USER MOD reduce.3.24.130724 H: found=0, std=0, add=1128, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1124 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 129 ASN : amide:sc= -1.99 K(o=-8.4,f=-16!) USER MOD Set 1.2: A 132 GLN : amide:sc= -6.44! C(o=-8.4!,f=-26!) USER MOD Set 2.1: A 27 THR OG1 : rot 120:sc= 0.0765 USER MOD Set 2.2: A 59 ASN : amide:sc= 0.0701 X(o=0.15,f=0.084) USER MOD Set 3.1: A 30 LYS NZ :NH3+ -160:sc= -2.39! (180deg=-4.24!) USER MOD Set 3.2: A 36 CYS SG : rot -113:sc= 1.41 USER MOD Set 3.3: A 39 CYS SG : rot 106:sc= 0.814 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 161:sc= -1.7 (180deg=-1.74) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= -0.055 USER MOD Single : A 7 SER OG : rot -76:sc= 0.806 USER MOD Single : A 8 THR OG1 : rot 76:sc= 1.11 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 165:sc= -0.716! USER MOD Single : A 14 ASN : amide:sc= 0.0508 X(o=0.051,f=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 152:sc= -0.0269 (180deg=-0.392) USER MOD Single : A 34 SER OG : rot 86:sc= -1.32! USER MOD Single : A 41 SER OG : rot -40:sc= 0.136 USER MOD Single : A 45 GLN : amide:sc= -0.29 X(o=-0.29,f=-0.29) USER MOD Single : A 46 THR OG1 : rot 175:sc= 0.721 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= -2.1 K(o=-2.1,f=-4.7!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot -99:sc= -0.119 USER MOD Single : A 65 SER OG : rot 175:sc= 0 USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= -0.166 K(o=-0.17,f=-2.1!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 TYR OH : rot 30:sc= -3.2! USER MOD Single : A 85 ASN : amide:sc= -4.1! C(o=-4.1!,f=-5.3!) USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ -161:sc= 0 (180deg=-0.174) USER MOD Single : A 93 THR OG1 : rot 51:sc= 0.0849 USER MOD Single : A 95 ASN : amide:sc= -1.21 K(o=-1.2,f=-2.7!) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= -1.01! X(o=-1!,f=-1.3) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -0.669 X(o=-0.67,f=-0.93) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 116:sc= 1.19 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 GLN : amide:sc= -0.827 X(o=-0.83,f=-0.62) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= -0.236 USER MOD Single : A 141 ASN : amide:sc= 1.17 K(o=1.2,f=-0.17) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 7.905 -12.070 8.948 1.00 0.00 N ATOM 2 CA MET A 1 7.905 -12.203 10.394 1.00 0.00 C ATOM 3 C MET A 1 8.040 -10.838 11.072 1.00 0.00 C ATOM 4 O MET A 1 9.017 -10.584 11.775 1.00 0.00 O ATOM 5 CB MET A 1 9.063 -13.104 10.826 1.00 0.00 C ATOM 6 CG MET A 1 8.709 -14.581 10.639 1.00 0.00 C ATOM 7 SD MET A 1 9.298 -15.530 12.031 1.00 0.00 S ATOM 8 CE MET A 1 9.151 -17.181 11.365 1.00 0.00 C ATOM 0 H1 MET A 1 8.135 -12.987 8.515 1.00 0.00 H new ATOM 0 H2 MET A 1 6.965 -11.762 8.628 1.00 0.00 H new ATOM 0 H3 MET A 1 8.615 -11.365 8.664 1.00 0.00 H new ATOM 0 HA MET A 1 6.956 -12.646 10.697 1.00 0.00 H new ATOM 0 HB2 MET A 1 9.952 -12.863 10.244 1.00 0.00 H new ATOM 0 HB3 MET A 1 9.305 -12.914 11.872 1.00 0.00 H new ATOM 0 HG2 MET A 1 7.629 -14.695 10.541 1.00 0.00 H new ATOM 0 HG3 MET A 1 9.154 -14.956 9.718 1.00 0.00 H new ATOM 0 HE1 MET A 1 9.480 -17.905 12.111 1.00 0.00 H new ATOM 0 HE2 MET A 1 8.111 -17.377 11.104 1.00 0.00 H new ATOM 0 HE3 MET A 1 9.772 -17.270 10.474 1.00 0.00 H new ATOM 18 N VAL A 2 7.047 -9.994 10.833 1.00 0.00 N ATOM 19 CA VAL A 2 7.043 -8.660 11.411 1.00 0.00 C ATOM 20 C VAL A 2 5.598 -8.188 11.583 1.00 0.00 C ATOM 21 O VAL A 2 5.182 -7.215 10.954 1.00 0.00 O ATOM 22 CB VAL A 2 7.884 -7.715 10.551 1.00 0.00 C ATOM 23 CG1 VAL A 2 8.398 -6.533 11.376 1.00 0.00 C ATOM 24 CG2 VAL A 2 9.041 -8.463 9.886 1.00 0.00 C ATOM 0 H VAL A 2 6.240 -10.208 10.247 1.00 0.00 H new ATOM 0 HA VAL A 2 7.501 -8.670 12.400 1.00 0.00 H new ATOM 0 HB VAL A 2 7.243 -7.320 9.763 1.00 0.00 H new ATOM 0 HG11 VAL A 2 8.993 -5.877 10.740 1.00 0.00 H new ATOM 0 HG12 VAL A 2 7.553 -5.977 11.781 1.00 0.00 H new ATOM 0 HG13 VAL A 2 9.015 -6.902 12.195 1.00 0.00 H new ATOM 0 HG21 VAL A 2 9.623 -7.768 9.280 1.00 0.00 H new ATOM 0 HG22 VAL A 2 9.681 -8.900 10.653 1.00 0.00 H new ATOM 0 HG23 VAL A 2 8.645 -9.255 9.250 1.00 0.00 H new ATOM 34 N PRO A 3 4.855 -8.914 12.458 1.00 0.00 N ATOM 35 CA PRO A 3 3.466 -8.579 12.720 1.00 0.00 C ATOM 36 C PRO A 3 3.359 -7.338 13.607 1.00 0.00 C ATOM 37 O PRO A 3 2.390 -6.586 13.516 1.00 0.00 O ATOM 38 CB PRO A 3 2.876 -9.822 13.365 1.00 0.00 C ATOM 39 CG PRO A 3 4.060 -10.635 13.863 1.00 0.00 C ATOM 40 CD PRO A 3 5.315 -10.071 13.221 1.00 0.00 C ATOM 0 HA PRO A 3 2.919 -8.318 11.814 1.00 0.00 H new ATOM 0 HB2 PRO A 3 2.211 -9.557 14.187 1.00 0.00 H new ATOM 0 HB3 PRO A 3 2.285 -10.391 12.647 1.00 0.00 H new ATOM 0 HG2 PRO A 3 4.130 -10.581 14.949 1.00 0.00 H new ATOM 0 HG3 PRO A 3 3.938 -11.686 13.603 1.00 0.00 H new ATOM 0 HD2 PRO A 3 6.049 -9.782 13.973 1.00 0.00 H new ATOM 0 HD3 PRO A 3 5.794 -10.807 12.574 1.00 0.00 H new ATOM 48 N HIS A 4 4.369 -7.160 14.445 1.00 0.00 N ATOM 49 CA HIS A 4 4.402 -6.021 15.349 1.00 0.00 C ATOM 50 C HIS A 4 4.364 -4.724 14.540 1.00 0.00 C ATOM 51 O HIS A 4 3.459 -3.908 14.710 1.00 0.00 O ATOM 52 CB HIS A 4 5.611 -6.104 16.283 1.00 0.00 C ATOM 53 CG HIS A 4 5.822 -4.867 17.124 1.00 0.00 C ATOM 54 ND1 HIS A 4 6.781 -3.914 16.828 1.00 0.00 N ATOM 55 CD2 HIS A 4 5.188 -4.438 18.253 1.00 0.00 C ATOM 56 CE1 HIS A 4 6.718 -2.959 17.745 1.00 0.00 C ATOM 57 NE2 HIS A 4 5.731 -3.287 18.627 1.00 0.00 N ATOM 0 H HIS A 4 5.172 -7.785 14.518 1.00 0.00 H new ATOM 0 HA HIS A 4 3.521 -6.034 15.990 1.00 0.00 H new ATOM 0 HB2 HIS A 4 5.490 -6.963 16.943 1.00 0.00 H new ATOM 0 HB3 HIS A 4 6.506 -6.283 15.687 1.00 0.00 H new ATOM 0 HD2 HIS A 4 4.381 -4.949 18.757 1.00 0.00 H new ATOM 0 HE1 HIS A 4 7.339 -2.076 17.786 1.00 0.00 H new ATOM 0 HE2 HIS A 4 5.455 -2.737 19.441 1.00 0.00 H new ATOM 66 N THR A 5 5.359 -4.572 13.677 1.00 0.00 N ATOM 67 CA THR A 5 5.451 -3.387 12.842 1.00 0.00 C ATOM 68 C THR A 5 4.181 -3.225 12.004 1.00 0.00 C ATOM 69 O THR A 5 3.551 -2.168 12.024 1.00 0.00 O ATOM 70 CB THR A 5 6.723 -3.500 12.000 1.00 0.00 C ATOM 71 OG1 THR A 5 7.739 -3.817 12.947 1.00 0.00 O ATOM 72 CG2 THR A 5 7.162 -2.154 11.421 1.00 0.00 C ATOM 0 H THR A 5 6.108 -5.250 13.539 1.00 0.00 H new ATOM 0 HA THR A 5 5.522 -2.482 13.446 1.00 0.00 H new ATOM 0 HB THR A 5 6.560 -4.209 11.189 1.00 0.00 H new ATOM 0 HG1 THR A 5 8.599 -3.910 12.486 1.00 0.00 H new ATOM 0 HG21 THR A 5 8.069 -2.290 10.832 1.00 0.00 H new ATOM 0 HG22 THR A 5 6.372 -1.757 10.784 1.00 0.00 H new ATOM 0 HG23 THR A 5 7.358 -1.455 12.234 1.00 0.00 H new ATOM 80 N LEU A 6 3.841 -4.288 11.291 1.00 0.00 N ATOM 81 CA LEU A 6 2.658 -4.277 10.448 1.00 0.00 C ATOM 82 C LEU A 6 1.436 -3.922 11.296 1.00 0.00 C ATOM 83 O LEU A 6 0.754 -2.933 11.028 1.00 0.00 O ATOM 84 CB LEU A 6 2.521 -5.603 9.698 1.00 0.00 C ATOM 85 CG LEU A 6 1.310 -5.728 8.771 1.00 0.00 C ATOM 86 CD1 LEU A 6 0.013 -5.836 9.576 1.00 0.00 C ATOM 87 CD2 LEU A 6 1.268 -4.575 7.766 1.00 0.00 C ATOM 0 H LEU A 6 4.364 -5.163 11.280 1.00 0.00 H new ATOM 0 HA LEU A 6 2.747 -3.510 9.679 1.00 0.00 H new ATOM 0 HB2 LEU A 6 3.424 -5.758 9.107 1.00 0.00 H new ATOM 0 HB3 LEU A 6 2.477 -6.409 10.431 1.00 0.00 H new ATOM 0 HG LEU A 6 1.411 -6.650 8.198 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -0.832 -5.924 8.894 1.00 0.00 H new ATOM 0 HD12 LEU A 6 0.055 -6.717 10.217 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -0.109 -4.945 10.191 1.00 0.00 H new ATOM 0 HD21 LEU A 6 0.398 -4.688 7.119 1.00 0.00 H new ATOM 0 HD22 LEU A 6 1.202 -3.628 8.301 1.00 0.00 H new ATOM 0 HD23 LEU A 6 2.174 -4.587 7.160 1.00 0.00 H new ATOM 99 N SER A 7 1.195 -4.747 12.306 1.00 0.00 N ATOM 100 CA SER A 7 0.068 -4.532 13.196 1.00 0.00 C ATOM 101 C SER A 7 0.169 -3.150 13.845 1.00 0.00 C ATOM 102 O SER A 7 -0.838 -2.586 14.269 1.00 0.00 O ATOM 103 CB SER A 7 0.000 -5.620 14.271 1.00 0.00 C ATOM 104 OG SER A 7 0.970 -5.419 15.296 1.00 0.00 O ATOM 0 H SER A 7 1.762 -5.566 12.527 1.00 0.00 H new ATOM 0 HA SER A 7 -0.848 -4.583 12.607 1.00 0.00 H new ATOM 0 HB2 SER A 7 -0.997 -5.632 14.712 1.00 0.00 H new ATOM 0 HB3 SER A 7 0.156 -6.595 13.810 1.00 0.00 H new ATOM 0 HG SER A 7 1.853 -5.690 14.968 1.00 0.00 H new ATOM 110 N THR A 8 1.394 -2.647 13.903 1.00 0.00 N ATOM 111 CA THR A 8 1.639 -1.342 14.494 1.00 0.00 C ATOM 112 C THR A 8 1.294 -0.234 13.498 1.00 0.00 C ATOM 113 O THR A 8 1.161 0.929 13.878 1.00 0.00 O ATOM 114 CB THR A 8 3.093 -1.304 14.967 1.00 0.00 C ATOM 115 OG1 THR A 8 3.064 -1.960 16.231 1.00 0.00 O ATOM 116 CG2 THR A 8 3.566 0.114 15.293 1.00 0.00 C ATOM 0 H THR A 8 2.227 -3.119 13.551 1.00 0.00 H new ATOM 0 HA THR A 8 0.997 -1.171 15.358 1.00 0.00 H new ATOM 0 HB THR A 8 3.736 -1.733 14.198 1.00 0.00 H new ATOM 0 HG1 THR A 8 2.992 -2.928 16.096 1.00 0.00 H new ATOM 0 HG21 THR A 8 4.604 0.084 15.624 1.00 0.00 H new ATOM 0 HG22 THR A 8 3.487 0.738 14.403 1.00 0.00 H new ATOM 0 HG23 THR A 8 2.945 0.532 16.085 1.00 0.00 H new ATOM 124 N LEU A 9 1.159 -0.631 12.240 1.00 0.00 N ATOM 125 CA LEU A 9 0.834 0.315 11.186 1.00 0.00 C ATOM 126 C LEU A 9 -0.679 0.544 11.164 1.00 0.00 C ATOM 127 O LEU A 9 -1.445 -0.375 10.881 1.00 0.00 O ATOM 128 CB LEU A 9 1.405 -0.157 9.848 1.00 0.00 C ATOM 129 CG LEU A 9 2.738 0.469 9.430 1.00 0.00 C ATOM 130 CD1 LEU A 9 2.604 1.983 9.260 1.00 0.00 C ATOM 131 CD2 LEU A 9 3.850 0.098 10.414 1.00 0.00 C ATOM 0 H LEU A 9 1.269 -1.596 11.928 1.00 0.00 H new ATOM 0 HA LEU A 9 1.301 1.280 11.381 1.00 0.00 H new ATOM 0 HB2 LEU A 9 1.532 -1.239 9.891 1.00 0.00 H new ATOM 0 HB3 LEU A 9 0.670 0.047 9.069 1.00 0.00 H new ATOM 0 HG LEU A 9 3.018 0.060 8.459 1.00 0.00 H new ATOM 0 HD11 LEU A 9 3.565 2.402 8.963 1.00 0.00 H new ATOM 0 HD12 LEU A 9 1.861 2.199 8.492 1.00 0.00 H new ATOM 0 HD13 LEU A 9 2.290 2.429 10.204 1.00 0.00 H new ATOM 0 HD21 LEU A 9 4.786 0.555 10.094 1.00 0.00 H new ATOM 0 HD22 LEU A 9 3.591 0.460 11.409 1.00 0.00 H new ATOM 0 HD23 LEU A 9 3.966 -0.986 10.440 1.00 0.00 H new ATOM 143 N LYS A 10 -1.062 1.776 11.465 1.00 0.00 N ATOM 144 CA LYS A 10 -2.469 2.138 11.482 1.00 0.00 C ATOM 145 C LYS A 10 -2.816 2.883 10.191 1.00 0.00 C ATOM 146 O LYS A 10 -1.968 3.562 9.616 1.00 0.00 O ATOM 147 CB LYS A 10 -2.806 2.921 12.753 1.00 0.00 C ATOM 148 CG LYS A 10 -2.520 2.086 14.003 1.00 0.00 C ATOM 149 CD LYS A 10 -3.800 1.841 14.805 1.00 0.00 C ATOM 150 CE LYS A 10 -3.788 2.636 16.112 1.00 0.00 C ATOM 151 NZ LYS A 10 -5.115 2.579 16.765 1.00 0.00 N ATOM 0 H LYS A 10 -0.423 2.536 11.699 1.00 0.00 H new ATOM 0 HA LYS A 10 -3.091 1.244 11.512 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -2.221 3.840 12.784 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -3.856 3.212 12.738 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -2.080 1.132 13.714 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -1.788 2.599 14.627 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -4.667 2.127 14.209 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -3.899 0.778 15.023 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -3.029 2.234 16.782 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -3.519 3.673 15.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -5.090 3.124 17.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -5.832 2.984 16.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -5.357 1.589 16.974 1.00 0.00 H new ATOM 164 N THR A 11 -4.065 2.729 9.774 1.00 0.00 N ATOM 165 CA THR A 11 -4.534 3.379 8.562 1.00 0.00 C ATOM 166 C THR A 11 -4.892 4.839 8.844 1.00 0.00 C ATOM 167 O THR A 11 -4.894 5.271 9.996 1.00 0.00 O ATOM 168 CB THR A 11 -5.705 2.562 8.011 1.00 0.00 C ATOM 169 OG1 THR A 11 -6.586 2.426 9.123 1.00 0.00 O ATOM 170 CG2 THR A 11 -5.306 1.124 7.672 1.00 0.00 C ATOM 0 H THR A 11 -4.766 2.164 10.254 1.00 0.00 H new ATOM 0 HA THR A 11 -3.753 3.410 7.802 1.00 0.00 H new ATOM 0 HB THR A 11 -6.101 3.048 7.119 1.00 0.00 H new ATOM 0 HG1 THR A 11 -7.466 2.130 8.809 1.00 0.00 H new ATOM 0 HG21 THR A 11 -6.172 0.588 7.285 1.00 0.00 H new ATOM 0 HG22 THR A 11 -4.519 1.133 6.918 1.00 0.00 H new ATOM 0 HG23 THR A 11 -4.942 0.626 8.571 1.00 0.00 H new ATOM 178 N ALA A 12 -5.183 5.561 7.772 1.00 0.00 N ATOM 179 CA ALA A 12 -5.541 6.965 7.890 1.00 0.00 C ATOM 180 C ALA A 12 -6.927 7.081 8.528 1.00 0.00 C ATOM 181 O ALA A 12 -7.382 8.181 8.834 1.00 0.00 O ATOM 182 CB ALA A 12 -5.477 7.624 6.512 1.00 0.00 C ATOM 0 H ALA A 12 -5.178 5.201 6.818 1.00 0.00 H new ATOM 0 HA ALA A 12 -4.836 7.489 8.536 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -5.745 8.677 6.599 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -4.466 7.539 6.115 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -6.174 7.127 5.838 1.00 0.00 H new ATOM 188 N ASP A 13 -7.560 5.931 8.708 1.00 0.00 N ATOM 189 CA ASP A 13 -8.884 5.891 9.304 1.00 0.00 C ATOM 190 C ASP A 13 -8.762 5.518 10.784 1.00 0.00 C ATOM 191 O ASP A 13 -9.745 5.130 11.413 1.00 0.00 O ATOM 192 CB ASP A 13 -9.761 4.839 8.623 1.00 0.00 C ATOM 193 CG ASP A 13 -9.002 3.791 7.808 1.00 0.00 C ATOM 194 OD1 ASP A 13 -9.051 2.589 8.109 1.00 0.00 O ATOM 195 OD2 ASP A 13 -8.328 4.258 6.812 1.00 0.00 O ATOM 0 H ASP A 13 -7.180 5.020 8.451 1.00 0.00 H new ATOM 0 HA ASP A 13 -9.339 6.874 9.183 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -10.348 4.328 9.386 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -10.467 5.347 7.966 1.00 0.00 H new ATOM 201 N ASN A 14 -7.547 5.648 11.296 1.00 0.00 N ATOM 202 CA ASN A 14 -7.283 5.330 12.689 1.00 0.00 C ATOM 203 C ASN A 14 -7.700 3.884 12.965 1.00 0.00 C ATOM 204 O ASN A 14 -8.276 3.589 14.012 1.00 0.00 O ATOM 205 CB ASN A 14 -8.084 6.240 13.622 1.00 0.00 C ATOM 206 CG ASN A 14 -7.207 6.769 14.758 1.00 0.00 C ATOM 207 OD1 ASN A 14 -6.904 7.946 14.848 1.00 0.00 O ATOM 208 ND2 ASN A 14 -6.814 5.833 15.619 1.00 0.00 N ATOM 0 H ASN A 14 -6.734 5.969 10.771 1.00 0.00 H new ATOM 0 HA ASN A 14 -6.218 5.473 12.872 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -8.495 7.076 13.056 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -8.929 5.689 14.036 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -6.223 6.085 16.412 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -7.103 4.864 15.486 1.00 0.00 H new ATOM 215 N ARG A 15 -7.395 3.020 12.007 1.00 0.00 N ATOM 216 CA ARG A 15 -7.731 1.613 12.135 1.00 0.00 C ATOM 217 C ARG A 15 -6.464 0.757 12.075 1.00 0.00 C ATOM 218 O ARG A 15 -5.476 1.146 11.453 1.00 0.00 O ATOM 219 CB ARG A 15 -8.688 1.172 11.025 1.00 0.00 C ATOM 220 CG ARG A 15 -9.963 2.018 11.035 1.00 0.00 C ATOM 221 CD ARG A 15 -11.151 1.211 11.564 1.00 0.00 C ATOM 222 NE ARG A 15 -12.353 2.071 11.639 1.00 0.00 N ATOM 223 CZ ARG A 15 -13.601 1.610 11.867 1.00 0.00 C ATOM 224 NH1 ARG A 15 -13.822 0.290 12.045 1.00 0.00 N ATOM 225 NH2 ARG A 15 -14.603 2.468 11.912 1.00 0.00 N ATOM 0 H ARG A 15 -6.919 3.268 11.140 1.00 0.00 H new ATOM 0 HA ARG A 15 -8.222 1.476 13.099 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -8.195 1.262 10.057 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -8.943 0.121 11.156 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -9.813 2.901 11.656 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -10.178 2.370 10.026 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -11.343 0.360 10.911 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -10.918 0.810 12.550 1.00 0.00 H new ATOM 0 HE ARG A 15 -12.231 3.075 11.510 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -13.043 -0.367 12.008 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -14.768 -0.050 12.217 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -14.428 3.464 11.775 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -15.552 2.135 12.083 1.00 0.00 H new ATOM 238 N PRO A 16 -6.535 -0.423 12.747 1.00 0.00 N ATOM 239 CA PRO A 16 -5.405 -1.337 12.777 1.00 0.00 C ATOM 240 C PRO A 16 -5.257 -2.068 11.441 1.00 0.00 C ATOM 241 O PRO A 16 -6.178 -2.750 10.998 1.00 0.00 O ATOM 242 CB PRO A 16 -5.689 -2.275 13.939 1.00 0.00 C ATOM 243 CG PRO A 16 -7.177 -2.150 14.223 1.00 0.00 C ATOM 244 CD PRO A 16 -7.688 -0.917 13.496 1.00 0.00 C ATOM 0 HA PRO A 16 -4.453 -0.826 12.919 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -5.425 -3.302 13.685 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -5.100 -2.001 14.814 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -7.707 -3.040 13.884 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -7.355 -2.062 15.295 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -8.516 -1.164 12.831 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -8.055 -0.168 14.197 1.00 0.00 H new ATOM 252 N ALA A 17 -4.089 -1.900 10.837 1.00 0.00 N ATOM 253 CA ALA A 17 -3.809 -2.535 9.561 1.00 0.00 C ATOM 254 C ALA A 17 -4.076 -4.037 9.675 1.00 0.00 C ATOM 255 O ALA A 17 -4.409 -4.687 8.684 1.00 0.00 O ATOM 256 CB ALA A 17 -2.369 -2.229 9.144 1.00 0.00 C ATOM 0 H ALA A 17 -3.326 -1.333 11.208 1.00 0.00 H new ATOM 0 HA ALA A 17 -4.464 -2.141 8.784 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -2.158 -2.705 8.186 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -2.239 -1.151 9.049 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -1.682 -2.612 9.899 1.00 0.00 H new ATOM 262 N SER A 18 -3.922 -4.544 10.889 1.00 0.00 N ATOM 263 CA SER A 18 -4.143 -5.957 11.143 1.00 0.00 C ATOM 264 C SER A 18 -5.546 -6.358 10.685 1.00 0.00 C ATOM 265 O SER A 18 -5.823 -7.540 10.486 1.00 0.00 O ATOM 266 CB SER A 18 -3.953 -6.286 12.626 1.00 0.00 C ATOM 267 OG SER A 18 -3.300 -7.537 12.815 1.00 0.00 O ATOM 0 H SER A 18 -3.647 -4.001 11.708 1.00 0.00 H new ATOM 0 HA SER A 18 -3.407 -6.526 10.575 1.00 0.00 H new ATOM 0 HB2 SER A 18 -3.370 -5.497 13.101 1.00 0.00 H new ATOM 0 HB3 SER A 18 -4.924 -6.306 13.120 1.00 0.00 H new ATOM 0 HG SER A 18 -3.196 -7.710 13.774 1.00 0.00 H new ATOM 273 N VAL A 19 -6.394 -5.352 10.532 1.00 0.00 N ATOM 274 CA VAL A 19 -7.763 -5.585 10.103 1.00 0.00 C ATOM 275 C VAL A 19 -7.762 -6.034 8.640 1.00 0.00 C ATOM 276 O VAL A 19 -8.690 -6.710 8.195 1.00 0.00 O ATOM 277 CB VAL A 19 -8.608 -4.331 10.343 1.00 0.00 C ATOM 278 CG1 VAL A 19 -9.949 -4.425 9.612 1.00 0.00 C ATOM 279 CG2 VAL A 19 -8.814 -4.089 11.839 1.00 0.00 C ATOM 0 H VAL A 19 -6.160 -4.373 10.697 1.00 0.00 H new ATOM 0 HA VAL A 19 -8.218 -6.383 10.690 1.00 0.00 H new ATOM 0 HB VAL A 19 -8.065 -3.477 9.937 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -10.530 -3.522 9.799 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -9.773 -4.528 8.541 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -10.501 -5.292 9.974 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -9.417 -3.193 11.983 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -9.326 -4.945 12.279 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -7.846 -3.957 12.323 1.00 0.00 H new ATOM 289 N TYR A 20 -6.714 -5.642 7.933 1.00 0.00 N ATOM 290 CA TYR A 20 -6.582 -5.995 6.530 1.00 0.00 C ATOM 291 C TYR A 20 -5.457 -7.012 6.326 1.00 0.00 C ATOM 292 O TYR A 20 -4.899 -7.114 5.234 1.00 0.00 O ATOM 293 CB TYR A 20 -6.221 -4.700 5.800 1.00 0.00 C ATOM 294 CG TYR A 20 -7.434 -3.888 5.340 1.00 0.00 C ATOM 295 CD1 TYR A 20 -8.246 -3.271 6.270 1.00 0.00 C ATOM 296 CD2 TYR A 20 -7.714 -3.772 3.993 1.00 0.00 C ATOM 297 CE1 TYR A 20 -9.386 -2.507 5.835 1.00 0.00 C ATOM 298 CE2 TYR A 20 -8.854 -3.007 3.559 1.00 0.00 C ATOM 299 CZ TYR A 20 -9.634 -2.413 4.501 1.00 0.00 C ATOM 300 OH TYR A 20 -10.712 -1.690 4.091 1.00 0.00 O ATOM 0 H TYR A 20 -5.947 -5.082 8.306 1.00 0.00 H new ATOM 0 HA TYR A 20 -7.505 -6.440 6.158 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -5.611 -4.082 6.458 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -5.608 -4.943 4.932 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -8.026 -3.361 7.324 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -7.078 -4.255 3.265 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -10.030 -2.019 6.552 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -9.084 -2.907 2.509 1.00 0.00 H new ATOM 0 HH TYR A 20 -10.765 -1.709 3.113 1.00 0.00 H new ATOM 310 N LEU A 21 -5.158 -7.738 7.392 1.00 0.00 N ATOM 311 CA LEU A 21 -4.110 -8.744 7.342 1.00 0.00 C ATOM 312 C LEU A 21 -4.526 -9.951 8.184 1.00 0.00 C ATOM 313 O LEU A 21 -4.752 -9.826 9.387 1.00 0.00 O ATOM 314 CB LEU A 21 -2.767 -8.139 7.757 1.00 0.00 C ATOM 315 CG LEU A 21 -1.872 -7.647 6.618 1.00 0.00 C ATOM 316 CD1 LEU A 21 -1.643 -6.137 6.715 1.00 0.00 C ATOM 317 CD2 LEU A 21 -0.555 -8.425 6.579 1.00 0.00 C ATOM 0 H LEU A 21 -5.623 -7.650 8.296 1.00 0.00 H new ATOM 0 HA LEU A 21 -3.972 -9.100 6.321 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -2.960 -7.302 8.428 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -2.216 -8.886 8.329 1.00 0.00 H new ATOM 0 HG LEU A 21 -2.385 -7.836 5.675 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -1.004 -5.812 5.894 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -2.600 -5.619 6.656 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -1.162 -5.902 7.664 1.00 0.00 H new ATOM 0 HD21 LEU A 21 0.062 -8.055 5.760 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -0.025 -8.291 7.522 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -0.762 -9.484 6.427 1.00 0.00 H new ATOM 329 N LYS A 22 -4.617 -11.094 7.520 1.00 0.00 N ATOM 330 CA LYS A 22 -5.003 -12.322 8.191 1.00 0.00 C ATOM 331 C LYS A 22 -5.410 -13.364 7.147 1.00 0.00 C ATOM 332 O LYS A 22 -5.245 -13.143 5.948 1.00 0.00 O ATOM 333 CB LYS A 22 -6.086 -12.044 9.236 1.00 0.00 C ATOM 334 CG LYS A 22 -5.488 -11.985 10.643 1.00 0.00 C ATOM 335 CD LYS A 22 -6.181 -10.912 11.488 1.00 0.00 C ATOM 336 CE LYS A 22 -6.944 -11.543 12.655 1.00 0.00 C ATOM 337 NZ LYS A 22 -8.399 -11.541 12.382 1.00 0.00 N ATOM 0 H LYS A 22 -4.429 -11.195 6.522 1.00 0.00 H new ATOM 0 HA LYS A 22 -4.158 -12.736 8.742 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -6.583 -11.101 9.008 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -6.847 -12.823 9.193 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -5.590 -12.956 11.127 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -4.421 -11.771 10.580 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -5.440 -10.210 11.870 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -6.869 -10.341 10.865 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -6.599 -12.565 12.813 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -6.739 -10.991 13.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -8.903 -11.972 13.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -8.727 -10.562 12.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -8.591 -12.087 11.518 1.00 0.00 H new ATOM 350 N LYS A 23 -5.933 -14.477 7.641 1.00 0.00 N ATOM 351 CA LYS A 23 -6.364 -15.553 6.765 1.00 0.00 C ATOM 352 C LYS A 23 -5.146 -16.143 6.052 1.00 0.00 C ATOM 353 O LYS A 23 -5.265 -16.681 4.952 1.00 0.00 O ATOM 354 CB LYS A 23 -7.456 -15.064 5.811 1.00 0.00 C ATOM 355 CG LYS A 23 -8.773 -15.802 6.061 1.00 0.00 C ATOM 356 CD LYS A 23 -8.678 -17.260 5.608 1.00 0.00 C ATOM 357 CE LYS A 23 -9.120 -18.210 6.724 1.00 0.00 C ATOM 358 NZ LYS A 23 -9.984 -19.282 6.179 1.00 0.00 N ATOM 0 H LYS A 23 -6.068 -14.657 8.636 1.00 0.00 H new ATOM 0 HA LYS A 23 -6.816 -16.357 7.345 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -7.605 -13.992 5.942 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -7.139 -15.218 4.780 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -9.021 -15.762 7.122 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -9.581 -15.303 5.526 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -9.302 -17.412 4.727 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -7.653 -17.488 5.316 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -8.245 -18.648 7.204 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -9.660 -17.654 7.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -10.275 -19.918 6.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -10.827 -18.859 5.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -9.457 -19.823 5.464 1.00 0.00 H new ATOM 371 N ASP A 24 -4.001 -16.026 6.709 1.00 0.00 N ATOM 372 CA ASP A 24 -2.762 -16.542 6.151 1.00 0.00 C ATOM 373 C ASP A 24 -2.724 -16.251 4.650 1.00 0.00 C ATOM 374 O ASP A 24 -2.273 -17.085 3.865 1.00 0.00 O ATOM 375 CB ASP A 24 -2.661 -18.056 6.344 1.00 0.00 C ATOM 376 CG ASP A 24 -2.843 -18.539 7.784 1.00 0.00 C ATOM 377 OD1 ASP A 24 -3.865 -19.148 8.130 1.00 0.00 O ATOM 378 OD2 ASP A 24 -1.864 -18.262 8.580 1.00 0.00 O ATOM 0 H ASP A 24 -3.905 -15.582 7.622 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.932 -16.057 6.665 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -3.412 -18.538 5.718 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -1.687 -18.388 5.986 1.00 0.00 H new ATOM 384 N LYS A 25 -3.202 -15.069 4.296 1.00 0.00 N ATOM 385 CA LYS A 25 -3.227 -14.659 2.902 1.00 0.00 C ATOM 386 C LYS A 25 -2.096 -13.661 2.647 1.00 0.00 C ATOM 387 O LYS A 25 -1.551 -13.081 3.586 1.00 0.00 O ATOM 388 CB LYS A 25 -4.612 -14.127 2.524 1.00 0.00 C ATOM 389 CG LYS A 25 -5.566 -15.273 2.182 1.00 0.00 C ATOM 390 CD LYS A 25 -6.691 -14.795 1.264 1.00 0.00 C ATOM 391 CE LYS A 25 -6.725 -15.606 -0.033 1.00 0.00 C ATOM 392 NZ LYS A 25 -6.948 -17.040 0.259 1.00 0.00 N ATOM 0 H LYS A 25 -3.575 -14.381 4.950 1.00 0.00 H new ATOM 0 HA LYS A 25 -3.050 -15.515 2.251 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -5.019 -13.544 3.350 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -4.526 -13.454 1.671 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -5.014 -16.078 1.697 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -5.990 -15.684 3.098 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -7.648 -14.886 1.778 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -6.552 -13.739 1.033 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -7.518 -15.233 -0.682 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -5.786 -15.480 -0.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -7.427 -17.488 -0.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -6.033 -17.507 0.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -7.541 -17.133 1.109 1.00 0.00 H new ATOM 405 N PRO A 26 -1.766 -13.487 1.339 1.00 0.00 N ATOM 406 CA PRO A 26 -0.710 -12.569 0.949 1.00 0.00 C ATOM 407 C PRO A 26 -1.176 -11.116 1.060 1.00 0.00 C ATOM 408 O PRO A 26 -2.347 -10.818 0.833 1.00 0.00 O ATOM 409 CB PRO A 26 -0.345 -12.970 -0.471 1.00 0.00 C ATOM 410 CG PRO A 26 -1.520 -13.784 -0.989 1.00 0.00 C ATOM 411 CD PRO A 26 -2.390 -14.157 0.201 1.00 0.00 C ATOM 0 HA PRO A 26 0.161 -12.628 1.602 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -0.174 -12.092 -1.093 1.00 0.00 H new ATOM 0 HB3 PRO A 26 0.574 -13.556 -0.487 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -2.093 -13.207 -1.715 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -1.168 -14.680 -1.500 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -3.418 -13.824 0.060 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -2.422 -15.237 0.346 1.00 0.00 H new ATOM 419 N THR A 27 -0.235 -10.252 1.410 1.00 0.00 N ATOM 420 CA THR A 27 -0.534 -8.838 1.554 1.00 0.00 C ATOM 421 C THR A 27 0.335 -8.009 0.606 1.00 0.00 C ATOM 422 O THR A 27 1.545 -8.219 0.525 1.00 0.00 O ATOM 423 CB THR A 27 -0.355 -8.464 3.026 1.00 0.00 C ATOM 424 OG1 THR A 27 -0.914 -9.568 3.734 1.00 0.00 O ATOM 425 CG2 THR A 27 -1.228 -7.276 3.439 1.00 0.00 C ATOM 0 H THR A 27 0.735 -10.504 1.598 1.00 0.00 H new ATOM 0 HA THR A 27 -1.564 -8.622 1.272 1.00 0.00 H new ATOM 0 HB THR A 27 0.692 -8.228 3.216 1.00 0.00 H new ATOM 0 HG1 THR A 27 -0.226 -9.975 4.301 1.00 0.00 H new ATOM 0 HG21 THR A 27 -1.063 -7.052 4.493 1.00 0.00 H new ATOM 0 HG22 THR A 27 -0.966 -6.406 2.837 1.00 0.00 H new ATOM 0 HG23 THR A 27 -2.278 -7.524 3.281 1.00 0.00 H new ATOM 433 N LEU A 28 -0.312 -7.084 -0.084 1.00 0.00 N ATOM 434 CA LEU A 28 0.387 -6.222 -1.022 1.00 0.00 C ATOM 435 C LEU A 28 0.409 -4.793 -0.477 1.00 0.00 C ATOM 436 O LEU A 28 -0.561 -4.342 0.130 1.00 0.00 O ATOM 437 CB LEU A 28 -0.229 -6.339 -2.419 1.00 0.00 C ATOM 438 CG LEU A 28 0.385 -5.446 -3.498 1.00 0.00 C ATOM 439 CD1 LEU A 28 0.338 -6.128 -4.867 1.00 0.00 C ATOM 440 CD2 LEU A 28 -0.287 -4.071 -3.520 1.00 0.00 C ATOM 0 H LEU A 28 -1.315 -6.911 -0.013 1.00 0.00 H new ATOM 0 HA LEU A 28 1.425 -6.538 -1.129 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -0.149 -7.376 -2.744 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.292 -6.109 -2.346 1.00 0.00 H new ATOM 0 HG LEU A 28 1.435 -5.288 -3.253 1.00 0.00 H new ATOM 0 HD11 LEU A 28 0.781 -5.471 -5.616 1.00 0.00 H new ATOM 0 HD12 LEU A 28 0.898 -7.063 -4.827 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -0.698 -6.336 -5.134 1.00 0.00 H new ATOM 0 HD21 LEU A 28 0.168 -3.456 -4.296 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -1.350 -4.189 -3.728 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.158 -3.588 -2.552 1.00 0.00 H new ATOM 452 N ILE A 29 1.525 -4.120 -0.714 1.00 0.00 N ATOM 453 CA ILE A 29 1.685 -2.751 -0.254 1.00 0.00 C ATOM 454 C ILE A 29 1.882 -1.832 -1.462 1.00 0.00 C ATOM 455 O ILE A 29 2.462 -2.237 -2.467 1.00 0.00 O ATOM 456 CB ILE A 29 2.812 -2.660 0.777 1.00 0.00 C ATOM 457 CG1 ILE A 29 2.875 -3.928 1.633 1.00 0.00 C ATOM 458 CG2 ILE A 29 2.673 -1.399 1.631 1.00 0.00 C ATOM 459 CD1 ILE A 29 1.613 -4.078 2.483 1.00 0.00 C ATOM 0 H ILE A 29 2.327 -4.497 -1.219 1.00 0.00 H new ATOM 0 HA ILE A 29 0.785 -2.415 0.261 1.00 0.00 H new ATOM 0 HB ILE A 29 3.759 -2.584 0.243 1.00 0.00 H new ATOM 0 HG12 ILE A 29 2.990 -4.800 0.990 1.00 0.00 H new ATOM 0 HG13 ILE A 29 3.751 -3.891 2.280 1.00 0.00 H new ATOM 0 HG21 ILE A 29 3.486 -1.359 2.356 1.00 0.00 H new ATOM 0 HG22 ILE A 29 2.715 -0.519 0.990 1.00 0.00 H new ATOM 0 HG23 ILE A 29 1.719 -1.420 2.158 1.00 0.00 H new ATOM 0 HD11 ILE A 29 1.683 -4.986 3.081 1.00 0.00 H new ATOM 0 HD12 ILE A 29 1.514 -3.216 3.142 1.00 0.00 H new ATOM 0 HD13 ILE A 29 0.741 -4.139 1.832 1.00 0.00 H new ATOM 471 N LYS A 30 1.387 -0.611 -1.322 1.00 0.00 N ATOM 472 CA LYS A 30 1.500 0.369 -2.388 1.00 0.00 C ATOM 473 C LYS A 30 1.843 1.734 -1.788 1.00 0.00 C ATOM 474 O LYS A 30 1.033 2.323 -1.073 1.00 0.00 O ATOM 475 CB LYS A 30 0.235 0.377 -3.248 1.00 0.00 C ATOM 476 CG LYS A 30 0.580 0.509 -4.731 1.00 0.00 C ATOM 477 CD LYS A 30 0.126 1.863 -5.281 1.00 0.00 C ATOM 478 CE LYS A 30 0.873 3.011 -4.597 1.00 0.00 C ATOM 479 NZ LYS A 30 0.794 4.242 -5.414 1.00 0.00 N ATOM 0 H LYS A 30 0.907 -0.278 -0.486 1.00 0.00 H new ATOM 0 HA LYS A 30 2.314 0.103 -3.062 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -0.327 -0.542 -3.082 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -0.409 1.203 -2.946 1.00 0.00 H new ATOM 0 HG2 LYS A 30 1.656 0.398 -4.869 1.00 0.00 H new ATOM 0 HG3 LYS A 30 0.102 -0.294 -5.292 1.00 0.00 H new ATOM 0 HD2 LYS A 30 0.301 1.900 -6.356 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -0.947 1.980 -5.128 1.00 0.00 H new ATOM 0 HE2 LYS A 30 0.446 3.194 -3.611 1.00 0.00 H new ATOM 0 HE3 LYS A 30 1.916 2.734 -4.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 1.555 4.893 -5.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 0.898 3.998 -6.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -0.127 4.701 -5.262 1.00 0.00 H new ATOM 492 N PHE A 31 3.044 2.198 -2.099 1.00 0.00 N ATOM 493 CA PHE A 31 3.503 3.483 -1.597 1.00 0.00 C ATOM 494 C PHE A 31 3.132 4.612 -2.562 1.00 0.00 C ATOM 495 O PHE A 31 3.450 4.549 -3.748 1.00 0.00 O ATOM 496 CB PHE A 31 5.027 3.402 -1.489 1.00 0.00 C ATOM 497 CG PHE A 31 5.532 2.176 -0.722 1.00 0.00 C ATOM 498 CD1 PHE A 31 5.687 0.988 -1.366 1.00 0.00 C ATOM 499 CD2 PHE A 31 5.826 2.278 0.602 1.00 0.00 C ATOM 500 CE1 PHE A 31 6.156 -0.147 -0.653 1.00 0.00 C ATOM 501 CE2 PHE A 31 6.295 1.143 1.313 1.00 0.00 C ATOM 502 CZ PHE A 31 6.450 -0.046 0.671 1.00 0.00 C ATOM 0 H PHE A 31 3.714 1.708 -2.692 1.00 0.00 H new ATOM 0 HA PHE A 31 3.037 3.695 -0.635 1.00 0.00 H new ATOM 0 HB2 PHE A 31 5.452 3.391 -2.493 1.00 0.00 H new ATOM 0 HB3 PHE A 31 5.395 4.303 -0.997 1.00 0.00 H new ATOM 0 HD1 PHE A 31 5.454 0.908 -2.418 1.00 0.00 H new ATOM 0 HD2 PHE A 31 5.703 3.222 1.112 1.00 0.00 H new ATOM 0 HE1 PHE A 31 6.279 -1.091 -1.163 1.00 0.00 H new ATOM 0 HE2 PHE A 31 6.529 1.223 2.364 1.00 0.00 H new ATOM 0 HZ PHE A 31 6.806 -0.910 1.213 1.00 0.00 H new ATOM 512 N TRP A 32 2.464 5.617 -2.015 1.00 0.00 N ATOM 513 CA TRP A 32 2.047 6.758 -2.811 1.00 0.00 C ATOM 514 C TRP A 32 2.430 8.030 -2.052 1.00 0.00 C ATOM 515 O TRP A 32 2.761 7.976 -0.868 1.00 0.00 O ATOM 516 CB TRP A 32 0.555 6.682 -3.137 1.00 0.00 C ATOM 517 CG TRP A 32 -0.344 6.539 -1.906 1.00 0.00 C ATOM 518 CD1 TRP A 32 -0.397 5.520 -1.038 1.00 0.00 C ATOM 519 CD2 TRP A 32 -1.322 7.493 -1.440 1.00 0.00 C ATOM 520 NE1 TRP A 32 -1.335 5.745 -0.051 1.00 0.00 N ATOM 521 CE2 TRP A 32 -1.916 6.984 -0.303 1.00 0.00 C ATOM 522 CE3 TRP A 32 -1.695 8.744 -1.962 1.00 0.00 C ATOM 523 CZ2 TRP A 32 -2.915 7.658 0.409 1.00 0.00 C ATOM 524 CZ3 TRP A 32 -2.694 9.405 -1.239 1.00 0.00 C ATOM 525 CH2 TRP A 32 -3.301 8.907 -0.093 1.00 0.00 C ATOM 0 H TRP A 32 2.201 5.665 -1.031 1.00 0.00 H new ATOM 0 HA TRP A 32 2.556 6.763 -3.775 1.00 0.00 H new ATOM 0 HB2 TRP A 32 0.266 7.580 -3.683 1.00 0.00 H new ATOM 0 HB3 TRP A 32 0.381 5.836 -3.802 1.00 0.00 H new ATOM 0 HD1 TRP A 32 0.217 4.634 -1.102 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -1.561 5.118 0.721 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -1.246 9.162 -2.851 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -3.364 7.238 1.297 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -3.016 10.371 -1.597 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -4.067 9.480 0.408 1.00 0.00 H new ATOM 536 N ALA A 33 2.370 9.147 -2.763 1.00 0.00 N ATOM 537 CA ALA A 33 2.706 10.430 -2.171 1.00 0.00 C ATOM 538 C ALA A 33 1.637 11.456 -2.548 1.00 0.00 C ATOM 539 O ALA A 33 0.950 11.300 -3.556 1.00 0.00 O ATOM 540 CB ALA A 33 4.105 10.851 -2.627 1.00 0.00 C ATOM 0 H ALA A 33 2.094 9.189 -3.744 1.00 0.00 H new ATOM 0 HA ALA A 33 2.725 10.358 -1.084 1.00 0.00 H new ATOM 0 HB1 ALA A 33 4.358 11.814 -2.183 1.00 0.00 H new ATOM 0 HB2 ALA A 33 4.832 10.103 -2.310 1.00 0.00 H new ATOM 0 HB3 ALA A 33 4.123 10.936 -3.713 1.00 0.00 H new ATOM 546 N SER A 34 1.529 12.484 -1.717 1.00 0.00 N ATOM 547 CA SER A 34 0.555 13.536 -1.951 1.00 0.00 C ATOM 548 C SER A 34 1.068 14.495 -3.026 1.00 0.00 C ATOM 549 O SER A 34 0.280 15.160 -3.697 1.00 0.00 O ATOM 550 CB SER A 34 0.248 14.299 -0.661 1.00 0.00 C ATOM 551 OG SER A 34 -0.963 15.043 -0.756 1.00 0.00 O ATOM 0 H SER A 34 2.100 12.610 -0.881 1.00 0.00 H new ATOM 0 HA SER A 34 -0.370 13.075 -2.297 1.00 0.00 H new ATOM 0 HB2 SER A 34 0.177 13.595 0.168 1.00 0.00 H new ATOM 0 HB3 SER A 34 1.072 14.975 -0.435 1.00 0.00 H new ATOM 0 HG SER A 34 -1.721 14.465 -0.527 1.00 0.00 H new ATOM 557 N TRP A 35 2.386 14.537 -3.157 1.00 0.00 N ATOM 558 CA TRP A 35 3.013 15.405 -4.139 1.00 0.00 C ATOM 559 C TRP A 35 2.956 14.702 -5.497 1.00 0.00 C ATOM 560 O TRP A 35 3.310 15.286 -6.519 1.00 0.00 O ATOM 561 CB TRP A 35 4.437 15.772 -3.717 1.00 0.00 C ATOM 562 CG TRP A 35 5.292 14.573 -3.301 1.00 0.00 C ATOM 563 CD1 TRP A 35 5.680 14.223 -2.067 1.00 0.00 C ATOM 564 CD2 TRP A 35 5.853 13.571 -4.177 1.00 0.00 C ATOM 565 NE1 TRP A 35 6.445 13.076 -2.083 1.00 0.00 N ATOM 566 CE2 TRP A 35 6.554 12.667 -3.407 1.00 0.00 C ATOM 567 CE3 TRP A 35 5.770 13.436 -5.574 1.00 0.00 C ATOM 568 CZ2 TRP A 35 7.227 11.562 -3.942 1.00 0.00 C ATOM 569 CZ3 TRP A 35 6.446 12.327 -6.095 1.00 0.00 C ATOM 570 CH2 TRP A 35 7.158 11.406 -5.332 1.00 0.00 C ATOM 0 H TRP A 35 3.037 13.984 -2.599 1.00 0.00 H new ATOM 0 HA TRP A 35 2.478 16.352 -4.213 1.00 0.00 H new ATOM 0 HB2 TRP A 35 4.928 16.286 -4.543 1.00 0.00 H new ATOM 0 HB3 TRP A 35 4.389 16.476 -2.886 1.00 0.00 H new ATOM 0 HD1 TRP A 35 5.425 14.771 -1.172 1.00 0.00 H new ATOM 0 HE1 TRP A 35 6.856 12.613 -1.272 1.00 0.00 H new ATOM 0 HE3 TRP A 35 5.228 14.133 -6.196 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 7.770 10.868 -3.317 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 6.413 12.175 -7.164 1.00 0.00 H new ATOM 0 HH2 TRP A 35 7.655 10.575 -5.810 1.00 0.00 H new ATOM 581 N CYS A 36 2.506 13.455 -5.463 1.00 0.00 N ATOM 582 CA CYS A 36 2.397 12.666 -6.679 1.00 0.00 C ATOM 583 C CYS A 36 0.950 12.740 -7.172 1.00 0.00 C ATOM 584 O CYS A 36 0.049 12.187 -6.544 1.00 0.00 O ATOM 585 CB CYS A 36 2.853 11.222 -6.459 1.00 0.00 C ATOM 586 SG CYS A 36 2.852 10.316 -8.048 1.00 0.00 S ATOM 0 H CYS A 36 2.213 12.973 -4.613 1.00 0.00 H new ATOM 0 HA CYS A 36 3.060 13.074 -7.442 1.00 0.00 H new ATOM 0 HB2 CYS A 36 3.853 11.210 -6.025 1.00 0.00 H new ATOM 0 HB3 CYS A 36 2.191 10.727 -5.748 1.00 0.00 H new ATOM 0 HG CYS A 36 1.939 9.391 -8.020 1.00 0.00 H new ATOM 592 N PRO A 37 0.769 13.444 -8.320 1.00 0.00 N ATOM 593 CA PRO A 37 -0.552 13.597 -8.903 1.00 0.00 C ATOM 594 C PRO A 37 -1.003 12.304 -9.586 1.00 0.00 C ATOM 595 O PRO A 37 -2.179 11.945 -9.529 1.00 0.00 O ATOM 596 CB PRO A 37 -0.424 14.764 -9.870 1.00 0.00 C ATOM 597 CG PRO A 37 1.065 14.921 -10.137 1.00 0.00 C ATOM 598 CD PRO A 37 1.814 14.112 -9.091 1.00 0.00 C ATOM 0 HA PRO A 37 -1.320 13.798 -8.156 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -0.968 14.568 -10.794 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -0.842 15.675 -9.441 1.00 0.00 H new ATOM 0 HG2 PRO A 37 1.312 14.571 -11.139 1.00 0.00 H new ATOM 0 HG3 PRO A 37 1.353 15.971 -10.086 1.00 0.00 H new ATOM 0 HD2 PRO A 37 2.486 13.390 -9.555 1.00 0.00 H new ATOM 0 HD3 PRO A 37 2.425 14.754 -8.457 1.00 0.00 H new ATOM 606 N LEU A 38 -0.045 11.639 -10.215 1.00 0.00 N ATOM 607 CA LEU A 38 -0.329 10.392 -10.907 1.00 0.00 C ATOM 608 C LEU A 38 -0.819 9.354 -9.896 1.00 0.00 C ATOM 609 O LEU A 38 -1.575 8.450 -10.248 1.00 0.00 O ATOM 610 CB LEU A 38 0.888 9.939 -11.714 1.00 0.00 C ATOM 611 CG LEU A 38 0.589 9.183 -13.009 1.00 0.00 C ATOM 612 CD1 LEU A 38 1.865 8.975 -13.830 1.00 0.00 C ATOM 613 CD2 LEU A 38 -0.129 7.863 -12.722 1.00 0.00 C ATOM 0 H LEU A 38 0.929 11.940 -10.260 1.00 0.00 H new ATOM 0 HA LEU A 38 -1.129 10.532 -11.634 1.00 0.00 H new ATOM 0 HB2 LEU A 38 1.484 10.818 -11.959 1.00 0.00 H new ATOM 0 HB3 LEU A 38 1.504 9.303 -11.079 1.00 0.00 H new ATOM 0 HG LEU A 38 -0.086 9.792 -13.611 1.00 0.00 H new ATOM 0 HD11 LEU A 38 1.624 8.435 -14.746 1.00 0.00 H new ATOM 0 HD12 LEU A 38 2.297 9.943 -14.083 1.00 0.00 H new ATOM 0 HD13 LEU A 38 2.583 8.398 -13.247 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -0.329 7.346 -13.661 1.00 0.00 H new ATOM 0 HD22 LEU A 38 0.500 7.236 -12.090 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -1.070 8.065 -12.211 1.00 0.00 H new ATOM 625 N CYS A 39 -0.367 9.517 -8.661 1.00 0.00 N ATOM 626 CA CYS A 39 -0.750 8.604 -7.597 1.00 0.00 C ATOM 627 C CYS A 39 -2.160 8.973 -7.132 1.00 0.00 C ATOM 628 O CYS A 39 -3.033 8.110 -7.039 1.00 0.00 O ATOM 629 CB CYS A 39 0.255 8.626 -6.445 1.00 0.00 C ATOM 630 SG CYS A 39 1.700 7.581 -6.855 1.00 0.00 S ATOM 0 H CYS A 39 0.261 10.268 -8.373 1.00 0.00 H new ATOM 0 HA CYS A 39 -0.749 7.581 -7.974 1.00 0.00 H new ATOM 0 HB2 CYS A 39 0.578 9.649 -6.253 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -0.218 8.265 -5.532 1.00 0.00 H new ATOM 0 HG CYS A 39 2.714 8.339 -7.150 1.00 0.00 H new ATOM 636 N LEU A 40 -2.341 10.256 -6.854 1.00 0.00 N ATOM 637 CA LEU A 40 -3.630 10.749 -6.399 1.00 0.00 C ATOM 638 C LEU A 40 -4.719 10.282 -7.370 1.00 0.00 C ATOM 639 O LEU A 40 -5.762 9.788 -6.945 1.00 0.00 O ATOM 640 CB LEU A 40 -3.585 12.266 -6.209 1.00 0.00 C ATOM 641 CG LEU A 40 -2.931 12.760 -4.917 1.00 0.00 C ATOM 642 CD1 LEU A 40 -2.379 14.177 -5.089 1.00 0.00 C ATOM 643 CD2 LEU A 40 -3.902 12.662 -3.737 1.00 0.00 C ATOM 0 H LEU A 40 -1.616 10.969 -6.935 1.00 0.00 H new ATOM 0 HA LEU A 40 -3.875 10.335 -5.421 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -3.051 12.702 -7.053 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -4.605 12.647 -6.245 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.086 12.110 -4.692 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -1.920 14.504 -4.156 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.632 14.183 -5.883 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -3.192 14.855 -5.350 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -3.412 13.019 -2.832 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -4.782 13.273 -3.938 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -4.205 11.624 -3.600 1.00 0.00 H new ATOM 655 N SER A 41 -4.438 10.458 -8.653 1.00 0.00 N ATOM 656 CA SER A 41 -5.381 10.062 -9.685 1.00 0.00 C ATOM 657 C SER A 41 -5.481 8.537 -9.744 1.00 0.00 C ATOM 658 O SER A 41 -6.497 7.994 -10.175 1.00 0.00 O ATOM 659 CB SER A 41 -4.971 10.621 -11.049 1.00 0.00 C ATOM 660 OG SER A 41 -4.002 9.798 -11.693 1.00 0.00 O ATOM 0 H SER A 41 -3.572 10.869 -9.001 1.00 0.00 H new ATOM 0 HA SER A 41 -6.358 10.474 -9.433 1.00 0.00 H new ATOM 0 HB2 SER A 41 -5.852 10.709 -11.685 1.00 0.00 H new ATOM 0 HB3 SER A 41 -4.567 11.626 -10.923 1.00 0.00 H new ATOM 0 HG SER A 41 -3.351 9.482 -11.033 1.00 0.00 H new ATOM 666 N GLU A 42 -4.412 7.887 -9.306 1.00 0.00 N ATOM 667 CA GLU A 42 -4.366 6.435 -9.304 1.00 0.00 C ATOM 668 C GLU A 42 -5.106 5.882 -8.084 1.00 0.00 C ATOM 669 O GLU A 42 -5.584 4.750 -8.106 1.00 0.00 O ATOM 670 CB GLU A 42 -2.923 5.932 -9.344 1.00 0.00 C ATOM 671 CG GLU A 42 -2.875 4.402 -9.328 1.00 0.00 C ATOM 672 CD GLU A 42 -2.085 3.891 -8.122 1.00 0.00 C ATOM 673 OE1 GLU A 42 -0.986 3.339 -8.288 1.00 0.00 O ATOM 674 OE2 GLU A 42 -2.650 4.085 -6.978 1.00 0.00 O ATOM 0 H GLU A 42 -3.571 8.340 -8.950 1.00 0.00 H new ATOM 0 HA GLU A 42 -4.867 6.074 -10.203 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -2.429 6.306 -10.241 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -2.373 6.326 -8.489 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -3.889 4.003 -9.299 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -2.416 4.039 -10.248 1.00 0.00 H new ATOM 682 N LEU A 43 -5.178 6.708 -7.051 1.00 0.00 N ATOM 683 CA LEU A 43 -5.851 6.316 -5.825 1.00 0.00 C ATOM 684 C LEU A 43 -7.229 5.742 -6.166 1.00 0.00 C ATOM 685 O LEU A 43 -7.566 4.638 -5.744 1.00 0.00 O ATOM 686 CB LEU A 43 -5.900 7.488 -4.842 1.00 0.00 C ATOM 687 CG LEU A 43 -4.568 7.879 -4.199 1.00 0.00 C ATOM 688 CD1 LEU A 43 -4.687 9.215 -3.462 1.00 0.00 C ATOM 689 CD2 LEU A 43 -4.053 6.766 -3.287 1.00 0.00 C ATOM 0 H LEU A 43 -4.781 7.648 -7.038 1.00 0.00 H new ATOM 0 HA LEU A 43 -5.293 5.528 -5.319 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -6.298 8.358 -5.364 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -6.606 7.242 -4.049 1.00 0.00 H new ATOM 0 HG LEU A 43 -3.832 8.013 -4.991 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.727 9.470 -3.014 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -4.977 9.995 -4.166 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -5.442 9.133 -2.680 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.105 7.069 -2.843 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.780 6.577 -2.497 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.906 5.857 -3.870 1.00 0.00 H new ATOM 701 N GLY A 44 -7.986 6.518 -6.926 1.00 0.00 N ATOM 702 CA GLY A 44 -9.318 6.100 -7.329 1.00 0.00 C ATOM 703 C GLY A 44 -9.286 4.714 -7.973 1.00 0.00 C ATOM 704 O GLY A 44 -10.072 3.838 -7.610 1.00 0.00 O ATOM 0 H GLY A 44 -7.703 7.434 -7.274 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -9.977 6.086 -6.461 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -9.732 6.822 -8.032 1.00 0.00 H new ATOM 708 N GLN A 45 -8.372 4.555 -8.918 1.00 0.00 N ATOM 709 CA GLN A 45 -8.227 3.289 -9.617 1.00 0.00 C ATOM 710 C GLN A 45 -7.798 2.192 -8.642 1.00 0.00 C ATOM 711 O GLN A 45 -8.224 1.044 -8.765 1.00 0.00 O ATOM 712 CB GLN A 45 -7.237 3.411 -10.775 1.00 0.00 C ATOM 713 CG GLN A 45 -7.208 2.130 -11.610 1.00 0.00 C ATOM 714 CD GLN A 45 -7.380 2.440 -13.099 1.00 0.00 C ATOM 715 OE1 GLN A 45 -8.468 2.396 -13.647 1.00 0.00 O ATOM 716 NE2 GLN A 45 -6.247 2.757 -13.719 1.00 0.00 N ATOM 0 H GLN A 45 -7.723 5.283 -9.217 1.00 0.00 H new ATOM 0 HA GLN A 45 -9.195 3.016 -10.038 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -7.514 4.255 -11.407 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -6.240 3.618 -10.385 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -6.264 1.609 -11.450 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -8.002 1.459 -11.281 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -5.369 2.775 -13.200 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -6.256 2.982 -14.714 1.00 0.00 H new ATOM 725 N THR A 46 -6.959 2.582 -7.693 1.00 0.00 N ATOM 726 CA THR A 46 -6.467 1.645 -6.696 1.00 0.00 C ATOM 727 C THR A 46 -7.604 1.201 -5.775 1.00 0.00 C ATOM 728 O THR A 46 -7.592 0.084 -5.260 1.00 0.00 O ATOM 729 CB THR A 46 -5.307 2.311 -5.953 1.00 0.00 C ATOM 730 OG1 THR A 46 -4.233 2.282 -6.890 1.00 0.00 O ATOM 731 CG2 THR A 46 -4.801 1.468 -4.781 1.00 0.00 C ATOM 0 H THR A 46 -6.607 3.534 -7.593 1.00 0.00 H new ATOM 0 HA THR A 46 -6.093 0.733 -7.161 1.00 0.00 H new ATOM 0 HB THR A 46 -5.623 3.288 -5.587 1.00 0.00 H new ATOM 0 HG1 THR A 46 -3.464 2.766 -6.522 1.00 0.00 H new ATOM 0 HG21 THR A 46 -3.978 1.986 -4.288 1.00 0.00 H new ATOM 0 HG22 THR A 46 -5.611 1.313 -4.068 1.00 0.00 H new ATOM 0 HG23 THR A 46 -4.453 0.503 -5.150 1.00 0.00 H new ATOM 739 N GLU A 47 -8.561 2.099 -5.592 1.00 0.00 N ATOM 740 CA GLU A 47 -9.703 1.816 -4.740 1.00 0.00 C ATOM 741 C GLU A 47 -10.573 0.723 -5.367 1.00 0.00 C ATOM 742 O GLU A 47 -11.122 -0.120 -4.660 1.00 0.00 O ATOM 743 CB GLU A 47 -10.519 3.083 -4.475 1.00 0.00 C ATOM 744 CG GLU A 47 -11.791 2.760 -3.690 1.00 0.00 C ATOM 745 CD GLU A 47 -12.317 4.000 -2.963 1.00 0.00 C ATOM 746 OE1 GLU A 47 -12.415 5.078 -3.568 1.00 0.00 O ATOM 747 OE2 GLU A 47 -12.628 3.815 -1.725 1.00 0.00 O ATOM 0 H GLU A 47 -8.569 3.025 -6.020 1.00 0.00 H new ATOM 0 HA GLU A 47 -9.335 1.455 -3.780 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -9.915 3.799 -3.918 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -10.781 3.556 -5.421 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -12.555 2.381 -4.369 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -11.586 1.970 -2.967 1.00 0.00 H new ATOM 755 N LYS A 48 -10.671 0.774 -6.688 1.00 0.00 N ATOM 756 CA LYS A 48 -11.466 -0.200 -7.416 1.00 0.00 C ATOM 757 C LYS A 48 -10.677 -1.505 -7.537 1.00 0.00 C ATOM 758 O LYS A 48 -11.263 -2.585 -7.590 1.00 0.00 O ATOM 759 CB LYS A 48 -11.913 0.375 -8.762 1.00 0.00 C ATOM 760 CG LYS A 48 -12.576 -0.701 -9.624 1.00 0.00 C ATOM 761 CD LYS A 48 -13.974 -0.265 -10.069 1.00 0.00 C ATOM 762 CE LYS A 48 -14.577 -1.273 -11.050 1.00 0.00 C ATOM 763 NZ LYS A 48 -15.525 -0.600 -11.965 1.00 0.00 N ATOM 0 H LYS A 48 -10.213 1.474 -7.272 1.00 0.00 H new ATOM 0 HA LYS A 48 -12.382 -0.429 -6.872 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -12.611 1.196 -8.597 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -11.053 0.789 -9.288 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -11.958 -0.902 -10.499 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -12.644 -1.632 -9.061 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -14.622 -0.167 -9.198 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -13.920 0.717 -10.539 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -13.783 -1.750 -11.625 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -15.090 -2.062 -10.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -15.926 -1.297 -12.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -16.292 -0.166 -11.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -15.025 0.137 -12.502 1.00 0.00 H new ATOM 776 N TRP A 49 -9.361 -1.363 -7.578 1.00 0.00 N ATOM 777 CA TRP A 49 -8.486 -2.518 -7.691 1.00 0.00 C ATOM 778 C TRP A 49 -8.398 -3.182 -6.315 1.00 0.00 C ATOM 779 O TRP A 49 -8.219 -4.395 -6.218 1.00 0.00 O ATOM 780 CB TRP A 49 -7.120 -2.119 -8.251 1.00 0.00 C ATOM 781 CG TRP A 49 -7.159 -1.632 -9.700 1.00 0.00 C ATOM 782 CD1 TRP A 49 -8.224 -1.529 -10.508 1.00 0.00 C ATOM 783 CD2 TRP A 49 -6.035 -1.181 -10.486 1.00 0.00 C ATOM 784 NE1 TRP A 49 -7.871 -1.048 -11.752 1.00 0.00 N ATOM 785 CE2 TRP A 49 -6.497 -0.830 -11.739 1.00 0.00 C ATOM 786 CE3 TRP A 49 -4.674 -1.076 -10.152 1.00 0.00 C ATOM 787 CZ2 TRP A 49 -5.664 -0.348 -12.756 1.00 0.00 C ATOM 788 CZ3 TRP A 49 -3.854 -0.592 -11.178 1.00 0.00 C ATOM 789 CH2 TRP A 49 -4.304 -0.235 -12.444 1.00 0.00 C ATOM 0 H TRP A 49 -8.879 -0.465 -7.535 1.00 0.00 H new ATOM 0 HA TRP A 49 -8.891 -3.240 -8.400 1.00 0.00 H new ATOM 0 HB2 TRP A 49 -6.698 -1.332 -7.625 1.00 0.00 H new ATOM 0 HB3 TRP A 49 -6.448 -2.974 -8.184 1.00 0.00 H new ATOM 0 HD1 TRP A 49 -9.232 -1.790 -10.221 1.00 0.00 H new ATOM 0 HE1 TRP A 49 -8.501 -0.883 -12.537 1.00 0.00 H new ATOM 0 HE3 TRP A 49 -4.291 -1.348 -9.180 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 -6.050 -0.078 -13.728 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 -2.799 -0.489 -10.972 1.00 0.00 H new ATOM 0 HH2 TRP A 49 -3.607 0.128 -13.184 1.00 0.00 H new ATOM 800 N ALA A 50 -8.529 -2.357 -5.287 1.00 0.00 N ATOM 801 CA ALA A 50 -8.466 -2.849 -3.921 1.00 0.00 C ATOM 802 C ALA A 50 -9.787 -3.539 -3.571 1.00 0.00 C ATOM 803 O ALA A 50 -9.864 -4.276 -2.589 1.00 0.00 O ATOM 804 CB ALA A 50 -8.145 -1.689 -2.974 1.00 0.00 C ATOM 0 H ALA A 50 -8.678 -1.352 -5.372 1.00 0.00 H new ATOM 0 HA ALA A 50 -7.670 -3.586 -3.815 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -8.098 -2.058 -1.949 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -7.185 -1.252 -3.247 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -8.924 -0.930 -3.051 1.00 0.00 H new ATOM 810 N GLN A 51 -10.792 -3.274 -4.392 1.00 0.00 N ATOM 811 CA GLN A 51 -12.105 -3.859 -4.182 1.00 0.00 C ATOM 812 C GLN A 51 -12.431 -4.848 -5.304 1.00 0.00 C ATOM 813 O GLN A 51 -13.542 -5.373 -5.369 1.00 0.00 O ATOM 814 CB GLN A 51 -13.179 -2.775 -4.077 1.00 0.00 C ATOM 815 CG GLN A 51 -13.704 -2.388 -5.460 1.00 0.00 C ATOM 816 CD GLN A 51 -15.044 -3.067 -5.749 1.00 0.00 C ATOM 817 OE1 GLN A 51 -15.483 -3.959 -5.041 1.00 0.00 O ATOM 818 NE2 GLN A 51 -15.668 -2.598 -6.825 1.00 0.00 N ATOM 0 H GLN A 51 -10.723 -2.661 -5.205 1.00 0.00 H new ATOM 0 HA GLN A 51 -12.092 -4.402 -3.237 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -14.002 -3.132 -3.459 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -12.766 -1.896 -3.582 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -13.821 -1.306 -5.519 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -12.977 -2.672 -6.221 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -15.245 -1.850 -7.374 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -16.570 -2.987 -7.101 1.00 0.00 H new ATOM 827 N ASP A 52 -11.444 -5.071 -6.159 1.00 0.00 N ATOM 828 CA ASP A 52 -11.611 -5.986 -7.274 1.00 0.00 C ATOM 829 C ASP A 52 -11.566 -7.426 -6.757 1.00 0.00 C ATOM 830 O ASP A 52 -10.644 -7.800 -6.035 1.00 0.00 O ATOM 831 CB ASP A 52 -10.490 -5.816 -8.299 1.00 0.00 C ATOM 832 CG ASP A 52 -10.201 -7.053 -9.153 1.00 0.00 C ATOM 833 OD1 ASP A 52 -11.120 -7.783 -9.552 1.00 0.00 O ATOM 834 OD2 ASP A 52 -8.952 -7.259 -9.408 1.00 0.00 O ATOM 0 H ASP A 52 -10.525 -4.633 -6.101 1.00 0.00 H new ATOM 0 HA ASP A 52 -12.568 -5.769 -7.748 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -10.745 -4.988 -8.960 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -9.577 -5.534 -7.774 1.00 0.00 H new ATOM 840 N ALA A 53 -12.573 -8.193 -7.149 1.00 0.00 N ATOM 841 CA ALA A 53 -12.659 -9.584 -6.735 1.00 0.00 C ATOM 842 C ALA A 53 -11.332 -10.284 -7.036 1.00 0.00 C ATOM 843 O ALA A 53 -10.760 -10.939 -6.167 1.00 0.00 O ATOM 844 CB ALA A 53 -13.843 -10.252 -7.435 1.00 0.00 C ATOM 0 H ALA A 53 -13.336 -7.878 -7.748 1.00 0.00 H new ATOM 0 HA ALA A 53 -12.833 -9.655 -5.661 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -13.908 -11.295 -7.125 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -14.764 -9.735 -7.165 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -13.702 -10.203 -8.515 1.00 0.00 H new ATOM 850 N LYS A 54 -10.882 -10.122 -8.273 1.00 0.00 N ATOM 851 CA LYS A 54 -9.633 -10.731 -8.699 1.00 0.00 C ATOM 852 C LYS A 54 -8.539 -10.409 -7.680 1.00 0.00 C ATOM 853 O LYS A 54 -7.754 -11.282 -7.311 1.00 0.00 O ATOM 854 CB LYS A 54 -9.289 -10.303 -10.127 1.00 0.00 C ATOM 855 CG LYS A 54 -9.128 -11.518 -11.042 1.00 0.00 C ATOM 856 CD LYS A 54 -10.485 -11.989 -11.570 1.00 0.00 C ATOM 857 CE LYS A 54 -10.435 -12.218 -13.081 1.00 0.00 C ATOM 858 NZ LYS A 54 -11.730 -12.745 -13.568 1.00 0.00 N ATOM 0 H LYS A 54 -11.359 -9.579 -8.992 1.00 0.00 H new ATOM 0 HA LYS A 54 -9.729 -11.816 -8.730 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -10.074 -9.654 -10.514 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -8.367 -9.722 -10.124 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -8.476 -11.265 -11.878 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -8.645 -12.328 -10.496 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -10.774 -12.912 -11.068 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -11.248 -11.247 -11.336 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -10.202 -11.282 -13.589 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -9.636 -12.919 -13.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -11.679 -12.895 -14.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -11.937 -13.648 -13.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -12.485 -12.062 -13.355 1.00 0.00 H new ATOM 871 N PHE A 55 -8.523 -9.156 -7.252 1.00 0.00 N ATOM 872 CA PHE A 55 -7.538 -8.709 -6.282 1.00 0.00 C ATOM 873 C PHE A 55 -7.904 -9.178 -4.873 1.00 0.00 C ATOM 874 O PHE A 55 -7.028 -9.368 -4.029 1.00 0.00 O ATOM 875 CB PHE A 55 -7.541 -7.179 -6.313 1.00 0.00 C ATOM 876 CG PHE A 55 -6.178 -6.560 -6.625 1.00 0.00 C ATOM 877 CD1 PHE A 55 -5.053 -7.077 -6.063 1.00 0.00 C ATOM 878 CD2 PHE A 55 -6.091 -5.493 -7.463 1.00 0.00 C ATOM 879 CE1 PHE A 55 -3.786 -6.502 -6.352 1.00 0.00 C ATOM 880 CE2 PHE A 55 -4.825 -4.917 -7.753 1.00 0.00 C ATOM 881 CZ PHE A 55 -3.700 -5.435 -7.190 1.00 0.00 C ATOM 0 H PHE A 55 -9.177 -8.436 -7.559 1.00 0.00 H new ATOM 0 HA PHE A 55 -6.559 -9.119 -6.530 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -8.261 -6.842 -7.059 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -7.885 -6.807 -5.348 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -5.122 -7.924 -5.397 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -6.985 -5.083 -7.909 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -2.892 -6.912 -5.906 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -4.756 -4.070 -8.419 1.00 0.00 H new ATOM 0 HZ PHE A 55 -2.737 -4.998 -7.409 1.00 0.00 H new ATOM 891 N SER A 56 -9.200 -9.354 -4.659 1.00 0.00 N ATOM 892 CA SER A 56 -9.693 -9.799 -3.367 1.00 0.00 C ATOM 893 C SER A 56 -8.859 -10.979 -2.867 1.00 0.00 C ATOM 894 O SER A 56 -8.596 -11.097 -1.671 1.00 0.00 O ATOM 895 CB SER A 56 -11.170 -10.186 -3.444 1.00 0.00 C ATOM 896 OG SER A 56 -11.750 -10.346 -2.152 1.00 0.00 O ATOM 0 H SER A 56 -9.924 -9.196 -5.360 1.00 0.00 H new ATOM 0 HA SER A 56 -9.599 -8.973 -2.662 1.00 0.00 H new ATOM 0 HB2 SER A 56 -11.717 -9.420 -3.994 1.00 0.00 H new ATOM 0 HB3 SER A 56 -11.272 -11.115 -4.004 1.00 0.00 H new ATOM 0 HG SER A 56 -12.694 -10.592 -2.245 1.00 0.00 H new ATOM 902 N SER A 57 -8.467 -11.825 -3.808 1.00 0.00 N ATOM 903 CA SER A 57 -7.668 -12.994 -3.477 1.00 0.00 C ATOM 904 C SER A 57 -6.642 -12.640 -2.401 1.00 0.00 C ATOM 905 O SER A 57 -6.579 -13.288 -1.358 1.00 0.00 O ATOM 906 CB SER A 57 -6.966 -13.550 -4.718 1.00 0.00 C ATOM 907 OG SER A 57 -5.944 -14.484 -4.381 1.00 0.00 O ATOM 0 H SER A 57 -8.687 -11.725 -4.799 1.00 0.00 H new ATOM 0 HA SER A 57 -8.335 -13.766 -3.093 1.00 0.00 H new ATOM 0 HB2 SER A 57 -7.700 -14.033 -5.363 1.00 0.00 H new ATOM 0 HB3 SER A 57 -6.532 -12.728 -5.288 1.00 0.00 H new ATOM 0 HG SER A 57 -5.522 -14.816 -5.200 1.00 0.00 H new ATOM 913 N ALA A 58 -5.859 -11.608 -2.690 1.00 0.00 N ATOM 914 CA ALA A 58 -4.839 -11.160 -1.761 1.00 0.00 C ATOM 915 C ALA A 58 -5.262 -9.822 -1.151 1.00 0.00 C ATOM 916 O ALA A 58 -6.173 -9.166 -1.655 1.00 0.00 O ATOM 917 CB ALA A 58 -3.493 -11.071 -2.482 1.00 0.00 C ATOM 0 H ALA A 58 -5.913 -11.071 -3.556 1.00 0.00 H new ATOM 0 HA ALA A 58 -4.725 -11.874 -0.945 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -2.727 -10.734 -1.783 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -3.223 -12.053 -2.871 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -3.568 -10.362 -3.307 1.00 0.00 H new ATOM 923 N ASN A 59 -4.581 -9.455 -0.075 1.00 0.00 N ATOM 924 CA ASN A 59 -4.875 -8.207 0.606 1.00 0.00 C ATOM 925 C ASN A 59 -4.033 -7.086 -0.003 1.00 0.00 C ATOM 926 O ASN A 59 -2.806 -7.170 -0.031 1.00 0.00 O ATOM 927 CB ASN A 59 -4.533 -8.299 2.095 1.00 0.00 C ATOM 928 CG ASN A 59 -5.001 -9.630 2.684 1.00 0.00 C ATOM 929 OD1 ASN A 59 -6.146 -10.028 2.552 1.00 0.00 O ATOM 930 ND2 ASN A 59 -4.054 -10.295 3.341 1.00 0.00 N ATOM 0 H ASN A 59 -3.827 -10.001 0.341 1.00 0.00 H new ATOM 0 HA ASN A 59 -5.940 -8.004 0.491 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -3.457 -8.195 2.231 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -5.003 -7.475 2.631 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -4.268 -11.195 3.771 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -3.114 -9.905 3.414 1.00 0.00 H new ATOM 937 N LEU A 60 -4.725 -6.061 -0.479 1.00 0.00 N ATOM 938 CA LEU A 60 -4.056 -4.923 -1.088 1.00 0.00 C ATOM 939 C LEU A 60 -4.258 -3.687 -0.208 1.00 0.00 C ATOM 940 O LEU A 60 -5.374 -3.408 0.229 1.00 0.00 O ATOM 941 CB LEU A 60 -4.526 -4.735 -2.532 1.00 0.00 C ATOM 942 CG LEU A 60 -3.977 -3.508 -3.262 1.00 0.00 C ATOM 943 CD1 LEU A 60 -4.352 -3.537 -4.743 1.00 0.00 C ATOM 944 CD2 LEU A 60 -4.432 -2.215 -2.581 1.00 0.00 C ATOM 0 H LEU A 60 -5.743 -5.995 -0.455 1.00 0.00 H new ATOM 0 HA LEU A 60 -2.982 -5.099 -1.148 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -4.253 -5.624 -3.101 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -5.614 -4.677 -2.534 1.00 0.00 H new ATOM 0 HG LEU A 60 -2.889 -3.537 -3.205 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -3.949 -2.653 -5.238 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -3.938 -4.433 -5.206 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -5.437 -3.546 -4.843 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.028 -1.358 -3.120 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -5.521 -2.165 -2.585 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -4.072 -2.199 -1.552 1.00 0.00 H new ATOM 956 N ILE A 61 -3.162 -2.980 0.025 1.00 0.00 N ATOM 957 CA ILE A 61 -3.205 -1.781 0.843 1.00 0.00 C ATOM 958 C ILE A 61 -2.098 -0.824 0.398 1.00 0.00 C ATOM 959 O ILE A 61 -1.139 -1.239 -0.253 1.00 0.00 O ATOM 960 CB ILE A 61 -3.144 -2.144 2.329 1.00 0.00 C ATOM 961 CG1 ILE A 61 -1.726 -2.553 2.735 1.00 0.00 C ATOM 962 CG2 ILE A 61 -4.172 -3.223 2.673 1.00 0.00 C ATOM 963 CD1 ILE A 61 -1.623 -2.741 4.249 1.00 0.00 C ATOM 0 H ILE A 61 -2.239 -3.215 -0.339 1.00 0.00 H new ATOM 0 HA ILE A 61 -4.152 -1.259 0.704 1.00 0.00 H new ATOM 0 HB ILE A 61 -3.402 -1.257 2.908 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -1.452 -3.480 2.230 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -1.017 -1.792 2.410 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -4.107 -3.462 3.734 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -5.173 -2.858 2.444 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -3.969 -4.119 2.086 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -0.606 -3.031 4.511 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -1.874 -1.806 4.750 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -2.316 -3.520 4.567 1.00 0.00 H new ATOM 975 N THR A 62 -2.265 0.437 0.767 1.00 0.00 N ATOM 976 CA THR A 62 -1.292 1.456 0.413 1.00 0.00 C ATOM 977 C THR A 62 -0.581 1.971 1.665 1.00 0.00 C ATOM 978 O THR A 62 -1.172 2.022 2.743 1.00 0.00 O ATOM 979 CB THR A 62 -2.018 2.552 -0.368 1.00 0.00 C ATOM 980 OG1 THR A 62 -2.905 3.128 0.586 1.00 0.00 O ATOM 981 CG2 THR A 62 -2.944 1.988 -1.447 1.00 0.00 C ATOM 0 H THR A 62 -3.060 0.777 1.308 1.00 0.00 H new ATOM 0 HA THR A 62 -0.507 1.049 -0.224 1.00 0.00 H new ATOM 0 HB THR A 62 -1.286 3.214 -0.830 1.00 0.00 H new ATOM 0 HG1 THR A 62 -3.803 2.756 0.464 1.00 0.00 H new ATOM 0 HG21 THR A 62 -3.434 2.809 -1.971 1.00 0.00 H new ATOM 0 HG22 THR A 62 -2.361 1.401 -2.157 1.00 0.00 H new ATOM 0 HG23 THR A 62 -3.698 1.352 -0.983 1.00 0.00 H new ATOM 989 N VAL A 63 0.678 2.342 1.482 1.00 0.00 N ATOM 990 CA VAL A 63 1.476 2.853 2.584 1.00 0.00 C ATOM 991 C VAL A 63 1.897 4.291 2.280 1.00 0.00 C ATOM 992 O VAL A 63 2.164 4.635 1.130 1.00 0.00 O ATOM 993 CB VAL A 63 2.665 1.924 2.842 1.00 0.00 C ATOM 994 CG1 VAL A 63 3.857 2.703 3.404 1.00 0.00 C ATOM 995 CG2 VAL A 63 2.272 0.776 3.774 1.00 0.00 C ATOM 0 H VAL A 63 1.165 2.299 0.587 1.00 0.00 H new ATOM 0 HA VAL A 63 0.890 2.874 3.503 1.00 0.00 H new ATOM 0 HB VAL A 63 2.966 1.492 1.888 1.00 0.00 H new ATOM 0 HG11 VAL A 63 4.688 2.020 3.578 1.00 0.00 H new ATOM 0 HG12 VAL A 63 4.160 3.469 2.690 1.00 0.00 H new ATOM 0 HG13 VAL A 63 3.572 3.176 4.344 1.00 0.00 H new ATOM 0 HG21 VAL A 63 3.135 0.131 3.941 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.932 1.181 4.727 1.00 0.00 H new ATOM 0 HG23 VAL A 63 1.469 0.197 3.319 1.00 0.00 H new ATOM 1005 N ALA A 64 1.942 5.096 3.332 1.00 0.00 N ATOM 1006 CA ALA A 64 2.326 6.490 3.193 1.00 0.00 C ATOM 1007 C ALA A 64 3.326 6.853 4.291 1.00 0.00 C ATOM 1008 O ALA A 64 3.204 6.390 5.425 1.00 0.00 O ATOM 1009 CB ALA A 64 1.073 7.370 3.230 1.00 0.00 C ATOM 0 H ALA A 64 1.719 4.809 4.285 1.00 0.00 H new ATOM 0 HA ALA A 64 2.816 6.659 2.234 1.00 0.00 H new ATOM 0 HB1 ALA A 64 1.360 8.416 3.126 1.00 0.00 H new ATOM 0 HB2 ALA A 64 0.409 7.093 2.411 1.00 0.00 H new ATOM 0 HB3 ALA A 64 0.557 7.228 4.179 1.00 0.00 H new ATOM 1015 N SER A 65 4.293 7.677 3.918 1.00 0.00 N ATOM 1016 CA SER A 65 5.315 8.106 4.859 1.00 0.00 C ATOM 1017 C SER A 65 5.275 9.629 5.016 1.00 0.00 C ATOM 1018 O SER A 65 5.657 10.360 4.105 1.00 0.00 O ATOM 1019 CB SER A 65 6.705 7.657 4.406 1.00 0.00 C ATOM 1020 OG SER A 65 6.760 6.254 4.165 1.00 0.00 O ATOM 0 H SER A 65 4.391 8.059 2.978 1.00 0.00 H new ATOM 0 HA SER A 65 5.109 7.641 5.823 1.00 0.00 H new ATOM 0 HB2 SER A 65 6.981 8.192 3.497 1.00 0.00 H new ATOM 0 HB3 SER A 65 7.438 7.923 5.167 1.00 0.00 H new ATOM 0 HG SER A 65 7.638 6.019 3.797 1.00 0.00 H new ATOM 1026 N PRO A 66 4.796 10.070 6.209 1.00 0.00 N ATOM 1027 CA PRO A 66 4.700 11.490 6.498 1.00 0.00 C ATOM 1028 C PRO A 66 6.080 12.083 6.794 1.00 0.00 C ATOM 1029 O PRO A 66 6.880 11.479 7.504 1.00 0.00 O ATOM 1030 CB PRO A 66 3.746 11.589 7.678 1.00 0.00 C ATOM 1031 CG PRO A 66 3.708 10.203 8.300 1.00 0.00 C ATOM 1032 CD PRO A 66 4.333 9.232 7.312 1.00 0.00 C ATOM 0 HA PRO A 66 4.326 12.067 5.652 1.00 0.00 H new ATOM 0 HB2 PRO A 66 4.091 12.331 8.398 1.00 0.00 H new ATOM 0 HB3 PRO A 66 2.753 11.898 7.352 1.00 0.00 H new ATOM 0 HG2 PRO A 66 4.254 10.193 9.243 1.00 0.00 H new ATOM 0 HG3 PRO A 66 2.681 9.913 8.523 1.00 0.00 H new ATOM 0 HD2 PRO A 66 5.158 8.683 7.765 1.00 0.00 H new ATOM 0 HD3 PRO A 66 3.608 8.493 6.970 1.00 0.00 H new ATOM 1040 N GLY A 67 6.316 13.260 6.230 1.00 0.00 N ATOM 1041 CA GLY A 67 7.583 13.942 6.424 1.00 0.00 C ATOM 1042 C GLY A 67 8.723 13.187 5.733 1.00 0.00 C ATOM 1043 O GLY A 67 9.892 13.522 5.914 1.00 0.00 O ATOM 0 H GLY A 67 5.650 13.757 5.639 1.00 0.00 H new ATOM 0 HA2 GLY A 67 7.520 14.955 6.027 1.00 0.00 H new ATOM 0 HA3 GLY A 67 7.794 14.030 7.490 1.00 0.00 H new ATOM 1047 N PHE A 68 8.340 12.184 4.957 1.00 0.00 N ATOM 1048 CA PHE A 68 9.313 11.380 4.240 1.00 0.00 C ATOM 1049 C PHE A 68 9.097 11.476 2.728 1.00 0.00 C ATOM 1050 O PHE A 68 7.972 11.339 2.249 1.00 0.00 O ATOM 1051 CB PHE A 68 9.108 9.929 4.680 1.00 0.00 C ATOM 1052 CG PHE A 68 10.192 8.969 4.186 1.00 0.00 C ATOM 1053 CD1 PHE A 68 11.462 9.073 4.660 1.00 0.00 C ATOM 1054 CD2 PHE A 68 9.885 8.013 3.269 1.00 0.00 C ATOM 1055 CE1 PHE A 68 12.467 8.181 4.201 1.00 0.00 C ATOM 1056 CE2 PHE A 68 10.890 7.121 2.808 1.00 0.00 C ATOM 1057 CZ PHE A 68 12.161 7.225 3.285 1.00 0.00 C ATOM 0 H PHE A 68 7.369 11.910 4.809 1.00 0.00 H new ATOM 0 HA PHE A 68 10.320 11.733 4.460 1.00 0.00 H new ATOM 0 HB2 PHE A 68 9.073 9.892 5.769 1.00 0.00 H new ATOM 0 HB3 PHE A 68 8.139 9.584 4.318 1.00 0.00 H new ATOM 0 HD1 PHE A 68 11.707 9.834 5.386 1.00 0.00 H new ATOM 0 HD2 PHE A 68 8.877 7.932 2.891 1.00 0.00 H new ATOM 0 HE1 PHE A 68 13.475 8.262 4.580 1.00 0.00 H new ATOM 0 HE2 PHE A 68 10.646 6.361 2.080 1.00 0.00 H new ATOM 0 HZ PHE A 68 12.926 6.548 2.935 1.00 0.00 H new ATOM 1067 N LEU A 69 10.191 11.712 2.019 1.00 0.00 N ATOM 1068 CA LEU A 69 10.135 11.827 0.572 1.00 0.00 C ATOM 1069 C LEU A 69 9.414 13.123 0.197 1.00 0.00 C ATOM 1070 O LEU A 69 8.598 13.140 -0.725 1.00 0.00 O ATOM 1071 CB LEU A 69 9.507 10.575 -0.042 1.00 0.00 C ATOM 1072 CG LEU A 69 10.438 9.704 -0.890 1.00 0.00 C ATOM 1073 CD1 LEU A 69 10.983 10.487 -2.085 1.00 0.00 C ATOM 1074 CD2 LEU A 69 11.559 9.108 -0.034 1.00 0.00 C ATOM 0 H LEU A 69 11.122 11.827 2.420 1.00 0.00 H new ATOM 0 HA LEU A 69 11.140 11.887 0.155 1.00 0.00 H new ATOM 0 HB2 LEU A 69 9.103 9.962 0.764 1.00 0.00 H new ATOM 0 HB3 LEU A 69 8.664 10.882 -0.662 1.00 0.00 H new ATOM 0 HG LEU A 69 9.859 8.871 -1.289 1.00 0.00 H new ATOM 0 HD11 LEU A 69 11.641 9.845 -2.671 1.00 0.00 H new ATOM 0 HD12 LEU A 69 10.154 10.823 -2.709 1.00 0.00 H new ATOM 0 HD13 LEU A 69 11.542 11.352 -1.729 1.00 0.00 H new ATOM 0 HD21 LEU A 69 12.207 8.493 -0.659 1.00 0.00 H new ATOM 0 HD22 LEU A 69 12.143 9.913 0.413 1.00 0.00 H new ATOM 0 HD23 LEU A 69 11.126 8.493 0.755 1.00 0.00 H new ATOM 1086 N HIS A 70 9.740 14.178 0.928 1.00 0.00 N ATOM 1087 CA HIS A 70 9.135 15.476 0.684 1.00 0.00 C ATOM 1088 C HIS A 70 7.625 15.390 0.922 1.00 0.00 C ATOM 1089 O HIS A 70 6.869 16.235 0.444 1.00 0.00 O ATOM 1090 CB HIS A 70 9.487 15.985 -0.715 1.00 0.00 C ATOM 1091 CG HIS A 70 10.871 16.578 -0.822 1.00 0.00 C ATOM 1092 ND1 HIS A 70 12.013 15.803 -0.924 1.00 0.00 N ATOM 1093 CD2 HIS A 70 11.284 17.878 -0.844 1.00 0.00 C ATOM 1094 CE1 HIS A 70 13.061 16.611 -1.001 1.00 0.00 C ATOM 1095 NE2 HIS A 70 12.608 17.896 -0.951 1.00 0.00 N ATOM 0 H HIS A 70 10.417 14.160 1.691 1.00 0.00 H new ATOM 0 HA HIS A 70 9.538 16.207 1.385 1.00 0.00 H new ATOM 0 HB2 HIS A 70 9.400 15.161 -1.423 1.00 0.00 H new ATOM 0 HB3 HIS A 70 8.756 16.738 -1.011 1.00 0.00 H new ATOM 0 HD2 HIS A 70 10.643 18.745 -0.785 1.00 0.00 H new ATOM 0 HE1 HIS A 70 14.093 16.305 -1.088 1.00 0.00 H new ATOM 0 HE2 HIS A 70 13.190 18.733 -0.989 1.00 0.00 H new ATOM 1104 N GLU A 71 7.233 14.363 1.659 1.00 0.00 N ATOM 1105 CA GLU A 71 5.827 14.156 1.966 1.00 0.00 C ATOM 1106 C GLU A 71 5.412 15.016 3.161 1.00 0.00 C ATOM 1107 O GLU A 71 6.261 15.476 3.923 1.00 0.00 O ATOM 1108 CB GLU A 71 5.535 12.678 2.226 1.00 0.00 C ATOM 1109 CG GLU A 71 4.031 12.432 2.367 1.00 0.00 C ATOM 1110 CD GLU A 71 3.267 13.009 1.173 1.00 0.00 C ATOM 1111 OE1 GLU A 71 2.142 13.501 1.336 1.00 0.00 O ATOM 1112 OE2 GLU A 71 3.886 12.936 0.043 1.00 0.00 O ATOM 0 H GLU A 71 7.863 13.665 2.053 1.00 0.00 H new ATOM 0 HA GLU A 71 5.238 14.462 1.102 1.00 0.00 H new ATOM 0 HB2 GLU A 71 5.930 12.076 1.408 1.00 0.00 H new ATOM 0 HB3 GLU A 71 6.046 12.357 3.134 1.00 0.00 H new ATOM 0 HG2 GLU A 71 3.839 11.362 2.443 1.00 0.00 H new ATOM 0 HG3 GLU A 71 3.669 12.887 3.289 1.00 0.00 H new ATOM 1120 N LYS A 72 4.107 15.207 3.287 1.00 0.00 N ATOM 1121 CA LYS A 72 3.569 16.005 4.377 1.00 0.00 C ATOM 1122 C LYS A 72 3.930 15.346 5.711 1.00 0.00 C ATOM 1123 O LYS A 72 3.896 14.123 5.833 1.00 0.00 O ATOM 1124 CB LYS A 72 2.068 16.226 4.189 1.00 0.00 C ATOM 1125 CG LYS A 72 1.754 17.710 3.987 1.00 0.00 C ATOM 1126 CD LYS A 72 1.832 18.091 2.507 1.00 0.00 C ATOM 1127 CE LYS A 72 2.565 19.422 2.321 1.00 0.00 C ATOM 1128 NZ LYS A 72 3.910 19.196 1.745 1.00 0.00 N ATOM 0 H LYS A 72 3.406 14.823 2.653 1.00 0.00 H new ATOM 0 HA LYS A 72 4.017 16.999 4.379 1.00 0.00 H new ATOM 0 HB2 LYS A 72 1.718 15.656 3.329 1.00 0.00 H new ATOM 0 HB3 LYS A 72 1.530 15.852 5.060 1.00 0.00 H new ATOM 0 HG2 LYS A 72 0.758 17.930 4.371 1.00 0.00 H new ATOM 0 HG3 LYS A 72 2.457 18.315 4.559 1.00 0.00 H new ATOM 0 HD2 LYS A 72 2.348 17.307 1.953 1.00 0.00 H new ATOM 0 HD3 LYS A 72 0.826 18.165 2.093 1.00 0.00 H new ATOM 0 HE2 LYS A 72 1.987 20.074 1.666 1.00 0.00 H new ATOM 0 HE3 LYS A 72 2.654 19.932 3.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 4.394 20.109 1.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 4.464 18.591 2.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 3.818 18.729 0.820 1.00 0.00 H new ATOM 1141 N LYS A 73 4.269 16.188 6.676 1.00 0.00 N ATOM 1142 CA LYS A 73 4.636 15.704 7.997 1.00 0.00 C ATOM 1143 C LYS A 73 3.424 15.031 8.643 1.00 0.00 C ATOM 1144 O LYS A 73 2.289 15.260 8.230 1.00 0.00 O ATOM 1145 CB LYS A 73 5.233 16.836 8.836 1.00 0.00 C ATOM 1146 CG LYS A 73 5.895 16.289 10.102 1.00 0.00 C ATOM 1147 CD LYS A 73 6.810 17.336 10.738 1.00 0.00 C ATOM 1148 CE LYS A 73 7.001 17.065 12.232 1.00 0.00 C ATOM 1149 NZ LYS A 73 7.558 18.257 12.908 1.00 0.00 N ATOM 0 H LYS A 73 4.297 17.202 6.570 1.00 0.00 H new ATOM 0 HA LYS A 73 5.418 14.948 7.923 1.00 0.00 H new ATOM 0 HB2 LYS A 73 5.967 17.383 8.245 1.00 0.00 H new ATOM 0 HB3 LYS A 73 4.450 17.544 9.107 1.00 0.00 H new ATOM 0 HG2 LYS A 73 5.129 15.988 10.817 1.00 0.00 H new ATOM 0 HG3 LYS A 73 6.472 15.397 9.859 1.00 0.00 H new ATOM 0 HD2 LYS A 73 7.778 17.330 10.237 1.00 0.00 H new ATOM 0 HD3 LYS A 73 6.384 18.330 10.597 1.00 0.00 H new ATOM 0 HE2 LYS A 73 6.046 16.796 12.684 1.00 0.00 H new ATOM 0 HE3 LYS A 73 7.669 16.215 12.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 7.681 18.056 13.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 8.479 18.496 12.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 6.906 19.059 12.791 1.00 0.00 H new ATOM 1162 N ASP A 74 3.707 14.213 9.647 1.00 0.00 N ATOM 1163 CA ASP A 74 2.654 13.504 10.355 1.00 0.00 C ATOM 1164 C ASP A 74 1.692 14.519 10.975 1.00 0.00 C ATOM 1165 O ASP A 74 2.108 15.598 11.394 1.00 0.00 O ATOM 1166 CB ASP A 74 3.229 12.647 11.483 1.00 0.00 C ATOM 1167 CG ASP A 74 2.246 12.308 12.605 1.00 0.00 C ATOM 1168 OD1 ASP A 74 1.779 13.195 13.335 1.00 0.00 O ATOM 1169 OD2 ASP A 74 1.957 11.057 12.717 1.00 0.00 O ATOM 0 H ASP A 74 4.650 14.026 9.987 1.00 0.00 H new ATOM 0 HA ASP A 74 2.140 12.861 9.641 1.00 0.00 H new ATOM 0 HB2 ASP A 74 3.605 11.717 11.057 1.00 0.00 H new ATOM 0 HB3 ASP A 74 4.084 13.168 11.915 1.00 0.00 H new ATOM 1175 N GLY A 75 0.424 14.136 11.015 1.00 0.00 N ATOM 1176 CA GLY A 75 -0.600 15.000 11.578 1.00 0.00 C ATOM 1177 C GLY A 75 -1.164 15.945 10.517 1.00 0.00 C ATOM 1178 O GLY A 75 -2.356 16.251 10.522 1.00 0.00 O ATOM 0 H GLY A 75 0.083 13.240 10.667 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -1.404 14.393 11.994 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -0.180 15.580 12.400 1.00 0.00 H new ATOM 1182 N ASP A 76 -0.281 16.383 9.631 1.00 0.00 N ATOM 1183 CA ASP A 76 -0.676 17.289 8.564 1.00 0.00 C ATOM 1184 C ASP A 76 -1.421 16.503 7.484 1.00 0.00 C ATOM 1185 O ASP A 76 -2.572 16.807 7.173 1.00 0.00 O ATOM 1186 CB ASP A 76 0.546 17.943 7.917 1.00 0.00 C ATOM 1187 CG ASP A 76 0.945 19.296 8.508 1.00 0.00 C ATOM 1188 OD1 ASP A 76 1.768 19.372 9.432 1.00 0.00 O ATOM 1189 OD2 ASP A 76 0.365 20.317 7.973 1.00 0.00 O ATOM 0 H ASP A 76 0.707 16.128 9.630 1.00 0.00 H new ATOM 0 HA ASP A 76 -1.312 18.062 8.995 1.00 0.00 H new ATOM 0 HB2 ASP A 76 1.392 17.262 8.004 1.00 0.00 H new ATOM 0 HB3 ASP A 76 0.349 18.072 6.853 1.00 0.00 H new ATOM 1195 N PHE A 77 -0.737 15.509 6.941 1.00 0.00 N ATOM 1196 CA PHE A 77 -1.319 14.677 5.902 1.00 0.00 C ATOM 1197 C PHE A 77 -2.615 14.024 6.386 1.00 0.00 C ATOM 1198 O PHE A 77 -3.518 13.764 5.590 1.00 0.00 O ATOM 1199 CB PHE A 77 -0.299 13.582 5.581 1.00 0.00 C ATOM 1200 CG PHE A 77 -0.728 12.644 4.451 1.00 0.00 C ATOM 1201 CD1 PHE A 77 -1.751 11.769 4.645 1.00 0.00 C ATOM 1202 CD2 PHE A 77 -0.088 12.686 3.252 1.00 0.00 C ATOM 1203 CE1 PHE A 77 -2.149 10.898 3.596 1.00 0.00 C ATOM 1204 CE2 PHE A 77 -0.486 11.816 2.203 1.00 0.00 C ATOM 1205 CZ PHE A 77 -1.509 10.940 2.398 1.00 0.00 C ATOM 0 H PHE A 77 0.217 15.260 7.201 1.00 0.00 H new ATOM 0 HA PHE A 77 -1.553 15.283 5.027 1.00 0.00 H new ATOM 0 HB2 PHE A 77 0.648 14.050 5.311 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -0.119 12.993 6.480 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -2.261 11.736 5.597 1.00 0.00 H new ATOM 0 HD2 PHE A 77 0.724 13.382 3.098 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -2.960 10.202 3.751 1.00 0.00 H new ATOM 0 HE2 PHE A 77 0.023 11.849 1.251 1.00 0.00 H new ATOM 0 HZ PHE A 77 -1.812 10.278 1.600 1.00 0.00 H new ATOM 1215 N GLN A 78 -2.667 13.777 7.686 1.00 0.00 N ATOM 1216 CA GLN A 78 -3.838 13.160 8.284 1.00 0.00 C ATOM 1217 C GLN A 78 -4.986 14.167 8.365 1.00 0.00 C ATOM 1218 O GLN A 78 -6.155 13.788 8.304 1.00 0.00 O ATOM 1219 CB GLN A 78 -3.511 12.588 9.665 1.00 0.00 C ATOM 1220 CG GLN A 78 -2.141 11.908 9.667 1.00 0.00 C ATOM 1221 CD GLN A 78 -1.922 11.120 10.960 1.00 0.00 C ATOM 1222 OE1 GLN A 78 -1.001 11.368 11.720 1.00 0.00 O ATOM 1223 NE2 GLN A 78 -2.817 10.158 11.166 1.00 0.00 N ATOM 0 H GLN A 78 -1.917 13.993 8.342 1.00 0.00 H new ATOM 0 HA GLN A 78 -4.152 12.332 7.649 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -3.525 13.387 10.406 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -4.278 11.870 9.956 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -2.062 11.238 8.811 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -1.358 12.659 9.557 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -3.564 10.003 10.489 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -2.756 9.575 12.001 1.00 0.00 H new ATOM 1232 N LYS A 79 -4.615 15.430 8.501 1.00 0.00 N ATOM 1233 CA LYS A 79 -5.598 16.496 8.592 1.00 0.00 C ATOM 1234 C LYS A 79 -6.098 16.844 7.188 1.00 0.00 C ATOM 1235 O LYS A 79 -7.243 17.259 7.018 1.00 0.00 O ATOM 1236 CB LYS A 79 -5.025 17.692 9.354 1.00 0.00 C ATOM 1237 CG LYS A 79 -5.810 17.949 10.642 1.00 0.00 C ATOM 1238 CD LYS A 79 -5.079 17.370 11.855 1.00 0.00 C ATOM 1239 CE LYS A 79 -6.071 16.866 12.905 1.00 0.00 C ATOM 1240 NZ LYS A 79 -6.022 15.390 12.997 1.00 0.00 N ATOM 0 H LYS A 79 -3.645 15.741 8.551 1.00 0.00 H new ATOM 0 HA LYS A 79 -6.463 16.167 9.167 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -3.978 17.508 9.593 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -5.056 18.579 8.722 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -5.953 19.021 10.777 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -6.801 17.502 10.563 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -4.433 16.551 11.538 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -4.435 18.132 12.294 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -5.837 17.305 13.875 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -7.080 17.187 12.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -6.701 15.064 13.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -6.267 14.976 12.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -5.063 15.091 13.267 1.00 0.00 H new ATOM 1253 N TRP A 80 -5.214 16.659 6.218 1.00 0.00 N ATOM 1254 CA TRP A 80 -5.551 16.947 4.835 1.00 0.00 C ATOM 1255 C TRP A 80 -6.554 15.893 4.362 1.00 0.00 C ATOM 1256 O TRP A 80 -7.571 16.226 3.752 1.00 0.00 O ATOM 1257 CB TRP A 80 -4.295 17.006 3.965 1.00 0.00 C ATOM 1258 CG TRP A 80 -4.568 16.892 2.464 1.00 0.00 C ATOM 1259 CD1 TRP A 80 -5.330 17.690 1.702 1.00 0.00 C ATOM 1260 CD2 TRP A 80 -4.051 15.886 1.569 1.00 0.00 C ATOM 1261 NE1 TRP A 80 -5.340 17.273 0.386 1.00 0.00 N ATOM 1262 CE2 TRP A 80 -4.537 16.140 0.304 1.00 0.00 C ATOM 1263 CE3 TRP A 80 -3.199 14.796 1.821 1.00 0.00 C ATOM 1264 CZ2 TRP A 80 -4.229 15.350 -0.810 1.00 0.00 C ATOM 1265 CZ3 TRP A 80 -2.900 14.015 0.698 1.00 0.00 C ATOM 1266 CH2 TRP A 80 -3.382 14.258 -0.582 1.00 0.00 C ATOM 0 H TRP A 80 -4.265 16.313 6.363 1.00 0.00 H new ATOM 0 HA TRP A 80 -6.012 17.931 4.749 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -3.776 17.945 4.159 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -3.622 16.202 4.263 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -5.868 18.551 2.071 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -5.843 17.714 -0.384 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -2.806 14.578 2.803 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -4.623 15.570 -1.791 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -2.249 13.164 0.837 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -3.105 13.607 -1.398 1.00 0.00 H new ATOM 1277 N TYR A 81 -6.236 14.643 4.661 1.00 0.00 N ATOM 1278 CA TYR A 81 -7.097 13.537 4.275 1.00 0.00 C ATOM 1279 C TYR A 81 -8.456 13.633 4.972 1.00 0.00 C ATOM 1280 O TYR A 81 -9.468 13.186 4.433 1.00 0.00 O ATOM 1281 CB TYR A 81 -6.386 12.265 4.741 1.00 0.00 C ATOM 1282 CG TYR A 81 -6.547 11.079 3.790 1.00 0.00 C ATOM 1283 CD1 TYR A 81 -6.473 11.275 2.425 1.00 0.00 C ATOM 1284 CD2 TYR A 81 -6.765 9.813 4.294 1.00 0.00 C ATOM 1285 CE1 TYR A 81 -6.623 10.157 1.528 1.00 0.00 C ATOM 1286 CE2 TYR A 81 -6.916 8.697 3.398 1.00 0.00 C ATOM 1287 CZ TYR A 81 -6.838 8.923 2.060 1.00 0.00 C ATOM 1288 OH TYR A 81 -6.981 7.868 1.213 1.00 0.00 O ATOM 0 H TYR A 81 -5.393 14.370 5.167 1.00 0.00 H new ATOM 0 HA TYR A 81 -7.274 13.545 3.200 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -5.324 12.478 4.863 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -6.769 11.985 5.722 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -6.303 12.266 2.030 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -6.822 9.660 5.362 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -6.566 10.295 0.458 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -7.088 7.702 3.780 1.00 0.00 H new ATOM 0 HH TYR A 81 -6.462 8.030 0.398 1.00 0.00 H new ATOM 1298 N ALA A 82 -8.437 14.217 6.161 1.00 0.00 N ATOM 1299 CA ALA A 82 -9.654 14.376 6.938 1.00 0.00 C ATOM 1300 C ALA A 82 -10.660 15.204 6.136 1.00 0.00 C ATOM 1301 O ALA A 82 -11.853 15.205 6.440 1.00 0.00 O ATOM 1302 CB ALA A 82 -9.320 15.012 8.289 1.00 0.00 C ATOM 0 H ALA A 82 -7.597 14.586 6.606 1.00 0.00 H new ATOM 0 HA ALA A 82 -10.110 13.407 7.140 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -10.234 15.131 8.871 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -8.625 14.371 8.831 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -8.863 15.988 8.128 1.00 0.00 H new ATOM 1308 N GLY A 83 -10.143 15.892 5.127 1.00 0.00 N ATOM 1309 CA GLY A 83 -10.982 16.722 4.280 1.00 0.00 C ATOM 1310 C GLY A 83 -11.243 16.044 2.933 1.00 0.00 C ATOM 1311 O GLY A 83 -11.997 16.561 2.110 1.00 0.00 O ATOM 0 H GLY A 83 -9.154 15.891 4.878 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -11.929 16.919 4.782 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -10.501 17.686 4.118 1.00 0.00 H new ATOM 1315 N LEU A 84 -10.605 14.897 2.751 1.00 0.00 N ATOM 1316 CA LEU A 84 -10.759 14.144 1.518 1.00 0.00 C ATOM 1317 C LEU A 84 -10.020 12.809 1.646 1.00 0.00 C ATOM 1318 O LEU A 84 -8.816 12.784 1.891 1.00 0.00 O ATOM 1319 CB LEU A 84 -10.312 14.981 0.318 1.00 0.00 C ATOM 1320 CG LEU A 84 -8.866 15.479 0.350 1.00 0.00 C ATOM 1321 CD1 LEU A 84 -7.971 14.623 -0.549 1.00 0.00 C ATOM 1322 CD2 LEU A 84 -8.790 16.964 -0.013 1.00 0.00 C ATOM 0 H LEU A 84 -9.981 14.471 3.436 1.00 0.00 H new ATOM 0 HA LEU A 84 -11.810 13.913 1.342 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -10.451 14.388 -0.586 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -10.971 15.845 0.237 1.00 0.00 H new ATOM 0 HG LEU A 84 -8.492 15.376 1.369 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -6.949 14.998 -0.508 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -7.992 13.589 -0.205 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -8.334 14.671 -1.576 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -7.751 17.293 0.017 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -9.189 17.114 -1.016 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -9.375 17.544 0.701 1.00 0.00 H new ATOM 1334 N ASN A 85 -10.775 11.733 1.476 1.00 0.00 N ATOM 1335 CA ASN A 85 -10.207 10.400 1.569 1.00 0.00 C ATOM 1336 C ASN A 85 -11.238 9.376 1.090 1.00 0.00 C ATOM 1337 O ASN A 85 -12.415 9.701 0.934 1.00 0.00 O ATOM 1338 CB ASN A 85 -9.836 10.057 3.013 1.00 0.00 C ATOM 1339 CG ASN A 85 -10.733 10.809 4.001 1.00 0.00 C ATOM 1340 OD1 ASN A 85 -11.825 11.245 3.678 1.00 0.00 O ATOM 1341 ND2 ASN A 85 -10.210 10.934 5.217 1.00 0.00 N ATOM 0 H ASN A 85 -11.775 11.758 1.275 1.00 0.00 H new ATOM 0 HA ASN A 85 -9.310 10.373 0.951 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -9.933 8.983 3.172 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -8.792 10.313 3.195 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -10.730 11.420 5.948 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -9.289 10.544 5.419 1.00 0.00 H new ATOM 1348 N TYR A 86 -10.760 8.161 0.869 1.00 0.00 N ATOM 1349 CA TYR A 86 -11.627 7.087 0.411 1.00 0.00 C ATOM 1350 C TYR A 86 -11.797 6.020 1.495 1.00 0.00 C ATOM 1351 O TYR A 86 -10.853 5.302 1.819 1.00 0.00 O ATOM 1352 CB TYR A 86 -10.923 6.464 -0.796 1.00 0.00 C ATOM 1353 CG TYR A 86 -10.710 7.432 -1.961 1.00 0.00 C ATOM 1354 CD1 TYR A 86 -11.734 7.671 -2.855 1.00 0.00 C ATOM 1355 CD2 TYR A 86 -9.494 8.064 -2.119 1.00 0.00 C ATOM 1356 CE1 TYR A 86 -11.535 8.582 -3.952 1.00 0.00 C ATOM 1357 CE2 TYR A 86 -9.295 8.976 -3.216 1.00 0.00 C ATOM 1358 CZ TYR A 86 -10.324 9.189 -4.078 1.00 0.00 C ATOM 1359 OH TYR A 86 -10.135 10.050 -5.114 1.00 0.00 O ATOM 0 H TYR A 86 -9.784 7.895 0.998 1.00 0.00 H new ATOM 0 HA TYR A 86 -12.617 7.470 0.166 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -9.955 6.076 -0.478 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -11.508 5.614 -1.146 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -12.685 7.174 -2.732 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -8.692 7.875 -1.421 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -12.328 8.779 -4.658 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -8.349 9.479 -3.351 1.00 0.00 H new ATOM 0 HH TYR A 86 -9.224 10.410 -5.078 1.00 0.00 H new ATOM 1369 N PRO A 87 -13.042 5.949 2.040 1.00 0.00 N ATOM 1370 CA PRO A 87 -13.348 4.982 3.079 1.00 0.00 C ATOM 1371 C PRO A 87 -13.486 3.574 2.496 1.00 0.00 C ATOM 1372 O PRO A 87 -13.703 2.612 3.231 1.00 0.00 O ATOM 1373 CB PRO A 87 -14.632 5.487 3.720 1.00 0.00 C ATOM 1374 CG PRO A 87 -15.246 6.453 2.719 1.00 0.00 C ATOM 1375 CD PRO A 87 -14.186 6.784 1.681 1.00 0.00 C ATOM 0 HA PRO A 87 -12.554 4.897 3.820 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -15.312 4.662 3.935 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -14.426 5.985 4.667 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -16.119 6.006 2.244 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -15.585 7.359 3.221 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -14.536 6.563 0.673 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -13.926 7.842 1.704 1.00 0.00 H new ATOM 1383 N LYS A 88 -13.353 3.498 1.179 1.00 0.00 N ATOM 1384 CA LYS A 88 -13.459 2.224 0.490 1.00 0.00 C ATOM 1385 C LYS A 88 -12.100 1.861 -0.111 1.00 0.00 C ATOM 1386 O LYS A 88 -12.020 1.038 -1.024 1.00 0.00 O ATOM 1387 CB LYS A 88 -14.594 2.261 -0.535 1.00 0.00 C ATOM 1388 CG LYS A 88 -15.575 1.109 -0.312 1.00 0.00 C ATOM 1389 CD LYS A 88 -14.915 -0.237 -0.620 1.00 0.00 C ATOM 1390 CE LYS A 88 -15.837 -1.118 -1.464 1.00 0.00 C ATOM 1391 NZ LYS A 88 -17.124 -1.341 -0.766 1.00 0.00 N ATOM 0 H LYS A 88 -13.173 4.298 0.572 1.00 0.00 H new ATOM 0 HA LYS A 88 -13.721 1.432 1.192 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -15.122 3.212 -0.463 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -14.181 2.201 -1.542 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -15.926 1.119 0.720 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -16.450 1.243 -0.947 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -13.977 -0.073 -1.150 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -14.670 -0.748 0.311 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -16.017 -0.645 -2.430 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -15.354 -2.075 -1.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -17.600 -2.172 -1.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -16.947 -1.504 0.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -17.731 -0.504 -0.880 1.00 0.00 H new ATOM 1404 N LEU A 89 -11.064 2.491 0.422 1.00 0.00 N ATOM 1405 CA LEU A 89 -9.713 2.244 -0.050 1.00 0.00 C ATOM 1406 C LEU A 89 -8.770 2.129 1.150 1.00 0.00 C ATOM 1407 O LEU A 89 -8.851 2.924 2.084 1.00 0.00 O ATOM 1408 CB LEU A 89 -9.295 3.314 -1.061 1.00 0.00 C ATOM 1409 CG LEU A 89 -7.871 3.854 -0.915 1.00 0.00 C ATOM 1410 CD1 LEU A 89 -6.852 2.884 -1.515 1.00 0.00 C ATOM 1411 CD2 LEU A 89 -7.752 5.256 -1.516 1.00 0.00 C ATOM 0 H LEU A 89 -11.133 3.173 1.177 1.00 0.00 H new ATOM 0 HA LEU A 89 -9.664 1.296 -0.585 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -9.405 2.901 -2.064 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -9.989 4.151 -0.983 1.00 0.00 H new ATOM 0 HG LEU A 89 -7.646 3.940 0.148 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -5.848 3.292 -1.398 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -6.916 1.925 -1.001 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -7.065 2.742 -2.575 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -6.730 5.616 -1.399 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -8.005 5.220 -2.576 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -8.436 5.931 -1.002 1.00 0.00 H new ATOM 1423 N PRO A 90 -7.877 1.106 1.082 1.00 0.00 N ATOM 1424 CA PRO A 90 -6.921 0.877 2.152 1.00 0.00 C ATOM 1425 C PRO A 90 -5.793 1.910 2.110 1.00 0.00 C ATOM 1426 O PRO A 90 -5.144 2.086 1.079 1.00 0.00 O ATOM 1427 CB PRO A 90 -6.429 -0.546 1.942 1.00 0.00 C ATOM 1428 CG PRO A 90 -6.773 -0.899 0.504 1.00 0.00 C ATOM 1429 CD PRO A 90 -7.753 0.144 -0.009 1.00 0.00 C ATOM 0 HA PRO A 90 -7.363 0.990 3.142 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -5.355 -0.617 2.115 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -6.911 -1.232 2.638 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -5.873 -0.913 -0.111 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -7.212 -1.895 0.450 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -7.384 0.621 -0.917 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -8.716 -0.304 -0.253 1.00 0.00 H new ATOM 1437 N VAL A 91 -5.594 2.567 3.243 1.00 0.00 N ATOM 1438 CA VAL A 91 -4.556 3.579 3.349 1.00 0.00 C ATOM 1439 C VAL A 91 -3.788 3.381 4.658 1.00 0.00 C ATOM 1440 O VAL A 91 -4.373 3.430 5.738 1.00 0.00 O ATOM 1441 CB VAL A 91 -5.171 4.975 3.222 1.00 0.00 C ATOM 1442 CG1 VAL A 91 -4.181 6.052 3.671 1.00 0.00 C ATOM 1443 CG2 VAL A 91 -5.653 5.233 1.794 1.00 0.00 C ATOM 0 H VAL A 91 -6.134 2.419 4.096 1.00 0.00 H new ATOM 0 HA VAL A 91 -3.840 3.478 2.533 1.00 0.00 H new ATOM 0 HB VAL A 91 -6.038 5.022 3.881 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -4.642 7.035 3.571 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -3.908 5.884 4.713 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -3.287 6.006 3.050 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -6.086 6.231 1.731 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -4.810 5.158 1.107 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -6.407 4.493 1.525 1.00 0.00 H new ATOM 1453 N VAL A 92 -2.489 3.161 4.517 1.00 0.00 N ATOM 1454 CA VAL A 92 -1.636 2.955 5.674 1.00 0.00 C ATOM 1455 C VAL A 92 -0.589 4.069 5.736 1.00 0.00 C ATOM 1456 O VAL A 92 -0.013 4.442 4.715 1.00 0.00 O ATOM 1457 CB VAL A 92 -1.017 1.556 5.625 1.00 0.00 C ATOM 1458 CG1 VAL A 92 -0.356 1.202 6.960 1.00 0.00 C ATOM 1459 CG2 VAL A 92 -2.059 0.508 5.235 1.00 0.00 C ATOM 0 H VAL A 92 -2.007 3.121 3.619 1.00 0.00 H new ATOM 0 HA VAL A 92 -2.220 3.006 6.593 1.00 0.00 H new ATOM 0 HB VAL A 92 -0.243 1.559 4.858 1.00 0.00 H new ATOM 0 HG11 VAL A 92 0.076 0.203 6.899 1.00 0.00 H new ATOM 0 HG12 VAL A 92 0.430 1.924 7.180 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -1.103 1.226 7.753 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -1.592 -0.477 5.208 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -2.866 0.507 5.968 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.463 0.745 4.251 1.00 0.00 H new ATOM 1469 N THR A 93 -0.377 4.572 6.943 1.00 0.00 N ATOM 1470 CA THR A 93 0.590 5.636 7.150 1.00 0.00 C ATOM 1471 C THR A 93 1.666 5.194 8.144 1.00 0.00 C ATOM 1472 O THR A 93 1.358 4.836 9.281 1.00 0.00 O ATOM 1473 CB THR A 93 -0.172 6.885 7.597 1.00 0.00 C ATOM 1474 OG1 THR A 93 -1.094 6.402 8.570 1.00 0.00 O ATOM 1475 CG2 THR A 93 -1.061 7.456 6.491 1.00 0.00 C ATOM 0 H THR A 93 -0.858 4.262 7.787 1.00 0.00 H new ATOM 0 HA THR A 93 1.121 5.872 6.228 1.00 0.00 H new ATOM 0 HB THR A 93 0.538 7.646 7.920 1.00 0.00 H new ATOM 0 HG1 THR A 93 -0.616 5.862 9.234 1.00 0.00 H new ATOM 0 HG21 THR A 93 -1.579 8.341 6.861 1.00 0.00 H new ATOM 0 HG22 THR A 93 -0.446 7.728 5.633 1.00 0.00 H new ATOM 0 HG23 THR A 93 -1.793 6.707 6.189 1.00 0.00 H new ATOM 1483 N ASP A 94 2.906 5.232 7.681 1.00 0.00 N ATOM 1484 CA ASP A 94 4.030 4.840 8.515 1.00 0.00 C ATOM 1485 C ASP A 94 4.922 6.056 8.767 1.00 0.00 C ATOM 1486 O ASP A 94 5.575 6.552 7.850 1.00 0.00 O ATOM 1487 CB ASP A 94 4.876 3.767 7.827 1.00 0.00 C ATOM 1488 CG ASP A 94 5.969 3.147 8.701 1.00 0.00 C ATOM 1489 OD1 ASP A 94 6.287 3.659 9.785 1.00 0.00 O ATOM 1490 OD2 ASP A 94 6.510 2.078 8.222 1.00 0.00 O ATOM 0 H ASP A 94 3.158 5.528 6.738 1.00 0.00 H new ATOM 0 HA ASP A 94 3.635 4.444 9.450 1.00 0.00 H new ATOM 0 HB2 ASP A 94 4.216 2.973 7.479 1.00 0.00 H new ATOM 0 HB3 ASP A 94 5.342 4.204 6.944 1.00 0.00 H new ATOM 1496 N ASN A 95 4.921 6.502 10.014 1.00 0.00 N ATOM 1497 CA ASN A 95 5.723 7.651 10.400 1.00 0.00 C ATOM 1498 C ASN A 95 7.199 7.345 10.147 1.00 0.00 C ATOM 1499 O ASN A 95 7.786 6.500 10.820 1.00 0.00 O ATOM 1500 CB ASN A 95 5.553 7.968 11.886 1.00 0.00 C ATOM 1501 CG ASN A 95 6.488 9.100 12.316 1.00 0.00 C ATOM 1502 OD1 ASN A 95 7.700 9.007 12.224 1.00 0.00 O ATOM 1503 ND2 ASN A 95 5.858 10.172 12.789 1.00 0.00 N ATOM 0 H ASN A 95 4.377 6.088 10.771 1.00 0.00 H new ATOM 0 HA ASN A 95 5.393 8.506 9.810 1.00 0.00 H new ATOM 0 HB2 ASN A 95 4.519 8.250 12.085 1.00 0.00 H new ATOM 0 HB3 ASN A 95 5.760 7.076 12.478 1.00 0.00 H new ATOM 0 HD21 ASN A 95 6.394 10.982 13.102 1.00 0.00 H new ATOM 0 HD22 ASN A 95 4.839 10.184 12.839 1.00 0.00 H new ATOM 1510 N GLY A 96 7.760 8.050 9.175 1.00 0.00 N ATOM 1511 CA GLY A 96 9.157 7.864 8.824 1.00 0.00 C ATOM 1512 C GLY A 96 9.317 6.768 7.769 1.00 0.00 C ATOM 1513 O GLY A 96 10.306 6.745 7.038 1.00 0.00 O ATOM 0 H GLY A 96 7.271 8.752 8.619 1.00 0.00 H new ATOM 0 HA2 GLY A 96 9.568 8.800 8.446 1.00 0.00 H new ATOM 0 HA3 GLY A 96 9.728 7.602 9.715 1.00 0.00 H new ATOM 1517 N GLY A 97 8.330 5.886 7.724 1.00 0.00 N ATOM 1518 CA GLY A 97 8.348 4.790 6.770 1.00 0.00 C ATOM 1519 C GLY A 97 9.423 3.764 7.135 1.00 0.00 C ATOM 1520 O GLY A 97 10.461 3.687 6.478 1.00 0.00 O ATOM 0 H GLY A 97 7.512 5.908 8.333 1.00 0.00 H new ATOM 0 HA2 GLY A 97 7.371 4.307 6.747 1.00 0.00 H new ATOM 0 HA3 GLY A 97 8.535 5.178 5.769 1.00 0.00 H new ATOM 1524 N THR A 98 9.138 3.002 8.180 1.00 0.00 N ATOM 1525 CA THR A 98 10.068 1.984 8.639 1.00 0.00 C ATOM 1526 C THR A 98 10.261 0.913 7.564 1.00 0.00 C ATOM 1527 O THR A 98 11.391 0.550 7.241 1.00 0.00 O ATOM 1528 CB THR A 98 9.543 1.426 9.964 1.00 0.00 C ATOM 1529 OG1 THR A 98 9.836 2.449 10.912 1.00 0.00 O ATOM 1530 CG2 THR A 98 10.349 0.222 10.453 1.00 0.00 C ATOM 0 H THR A 98 8.277 3.069 8.722 1.00 0.00 H new ATOM 0 HA THR A 98 11.058 2.405 8.816 1.00 0.00 H new ATOM 0 HB THR A 98 8.498 1.139 9.848 1.00 0.00 H new ATOM 0 HG1 THR A 98 9.527 2.171 11.799 1.00 0.00 H new ATOM 0 HG21 THR A 98 9.935 -0.134 11.396 1.00 0.00 H new ATOM 0 HG22 THR A 98 10.300 -0.575 9.711 1.00 0.00 H new ATOM 0 HG23 THR A 98 11.388 0.516 10.601 1.00 0.00 H new ATOM 1538 N ILE A 99 9.142 0.439 7.038 1.00 0.00 N ATOM 1539 CA ILE A 99 9.174 -0.583 6.005 1.00 0.00 C ATOM 1540 C ILE A 99 9.746 0.016 4.720 1.00 0.00 C ATOM 1541 O ILE A 99 10.503 -0.642 4.007 1.00 0.00 O ATOM 1542 CB ILE A 99 7.789 -1.211 5.829 1.00 0.00 C ATOM 1543 CG1 ILE A 99 7.226 -1.681 7.172 1.00 0.00 C ATOM 1544 CG2 ILE A 99 7.826 -2.338 4.796 1.00 0.00 C ATOM 1545 CD1 ILE A 99 5.761 -1.264 7.328 1.00 0.00 C ATOM 0 H ILE A 99 8.207 0.744 7.308 1.00 0.00 H new ATOM 0 HA ILE A 99 9.833 -1.400 6.297 1.00 0.00 H new ATOM 0 HB ILE A 99 7.113 -0.447 5.447 1.00 0.00 H new ATOM 0 HG12 ILE A 99 7.309 -2.765 7.246 1.00 0.00 H new ATOM 0 HG13 ILE A 99 7.817 -1.260 7.986 1.00 0.00 H new ATOM 0 HG21 ILE A 99 6.830 -2.767 4.690 1.00 0.00 H new ATOM 0 HG22 ILE A 99 8.154 -1.941 3.836 1.00 0.00 H new ATOM 0 HG23 ILE A 99 8.521 -3.111 5.125 1.00 0.00 H new ATOM 0 HD11 ILE A 99 5.385 -1.610 8.291 1.00 0.00 H new ATOM 0 HD12 ILE A 99 5.685 -0.178 7.278 1.00 0.00 H new ATOM 0 HD13 ILE A 99 5.169 -1.707 6.527 1.00 0.00 H new ATOM 1557 N ALA A 100 9.361 1.258 4.461 1.00 0.00 N ATOM 1558 CA ALA A 100 9.827 1.953 3.273 1.00 0.00 C ATOM 1559 C ALA A 100 11.350 2.093 3.334 1.00 0.00 C ATOM 1560 O ALA A 100 12.043 1.802 2.359 1.00 0.00 O ATOM 1561 CB ALA A 100 9.121 3.305 3.163 1.00 0.00 C ATOM 0 H ALA A 100 8.732 1.800 5.053 1.00 0.00 H new ATOM 0 HA ALA A 100 9.584 1.385 2.375 1.00 0.00 H new ATOM 0 HB1 ALA A 100 9.470 3.827 2.272 1.00 0.00 H new ATOM 0 HB2 ALA A 100 8.045 3.149 3.093 1.00 0.00 H new ATOM 0 HB3 ALA A 100 9.344 3.905 4.045 1.00 0.00 H new ATOM 1567 N GLN A 101 11.825 2.541 4.485 1.00 0.00 N ATOM 1568 CA GLN A 101 13.252 2.724 4.686 1.00 0.00 C ATOM 1569 C GLN A 101 13.942 1.369 4.865 1.00 0.00 C ATOM 1570 O GLN A 101 15.100 1.203 4.484 1.00 0.00 O ATOM 1571 CB GLN A 101 13.526 3.639 5.881 1.00 0.00 C ATOM 1572 CG GLN A 101 13.296 5.106 5.510 1.00 0.00 C ATOM 1573 CD GLN A 101 13.689 6.032 6.665 1.00 0.00 C ATOM 1574 OE1 GLN A 101 14.722 5.874 7.295 1.00 0.00 O ATOM 1575 NE2 GLN A 101 12.811 6.999 6.906 1.00 0.00 N ATOM 0 H GLN A 101 11.247 2.783 5.290 1.00 0.00 H new ATOM 0 HA GLN A 101 13.664 3.206 3.799 1.00 0.00 H new ATOM 0 HB2 GLN A 101 12.876 3.364 6.711 1.00 0.00 H new ATOM 0 HB3 GLN A 101 14.553 3.502 6.221 1.00 0.00 H new ATOM 0 HG2 GLN A 101 13.879 5.356 4.624 1.00 0.00 H new ATOM 0 HG3 GLN A 101 12.247 5.261 5.256 1.00 0.00 H new ATOM 0 HE21 GLN A 101 11.966 7.073 6.340 1.00 0.00 H new ATOM 0 HE22 GLN A 101 12.982 7.667 7.658 1.00 0.00 H new ATOM 1584 N SER A 102 13.201 0.435 5.444 1.00 0.00 N ATOM 1585 CA SER A 102 13.726 -0.898 5.678 1.00 0.00 C ATOM 1586 C SER A 102 13.966 -1.608 4.343 1.00 0.00 C ATOM 1587 O SER A 102 14.849 -2.457 4.237 1.00 0.00 O ATOM 1588 CB SER A 102 12.775 -1.719 6.552 1.00 0.00 C ATOM 1589 OG SER A 102 13.248 -3.049 6.752 1.00 0.00 O ATOM 0 H SER A 102 12.241 0.576 5.758 1.00 0.00 H new ATOM 0 HA SER A 102 14.674 -0.804 6.208 1.00 0.00 H new ATOM 0 HB2 SER A 102 12.655 -1.228 7.518 1.00 0.00 H new ATOM 0 HB3 SER A 102 11.790 -1.751 6.086 1.00 0.00 H new ATOM 0 HG SER A 102 12.615 -3.540 7.316 1.00 0.00 H new ATOM 1595 N LEU A 103 13.164 -1.232 3.357 1.00 0.00 N ATOM 1596 CA LEU A 103 13.279 -1.821 2.035 1.00 0.00 C ATOM 1597 C LEU A 103 13.865 -0.788 1.069 1.00 0.00 C ATOM 1598 O LEU A 103 13.900 -1.013 -0.139 1.00 0.00 O ATOM 1599 CB LEU A 103 11.932 -2.390 1.583 1.00 0.00 C ATOM 1600 CG LEU A 103 11.436 -3.623 2.342 1.00 0.00 C ATOM 1601 CD1 LEU A 103 9.919 -3.770 2.217 1.00 0.00 C ATOM 1602 CD2 LEU A 103 12.174 -4.882 1.884 1.00 0.00 C ATOM 0 H LEU A 103 12.433 -0.527 3.448 1.00 0.00 H new ATOM 0 HA LEU A 103 13.967 -2.666 2.054 1.00 0.00 H new ATOM 0 HB2 LEU A 103 11.180 -1.606 1.673 1.00 0.00 H new ATOM 0 HB3 LEU A 103 12.004 -2.643 0.525 1.00 0.00 H new ATOM 0 HG LEU A 103 11.660 -3.486 3.400 1.00 0.00 H new ATOM 0 HD11 LEU A 103 9.593 -4.654 2.765 1.00 0.00 H new ATOM 0 HD12 LEU A 103 9.433 -2.886 2.630 1.00 0.00 H new ATOM 0 HD13 LEU A 103 9.649 -3.875 1.166 1.00 0.00 H new ATOM 0 HD21 LEU A 103 11.803 -5.744 2.439 1.00 0.00 H new ATOM 0 HD22 LEU A 103 12.004 -5.036 0.818 1.00 0.00 H new ATOM 0 HD23 LEU A 103 13.242 -4.765 2.068 1.00 0.00 H new ATOM 1614 N ASN A 104 14.308 0.323 1.639 1.00 0.00 N ATOM 1615 CA ASN A 104 14.891 1.390 0.845 1.00 0.00 C ATOM 1616 C ASN A 104 13.952 1.726 -0.316 1.00 0.00 C ATOM 1617 O ASN A 104 14.275 1.472 -1.474 1.00 0.00 O ATOM 1618 CB ASN A 104 16.237 0.967 0.257 1.00 0.00 C ATOM 1619 CG ASN A 104 16.752 2.010 -0.738 1.00 0.00 C ATOM 1620 OD1 ASN A 104 16.896 1.758 -1.923 1.00 0.00 O ATOM 1621 ND2 ASN A 104 17.022 3.192 -0.191 1.00 0.00 N ATOM 0 H ASN A 104 14.275 0.507 2.642 1.00 0.00 H new ATOM 0 HA ASN A 104 15.037 2.253 1.495 1.00 0.00 H new ATOM 0 HB2 ASN A 104 16.963 0.835 1.059 1.00 0.00 H new ATOM 0 HB3 ASN A 104 16.134 0.003 -0.242 1.00 0.00 H new ATOM 0 HD21 ASN A 104 17.372 3.954 -0.771 1.00 0.00 H new ATOM 0 HD22 ASN A 104 16.879 3.336 0.809 1.00 0.00 H new ATOM 1628 N ILE A 105 12.808 2.294 0.037 1.00 0.00 N ATOM 1629 CA ILE A 105 11.819 2.667 -0.961 1.00 0.00 C ATOM 1630 C ILE A 105 11.732 4.193 -1.039 1.00 0.00 C ATOM 1631 O ILE A 105 11.083 4.824 -0.208 1.00 0.00 O ATOM 1632 CB ILE A 105 10.480 1.989 -0.669 1.00 0.00 C ATOM 1633 CG1 ILE A 105 10.663 0.487 -0.439 1.00 0.00 C ATOM 1634 CG2 ILE A 105 9.464 2.280 -1.776 1.00 0.00 C ATOM 1635 CD1 ILE A 105 9.339 -0.176 -0.058 1.00 0.00 C ATOM 0 H ILE A 105 12.544 2.505 0.999 1.00 0.00 H new ATOM 0 HA ILE A 105 12.120 2.313 -1.947 1.00 0.00 H new ATOM 0 HB ILE A 105 10.080 2.409 0.254 1.00 0.00 H new ATOM 0 HG12 ILE A 105 11.059 0.023 -1.342 1.00 0.00 H new ATOM 0 HG13 ILE A 105 11.396 0.323 0.351 1.00 0.00 H new ATOM 0 HG21 ILE A 105 8.521 1.786 -1.543 1.00 0.00 H new ATOM 0 HG22 ILE A 105 9.302 3.356 -1.848 1.00 0.00 H new ATOM 0 HG23 ILE A 105 9.844 1.906 -2.727 1.00 0.00 H new ATOM 0 HD11 ILE A 105 9.498 -1.243 0.099 1.00 0.00 H new ATOM 0 HD12 ILE A 105 8.958 0.273 0.859 1.00 0.00 H new ATOM 0 HD13 ILE A 105 8.616 -0.032 -0.861 1.00 0.00 H new ATOM 1647 N SER A 106 12.395 4.741 -2.048 1.00 0.00 N ATOM 1648 CA SER A 106 12.400 6.180 -2.246 1.00 0.00 C ATOM 1649 C SER A 106 11.943 6.515 -3.667 1.00 0.00 C ATOM 1650 O SER A 106 12.418 7.478 -4.264 1.00 0.00 O ATOM 1651 CB SER A 106 13.788 6.767 -1.982 1.00 0.00 C ATOM 1652 OG SER A 106 14.804 6.080 -2.707 1.00 0.00 O ATOM 0 H SER A 106 12.932 4.214 -2.736 1.00 0.00 H new ATOM 0 HA SER A 106 11.705 6.626 -1.534 1.00 0.00 H new ATOM 0 HB2 SER A 106 13.795 7.821 -2.259 1.00 0.00 H new ATOM 0 HB3 SER A 106 14.006 6.716 -0.915 1.00 0.00 H new ATOM 0 HG SER A 106 15.675 6.485 -2.513 1.00 0.00 H new ATOM 1658 N VAL A 107 11.026 5.699 -4.167 1.00 0.00 N ATOM 1659 CA VAL A 107 10.500 5.897 -5.506 1.00 0.00 C ATOM 1660 C VAL A 107 9.023 5.497 -5.534 1.00 0.00 C ATOM 1661 O VAL A 107 8.655 4.432 -5.040 1.00 0.00 O ATOM 1662 CB VAL A 107 11.347 5.123 -6.520 1.00 0.00 C ATOM 1663 CG1 VAL A 107 11.692 3.728 -5.996 1.00 0.00 C ATOM 1664 CG2 VAL A 107 10.640 5.041 -7.874 1.00 0.00 C ATOM 0 H VAL A 107 10.634 4.900 -3.668 1.00 0.00 H new ATOM 0 HA VAL A 107 10.558 6.949 -5.787 1.00 0.00 H new ATOM 0 HB VAL A 107 12.281 5.667 -6.661 1.00 0.00 H new ATOM 0 HG11 VAL A 107 12.294 3.200 -6.736 1.00 0.00 H new ATOM 0 HG12 VAL A 107 12.255 3.817 -5.067 1.00 0.00 H new ATOM 0 HG13 VAL A 107 10.773 3.171 -5.811 1.00 0.00 H new ATOM 0 HG21 VAL A 107 11.262 4.486 -8.576 1.00 0.00 H new ATOM 0 HG22 VAL A 107 9.684 4.531 -7.755 1.00 0.00 H new ATOM 0 HG23 VAL A 107 10.469 6.047 -8.257 1.00 0.00 H new ATOM 1674 N TYR A 108 8.217 6.373 -6.114 1.00 0.00 N ATOM 1675 CA TYR A 108 6.788 6.125 -6.212 1.00 0.00 C ATOM 1676 C TYR A 108 6.286 6.363 -7.637 1.00 0.00 C ATOM 1677 O TYR A 108 6.865 7.157 -8.378 1.00 0.00 O ATOM 1678 CB TYR A 108 6.120 7.133 -5.273 1.00 0.00 C ATOM 1679 CG TYR A 108 6.500 6.959 -3.802 1.00 0.00 C ATOM 1680 CD1 TYR A 108 6.798 5.705 -3.309 1.00 0.00 C ATOM 1681 CD2 TYR A 108 6.545 8.057 -2.967 1.00 0.00 C ATOM 1682 CE1 TYR A 108 7.155 5.543 -1.923 1.00 0.00 C ATOM 1683 CE2 TYR A 108 6.903 7.893 -1.581 1.00 0.00 C ATOM 1684 CZ TYR A 108 7.190 6.645 -1.129 1.00 0.00 C ATOM 1685 OH TYR A 108 7.527 6.490 0.180 1.00 0.00 O ATOM 0 H TYR A 108 8.526 7.256 -6.521 1.00 0.00 H new ATOM 0 HA TYR A 108 6.559 5.092 -5.949 1.00 0.00 H new ATOM 0 HB2 TYR A 108 6.387 8.141 -5.590 1.00 0.00 H new ATOM 0 HB3 TYR A 108 5.038 7.044 -5.371 1.00 0.00 H new ATOM 0 HD1 TYR A 108 6.764 4.846 -3.962 1.00 0.00 H new ATOM 0 HD2 TYR A 108 6.312 9.039 -3.352 1.00 0.00 H new ATOM 0 HE1 TYR A 108 7.390 4.567 -1.524 1.00 0.00 H new ATOM 0 HE2 TYR A 108 6.942 8.743 -0.917 1.00 0.00 H new ATOM 0 HH TYR A 108 7.512 7.362 0.627 1.00 0.00 H new ATOM 1695 N PRO A 109 5.187 5.644 -7.988 1.00 0.00 N ATOM 1696 CA PRO A 109 4.563 4.726 -7.049 1.00 0.00 C ATOM 1697 C PRO A 109 5.394 3.449 -6.897 1.00 0.00 C ATOM 1698 O PRO A 109 6.218 3.134 -7.754 1.00 0.00 O ATOM 1699 CB PRO A 109 3.176 4.468 -7.615 1.00 0.00 C ATOM 1700 CG PRO A 109 3.239 4.878 -9.077 1.00 0.00 C ATOM 1701 CD PRO A 109 4.511 5.684 -9.281 1.00 0.00 C ATOM 0 HA PRO A 109 4.498 5.135 -6.041 1.00 0.00 H new ATOM 0 HB2 PRO A 109 2.903 3.417 -7.516 1.00 0.00 H new ATOM 0 HB3 PRO A 109 2.422 5.045 -7.080 1.00 0.00 H new ATOM 0 HG2 PRO A 109 3.237 3.998 -9.720 1.00 0.00 H new ATOM 0 HG3 PRO A 109 2.364 5.471 -9.345 1.00 0.00 H new ATOM 0 HD2 PRO A 109 5.132 5.252 -10.066 1.00 0.00 H new ATOM 0 HD3 PRO A 109 4.287 6.708 -9.579 1.00 0.00 H new ATOM 1709 N SER A 110 5.147 2.750 -5.799 1.00 0.00 N ATOM 1710 CA SER A 110 5.862 1.516 -5.524 1.00 0.00 C ATOM 1711 C SER A 110 4.881 0.435 -5.061 1.00 0.00 C ATOM 1712 O SER A 110 3.807 0.746 -4.547 1.00 0.00 O ATOM 1713 CB SER A 110 6.949 1.732 -4.469 1.00 0.00 C ATOM 1714 OG SER A 110 8.228 1.950 -5.058 1.00 0.00 O ATOM 0 H SER A 110 4.463 3.014 -5.090 1.00 0.00 H new ATOM 0 HA SER A 110 6.346 1.189 -6.444 1.00 0.00 H new ATOM 0 HB2 SER A 110 6.686 2.587 -3.847 1.00 0.00 H new ATOM 0 HB3 SER A 110 6.995 0.863 -3.813 1.00 0.00 H new ATOM 0 HG SER A 110 8.537 2.855 -4.843 1.00 0.00 H new ATOM 1720 N TRP A 111 5.285 -0.810 -5.258 1.00 0.00 N ATOM 1721 CA TRP A 111 4.455 -1.937 -4.867 1.00 0.00 C ATOM 1722 C TRP A 111 5.345 -2.949 -4.139 1.00 0.00 C ATOM 1723 O TRP A 111 6.477 -3.197 -4.554 1.00 0.00 O ATOM 1724 CB TRP A 111 3.738 -2.536 -6.078 1.00 0.00 C ATOM 1725 CG TRP A 111 2.785 -1.565 -6.778 1.00 0.00 C ATOM 1726 CD1 TRP A 111 3.094 -0.462 -7.474 1.00 0.00 C ATOM 1727 CD2 TRP A 111 1.346 -1.655 -6.822 1.00 0.00 C ATOM 1728 NE1 TRP A 111 1.964 0.162 -7.961 1.00 0.00 N ATOM 1729 CE2 TRP A 111 0.866 -0.587 -7.552 1.00 0.00 C ATOM 1730 CE3 TRP A 111 0.476 -2.610 -6.265 1.00 0.00 C ATOM 1731 CZ2 TRP A 111 -0.495 -0.371 -7.792 1.00 0.00 C ATOM 1732 CZ3 TRP A 111 -0.883 -2.379 -6.512 1.00 0.00 C ATOM 1733 CH2 TRP A 111 -1.380 -1.307 -7.245 1.00 0.00 C ATOM 0 H TRP A 111 6.177 -1.064 -5.683 1.00 0.00 H new ATOM 0 HA TRP A 111 3.664 -1.617 -4.189 1.00 0.00 H new ATOM 0 HB2 TRP A 111 4.483 -2.879 -6.796 1.00 0.00 H new ATOM 0 HB3 TRP A 111 3.176 -3.413 -5.758 1.00 0.00 H new ATOM 0 HD1 TRP A 111 4.101 -0.106 -7.634 1.00 0.00 H new ATOM 0 HE1 TRP A 111 1.939 1.016 -8.519 1.00 0.00 H new ATOM 0 HE3 TRP A 111 0.828 -3.455 -5.692 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 -0.844 0.473 -8.369 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 -1.594 -3.082 -6.105 1.00 0.00 H new ATOM 0 HH2 TRP A 111 -2.444 -1.197 -7.392 1.00 0.00 H new ATOM 1744 N ALA A 112 4.799 -3.505 -3.068 1.00 0.00 N ATOM 1745 CA ALA A 112 5.527 -4.484 -2.278 1.00 0.00 C ATOM 1746 C ALA A 112 4.620 -5.682 -1.996 1.00 0.00 C ATOM 1747 O ALA A 112 3.445 -5.515 -1.680 1.00 0.00 O ATOM 1748 CB ALA A 112 6.041 -3.826 -0.996 1.00 0.00 C ATOM 0 H ALA A 112 3.860 -3.296 -2.728 1.00 0.00 H new ATOM 0 HA ALA A 112 6.395 -4.850 -2.826 1.00 0.00 H new ATOM 0 HB1 ALA A 112 6.587 -4.560 -0.404 1.00 0.00 H new ATOM 0 HB2 ALA A 112 6.705 -3.000 -1.252 1.00 0.00 H new ATOM 0 HB3 ALA A 112 5.198 -3.448 -0.418 1.00 0.00 H new ATOM 1754 N LEU A 113 5.202 -6.867 -2.120 1.00 0.00 N ATOM 1755 CA LEU A 113 4.461 -8.092 -1.883 1.00 0.00 C ATOM 1756 C LEU A 113 4.955 -8.739 -0.586 1.00 0.00 C ATOM 1757 O LEU A 113 6.141 -9.031 -0.447 1.00 0.00 O ATOM 1758 CB LEU A 113 4.546 -9.016 -3.099 1.00 0.00 C ATOM 1759 CG LEU A 113 3.775 -10.333 -2.999 1.00 0.00 C ATOM 1760 CD1 LEU A 113 2.268 -10.097 -3.122 1.00 0.00 C ATOM 1761 CD2 LEU A 113 4.282 -11.345 -4.027 1.00 0.00 C ATOM 0 H LEU A 113 6.178 -7.003 -2.382 1.00 0.00 H new ATOM 0 HA LEU A 113 3.401 -7.874 -1.750 1.00 0.00 H new ATOM 0 HB2 LEU A 113 4.182 -8.471 -3.970 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.596 -9.246 -3.282 1.00 0.00 H new ATOM 0 HG LEU A 113 3.955 -10.759 -2.012 1.00 0.00 H new ATOM 0 HD11 LEU A 113 1.743 -11.049 -3.048 1.00 0.00 H new ATOM 0 HD12 LEU A 113 1.937 -9.437 -2.321 1.00 0.00 H new ATOM 0 HD13 LEU A 113 2.049 -9.637 -4.085 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.717 -12.272 -3.934 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.152 -10.940 -5.031 1.00 0.00 H new ATOM 0 HD23 LEU A 113 5.339 -11.545 -3.850 1.00 0.00 H new ATOM 1773 N ILE A 114 4.019 -8.943 0.330 1.00 0.00 N ATOM 1774 CA ILE A 114 4.344 -9.548 1.610 1.00 0.00 C ATOM 1775 C ILE A 114 3.790 -10.974 1.650 1.00 0.00 C ATOM 1776 O ILE A 114 2.593 -11.183 1.462 1.00 0.00 O ATOM 1777 CB ILE A 114 3.856 -8.665 2.760 1.00 0.00 C ATOM 1778 CG1 ILE A 114 4.826 -7.510 3.016 1.00 0.00 C ATOM 1779 CG2 ILE A 114 3.608 -9.496 4.021 1.00 0.00 C ATOM 1780 CD1 ILE A 114 5.307 -6.898 1.698 1.00 0.00 C ATOM 0 H ILE A 114 3.036 -8.700 0.211 1.00 0.00 H new ATOM 0 HA ILE A 114 5.424 -9.622 1.733 1.00 0.00 H new ATOM 0 HB ILE A 114 2.902 -8.224 2.471 1.00 0.00 H new ATOM 0 HG12 ILE A 114 4.336 -6.746 3.619 1.00 0.00 H new ATOM 0 HG13 ILE A 114 5.681 -7.868 3.589 1.00 0.00 H new ATOM 0 HG21 ILE A 114 3.262 -8.845 4.824 1.00 0.00 H new ATOM 0 HG22 ILE A 114 2.851 -10.252 3.815 1.00 0.00 H new ATOM 0 HG23 ILE A 114 4.535 -9.984 4.324 1.00 0.00 H new ATOM 0 HD11 ILE A 114 5.995 -6.079 1.907 1.00 0.00 H new ATOM 0 HD12 ILE A 114 5.817 -7.659 1.108 1.00 0.00 H new ATOM 0 HD13 ILE A 114 4.451 -6.519 1.139 1.00 0.00 H new ATOM 1792 N GLY A 115 4.689 -11.917 1.895 1.00 0.00 N ATOM 1793 CA GLY A 115 4.304 -13.317 1.964 1.00 0.00 C ATOM 1794 C GLY A 115 3.065 -13.504 2.840 1.00 0.00 C ATOM 1795 O GLY A 115 2.620 -12.566 3.501 1.00 0.00 O ATOM 0 H GLY A 115 5.682 -11.739 2.048 1.00 0.00 H new ATOM 0 HA2 GLY A 115 4.104 -13.692 0.960 1.00 0.00 H new ATOM 0 HA3 GLY A 115 5.129 -13.905 2.365 1.00 0.00 H new ATOM 1799 N LYS A 116 2.542 -14.720 2.819 1.00 0.00 N ATOM 1800 CA LYS A 116 1.362 -15.042 3.605 1.00 0.00 C ATOM 1801 C LYS A 116 1.728 -15.040 5.090 1.00 0.00 C ATOM 1802 O LYS A 116 0.848 -15.007 5.948 1.00 0.00 O ATOM 1803 CB LYS A 116 0.743 -16.356 3.125 1.00 0.00 C ATOM 1804 CG LYS A 116 1.778 -17.483 3.123 1.00 0.00 C ATOM 1805 CD LYS A 116 2.145 -17.887 1.694 1.00 0.00 C ATOM 1806 CE LYS A 116 1.047 -18.751 1.070 1.00 0.00 C ATOM 1807 NZ LYS A 116 1.548 -19.423 -0.149 1.00 0.00 N ATOM 0 H LYS A 116 2.913 -15.495 2.270 1.00 0.00 H new ATOM 0 HA LYS A 116 0.592 -14.284 3.466 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -0.092 -16.626 3.771 1.00 0.00 H new ATOM 0 HB3 LYS A 116 0.340 -16.226 2.121 1.00 0.00 H new ATOM 0 HG2 LYS A 116 2.673 -17.161 3.655 1.00 0.00 H new ATOM 0 HG3 LYS A 116 1.382 -18.346 3.659 1.00 0.00 H new ATOM 0 HD2 LYS A 116 2.299 -16.994 1.088 1.00 0.00 H new ATOM 0 HD3 LYS A 116 3.087 -18.436 1.698 1.00 0.00 H new ATOM 0 HE2 LYS A 116 0.709 -19.496 1.790 1.00 0.00 H new ATOM 0 HE3 LYS A 116 0.185 -18.132 0.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 0.791 -20.005 -0.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 1.849 -18.707 -0.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 2.357 -20.029 0.096 1.00 0.00 H new ATOM 1820 N ASP A 117 3.027 -15.075 5.348 1.00 0.00 N ATOM 1821 CA ASP A 117 3.521 -15.077 6.714 1.00 0.00 C ATOM 1822 C ASP A 117 3.551 -13.642 7.242 1.00 0.00 C ATOM 1823 O ASP A 117 3.578 -13.423 8.452 1.00 0.00 O ATOM 1824 CB ASP A 117 4.942 -15.638 6.787 1.00 0.00 C ATOM 1825 CG ASP A 117 5.042 -17.084 7.277 1.00 0.00 C ATOM 1826 OD1 ASP A 117 4.665 -17.400 8.414 1.00 0.00 O ATOM 1827 OD2 ASP A 117 5.540 -17.914 6.425 1.00 0.00 O ATOM 0 H ASP A 117 3.753 -15.102 4.633 1.00 0.00 H new ATOM 0 HA ASP A 117 2.857 -15.702 7.311 1.00 0.00 H new ATOM 0 HB2 ASP A 117 5.393 -15.574 5.797 1.00 0.00 H new ATOM 0 HB3 ASP A 117 5.533 -15.004 7.448 1.00 0.00 H new ATOM 1833 N GLY A 118 3.545 -12.701 6.310 1.00 0.00 N ATOM 1834 CA GLY A 118 3.570 -11.293 6.667 1.00 0.00 C ATOM 1835 C GLY A 118 4.988 -10.728 6.563 1.00 0.00 C ATOM 1836 O GLY A 118 5.313 -9.733 7.208 1.00 0.00 O ATOM 0 H GLY A 118 3.523 -12.886 5.307 1.00 0.00 H new ATOM 0 HA2 GLY A 118 2.903 -10.735 6.010 1.00 0.00 H new ATOM 0 HA3 GLY A 118 3.197 -11.165 7.683 1.00 0.00 H new ATOM 1840 N ASP A 119 5.796 -11.388 5.745 1.00 0.00 N ATOM 1841 CA ASP A 119 7.172 -10.963 5.549 1.00 0.00 C ATOM 1842 C ASP A 119 7.365 -10.534 4.093 1.00 0.00 C ATOM 1843 O ASP A 119 6.659 -11.007 3.203 1.00 0.00 O ATOM 1844 CB ASP A 119 8.147 -12.106 5.838 1.00 0.00 C ATOM 1845 CG ASP A 119 8.347 -13.093 4.687 1.00 0.00 C ATOM 1846 OD1 ASP A 119 9.371 -13.062 3.989 1.00 0.00 O ATOM 1847 OD2 ASP A 119 7.382 -13.932 4.515 1.00 0.00 O ATOM 0 H ASP A 119 5.524 -12.213 5.211 1.00 0.00 H new ATOM 0 HA ASP A 119 7.371 -10.137 6.232 1.00 0.00 H new ATOM 0 HB2 ASP A 119 9.115 -11.680 6.103 1.00 0.00 H new ATOM 0 HB3 ASP A 119 7.791 -12.655 6.710 1.00 0.00 H new ATOM 1853 N VAL A 120 8.325 -9.643 3.894 1.00 0.00 N ATOM 1854 CA VAL A 120 8.620 -9.144 2.563 1.00 0.00 C ATOM 1855 C VAL A 120 8.935 -10.324 1.638 1.00 0.00 C ATOM 1856 O VAL A 120 9.931 -11.018 1.830 1.00 0.00 O ATOM 1857 CB VAL A 120 9.753 -8.118 2.627 1.00 0.00 C ATOM 1858 CG1 VAL A 120 10.213 -7.721 1.222 1.00 0.00 C ATOM 1859 CG2 VAL A 120 9.334 -6.888 3.436 1.00 0.00 C ATOM 0 H VAL A 120 8.909 -9.254 4.634 1.00 0.00 H new ATOM 0 HA VAL A 120 7.754 -8.627 2.149 1.00 0.00 H new ATOM 0 HB VAL A 120 10.597 -8.582 3.137 1.00 0.00 H new ATOM 0 HG11 VAL A 120 11.019 -6.991 1.296 1.00 0.00 H new ATOM 0 HG12 VAL A 120 10.571 -8.604 0.693 1.00 0.00 H new ATOM 0 HG13 VAL A 120 9.377 -7.285 0.675 1.00 0.00 H new ATOM 0 HG21 VAL A 120 10.157 -6.174 3.466 1.00 0.00 H new ATOM 0 HG22 VAL A 120 8.467 -6.422 2.967 1.00 0.00 H new ATOM 0 HG23 VAL A 120 9.079 -7.190 4.452 1.00 0.00 H new ATOM 1869 N GLN A 121 8.065 -10.514 0.658 1.00 0.00 N ATOM 1870 CA GLN A 121 8.237 -11.598 -0.295 1.00 0.00 C ATOM 1871 C GLN A 121 8.963 -11.094 -1.545 1.00 0.00 C ATOM 1872 O GLN A 121 9.968 -11.670 -1.957 1.00 0.00 O ATOM 1873 CB GLN A 121 6.890 -12.226 -0.659 1.00 0.00 C ATOM 1874 CG GLN A 121 7.052 -13.711 -0.994 1.00 0.00 C ATOM 1875 CD GLN A 121 5.731 -14.310 -1.480 1.00 0.00 C ATOM 1876 OE1 GLN A 121 5.246 -14.013 -2.560 1.00 0.00 O ATOM 1877 NE2 GLN A 121 5.178 -15.166 -0.626 1.00 0.00 N ATOM 0 H GLN A 121 7.239 -9.936 0.503 1.00 0.00 H new ATOM 0 HA GLN A 121 8.848 -12.372 0.170 1.00 0.00 H new ATOM 0 HB2 GLN A 121 6.194 -12.110 0.172 1.00 0.00 H new ATOM 0 HB3 GLN A 121 6.458 -11.702 -1.512 1.00 0.00 H new ATOM 0 HG2 GLN A 121 7.815 -13.833 -1.762 1.00 0.00 H new ATOM 0 HG3 GLN A 121 7.398 -14.251 -0.112 1.00 0.00 H new ATOM 0 HE21 GLN A 121 5.638 -15.370 0.262 1.00 0.00 H new ATOM 0 HE22 GLN A 121 4.294 -15.619 -0.858 1.00 0.00 H new ATOM 1886 N ARG A 122 8.425 -10.025 -2.113 1.00 0.00 N ATOM 1887 CA ARG A 122 9.009 -9.438 -3.308 1.00 0.00 C ATOM 1888 C ARG A 122 8.692 -7.942 -3.372 1.00 0.00 C ATOM 1889 O ARG A 122 7.589 -7.522 -3.028 1.00 0.00 O ATOM 1890 CB ARG A 122 8.480 -10.120 -4.571 1.00 0.00 C ATOM 1891 CG ARG A 122 9.478 -9.991 -5.723 1.00 0.00 C ATOM 1892 CD ARG A 122 10.705 -10.874 -5.486 1.00 0.00 C ATOM 1893 NE ARG A 122 10.880 -11.812 -6.615 1.00 0.00 N ATOM 1894 CZ ARG A 122 11.317 -11.450 -7.841 1.00 0.00 C ATOM 1895 NH1 ARG A 122 11.628 -10.163 -8.104 1.00 0.00 N ATOM 1896 NH2 ARG A 122 11.436 -12.372 -8.777 1.00 0.00 N ATOM 0 H ARG A 122 7.591 -9.550 -1.768 1.00 0.00 H new ATOM 0 HA ARG A 122 10.088 -9.583 -3.257 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.289 -11.174 -4.367 1.00 0.00 H new ATOM 0 HB3 ARG A 122 7.528 -9.673 -4.858 1.00 0.00 H new ATOM 0 HG2 ARG A 122 8.997 -10.274 -6.659 1.00 0.00 H new ATOM 0 HG3 ARG A 122 9.788 -8.951 -5.826 1.00 0.00 H new ATOM 0 HD2 ARG A 122 11.594 -10.253 -5.377 1.00 0.00 H new ATOM 0 HD3 ARG A 122 10.589 -11.430 -4.556 1.00 0.00 H new ATOM 0 HE ARG A 122 10.657 -12.795 -6.458 1.00 0.00 H new ATOM 0 HH11 ARG A 122 11.534 -9.456 -7.375 1.00 0.00 H new ATOM 0 HH12 ARG A 122 11.957 -9.897 -9.032 1.00 0.00 H new ATOM 0 HH21 ARG A 122 11.199 -13.342 -8.570 1.00 0.00 H new ATOM 0 HH22 ARG A 122 11.765 -12.115 -9.708 1.00 0.00 H new ATOM 1909 N ILE A 123 9.681 -7.180 -3.817 1.00 0.00 N ATOM 1910 CA ILE A 123 9.523 -5.741 -3.932 1.00 0.00 C ATOM 1911 C ILE A 123 9.357 -5.366 -5.406 1.00 0.00 C ATOM 1912 O ILE A 123 10.029 -5.925 -6.271 1.00 0.00 O ATOM 1913 CB ILE A 123 10.680 -5.017 -3.239 1.00 0.00 C ATOM 1914 CG1 ILE A 123 10.380 -3.525 -3.086 1.00 0.00 C ATOM 1915 CG2 ILE A 123 11.999 -5.264 -3.975 1.00 0.00 C ATOM 1916 CD1 ILE A 123 10.520 -3.086 -1.627 1.00 0.00 C ATOM 0 H ILE A 123 10.595 -7.533 -4.102 1.00 0.00 H new ATOM 0 HA ILE A 123 8.620 -5.415 -3.416 1.00 0.00 H new ATOM 0 HB ILE A 123 10.789 -5.428 -2.235 1.00 0.00 H new ATOM 0 HG12 ILE A 123 11.061 -2.947 -3.711 1.00 0.00 H new ATOM 0 HG13 ILE A 123 9.370 -3.315 -3.438 1.00 0.00 H new ATOM 0 HG21 ILE A 123 12.805 -4.739 -3.463 1.00 0.00 H new ATOM 0 HG22 ILE A 123 12.213 -6.333 -3.989 1.00 0.00 H new ATOM 0 HG23 ILE A 123 11.919 -4.897 -4.998 1.00 0.00 H new ATOM 0 HD11 ILE A 123 10.302 -2.021 -1.545 1.00 0.00 H new ATOM 0 HD12 ILE A 123 9.820 -3.649 -1.009 1.00 0.00 H new ATOM 0 HD13 ILE A 123 11.538 -3.275 -1.286 1.00 0.00 H new ATOM 1928 N VAL A 124 8.457 -4.422 -5.647 1.00 0.00 N ATOM 1929 CA VAL A 124 8.194 -3.968 -7.001 1.00 0.00 C ATOM 1930 C VAL A 124 8.363 -2.447 -7.064 1.00 0.00 C ATOM 1931 O VAL A 124 7.883 -1.730 -6.189 1.00 0.00 O ATOM 1932 CB VAL A 124 6.810 -4.436 -7.451 1.00 0.00 C ATOM 1933 CG1 VAL A 124 6.446 -3.841 -8.814 1.00 0.00 C ATOM 1934 CG2 VAL A 124 6.731 -5.963 -7.481 1.00 0.00 C ATOM 0 H VAL A 124 7.902 -3.960 -4.927 1.00 0.00 H new ATOM 0 HA VAL A 124 8.910 -4.405 -7.697 1.00 0.00 H new ATOM 0 HB VAL A 124 6.082 -4.077 -6.724 1.00 0.00 H new ATOM 0 HG11 VAL A 124 5.457 -4.190 -9.111 1.00 0.00 H new ATOM 0 HG12 VAL A 124 6.442 -2.753 -8.747 1.00 0.00 H new ATOM 0 HG13 VAL A 124 7.180 -4.156 -9.556 1.00 0.00 H new ATOM 0 HG21 VAL A 124 5.736 -6.270 -7.804 1.00 0.00 H new ATOM 0 HG22 VAL A 124 7.475 -6.352 -8.176 1.00 0.00 H new ATOM 0 HG23 VAL A 124 6.926 -6.357 -6.484 1.00 0.00 H new ATOM 1944 N LYS A 125 9.045 -2.004 -8.110 1.00 0.00 N ATOM 1945 CA LYS A 125 9.281 -0.582 -8.300 1.00 0.00 C ATOM 1946 C LYS A 125 8.595 -0.123 -9.588 1.00 0.00 C ATOM 1947 O LYS A 125 8.794 -0.717 -10.647 1.00 0.00 O ATOM 1948 CB LYS A 125 10.779 -0.279 -8.259 1.00 0.00 C ATOM 1949 CG LYS A 125 11.553 -1.206 -9.199 1.00 0.00 C ATOM 1950 CD LYS A 125 12.024 -2.463 -8.464 1.00 0.00 C ATOM 1951 CE LYS A 125 11.774 -3.716 -9.306 1.00 0.00 C ATOM 1952 NZ LYS A 125 13.022 -4.146 -9.976 1.00 0.00 N ATOM 0 H LYS A 125 9.441 -2.603 -8.834 1.00 0.00 H new ATOM 0 HA LYS A 125 8.841 -0.010 -7.484 1.00 0.00 H new ATOM 0 HB2 LYS A 125 10.951 0.759 -8.543 1.00 0.00 H new ATOM 0 HB3 LYS A 125 11.149 -0.396 -7.241 1.00 0.00 H new ATOM 0 HG2 LYS A 125 10.920 -1.488 -10.040 1.00 0.00 H new ATOM 0 HG3 LYS A 125 12.413 -0.677 -9.610 1.00 0.00 H new ATOM 0 HD2 LYS A 125 13.087 -2.379 -8.237 1.00 0.00 H new ATOM 0 HD3 LYS A 125 11.500 -2.550 -7.512 1.00 0.00 H new ATOM 0 HE2 LYS A 125 11.399 -4.519 -8.672 1.00 0.00 H new ATOM 0 HE3 LYS A 125 11.005 -3.513 -10.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 12.836 -4.997 -10.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 13.363 -3.384 -10.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 13.745 -4.359 -9.259 1.00 0.00 H new ATOM 1965 N GLY A 126 7.802 0.930 -9.454 1.00 0.00 N ATOM 1966 CA GLY A 126 7.085 1.476 -10.595 1.00 0.00 C ATOM 1967 C GLY A 126 5.601 1.108 -10.537 1.00 0.00 C ATOM 1968 O GLY A 126 5.228 0.112 -9.919 1.00 0.00 O ATOM 0 H GLY A 126 7.640 1.419 -8.574 1.00 0.00 H new ATOM 0 HA2 GLY A 126 7.194 2.560 -10.613 1.00 0.00 H new ATOM 0 HA3 GLY A 126 7.522 1.097 -11.519 1.00 0.00 H new ATOM 1972 N SER A 127 4.794 1.933 -11.188 1.00 0.00 N ATOM 1973 CA SER A 127 3.359 1.707 -11.219 1.00 0.00 C ATOM 1974 C SER A 127 3.043 0.460 -12.046 1.00 0.00 C ATOM 1975 O SER A 127 3.855 0.033 -12.867 1.00 0.00 O ATOM 1976 CB SER A 127 2.622 2.923 -11.786 1.00 0.00 C ATOM 1977 OG SER A 127 1.453 3.236 -11.036 1.00 0.00 O ATOM 0 H SER A 127 5.107 2.759 -11.698 1.00 0.00 H new ATOM 0 HA SER A 127 3.015 1.552 -10.196 1.00 0.00 H new ATOM 0 HB2 SER A 127 3.291 3.783 -11.790 1.00 0.00 H new ATOM 0 HB3 SER A 127 2.346 2.729 -12.823 1.00 0.00 H new ATOM 0 HG SER A 127 1.012 4.018 -11.428 1.00 0.00 H new ATOM 1983 N ILE A 128 1.862 -0.089 -11.802 1.00 0.00 N ATOM 1984 CA ILE A 128 1.429 -1.279 -12.516 1.00 0.00 C ATOM 1985 C ILE A 128 -0.025 -1.100 -12.962 1.00 0.00 C ATOM 1986 O ILE A 128 -0.703 -0.174 -12.522 1.00 0.00 O ATOM 1987 CB ILE A 128 1.661 -2.528 -11.664 1.00 0.00 C ATOM 1988 CG1 ILE A 128 1.178 -2.311 -10.229 1.00 0.00 C ATOM 1989 CG2 ILE A 128 3.128 -2.962 -11.715 1.00 0.00 C ATOM 1990 CD1 ILE A 128 1.080 -3.640 -9.475 1.00 0.00 C ATOM 0 H ILE A 128 1.192 0.268 -11.121 1.00 0.00 H new ATOM 0 HA ILE A 128 2.025 -1.421 -13.418 1.00 0.00 H new ATOM 0 HB ILE A 128 1.069 -3.342 -12.083 1.00 0.00 H new ATOM 0 HG12 ILE A 128 1.864 -1.643 -9.708 1.00 0.00 H new ATOM 0 HG13 ILE A 128 0.204 -1.822 -10.240 1.00 0.00 H new ATOM 0 HG21 ILE A 128 3.266 -3.852 -11.101 1.00 0.00 H new ATOM 0 HG22 ILE A 128 3.406 -3.185 -12.745 1.00 0.00 H new ATOM 0 HG23 ILE A 128 3.759 -2.158 -11.335 1.00 0.00 H new ATOM 0 HD11 ILE A 128 0.734 -3.457 -8.458 1.00 0.00 H new ATOM 0 HD12 ILE A 128 0.375 -4.296 -9.985 1.00 0.00 H new ATOM 0 HD13 ILE A 128 2.061 -4.114 -9.445 1.00 0.00 H new ATOM 2002 N ASN A 129 -0.458 -2.002 -13.830 1.00 0.00 N ATOM 2003 CA ASN A 129 -1.818 -1.956 -14.340 1.00 0.00 C ATOM 2004 C ASN A 129 -2.638 -3.076 -13.698 1.00 0.00 C ATOM 2005 O ASN A 129 -2.081 -3.978 -13.073 1.00 0.00 O ATOM 2006 CB ASN A 129 -1.845 -2.160 -15.856 1.00 0.00 C ATOM 2007 CG ASN A 129 -0.784 -3.173 -16.292 1.00 0.00 C ATOM 2008 OD1 ASN A 129 -0.806 -4.333 -15.916 1.00 0.00 O ATOM 2009 ND2 ASN A 129 0.142 -2.671 -17.102 1.00 0.00 N ATOM 0 H ASN A 129 0.108 -2.769 -14.193 1.00 0.00 H new ATOM 0 HA ASN A 129 -2.235 -0.978 -14.100 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -2.832 -2.507 -16.162 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -1.672 -1.208 -16.358 1.00 0.00 H new ATOM 0 HD21 ASN A 129 0.894 -3.267 -17.448 1.00 0.00 H new ATOM 0 HD22 ASN A 129 0.101 -1.690 -17.378 1.00 0.00 H new ATOM 2016 N GLU A 130 -3.948 -2.985 -13.874 1.00 0.00 N ATOM 2017 CA GLU A 130 -4.850 -3.979 -13.319 1.00 0.00 C ATOM 2018 C GLU A 130 -4.408 -5.385 -13.733 1.00 0.00 C ATOM 2019 O GLU A 130 -4.509 -6.327 -12.949 1.00 0.00 O ATOM 2020 CB GLU A 130 -6.294 -3.710 -13.747 1.00 0.00 C ATOM 2021 CG GLU A 130 -7.251 -4.723 -13.116 1.00 0.00 C ATOM 2022 CD GLU A 130 -8.537 -4.846 -13.936 1.00 0.00 C ATOM 2023 OE1 GLU A 130 -9.323 -3.890 -14.000 1.00 0.00 O ATOM 2024 OE2 GLU A 130 -8.705 -5.984 -14.517 1.00 0.00 O ATOM 0 H GLU A 130 -4.407 -2.237 -14.394 1.00 0.00 H new ATOM 0 HA GLU A 130 -4.810 -3.911 -12.232 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -6.582 -2.701 -13.453 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -6.370 -3.760 -14.833 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -6.764 -5.696 -13.049 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -7.492 -4.416 -12.098 1.00 0.00 H new ATOM 2032 N ALA A 131 -3.928 -5.481 -14.964 1.00 0.00 N ATOM 2033 CA ALA A 131 -3.470 -6.755 -15.490 1.00 0.00 C ATOM 2034 C ALA A 131 -2.292 -7.256 -14.654 1.00 0.00 C ATOM 2035 O ALA A 131 -2.283 -8.404 -14.212 1.00 0.00 O ATOM 2036 CB ALA A 131 -3.109 -6.596 -16.970 1.00 0.00 C ATOM 0 H ALA A 131 -3.846 -4.697 -15.612 1.00 0.00 H new ATOM 0 HA ALA A 131 -4.261 -7.503 -15.424 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -2.765 -7.552 -17.365 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -3.988 -6.268 -17.526 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -2.317 -5.854 -17.074 1.00 0.00 H new ATOM 2042 N GLN A 132 -1.326 -6.369 -14.460 1.00 0.00 N ATOM 2043 CA GLN A 132 -0.145 -6.707 -13.685 1.00 0.00 C ATOM 2044 C GLN A 132 -0.549 -7.300 -12.334 1.00 0.00 C ATOM 2045 O GLN A 132 0.040 -8.281 -11.882 1.00 0.00 O ATOM 2046 CB GLN A 132 0.756 -5.485 -13.498 1.00 0.00 C ATOM 2047 CG GLN A 132 1.818 -5.413 -14.597 1.00 0.00 C ATOM 2048 CD GLN A 132 2.371 -3.993 -14.734 1.00 0.00 C ATOM 2049 OE1 GLN A 132 1.658 -3.048 -15.032 1.00 0.00 O ATOM 2050 NE2 GLN A 132 3.677 -3.896 -14.503 1.00 0.00 N ATOM 0 H GLN A 132 -1.338 -5.417 -14.826 1.00 0.00 H new ATOM 0 HA GLN A 132 0.424 -7.457 -14.235 1.00 0.00 H new ATOM 0 HB2 GLN A 132 0.152 -4.578 -13.511 1.00 0.00 H new ATOM 0 HB3 GLN A 132 1.240 -5.531 -12.522 1.00 0.00 H new ATOM 0 HG2 GLN A 132 2.630 -6.103 -14.368 1.00 0.00 H new ATOM 0 HG3 GLN A 132 1.387 -5.732 -15.546 1.00 0.00 H new ATOM 0 HE21 GLN A 132 4.215 -4.727 -14.258 1.00 0.00 H new ATOM 0 HE22 GLN A 132 4.141 -2.990 -14.571 1.00 0.00 H new ATOM 2059 N ALA A 133 -1.552 -6.682 -11.728 1.00 0.00 N ATOM 2060 CA ALA A 133 -2.043 -7.138 -10.438 1.00 0.00 C ATOM 2061 C ALA A 133 -2.447 -8.609 -10.542 1.00 0.00 C ATOM 2062 O ALA A 133 -2.198 -9.391 -9.625 1.00 0.00 O ATOM 2063 CB ALA A 133 -3.201 -6.245 -9.988 1.00 0.00 C ATOM 0 H ALA A 133 -2.038 -5.869 -12.106 1.00 0.00 H new ATOM 0 HA ALA A 133 -1.262 -7.064 -9.682 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -3.569 -6.587 -9.021 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -2.854 -5.215 -9.901 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -4.006 -6.296 -10.721 1.00 0.00 H new ATOM 2069 N LEU A 134 -3.062 -8.944 -11.666 1.00 0.00 N ATOM 2070 CA LEU A 134 -3.502 -10.309 -11.901 1.00 0.00 C ATOM 2071 C LEU A 134 -2.279 -11.214 -12.058 1.00 0.00 C ATOM 2072 O LEU A 134 -2.172 -12.241 -11.390 1.00 0.00 O ATOM 2073 CB LEU A 134 -4.465 -10.364 -13.089 1.00 0.00 C ATOM 2074 CG LEU A 134 -5.606 -9.346 -13.075 1.00 0.00 C ATOM 2075 CD1 LEU A 134 -6.681 -9.712 -14.101 1.00 0.00 C ATOM 2076 CD2 LEU A 134 -6.187 -9.193 -11.668 1.00 0.00 C ATOM 0 H LEU A 134 -3.266 -8.294 -12.425 1.00 0.00 H new ATOM 0 HA LEU A 134 -4.066 -10.681 -11.046 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -3.890 -10.223 -14.004 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -4.897 -11.364 -13.135 1.00 0.00 H new ATOM 0 HG LEU A 134 -5.201 -8.376 -13.364 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -7.481 -8.972 -14.070 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -6.241 -9.730 -15.098 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -7.088 -10.696 -13.866 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -6.997 -8.463 -11.686 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -6.572 -10.154 -11.327 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -5.407 -8.852 -10.987 1.00 0.00 H new ATOM 2088 N ALA A 135 -1.387 -10.802 -12.946 1.00 0.00 N ATOM 2089 CA ALA A 135 -0.176 -11.563 -13.200 1.00 0.00 C ATOM 2090 C ALA A 135 0.664 -11.619 -11.923 1.00 0.00 C ATOM 2091 O ALA A 135 1.461 -12.537 -11.739 1.00 0.00 O ATOM 2092 CB ALA A 135 0.586 -10.937 -14.371 1.00 0.00 C ATOM 0 H ALA A 135 -1.479 -9.950 -13.499 1.00 0.00 H new ATOM 0 HA ALA A 135 -0.420 -12.588 -13.480 1.00 0.00 H new ATOM 0 HB1 ALA A 135 1.495 -11.508 -14.561 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -0.042 -10.948 -15.262 1.00 0.00 H new ATOM 0 HB3 ALA A 135 0.849 -9.908 -14.125 1.00 0.00 H new ATOM 2098 N LEU A 136 0.456 -10.625 -11.072 1.00 0.00 N ATOM 2099 CA LEU A 136 1.183 -10.548 -9.816 1.00 0.00 C ATOM 2100 C LEU A 136 0.633 -11.599 -8.849 1.00 0.00 C ATOM 2101 O LEU A 136 1.396 -12.291 -8.178 1.00 0.00 O ATOM 2102 CB LEU A 136 1.147 -9.123 -9.261 1.00 0.00 C ATOM 2103 CG LEU A 136 1.958 -8.879 -7.988 1.00 0.00 C ATOM 2104 CD1 LEU A 136 3.435 -8.644 -8.314 1.00 0.00 C ATOM 2105 CD2 LEU A 136 1.364 -7.730 -7.171 1.00 0.00 C ATOM 0 H LEU A 136 -0.206 -9.865 -11.228 1.00 0.00 H new ATOM 0 HA LEU A 136 2.237 -10.777 -9.972 1.00 0.00 H new ATOM 0 HB2 LEU A 136 1.508 -8.444 -10.034 1.00 0.00 H new ATOM 0 HB3 LEU A 136 0.109 -8.857 -9.063 1.00 0.00 H new ATOM 0 HG LEU A 136 1.902 -9.776 -7.372 1.00 0.00 H new ATOM 0 HD11 LEU A 136 3.989 -8.473 -7.391 1.00 0.00 H new ATOM 0 HD12 LEU A 136 3.839 -9.519 -8.823 1.00 0.00 H new ATOM 0 HD13 LEU A 136 3.531 -7.772 -8.961 1.00 0.00 H new ATOM 0 HD21 LEU A 136 1.960 -7.577 -6.271 1.00 0.00 H new ATOM 0 HD22 LEU A 136 1.369 -6.818 -7.768 1.00 0.00 H new ATOM 0 HD23 LEU A 136 0.339 -7.975 -6.891 1.00 0.00 H new ATOM 2117 N ILE A 137 -0.690 -11.684 -8.808 1.00 0.00 N ATOM 2118 CA ILE A 137 -1.350 -12.639 -7.934 1.00 0.00 C ATOM 2119 C ILE A 137 -1.219 -14.044 -8.526 1.00 0.00 C ATOM 2120 O ILE A 137 -1.391 -15.036 -7.822 1.00 0.00 O ATOM 2121 CB ILE A 137 -2.798 -12.214 -7.674 1.00 0.00 C ATOM 2122 CG1 ILE A 137 -2.854 -10.845 -6.993 1.00 0.00 C ATOM 2123 CG2 ILE A 137 -3.549 -13.282 -6.878 1.00 0.00 C ATOM 2124 CD1 ILE A 137 -3.877 -9.935 -7.676 1.00 0.00 C ATOM 0 H ILE A 137 -1.321 -11.108 -9.365 1.00 0.00 H new ATOM 0 HA ILE A 137 -0.866 -12.659 -6.958 1.00 0.00 H new ATOM 0 HB ILE A 137 -3.303 -12.116 -8.635 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -3.116 -10.968 -5.942 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -1.869 -10.379 -7.024 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -4.575 -12.955 -6.707 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -3.555 -14.217 -7.439 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -3.053 -13.437 -5.920 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -3.897 -8.968 -7.173 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -3.599 -9.795 -8.721 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -4.865 -10.393 -7.622 1.00 0.00 H new ATOM 2136 N ARG A 138 -0.913 -14.081 -9.814 1.00 0.00 N ATOM 2137 CA ARG A 138 -0.757 -15.347 -10.510 1.00 0.00 C ATOM 2138 C ARG A 138 0.664 -15.883 -10.323 1.00 0.00 C ATOM 2139 O ARG A 138 0.853 -17.054 -9.999 1.00 0.00 O ATOM 2140 CB ARG A 138 -1.043 -15.194 -12.005 1.00 0.00 C ATOM 2141 CG ARG A 138 -2.180 -16.120 -12.443 1.00 0.00 C ATOM 2142 CD ARG A 138 -3.539 -15.443 -12.259 1.00 0.00 C ATOM 2143 NE ARG A 138 -4.584 -16.199 -12.984 1.00 0.00 N ATOM 2144 CZ ARG A 138 -5.085 -17.382 -12.571 1.00 0.00 C ATOM 2145 NH1 ARG A 138 -4.641 -17.956 -11.433 1.00 0.00 N ATOM 2146 NH2 ARG A 138 -6.017 -17.971 -13.298 1.00 0.00 N ATOM 0 H ARG A 138 -0.769 -13.255 -10.394 1.00 0.00 H new ATOM 0 HA ARG A 138 -1.474 -16.049 -10.085 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -1.307 -14.159 -12.225 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -0.143 -15.422 -12.576 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -2.046 -16.397 -13.489 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -2.147 -17.042 -11.862 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -3.787 -15.389 -11.199 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -3.497 -14.419 -12.629 1.00 0.00 H new ATOM 0 HE ARG A 138 -4.948 -15.801 -13.850 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -3.921 -17.495 -10.877 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -5.026 -18.850 -11.129 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -6.347 -17.531 -14.157 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -6.407 -18.865 -13.000 1.00 0.00 H new ATOM 2159 N ASP A 139 1.629 -14.998 -10.533 1.00 0.00 N ATOM 2160 CA ASP A 139 3.026 -15.368 -10.391 1.00 0.00 C ATOM 2161 C ASP A 139 3.877 -14.100 -10.291 1.00 0.00 C ATOM 2162 O ASP A 139 3.813 -13.235 -11.163 1.00 0.00 O ATOM 2163 CB ASP A 139 3.511 -16.168 -11.603 1.00 0.00 C ATOM 2164 CG ASP A 139 4.694 -17.099 -11.332 1.00 0.00 C ATOM 2165 OD1 ASP A 139 5.629 -16.746 -10.598 1.00 0.00 O ATOM 2166 OD2 ASP A 139 4.630 -18.246 -11.917 1.00 0.00 O ATOM 0 H ASP A 139 1.470 -14.027 -10.800 1.00 0.00 H new ATOM 0 HA ASP A 139 3.123 -15.979 -9.493 1.00 0.00 H new ATOM 0 HB2 ASP A 139 2.680 -16.762 -11.983 1.00 0.00 H new ATOM 0 HB3 ASP A 139 3.791 -15.470 -12.392 1.00 0.00 H new ATOM 2172 N PRO A 140 4.676 -14.028 -9.192 1.00 0.00 N ATOM 2173 CA PRO A 140 5.537 -12.880 -8.967 1.00 0.00 C ATOM 2174 C PRO A 140 6.756 -12.920 -9.892 1.00 0.00 C ATOM 2175 O PRO A 140 7.457 -11.921 -10.043 1.00 0.00 O ATOM 2176 CB PRO A 140 5.907 -12.950 -7.495 1.00 0.00 C ATOM 2177 CG PRO A 140 5.623 -14.377 -7.060 1.00 0.00 C ATOM 2178 CD PRO A 140 4.779 -15.034 -8.140 1.00 0.00 C ATOM 0 HA PRO A 140 5.047 -11.934 -9.197 1.00 0.00 H new ATOM 0 HB2 PRO A 140 6.957 -12.698 -7.344 1.00 0.00 H new ATOM 0 HB3 PRO A 140 5.321 -12.240 -6.911 1.00 0.00 H new ATOM 0 HG2 PRO A 140 6.554 -14.925 -6.917 1.00 0.00 H new ATOM 0 HG3 PRO A 140 5.097 -14.388 -6.105 1.00 0.00 H new ATOM 0 HD2 PRO A 140 5.248 -15.946 -8.509 1.00 0.00 H new ATOM 0 HD3 PRO A 140 3.796 -15.312 -7.760 1.00 0.00 H new ATOM 2186 N ASN A 141 6.971 -14.085 -10.486 1.00 0.00 N ATOM 2187 CA ASN A 141 8.091 -14.266 -11.393 1.00 0.00 C ATOM 2188 C ASN A 141 7.770 -13.605 -12.735 1.00 0.00 C ATOM 2189 O ASN A 141 8.676 -13.224 -13.474 1.00 0.00 O ATOM 2190 CB ASN A 141 8.355 -15.752 -11.650 1.00 0.00 C ATOM 2191 CG ASN A 141 8.976 -16.418 -10.421 1.00 0.00 C ATOM 2192 OD1 ASN A 141 10.184 -16.465 -10.251 1.00 0.00 O ATOM 2193 ND2 ASN A 141 8.087 -16.930 -9.575 1.00 0.00 N ATOM 0 H ASN A 141 6.389 -14.912 -10.357 1.00 0.00 H new ATOM 0 HA ASN A 141 8.971 -13.815 -10.935 1.00 0.00 H new ATOM 0 HB2 ASN A 141 7.421 -16.252 -11.906 1.00 0.00 H new ATOM 0 HB3 ASN A 141 9.022 -15.864 -12.505 1.00 0.00 H new ATOM 0 HD21 ASN A 141 8.402 -17.396 -8.724 1.00 0.00 H new ATOM 0 HD22 ASN A 141 7.090 -16.857 -9.777 1.00 0.00 H new ATOM 2200 N ALA A 142 6.479 -13.489 -13.007 1.00 0.00 N ATOM 2201 CA ALA A 142 6.027 -12.881 -14.247 1.00 0.00 C ATOM 2202 C ALA A 142 6.785 -11.570 -14.471 1.00 0.00 C ATOM 2203 O ALA A 142 7.161 -10.896 -13.515 1.00 0.00 O ATOM 2204 CB ALA A 142 4.513 -12.676 -14.193 1.00 0.00 C ATOM 0 H ALA A 142 5.731 -13.806 -12.390 1.00 0.00 H new ATOM 0 HA ALA A 142 6.237 -13.534 -15.094 1.00 0.00 H new ATOM 0 HB1 ALA A 142 4.174 -12.220 -15.123 1.00 0.00 H new ATOM 0 HB2 ALA A 142 4.020 -13.639 -14.060 1.00 0.00 H new ATOM 0 HB3 ALA A 142 4.264 -12.023 -13.357 1.00 0.00 H new ATOM 2210 N ASP A 143 6.987 -11.250 -15.741 1.00 0.00 N ATOM 2211 CA ASP A 143 7.692 -10.033 -16.104 1.00 0.00 C ATOM 2212 C ASP A 143 7.109 -8.857 -15.317 1.00 0.00 C ATOM 2213 O ASP A 143 5.902 -8.795 -15.089 1.00 0.00 O ATOM 2214 CB ASP A 143 7.535 -9.729 -17.595 1.00 0.00 C ATOM 2215 CG ASP A 143 8.839 -9.414 -18.331 1.00 0.00 C ATOM 2216 OD1 ASP A 143 9.373 -10.253 -19.071 1.00 0.00 O ATOM 2217 OD2 ASP A 143 9.314 -8.233 -18.118 1.00 0.00 O ATOM 0 H ASP A 143 6.674 -11.813 -16.532 1.00 0.00 H new ATOM 0 HA ASP A 143 8.748 -10.174 -15.875 1.00 0.00 H new ATOM 0 HB2 ASP A 143 7.061 -10.584 -18.077 1.00 0.00 H new ATOM 0 HB3 ASP A 143 6.858 -8.883 -17.709 1.00 0.00 H new ATOM 2223 N LEU A 144 7.994 -7.953 -14.925 1.00 0.00 N ATOM 2224 CA LEU A 144 7.582 -6.782 -14.169 1.00 0.00 C ATOM 2225 C LEU A 144 6.447 -6.073 -14.911 1.00 0.00 C ATOM 2226 O LEU A 144 5.503 -5.588 -14.290 1.00 0.00 O ATOM 2227 CB LEU A 144 8.784 -5.881 -13.880 1.00 0.00 C ATOM 2228 CG LEU A 144 10.080 -6.595 -13.490 1.00 0.00 C ATOM 2229 CD1 LEU A 144 9.784 -7.894 -12.738 1.00 0.00 C ATOM 2230 CD2 LEU A 144 10.966 -6.831 -14.715 1.00 0.00 C ATOM 0 H LEU A 144 8.994 -8.007 -15.116 1.00 0.00 H new ATOM 0 HA LEU A 144 7.191 -7.076 -13.195 1.00 0.00 H new ATOM 0 HB2 LEU A 144 8.979 -5.274 -14.764 1.00 0.00 H new ATOM 0 HB3 LEU A 144 8.514 -5.196 -13.076 1.00 0.00 H new ATOM 0 HG LEU A 144 10.636 -5.949 -12.811 1.00 0.00 H new ATOM 0 HD11 LEU A 144 10.722 -8.382 -12.472 1.00 0.00 H new ATOM 0 HD12 LEU A 144 9.222 -7.670 -11.831 1.00 0.00 H new ATOM 0 HD13 LEU A 144 9.197 -8.557 -13.374 1.00 0.00 H new ATOM 0 HD21 LEU A 144 11.880 -7.340 -14.410 1.00 0.00 H new ATOM 0 HD22 LEU A 144 10.431 -7.448 -15.437 1.00 0.00 H new ATOM 0 HD23 LEU A 144 11.218 -5.874 -15.171 1.00 0.00 H new TER 2242 LEU A 144