457 -18.382 -12.433 1.00 0.00 C ATOM 775 CG MET A 96 -18.098 -17.021 -12.709 1.00 0.00 C ATOM 776 SD MET A 96 -19.610 -16.854 -11.729 1.00 0.00 S ATOM 777 CE MET A 96 -19.036 -15.511 -10.660 1.00 0.00 C ATOM 0 H MET A 96 -15.929 -16.606 -11.550 1.00 0.00 H new ATOM 0 HA MET A 96 -17.735 -18.535 -10.306 1.00 0.00 H new ATOM 0 HB2 MET A 96 -16.654 -18.567 -13.146 1.00 0.00 H new ATOM 0 HB3 MET A 96 -18.193 -19.175 -12.568 1.00 0.00 H new ATOM 0 HG2 MET A 96 -17.400 -16.222 -12.459 1.00 0.00 H new ATOM 0 HG3 MET A 96 -18.327 -16.924 -13.770 1.00 0.00 H new ATOM 0 HE1 MET A 96 -19.895 -14.971 -10.261 1.00 0.00 H new ATOM 0 HE2 MET A 96 -18.453 -15.925 -9.837 1.00 0.00 H new ATOM 0 HE3 MET A 96 -18.414 -14.827 -11.237 1.00 0.00 H new ATOM 778 N LYS A 97 -14.681 -19.354 -11.201 1.00 0.00 N ATOM 779 CA LYS A 97 -13.657 -20.414 -11.113 1.00 0.00 C ATOM 780 C LYS A 97 -13.852 -21.267 -9.866 1.00 0.00 C ATOM 781 O LYS A 97 -13.447 -22.411 -9.797 1.00 0.00 O ATOM 782 CB LYS A 97 -12.259 -19.780 -11.124 1.00 0.00 C ATOM 783 CG LYS A 97 -11.841 -19.384 -9.707 1.00 0.00 C ATOM 784 CD LYS A 97 -10.801 -20.380 -9.199 1.00 0.00 C ATOM 785 CE LYS A 97 -11.311 -21.063 -7.927 1.00 0.00 C ATOM 786 NZ LYS A 97 -10.195 -21.182 -6.947 1.00 0.00 N ATOM 0 H LYS A 97 -14.334 -18.455 -11.536 1.00 0.00 H new ATOM 0 HA LYS A 97 -13.759 -21.070 -11.977 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -11.537 -20.483 -11.540 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -12.256 -18.902 -11.769 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -11.429 -18.375 -9.704 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -12.708 -19.376 -9.047 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -10.595 -21.127 -9.966 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -9.862 -19.866 -8.995 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -12.129 -20.487 -7.495 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -11.707 -22.050 -8.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -10.557 -21.015 -5.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -9.785 -22.136 -7.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -9.462 -20.478 -7.168 1.00 0.00 H new ATOM 787 N GLY A 98 -14.454 -20.697 -8.889 1.00 0.00 N ATOM 788 CA GLY A 98 -14.694 -21.411 -7.607 1.00 0.00 C ATOM 789 C GLY A 98 -14.389 -20.436 -6.480 1.00 0.00 C ATOM 790 O GLY A 98 -13.714 -20.759 -5.523 1.00 0.00 O ATOM 0 H GLY A 98 -14.805 -19.739 -8.913 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -15.726 -21.756 -7.547 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -14.058 -22.293 -7.534 1.00 0.00 H new ATOM 791 N THR A 99 -14.862 -19.229 -6.613 1.00 0.00 N ATOM 792 CA THR A 99 -14.587 -18.197 -5.583 1.00 0.00 C ATOM 793 C THR A 99 -13.080 -17.968 -5.528 1.00 0.00 C ATOM 794 O THR A 99 -12.553 -17.444 -4.567 1.00 0.00 O ATOM 795 CB THR A 99 -15.095 -18.669 -4.218 1.00 0.00 C ATOM 796 OG1 THR A 99 -14.124 -19.513 -3.616 1.00 0.00 O ATOM 797 CG2 THR A 99 -16.406 -19.435 -4.402 1.00 0.00 C ATOM 0 H THR A 99 -15.431 -18.913 -7.398 1.00 0.00 H new ATOM 0 HA THR A 99 -15.099 -17.269 -5.837 1.00 0.00 H new ATOM 0 HB THR A 99 -15.268 -17.807 -3.574 1.00 0.00 H new ATOM 0 HG1 THR A 99 -13.900 -20.244 -4.229 1.00 0.00 H new ATOM 0 HG21 THR A 99 -16.770 -19.772 -3.431 1.00 0.00 H new ATOM 0 HG22 THR A 99 -17.148 -18.781 -4.861 1.00 0.00 H new ATOM 0 HG23 THR A 99 -16.236 -20.298 -5.045 1.00 0.00 H new ATOM 798 N PHE A 100 -12.379 -18.361 -6.562 1.00 0.00 N ATOM 799 CA PHE A 100 -10.904 -18.167 -6.570 1.00 0.00 C ATOM 800 C PHE A 100 -10.291 -18.883 -5.367 1.00 0.00 C ATOM 801 O PHE A 100 -10.980 -19.267 -4.442 1.00 0.00 O ATOM 802 CB PHE A 100 -10.585 -16.673 -6.493 1.00 0.00 C ATOM 803 CG PHE A 100 -9.183 -16.435 -6.996 1.00 0.00 C ATOM 804 CD1 PHE A 100 -8.958 -16.222 -8.361 1.00 0.00 C ATOM 805 CD2 PHE A 100 -8.109 -16.428 -6.098 1.00 0.00 C ATOM 806 CE1 PHE A 100 -7.658 -16.002 -8.829 1.00 0.00 C ATOM 807 CE2 PHE A 100 -6.808 -16.208 -6.568 1.00 0.00 C ATOM 808 CZ PHE A 100 -6.583 -15.995 -7.933 1.00 0.00 C ATOM 0 H PHE A 100 -12.765 -18.805 -7.395 1.00 0.00 H new ATOM 0 HA PHE A 100 -10.488 -18.579 -7.489 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -11.299 -16.106 -7.090 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -10.679 -16.322 -5.465 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -9.787 -16.227 -9.053 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -8.283 -16.592 -5.045 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -7.484 -15.838 -9.882 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -5.978 -16.203 -5.877 1.00 0.00 H new ATOM 0 HZ PHE A 100 -5.580 -15.825 -8.295 1.00 0.00 H new ATOM 809 N VAL A 101 -9.000 -19.067 -5.371 1.00 0.00 N ATOM 810 CA VAL A 101 -8.340 -19.759 -4.234 1.00 0.00 C ATOM 811 C VAL A 101 -8.384 -18.863 -2.994 1.00 0.00 C ATOM 812 O VAL A 101 -8.293 -17.656 -3.093 1.00 0.00 O ATOM 813 CB VAL A 101 -6.890 -20.052 -4.611 1.00 0.00 C ATOM 814 CG1 VAL A 101 -6.119 -20.525 -3.376 1.00 0.00 C ATOM 815 CG2 VAL A 101 -6.862 -21.143 -5.682 1.00 0.00 C ATOM 0 H VAL A 101 -8.373 -18.766 -6.117 1.00 0.00 H new ATOM 0 HA VAL A 101 -8.858 -20.693 -4.014 1.00 0.00 H new ATOM 0 HB VAL A 101 -6.423 -19.146 -4.997 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -5.085 -20.733 -3.650 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -6.143 -19.748 -2.612 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -6.580 -21.432 -2.985 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -5.829 -21.357 -5.956 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -7.329 -22.047 -5.292 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -7.408 -20.803 -6.562 1.00 0.00 H new ATOM 816 N GLU A 102 -8.545 -19.456 -1.835 1.00 0.00 N ATOM 817 CA GLU A 102 -8.617 -18.687 -0.568 1.00 0.00 C ATOM 818 C GLU A 102 -7.819 -17.383 -0.670 1.00 0.00 C ATOM 819 O GLU A 102 -8.335 -16.359 -1.071 1.00 0.00 O ATOM 820 CB GLU A 102 -8.053 -19.538 0.572 1.00 0.00 C ATOM 821 CG GLU A 102 -9.175 -20.377 1.185 1.00 0.00 C ATOM 822 CD GLU A 102 -8.613 -21.221 2.332 1.00 0.00 C ATOM 823 OE1 GLU A 102 -7.544 -20.888 2.816 1.00 0.00 O ATOM 824 OE2 GLU A 102 -9.261 -22.185 2.704 1.00 0.00 O ATOM 0 H GLU A 102 -8.631 -20.466 -1.720 1.00 0.00 H new ATOM 0 HA GLU A 102 -9.660 -18.439 -0.373 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -7.261 -20.187 0.198 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -7.607 -18.897 1.332 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -9.970 -19.728 1.553 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -9.616 -21.023 0.426 1.00 0.00 H new ATOM 825 N ARG A 103 -6.566 -17.413 -0.308 1.00 0.00 N ATOM 826 CA ARG A 103 -5.741 -16.176 -0.384 1.00 0.00 C ATOM 827 C ARG A 103 -4.678 -16.337 -1.473 1.00 0.00 C ATOM 828 O ARG A 103 -4.758 -15.736 -2.526 1.00 0.00 O ATOM 829 CB ARG A 103 -5.057 -15.935 0.964 1.00 0.00 C ATOM 830 CG ARG A 103 -5.936 -15.027 1.827 1.00 0.00 C ATOM 831 CD ARG A 103 -5.251 -14.782 3.173 1.00 0.00 C ATOM 832 NE ARG A 103 -6.230 -14.193 4.129 1.00 0.00 N ATOM 833 CZ ARG A 103 -5.952 -14.148 5.404 1.00 0.00 C ATOM 834 NH1 ARG A 103 -4.888 -13.516 5.818 1.00 0.00 N ATOM 835 NH2 ARG A 103 -6.739 -14.735 6.264 1.00 0.00 N ATOM 0 H ARG A 103 -6.079 -18.240 0.037 1.00 0.00 H new ATOM 0 HA ARG A 103 -6.381 -15.327 -0.624 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -4.887 -16.884 1.472 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -4.080 -15.475 0.811 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -6.109 -14.079 1.317 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -6.911 -15.488 1.982 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -4.858 -15.719 3.569 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -4.403 -14.110 3.044 1.00 0.00 H new ATOM 0 HE ARG A 103 -7.118 -13.825 3.787 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -4.273 -13.057 5.146 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -4.671 -13.481 6.814 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -7.571 -15.229 5.940 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -6.522 -14.700 7.260 1.00 0.00 H new ATOM 836 N ASP A 104 -3.680 -17.143 -1.228 1.00 0.00 N ATOM 837 CA ASP A 104 -2.614 -17.339 -2.249 1.00 0.00 C ATOM 838 C ASP A 104 -3.050 -18.417 -3.244 1.00 0.00 C ATOM 839 O ASP A 104 -4.210 -18.772 -3.321 1.00 0.00 O ATOM 840 CB ASP A 104 -1.321 -17.779 -1.560 1.00 0.00 C ATOM 841 CG ASP A 104 -0.133 -17.048 -2.189 1.00 0.00 C ATOM 842 OD1 ASP A 104 -0.069 -15.837 -2.054 1.00 0.00 O ATOM 843 OD2 ASP A 104 0.691 -17.711 -2.797 1.00 0.00 O ATOM 0 H ASP A 104 -3.558 -17.673 -0.365 1.00 0.00 H new ATOM 0 HA ASP A 104 -2.444 -16.401 -2.779 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -1.372 -17.561 -0.493 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -1.192 -18.857 -1.659 1.00 0.00 H new ATOM 844 N ARG A 105 -2.131 -18.939 -4.007 1.00 0.00 N ATOM 845 CA ARG A 105 -2.493 -19.992 -4.995 1.00 0.00 C ATOM 846 C ARG A 105 -2.536 -21.353 -4.297 1.00 0.00 C ATOM 847 O ARG A 105 -3.539 -22.038 -4.316 1.00 0.00 O ATOM 848 CB ARG A 105 -1.448 -20.025 -6.112 1.00 0.00 C ATOM 849 CG ARG A 105 -1.864 -19.068 -7.232 1.00 0.00 C ATOM 850 CD ARG A 105 -3.148 -19.578 -7.889 1.00 0.00 C ATOM 851 NE ARG A 105 -3.049 -19.409 -9.365 1.00 0.00 N ATOM 852 CZ ARG A 105 -4.042 -19.767 -10.131 1.00 0.00 C ATOM 853 NH1 ARG A 105 -4.228 -21.028 -10.408 1.00 0.00 N ATOM 854 NH2 ARG A 105 -4.851 -18.865 -10.616 1.00 0.00 N ATOM 0 H ARG A 105 -1.144 -18.682 -3.989 1.00 0.00 H new ATOM 0 HA ARG A 105 -3.472 -19.770 -5.420 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -0.472 -19.739 -5.719 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -1.350 -21.038 -6.503 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -2.022 -18.067 -6.830 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -1.069 -18.992 -7.974 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -3.304 -20.628 -7.642 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -4.008 -19.029 -7.506 1.00 0.00 H new ATOM 0 HE ARG A 105 -2.204 -19.013 -9.777 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -3.597 -21.733 -10.026 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -5.004 -21.309 -11.007 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -4.707 -17.879 -10.396 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -5.627 -19.146 -11.215 1.00 0.00 H new ATOM 855 N LYS A 106 -1.456 -21.750 -3.680 1.00 0.00 N ATOM 856 CA LYS A 106 -1.438 -23.067 -2.985 1.00 0.00 C ATOM 857 C LYS A 106 -1.680 -24.181 -4.006 1.00 0.00 C ATOM 858 O LYS A 106 -2.580 -24.106 -4.818 1.00 0.00 O ATOM 859 CB LYS A 106 -2.539 -23.101 -1.922 1.00 0.00 C ATOM 860 CG LYS A 106 -2.610 -21.745 -1.219 1.00 0.00 C ATOM 861 CD LYS A 106 -3.463 -21.870 0.045 1.00 0.00 C ATOM 862 CE LYS A 106 -4.060 -20.506 0.395 1.00 0.00 C ATOM 863 NZ LYS A 106 -4.343 -20.451 1.857 1.00 0.00 N ATOM 0 H LYS A 106 -0.587 -21.219 -3.628 1.00 0.00 H new ATOM 0 HA LYS A 106 -0.470 -23.213 -2.507 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -3.498 -23.334 -2.384 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -2.335 -23.889 -1.197 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -1.607 -21.404 -0.962 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -3.039 -20.999 -1.888 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -4.259 -22.598 -0.111 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -2.855 -22.236 0.872 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -3.368 -19.711 0.117 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -4.977 -20.342 -0.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -4.749 -19.524 2.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -5.019 -21.201 2.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -3.459 -20.590 2.387 1.00 0.00 H new ATOM 864 N ARG A 107 -0.880 -25.211 -3.976 1.00 0.00 N ATOM 865 CA ARG A 107 -1.066 -26.324 -4.950 1.00 0.00 C ATOM 866 C ARG A 107 -1.607 -27.558 -4.225 1.00 0.00 C ATOM 867 O ARG A 107 -1.100 -28.651 -4.379 1.00 0.00 O ATOM 868 CB ARG A 107 0.277 -26.664 -5.600 1.00 0.00 C ATOM 869 CG ARG A 107 1.347 -26.811 -4.516 1.00 0.00 C ATOM 870 CD ARG A 107 2.251 -25.576 -4.518 1.00 0.00 C ATOM 871 NE ARG A 107 3.613 -25.960 -4.984 1.00 0.00 N ATOM 872 CZ ARG A 107 4.566 -25.068 -5.026 1.00 0.00 C ATOM 873 NH1 ARG A 107 4.365 -23.868 -4.550 1.00 0.00 N ATOM 874 NH2 ARG A 107 5.723 -25.376 -5.545 1.00 0.00 N ATOM 0 H ARG A 107 -0.107 -25.330 -3.321 1.00 0.00 H new ATOM 0 HA ARG A 107 -1.775 -26.016 -5.718 1.00 0.00 H new ATOM 0 HB2 ARG A 107 0.193 -27.589 -6.171 1.00 0.00 H new ATOM 0 HB3 ARG A 107 0.561 -25.881 -6.303 1.00 0.00 H new ATOM 0 HG2 ARG A 107 0.877 -26.929 -3.540 1.00 0.00 H new ATOM 0 HG3 ARG A 107 1.939 -27.708 -4.695 1.00 0.00 H new ATOM 0 HD2 ARG A 107 1.835 -24.808 -5.170 1.00 0.00 H new ATOM 0 HD3 ARG A 107 2.304 -25.149 -3.516 1.00 0.00 H new ATOM 0 HE ARG A 107 3.801 -26.921 -5.271 1.00 0.00 H new ATOM 0 HH11 ARG A 107 3.461 -23.625 -4.144 1.00 0.00 H new ATOM 0 HH12 ARG A 107 5.112 -23.174 -4.585 1.00 0.00 H new ATOM 0 HH21 ARG A 107 5.882 -26.312 -5.917 1.00 0.00 H new ATOM 0 HH22 ARG A 107 6.468 -24.680 -5.579 1.00 0.00 H new ATOM 875 N GLU A 108 -2.635 -27.395 -3.438 1.00 0.00 N ATOM 876 CA GLU A 108 -3.204 -28.563 -2.709 1.00 0.00 C ATOM 877 C GLU A 108 -3.640 -29.628 -3.718 1.00 0.00 C ATOM 878 O GLU A 108 -4.453 -29.378 -4.586 1.00 0.00 O ATOM 879 CB GLU A 108 -4.413 -28.113 -1.884 1.00 0.00 C ATOM 880 CG GLU A 108 -5.446 -27.463 -2.804 1.00 0.00 C ATOM 881 CD GLU A 108 -5.740 -26.042 -2.318 1.00 0.00 C ATOM 882 OE1 GLU A 108 -5.846 -25.859 -1.116 1.00 0.00 O ATOM 883 OE2 GLU A 108 -5.857 -25.162 -3.155 1.00 0.00 O ATOM 0 H GLU A 108 -3.104 -26.505 -3.269 1.00 0.00 H new ATOM 0 HA GLU A 108 -2.448 -28.980 -2.043 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -4.854 -28.967 -1.371 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -4.099 -27.406 -1.116 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -5.073 -27.439 -3.828 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -6.363 -28.053 -2.813 1.00 0.00 H new ATOM 884 N LYS A 109 -3.103 -30.812 -3.614 1.00 0.00 N ATOM 885 CA LYS A 109 -3.483 -31.891 -4.569 1.00 0.00 C ATOM 886 C LYS A 109 -4.963 -32.237 -4.389 1.00 0.00 C ATOM 887 O LYS A 109 -5.680 -31.577 -3.665 1.00 0.00 O ATOM 888 CB LYS A 109 -2.632 -33.133 -4.300 1.00 0.00 C ATOM 889 CG LYS A 109 -1.329 -33.044 -5.097 1.00 0.00 C ATOM 890 CD LYS A 109 -1.043 -34.392 -5.761 1.00 0.00 C ATOM 891 CE LYS A 109 -0.762 -34.179 -7.250 1.00 0.00 C ATOM 892 NZ LYS A 109 0.499 -34.881 -7.624 1.00 0.00 N ATOM 0 H LYS A 109 -2.417 -31.079 -2.908 1.00 0.00 H new ATOM 0 HA LYS A 109 -3.313 -31.548 -5.590 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -2.414 -33.213 -3.235 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -3.182 -34.031 -4.582 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -1.406 -32.263 -5.854 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -0.505 -32.769 -4.438 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -0.188 -34.870 -5.284 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -1.894 -35.060 -5.633 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -1.592 -34.559 -7.845 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -0.676 -33.114 -7.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 0.690 -34.736 -8.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 1.288 -34.499 -7.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 0.400 -35.898 -7.433 1.00 0.00 H new ATOM 893 N ARG A 110 -5.425 -33.266 -5.045 1.00 0.00 N ATOM 894 CA ARG A 110 -6.857 -33.652 -4.914 1.00 0.00 C ATOM 895 C ARG A 110 -6.971 -35.174 -4.811 1.00 0.00 C ATOM 896 O ARG A 110 -6.424 -35.904 -5.614 1.00 0.00 O ATOM 897 CB ARG A 110 -7.627 -33.165 -6.142 1.00 0.00 C ATOM 898 CG ARG A 110 -6.956 -33.699 -7.409 1.00 0.00 C ATOM 899 CD ARG A 110 -7.143 -32.696 -8.549 1.00 0.00 C ATOM 900 NE ARG A 110 -7.443 -33.431 -9.809 1.00 0.00 N ATOM 901 CZ ARG A 110 -6.528 -33.547 -10.733 1.00 0.00 C ATOM 902 NH1 ARG A 110 -5.293 -33.802 -10.399 1.00 0.00 N ATOM 903 NH2 ARG A 110 -6.849 -33.410 -11.990 1.00 0.00 N ATOM 0 H ARG A 110 -4.872 -33.856 -5.666 1.00 0.00 H new ATOM 0 HA ARG A 110 -7.275 -33.197 -4.016 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -8.661 -33.505 -6.094 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -7.650 -32.075 -6.161 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -5.894 -33.866 -7.228 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -7.387 -34.662 -7.683 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -7.955 -32.008 -8.314 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -6.242 -32.095 -8.671 1.00 0.00 H new ATOM 0 HE ARG A 110 -8.365 -33.844 -9.950 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -5.043 -33.911 -9.416 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -4.578 -33.893 -11.121 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -7.815 -33.212 -12.251 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -6.134 -33.501 -12.712 1.00 0.00 H new ATOM 904 N LYS A 111 -7.681 -35.658 -3.829 1.00 0.00 N ATOM 905 CA LYS A 111 -7.834 -37.132 -3.673 1.00 0.00 C ATOM 906 C LYS A 111 -8.210 -37.753 -5.025 1.00 0.00 C ATOM 907 O LYS A 111 -9.320 -37.585 -5.489 1.00 0.00 O ATOM 908 CB LYS A 111 -8.942 -37.420 -2.657 1.00 0.00 C ATOM 909 CG LYS A 111 -8.665 -36.650 -1.365 1.00 0.00 C ATOM 910 CD LYS A 111 -7.211 -36.871 -0.942 1.00 0.00 C ATOM 911 CE LYS A 111 -7.012 -36.363 0.487 1.00 0.00 C ATOM 912 NZ LYS A 111 -7.332 -34.908 0.547 1.00 0.00 N ATOM 0 H LYS A 111 -8.162 -35.096 -3.127 1.00 0.00 H new ATOM 0 HA LYS A 111 -6.895 -37.562 -3.324 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -9.909 -37.128 -3.066 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -8.992 -38.489 -2.452 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -8.854 -35.587 -1.515 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -9.339 -36.986 -0.577 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -6.961 -37.930 -1.001 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -6.540 -36.347 -1.622 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -7.653 -36.916 1.173 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -5.983 -36.533 0.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -6.977 -34.511 1.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -6.880 -34.420 -0.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -8.362 -34.777 0.495 1.00 0.00 H new ATOM 913 N PRO A 112 -7.275 -38.455 -5.618 1.00 0.00 N ATOM 914 CA PRO A 112 -7.488 -39.111 -6.921 1.00 0.00 C ATOM 915 C PRO A 112 -8.303 -40.397 -6.748 1.00 0.00 C ATOM 916 O PRO A 112 -8.783 -40.971 -7.706 1.00 0.00 O ATOM 917 CB PRO A 112 -6.069 -39.422 -7.403 1.00 0.00 C ATOM 918 CG PRO A 112 -5.174 -39.449 -6.140 1.00 0.00 C ATOM 919 CD PRO A 112 -5.926 -38.658 -5.054 1.00 0.00 C ATOM 0 HA PRO A 112 -8.046 -38.494 -7.625 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -6.037 -40.380 -7.922 1.00 0.00 H new ATOM 0 HB3 PRO A 112 -5.724 -38.665 -8.108 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -4.990 -40.474 -5.817 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -4.202 -39.000 -6.344 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -5.966 -39.211 -4.116 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -5.436 -37.707 -4.843 1.00 0.00 H new ATOM 920 N LYS A 113 -8.462 -40.853 -5.535 1.00 0.00 N ATOM 921 CA LYS A 113 -9.246 -42.100 -5.305 1.00 0.00 C ATOM 922 C LYS A 113 -8.520 -43.288 -5.939 1.00 0.00 C ATOM 923 O LYS A 113 -7.824 -43.148 -6.925 1.00 0.00 O ATOM 924 CB LYS A 113 -10.632 -41.955 -5.937 1.00 0.00 C ATOM 925 CG LYS A 113 -11.704 -42.112 -4.857 1.00 0.00 C ATOM 926 CD LYS A 113 -12.967 -42.715 -5.474 1.00 0.00 C ATOM 927 CE LYS A 113 -13.340 -43.995 -4.724 1.00 0.00 C ATOM 928 NZ LYS A 113 -14.017 -44.940 -5.658 1.00 0.00 N ATOM 0 H LYS A 113 -8.083 -40.417 -4.694 1.00 0.00 H new ATOM 0 HA LYS A 113 -9.349 -42.269 -4.233 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -10.724 -40.981 -6.417 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -10.770 -42.707 -6.713 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -11.337 -42.753 -4.056 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -11.931 -41.143 -4.412 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -13.787 -41.999 -5.423 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -12.800 -42.934 -6.529 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -12.446 -44.458 -4.306 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -13.998 -43.760 -3.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -14.271 -45.810 -5.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -14.878 -44.497 -6.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -13.375 -45.173 -6.442 1.00 0.00 H new ATOM 929 N SER A 114 -8.677 -44.457 -5.380 1.00 0.00 N ATOM 930 CA SER A 114 -7.997 -45.654 -5.950 1.00 0.00 C ATOM 931 C SER A 114 -8.930 -46.864 -5.856 1.00 0.00 C ATOM 932 O SER A 114 -9.446 -47.182 -4.803 1.00 0.00 O ATOM 933 CB SER A 114 -6.717 -45.936 -5.161 1.00 0.00 C ATOM 934 OG SER A 114 -7.018 -46.797 -4.071 1.00 0.00 O ATOM 0 H SER A 114 -9.247 -44.635 -4.553 1.00 0.00 H new ATOM 0 HA SER A 114 -7.748 -45.467 -6.995 1.00 0.00 H new ATOM 0 HB2 SER A 114 -5.971 -46.397 -5.808 1.00 0.00 H new ATOM 0 HB3 SER A 114 -6.289 -45.003 -4.795 1.00 0.00 H new ATOM 0 HG SER A 114 -7.988 -46.825 -3.934 1.00 0.00 H new ATOM 935 N GLN A 115 -9.149 -47.543 -6.949 1.00 0.00 N ATOM 936 CA GLN A 115 -10.046 -48.733 -6.922 1.00 0.00 C ATOM 937 C GLN A 115 -9.199 -50.004 -6.846 1.00 0.00 C ATOM 938 O GLN A 115 -7.985 -49.953 -6.837 1.00 0.00 O ATOM 939 CB GLN A 115 -10.894 -48.760 -8.196 1.00 0.00 C ATOM 940 CG GLN A 115 -12.110 -47.848 -8.020 1.00 0.00 C ATOM 941 CD GLN A 115 -13.306 -48.675 -7.543 1.00 0.00 C ATOM 942 OE1 GLN A 115 -13.340 -49.119 -6.412 1.00 0.00 O ATOM 943 NE2 GLN A 115 -14.296 -48.900 -8.363 1.00 0.00 N ATOM 0 H GLN A 115 -8.745 -47.325 -7.860 1.00 0.00 H new ATOM 0 HA GLN A 115 -10.700 -48.678 -6.052 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -10.300 -48.431 -9.048 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -11.218 -49.779 -8.408 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -11.887 -47.062 -7.298 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -12.348 -47.356 -8.963 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -14.267 -48.527 -9.312 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -15.099 -49.449 -8.055 1.00 0.00 H new ATOM 944 N GLU A 116 -9.827 -51.147 -6.792 1.00 0.00 N ATOM 945 CA GLU A 116 -9.054 -52.417 -6.716 1.00 0.00 C ATOM 946 C GLU A 116 -8.158 -52.395 -5.477 1.00 0.00 C ATOM 947 O GLU A 116 -8.581 -51.842 -4.474 1.00 0.00 O ATOM 948 CB GLU A 116 -8.187 -52.561 -7.968 1.00 0.00 C ATOM 949 CG GLU A 116 -8.324 -53.979 -8.525 1.00 0.00 C ATOM 950 CD GLU A 116 -7.827 -54.010 -9.972 1.00 0.00 C ATOM 951 OE1 GLU A 116 -7.432 -52.966 -10.464 1.00 0.00 O ATOM 952 OE2 GLU A 116 -7.847 -55.078 -10.562 1.00 0.00 O ATOM 953 OXT GLU A 116 -7.064 -52.931 -5.549 1.00 0.00 O ATOM 0 H GLU A 116 -10.841 -51.255 -6.797 1.00 0.00 H new ATOM 0 HA GLU A 116 -9.743 -53.259 -6.651 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -8.492 -51.833 -8.720 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -7.145 -52.353 -7.727 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -7.749 -54.677 -7.917 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -9.365 -54.300 -8.480 1.00 0.00 H new TER 954 GLU A 116