USER MOD reduce.3.24.130724 H: found=0, std=0, add=1103, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1097 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 127 GLN : amide:sc= -6.46! C(o=-22!,f=-23!) USER MOD Set 1.2: A 129 HIS : no HE2:sc= -15.6! C(o=-22!,f=-27!) USER MOD Set 2.1: A 103 ASN : amide:sc= -1.3 X(o=-1.3,f=-1.6) USER MOD Set 2.2: A 110 THR OG1 : rot 180:sc= -0.0136 USER MOD Set 3.1: A 63 SER OG : rot 38:sc= 0.398 USER MOD Set 3.2: A 100 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 29 HIS : no HD1:sc= -4.72! K(o=-5!,f=-5.7) USER MOD Set 4.2: A 102 TYR OH : rot 134:sc= -0.248 USER MOD Set 5.1: A 19 ASN : amide:sc= -2.99 K(o=-16,f=-21!) USER MOD Set 5.2: A 55 HIS : no HD1:sc= -9.37! C(o=-16!,f=-19!) USER MOD Set 5.3: A 119 MET CE :methyl 163:sc= -3.28! (180deg=-0.918) USER MOD Set 6.1: A 1 GLY N :NH3+ -125:sc= 0.0986 (180deg=0) USER MOD Set 6.2: A 6 SER OG : rot 134:sc= 0 USER MOD Single : A 2 SER OG : rot 174:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= -0.0827 USER MOD Single : A 5 SER OG : rot -29:sc= 0.389 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 16:sc= 0.378 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0.059 USER MOD Single : A 20 LYS NZ :NH3+ 160:sc= -0.0319 (180deg=-0.365) USER MOD Single : A 24 HIS : no HD1:sc= -2.93! K(o=-2.9!,f=-3.7) USER MOD Single : A 25 ASN : amide:sc= -0.0418 X(o=-0.042,f=-0.47) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 CYS SG : rot 61:sc= -0.339 USER MOD Single : A 31 CYS SG : rot 97:sc= -0.0749 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN : amide:sc= -0.778 K(o=-0.78,f=-2!) USER MOD Single : A 40 GLN : amide:sc= -0.239 K(o=-0.24,f=-2.6!) USER MOD Single : A 41 LYS NZ :NH3+ 150:sc= -0.0338 (180deg=-0.991) USER MOD Single : A 42 ASN : amide:sc= 1.04 K(o=1,f=-0.56) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot 120:sc= 0.0317 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= -0.182 X(o=-0.18,f=-0.084) USER MOD Single : A 64 SER OG : rot 50:sc= -0.176 USER MOD Single : A 65 CYS SG : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc= -0.185 K(o=-0.19,f=-1.6) USER MOD Single : A 71 TYR OH : rot 158:sc= -0.481 USER MOD Single : A 72 THR OG1 : rot 180:sc= 0.0315 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 171:sc= 0.024 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot 165:sc= -0.882 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.779 USER MOD Single : A 95 MET CE :methyl -169:sc= -3.79! (180deg=-4.09!) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 SER OG : rot -160:sc= -1.08 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 GLN : amide:sc= -0.0117 X(o=-0.012,f=-0.00088) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 MET CE :methyl 151:sc= -1.31 (180deg=-2.09!) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 37:sc= 0.225 USER MOD Single : A 132 GLN : amide:sc= -0.11 K(o=-0.11,f=-0.98) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 SER OG : rot 24:sc= 1.13 USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 24.009 0.434 -15.048 1.00 0.00 N ATOM 2 CA GLY A 1 24.167 -0.907 -15.585 1.00 0.00 C ATOM 3 C GLY A 1 25.428 -1.574 -15.031 1.00 0.00 C ATOM 4 O GLY A 1 26.054 -1.057 -14.107 1.00 0.00 O ATOM 0 H1 GLY A 1 23.073 0.522 -14.604 1.00 0.00 H new ATOM 0 H2 GLY A 1 24.747 0.613 -14.338 1.00 0.00 H new ATOM 0 H3 GLY A 1 24.094 1.128 -15.818 1.00 0.00 H new ATOM 0 HA2 GLY A 1 23.293 -1.508 -15.334 1.00 0.00 H new ATOM 0 HA3 GLY A 1 24.222 -0.863 -16.673 1.00 0.00 H new ATOM 8 N SER A 2 25.763 -2.713 -15.620 1.00 0.00 N ATOM 9 CA SER A 2 26.938 -3.456 -15.198 1.00 0.00 C ATOM 10 C SER A 2 26.784 -3.893 -13.740 1.00 0.00 C ATOM 11 O SER A 2 26.372 -3.104 -12.891 1.00 0.00 O ATOM 12 CB SER A 2 28.209 -2.623 -15.371 1.00 0.00 C ATOM 13 OG SER A 2 28.878 -2.917 -16.594 1.00 0.00 O ATOM 0 H SER A 2 25.241 -3.139 -16.386 1.00 0.00 H new ATOM 0 HA SER A 2 27.028 -4.340 -15.829 1.00 0.00 H new ATOM 0 HB2 SER A 2 27.955 -1.563 -15.343 1.00 0.00 H new ATOM 0 HB3 SER A 2 28.883 -2.812 -14.535 1.00 0.00 H new ATOM 0 HG SER A 2 29.632 -2.302 -16.711 1.00 0.00 H new ATOM 19 N SER A 3 27.124 -5.150 -13.493 1.00 0.00 N ATOM 20 CA SER A 3 27.029 -5.701 -12.152 1.00 0.00 C ATOM 21 C SER A 3 27.551 -4.688 -11.131 1.00 0.00 C ATOM 22 O SER A 3 26.830 -4.299 -10.214 1.00 0.00 O ATOM 23 CB SER A 3 27.806 -7.015 -12.040 1.00 0.00 C ATOM 24 OG SER A 3 29.165 -6.867 -12.441 1.00 0.00 O ATOM 0 H SER A 3 27.466 -5.802 -14.199 1.00 0.00 H new ATOM 0 HA SER A 3 25.980 -5.911 -11.943 1.00 0.00 H new ATOM 0 HB2 SER A 3 27.768 -7.372 -11.011 1.00 0.00 H new ATOM 0 HB3 SER A 3 27.326 -7.774 -12.658 1.00 0.00 H new ATOM 0 HG SER A 3 29.627 -7.727 -12.354 1.00 0.00 H new ATOM 30 N GLY A 4 28.799 -4.289 -11.325 1.00 0.00 N ATOM 31 CA GLY A 4 29.425 -3.329 -10.433 1.00 0.00 C ATOM 32 C GLY A 4 30.565 -2.589 -11.137 1.00 0.00 C ATOM 33 O GLY A 4 31.699 -2.592 -10.661 1.00 0.00 O ATOM 0 H GLY A 4 29.394 -4.613 -12.087 1.00 0.00 H new ATOM 0 HA2 GLY A 4 28.681 -2.612 -10.085 1.00 0.00 H new ATOM 0 HA3 GLY A 4 29.809 -3.843 -9.552 1.00 0.00 H new ATOM 37 N SER A 5 30.223 -1.972 -12.259 1.00 0.00 N ATOM 38 CA SER A 5 31.203 -1.229 -13.033 1.00 0.00 C ATOM 39 C SER A 5 30.498 -0.212 -13.933 1.00 0.00 C ATOM 40 O SER A 5 30.419 -0.401 -15.145 1.00 0.00 O ATOM 41 CB SER A 5 32.070 -2.170 -13.872 1.00 0.00 C ATOM 42 OG SER A 5 32.567 -3.264 -13.106 1.00 0.00 O ATOM 0 H SER A 5 29.281 -1.972 -12.650 1.00 0.00 H new ATOM 0 HA SER A 5 31.856 -0.699 -12.340 1.00 0.00 H new ATOM 0 HB2 SER A 5 31.486 -2.550 -14.710 1.00 0.00 H new ATOM 0 HB3 SER A 5 32.907 -1.613 -14.293 1.00 0.00 H new ATOM 0 HG SER A 5 32.668 -2.989 -12.171 1.00 0.00 H new ATOM 48 N SER A 6 30.003 0.844 -13.304 1.00 0.00 N ATOM 49 CA SER A 6 29.307 1.890 -14.033 1.00 0.00 C ATOM 50 C SER A 6 29.602 3.252 -13.401 1.00 0.00 C ATOM 51 O SER A 6 29.781 3.353 -12.188 1.00 0.00 O ATOM 52 CB SER A 6 27.799 1.633 -14.060 1.00 0.00 C ATOM 53 OG SER A 6 27.241 1.865 -15.350 1.00 0.00 O ATOM 0 H SER A 6 30.070 0.997 -12.298 1.00 0.00 H new ATOM 0 HA SER A 6 29.667 1.888 -15.062 1.00 0.00 H new ATOM 0 HB2 SER A 6 27.601 0.604 -13.759 1.00 0.00 H new ATOM 0 HB3 SER A 6 27.308 2.278 -13.331 1.00 0.00 H new ATOM 0 HG SER A 6 26.642 1.126 -15.585 1.00 0.00 H new ATOM 59 N GLY A 7 29.643 4.267 -14.253 1.00 0.00 N ATOM 60 CA GLY A 7 29.914 5.619 -13.793 1.00 0.00 C ATOM 61 C GLY A 7 29.125 5.933 -12.520 1.00 0.00 C ATOM 62 O GLY A 7 28.010 5.446 -12.340 1.00 0.00 O ATOM 0 H GLY A 7 29.493 4.180 -15.258 1.00 0.00 H new ATOM 0 HA2 GLY A 7 30.981 5.735 -13.602 1.00 0.00 H new ATOM 0 HA3 GLY A 7 29.651 6.332 -14.574 1.00 0.00 H new ATOM 66 N PRO A 8 29.752 6.766 -11.647 1.00 0.00 N ATOM 67 CA PRO A 8 29.122 7.151 -10.396 1.00 0.00 C ATOM 68 C PRO A 8 28.013 8.178 -10.633 1.00 0.00 C ATOM 69 O PRO A 8 28.229 9.378 -10.472 1.00 0.00 O ATOM 70 CB PRO A 8 30.253 7.686 -9.533 1.00 0.00 C ATOM 71 CG PRO A 8 31.387 8.014 -10.491 1.00 0.00 C ATOM 72 CD PRO A 8 31.073 7.361 -11.827 1.00 0.00 C ATOM 0 HA PRO A 8 28.624 6.317 -9.903 1.00 0.00 H new ATOM 0 HB2 PRO A 8 29.938 8.572 -8.982 1.00 0.00 H new ATOM 0 HB3 PRO A 8 30.566 6.946 -8.796 1.00 0.00 H new ATOM 0 HG2 PRO A 8 31.488 9.093 -10.608 1.00 0.00 H new ATOM 0 HG3 PRO A 8 32.335 7.646 -10.100 1.00 0.00 H new ATOM 0 HD2 PRO A 8 31.071 8.093 -12.635 1.00 0.00 H new ATOM 0 HD3 PRO A 8 31.816 6.606 -12.083 1.00 0.00 H new ATOM 80 N ARG A 9 26.851 7.669 -11.013 1.00 0.00 N ATOM 81 CA ARG A 9 25.708 8.528 -11.275 1.00 0.00 C ATOM 82 C ARG A 9 24.404 7.749 -11.085 1.00 0.00 C ATOM 83 O ARG A 9 24.367 6.536 -11.286 1.00 0.00 O ATOM 84 CB ARG A 9 25.755 9.089 -12.698 1.00 0.00 C ATOM 85 CG ARG A 9 25.736 7.963 -13.733 1.00 0.00 C ATOM 86 CD ARG A 9 27.141 7.692 -14.275 1.00 0.00 C ATOM 87 NE ARG A 9 27.181 7.954 -15.731 1.00 0.00 N ATOM 88 CZ ARG A 9 27.399 9.161 -16.271 1.00 0.00 C ATOM 89 NH1 ARG A 9 27.598 10.223 -15.480 1.00 0.00 N ATOM 90 NH2 ARG A 9 27.418 9.305 -17.603 1.00 0.00 N ATOM 0 H ARG A 9 26.676 6.673 -11.146 1.00 0.00 H new ATOM 0 HA ARG A 9 25.747 9.357 -10.568 1.00 0.00 H new ATOM 0 HB2 ARG A 9 24.904 9.751 -12.860 1.00 0.00 H new ATOM 0 HB3 ARG A 9 26.655 9.690 -12.826 1.00 0.00 H new ATOM 0 HG2 ARG A 9 25.336 7.056 -13.281 1.00 0.00 H new ATOM 0 HG3 ARG A 9 25.071 8.230 -14.554 1.00 0.00 H new ATOM 0 HD2 ARG A 9 27.866 8.325 -13.763 1.00 0.00 H new ATOM 0 HD3 ARG A 9 27.424 6.658 -14.075 1.00 0.00 H new ATOM 0 HE ARG A 9 27.033 7.167 -16.363 1.00 0.00 H new ATOM 0 HH11 ARG A 9 27.584 10.113 -14.466 1.00 0.00 H new ATOM 0 HH12 ARG A 9 27.764 11.141 -15.891 1.00 0.00 H new ATOM 0 HH21 ARG A 9 27.267 8.496 -18.206 1.00 0.00 H new ATOM 0 HH22 ARG A 9 27.584 10.224 -18.014 1.00 0.00 H new ATOM 104 N LEU A 10 23.368 8.479 -10.699 1.00 0.00 N ATOM 105 CA LEU A 10 22.066 7.872 -10.479 1.00 0.00 C ATOM 106 C LEU A 10 21.167 8.152 -11.685 1.00 0.00 C ATOM 107 O LEU A 10 19.949 8.004 -11.603 1.00 0.00 O ATOM 108 CB LEU A 10 21.474 8.341 -9.149 1.00 0.00 C ATOM 109 CG LEU A 10 21.129 7.241 -8.143 1.00 0.00 C ATOM 110 CD1 LEU A 10 21.887 7.441 -6.829 1.00 0.00 C ATOM 111 CD2 LEU A 10 19.617 7.153 -7.924 1.00 0.00 C ATOM 0 H LEU A 10 23.404 9.485 -10.533 1.00 0.00 H new ATOM 0 HA LEU A 10 22.160 6.789 -10.395 1.00 0.00 H new ATOM 0 HB2 LEU A 10 22.181 9.025 -8.681 1.00 0.00 H new ATOM 0 HB3 LEU A 10 20.569 8.912 -9.358 1.00 0.00 H new ATOM 0 HG LEU A 10 21.451 6.286 -8.558 1.00 0.00 H new ATOM 0 HD11 LEU A 10 21.623 6.645 -6.132 1.00 0.00 H new ATOM 0 HD12 LEU A 10 22.960 7.415 -7.020 1.00 0.00 H new ATOM 0 HD13 LEU A 10 21.619 8.405 -6.397 1.00 0.00 H new ATOM 0 HD21 LEU A 10 19.399 6.364 -7.205 1.00 0.00 H new ATOM 0 HD22 LEU A 10 19.249 8.105 -7.541 1.00 0.00 H new ATOM 0 HD23 LEU A 10 19.125 6.928 -8.870 1.00 0.00 H new ATOM 123 N TYR A 11 21.803 8.551 -12.777 1.00 0.00 N ATOM 124 CA TYR A 11 21.076 8.853 -13.998 1.00 0.00 C ATOM 125 C TYR A 11 20.731 7.573 -14.761 1.00 0.00 C ATOM 126 O TYR A 11 21.538 6.647 -14.824 1.00 0.00 O ATOM 127 CB TYR A 11 22.020 9.702 -14.851 1.00 0.00 C ATOM 128 CG TYR A 11 21.859 11.210 -14.645 1.00 0.00 C ATOM 129 CD1 TYR A 11 20.754 11.861 -15.155 1.00 0.00 C ATOM 130 CD2 TYR A 11 22.818 11.918 -13.950 1.00 0.00 C ATOM 131 CE1 TYR A 11 20.602 13.280 -14.961 1.00 0.00 C ATOM 132 CE2 TYR A 11 22.666 13.337 -13.756 1.00 0.00 C ATOM 133 CZ TYR A 11 21.566 13.948 -14.271 1.00 0.00 C ATOM 134 OH TYR A 11 21.422 15.288 -14.088 1.00 0.00 O ATOM 0 H TYR A 11 22.814 8.672 -12.841 1.00 0.00 H new ATOM 0 HA TYR A 11 20.141 9.366 -13.772 1.00 0.00 H new ATOM 0 HB2 TYR A 11 23.049 9.422 -14.624 1.00 0.00 H new ATOM 0 HB3 TYR A 11 21.851 9.469 -15.902 1.00 0.00 H new ATOM 0 HD1 TYR A 11 20.004 11.307 -15.699 1.00 0.00 H new ATOM 0 HD2 TYR A 11 23.683 11.408 -13.551 1.00 0.00 H new ATOM 0 HE1 TYR A 11 19.742 13.802 -15.354 1.00 0.00 H new ATOM 0 HE2 TYR A 11 23.409 13.903 -13.214 1.00 0.00 H new ATOM 0 HH TYR A 11 22.184 15.632 -13.577 1.00 0.00 H new ATOM 144 N LYS A 12 19.530 7.562 -15.322 1.00 0.00 N ATOM 145 CA LYS A 12 19.068 6.411 -16.078 1.00 0.00 C ATOM 146 C LYS A 12 17.708 6.729 -16.703 1.00 0.00 C ATOM 147 O LYS A 12 16.816 7.241 -16.028 1.00 0.00 O ATOM 148 CB LYS A 12 19.063 5.159 -15.199 1.00 0.00 C ATOM 149 CG LYS A 12 17.973 5.244 -14.129 1.00 0.00 C ATOM 150 CD LYS A 12 16.939 4.130 -14.310 1.00 0.00 C ATOM 151 CE LYS A 12 15.691 4.398 -13.466 1.00 0.00 C ATOM 152 NZ LYS A 12 14.570 3.541 -13.913 1.00 0.00 N ATOM 0 H LYS A 12 18.863 8.332 -15.268 1.00 0.00 H new ATOM 0 HA LYS A 12 19.753 6.194 -16.898 1.00 0.00 H new ATOM 0 HB2 LYS A 12 18.902 4.276 -15.818 1.00 0.00 H new ATOM 0 HB3 LYS A 12 20.036 5.041 -14.723 1.00 0.00 H new ATOM 0 HG2 LYS A 12 18.423 5.170 -13.139 1.00 0.00 H new ATOM 0 HG3 LYS A 12 17.480 6.215 -14.183 1.00 0.00 H new ATOM 0 HD2 LYS A 12 16.662 4.054 -15.361 1.00 0.00 H new ATOM 0 HD3 LYS A 12 17.376 3.173 -14.025 1.00 0.00 H new ATOM 0 HE2 LYS A 12 15.907 4.206 -12.415 1.00 0.00 H new ATOM 0 HE3 LYS A 12 15.409 5.448 -13.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 13.731 3.735 -13.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 14.354 3.744 -14.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 14.837 2.541 -13.814 1.00 0.00 H new ATOM 166 N GLU A 13 17.592 6.412 -17.984 1.00 0.00 N ATOM 167 CA GLU A 13 16.356 6.657 -18.706 1.00 0.00 C ATOM 168 C GLU A 13 15.151 6.290 -17.838 1.00 0.00 C ATOM 169 O GLU A 13 15.251 5.431 -16.963 1.00 0.00 O ATOM 170 CB GLU A 13 16.332 5.889 -20.030 1.00 0.00 C ATOM 171 CG GLU A 13 16.795 6.777 -21.187 1.00 0.00 C ATOM 172 CD GLU A 13 17.405 5.938 -22.312 1.00 0.00 C ATOM 173 OE1 GLU A 13 16.611 5.405 -23.117 1.00 0.00 O ATOM 174 OE2 GLU A 13 18.651 5.848 -22.341 1.00 0.00 O ATOM 0 H GLU A 13 18.334 5.988 -18.540 1.00 0.00 H new ATOM 0 HA GLU A 13 16.300 7.720 -18.939 1.00 0.00 H new ATOM 0 HB2 GLU A 13 16.977 5.013 -19.958 1.00 0.00 H new ATOM 0 HB3 GLU A 13 15.323 5.527 -20.226 1.00 0.00 H new ATOM 0 HG2 GLU A 13 15.951 7.349 -21.572 1.00 0.00 H new ATOM 0 HG3 GLU A 13 17.530 7.497 -20.826 1.00 0.00 H new ATOM 181 N PRO A 14 14.010 6.976 -18.117 1.00 0.00 N ATOM 182 CA PRO A 14 12.788 6.730 -17.371 1.00 0.00 C ATOM 183 C PRO A 14 12.140 5.411 -17.799 1.00 0.00 C ATOM 184 O PRO A 14 12.666 4.708 -18.661 1.00 0.00 O ATOM 185 CB PRO A 14 11.909 7.940 -17.646 1.00 0.00 C ATOM 186 CG PRO A 14 12.477 8.591 -18.897 1.00 0.00 C ATOM 187 CD PRO A 14 13.855 8.000 -19.146 1.00 0.00 C ATOM 0 HA PRO A 14 12.964 6.617 -16.301 1.00 0.00 H new ATOM 0 HB2 PRO A 14 10.871 7.643 -17.797 1.00 0.00 H new ATOM 0 HB3 PRO A 14 11.923 8.633 -16.804 1.00 0.00 H new ATOM 0 HG2 PRO A 14 11.824 8.410 -19.751 1.00 0.00 H new ATOM 0 HG3 PRO A 14 12.543 9.671 -18.769 1.00 0.00 H new ATOM 0 HD2 PRO A 14 13.927 7.571 -20.146 1.00 0.00 H new ATOM 0 HD3 PRO A 14 14.632 8.760 -19.068 1.00 0.00 H new ATOM 195 N SER A 15 11.008 5.116 -17.177 1.00 0.00 N ATOM 196 CA SER A 15 10.284 3.894 -17.482 1.00 0.00 C ATOM 197 C SER A 15 8.793 4.085 -17.198 1.00 0.00 C ATOM 198 O SER A 15 8.413 4.489 -16.099 1.00 0.00 O ATOM 199 CB SER A 15 10.831 2.713 -16.677 1.00 0.00 C ATOM 200 OG SER A 15 12.020 2.180 -17.253 1.00 0.00 O ATOM 0 H SER A 15 10.575 5.702 -16.463 1.00 0.00 H new ATOM 0 HA SER A 15 10.420 3.671 -18.540 1.00 0.00 H new ATOM 0 HB2 SER A 15 11.035 3.034 -15.656 1.00 0.00 H new ATOM 0 HB3 SER A 15 10.074 1.931 -16.620 1.00 0.00 H new ATOM 0 HG SER A 15 12.391 2.824 -17.892 1.00 0.00 H new ATOM 206 N ALA A 16 7.987 3.785 -18.206 1.00 0.00 N ATOM 207 CA ALA A 16 6.546 3.919 -18.078 1.00 0.00 C ATOM 208 C ALA A 16 5.971 2.637 -17.471 1.00 0.00 C ATOM 209 O ALA A 16 5.804 1.637 -18.167 1.00 0.00 O ATOM 210 CB ALA A 16 5.939 4.239 -19.445 1.00 0.00 C ATOM 0 H ALA A 16 8.305 3.449 -19.115 1.00 0.00 H new ATOM 0 HA ALA A 16 6.295 4.742 -17.409 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.858 4.339 -19.349 1.00 0.00 H new ATOM 0 HB2 ALA A 16 6.358 5.173 -19.820 1.00 0.00 H new ATOM 0 HB3 ALA A 16 6.168 3.433 -20.142 1.00 0.00 H new ATOM 216 N LYS A 17 5.685 2.709 -16.179 1.00 0.00 N ATOM 217 CA LYS A 17 5.132 1.567 -15.470 1.00 0.00 C ATOM 218 C LYS A 17 4.349 2.059 -14.252 1.00 0.00 C ATOM 219 O LYS A 17 4.296 1.380 -13.228 1.00 0.00 O ATOM 220 CB LYS A 17 6.235 0.564 -15.129 1.00 0.00 C ATOM 221 CG LYS A 17 6.072 -0.726 -15.935 1.00 0.00 C ATOM 222 CD LYS A 17 4.898 -1.555 -15.410 1.00 0.00 C ATOM 223 CE LYS A 17 5.385 -2.669 -14.480 1.00 0.00 C ATOM 224 NZ LYS A 17 4.235 -3.396 -13.896 1.00 0.00 N ATOM 0 H LYS A 17 5.826 3.540 -15.605 1.00 0.00 H new ATOM 0 HA LYS A 17 4.428 1.028 -16.104 1.00 0.00 H new ATOM 0 HB2 LYS A 17 7.210 1.006 -15.336 1.00 0.00 H new ATOM 0 HB3 LYS A 17 6.208 0.337 -14.063 1.00 0.00 H new ATOM 0 HG2 LYS A 17 5.911 -0.485 -16.986 1.00 0.00 H new ATOM 0 HG3 LYS A 17 6.989 -1.312 -15.880 1.00 0.00 H new ATOM 0 HD2 LYS A 17 4.202 -0.908 -14.875 1.00 0.00 H new ATOM 0 HD3 LYS A 17 4.351 -1.989 -16.247 1.00 0.00 H new ATOM 0 HE2 LYS A 17 6.018 -3.362 -15.034 1.00 0.00 H new ATOM 0 HE3 LYS A 17 5.997 -2.245 -13.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 4.583 -4.148 -13.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 3.646 -2.734 -13.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 3.667 -3.817 -14.659 1.00 0.00 H new ATOM 238 N SER A 18 3.760 3.237 -14.402 1.00 0.00 N ATOM 239 CA SER A 18 2.983 3.827 -13.326 1.00 0.00 C ATOM 240 C SER A 18 2.123 2.756 -12.653 1.00 0.00 C ATOM 241 O SER A 18 1.402 2.020 -13.325 1.00 0.00 O ATOM 242 CB SER A 18 2.102 4.966 -13.844 1.00 0.00 C ATOM 243 OG SER A 18 2.696 5.640 -14.951 1.00 0.00 O ATOM 0 H SER A 18 3.806 3.798 -15.253 1.00 0.00 H new ATOM 0 HA SER A 18 3.674 4.242 -12.593 1.00 0.00 H new ATOM 0 HB2 SER A 18 1.132 4.568 -14.140 1.00 0.00 H new ATOM 0 HB3 SER A 18 1.922 5.679 -13.040 1.00 0.00 H new ATOM 0 HG SER A 18 2.102 6.359 -15.253 1.00 0.00 H new ATOM 249 N ASN A 19 2.228 2.701 -11.333 1.00 0.00 N ATOM 250 CA ASN A 19 1.470 1.732 -10.561 1.00 0.00 C ATOM 251 C ASN A 19 0.581 2.469 -9.557 1.00 0.00 C ATOM 252 O ASN A 19 0.483 2.069 -8.398 1.00 0.00 O ATOM 253 CB ASN A 19 2.399 0.804 -9.777 1.00 0.00 C ATOM 254 CG ASN A 19 3.108 1.560 -8.651 1.00 0.00 C ATOM 255 OD1 ASN A 19 3.769 2.563 -8.863 1.00 0.00 O ATOM 256 ND2 ASN A 19 2.933 1.025 -7.446 1.00 0.00 N ATOM 0 H ASN A 19 2.827 3.313 -10.779 1.00 0.00 H new ATOM 0 HA ASN A 19 0.872 1.141 -11.255 1.00 0.00 H new ATOM 0 HB2 ASN A 19 1.825 -0.023 -9.359 1.00 0.00 H new ATOM 0 HB3 ASN A 19 3.138 0.370 -10.450 1.00 0.00 H new ATOM 0 HD21 ASN A 19 3.365 1.456 -6.629 1.00 0.00 H new ATOM 0 HD22 ASN A 19 2.367 0.183 -7.339 1.00 0.00 H new ATOM 263 N LYS A 20 -0.045 3.533 -10.039 1.00 0.00 N ATOM 264 CA LYS A 20 -0.922 4.330 -9.198 1.00 0.00 C ATOM 265 C LYS A 20 -2.302 3.673 -9.143 1.00 0.00 C ATOM 266 O LYS A 20 -2.869 3.501 -8.064 1.00 0.00 O ATOM 267 CB LYS A 20 -0.951 5.782 -9.679 1.00 0.00 C ATOM 268 CG LYS A 20 -2.278 6.453 -9.318 1.00 0.00 C ATOM 269 CD LYS A 20 -2.077 7.939 -9.016 1.00 0.00 C ATOM 270 CE LYS A 20 -1.777 8.723 -10.295 1.00 0.00 C ATOM 271 NZ LYS A 20 -2.965 8.749 -11.178 1.00 0.00 N ATOM 0 H LYS A 20 0.038 3.862 -11.001 1.00 0.00 H new ATOM 0 HA LYS A 20 -0.543 4.364 -8.176 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -0.126 6.334 -9.229 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -0.805 5.814 -10.759 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -2.983 6.338 -10.141 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -2.716 5.958 -8.451 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -2.971 8.341 -8.540 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -1.257 8.062 -8.309 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -1.481 9.741 -10.043 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -0.937 8.267 -10.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -2.878 9.535 -11.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -3.030 7.851 -11.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -3.822 8.879 -10.603 1.00 0.00 H new ATOM 285 N PHE A 21 -2.804 3.323 -10.318 1.00 0.00 N ATOM 286 CA PHE A 21 -4.108 2.689 -10.416 1.00 0.00 C ATOM 287 C PHE A 21 -4.110 1.329 -9.714 1.00 0.00 C ATOM 288 O PHE A 21 -5.156 0.859 -9.269 1.00 0.00 O ATOM 289 CB PHE A 21 -4.392 2.480 -11.905 1.00 0.00 C ATOM 290 CG PHE A 21 -4.936 3.722 -12.614 1.00 0.00 C ATOM 291 CD1 PHE A 21 -4.324 4.925 -12.445 1.00 0.00 C ATOM 292 CD2 PHE A 21 -6.031 3.624 -13.415 1.00 0.00 C ATOM 293 CE1 PHE A 21 -4.828 6.078 -13.103 1.00 0.00 C ATOM 294 CE2 PHE A 21 -6.535 4.777 -14.073 1.00 0.00 C ATOM 295 CZ PHE A 21 -5.923 5.979 -13.903 1.00 0.00 C ATOM 0 H PHE A 21 -2.331 3.466 -11.210 1.00 0.00 H new ATOM 0 HA PHE A 21 -4.863 3.315 -9.941 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -3.473 2.165 -12.399 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -5.109 1.667 -12.017 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -3.454 5.003 -11.810 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -6.517 2.669 -13.551 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -4.342 7.033 -12.968 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -7.405 4.699 -14.709 1.00 0.00 H new ATOM 0 HZ PHE A 21 -6.307 6.856 -14.404 1.00 0.00 H new ATOM 305 N ILE A 22 -2.928 0.737 -9.636 1.00 0.00 N ATOM 306 CA ILE A 22 -2.780 -0.559 -8.995 1.00 0.00 C ATOM 307 C ILE A 22 -2.929 -0.394 -7.481 1.00 0.00 C ATOM 308 O ILE A 22 -3.264 -1.347 -6.779 1.00 0.00 O ATOM 309 CB ILE A 22 -1.466 -1.218 -9.416 1.00 0.00 C ATOM 310 CG1 ILE A 22 -1.376 -1.340 -10.938 1.00 0.00 C ATOM 311 CG2 ILE A 22 -1.283 -2.569 -8.721 1.00 0.00 C ATOM 312 CD1 ILE A 22 0.071 -1.557 -11.387 1.00 0.00 C ATOM 0 H ILE A 22 -2.063 1.131 -10.006 1.00 0.00 H new ATOM 0 HA ILE A 22 -3.568 -1.238 -9.321 1.00 0.00 H new ATOM 0 HB ILE A 22 -0.645 -0.577 -9.096 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -1.994 -2.171 -11.277 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -1.773 -0.438 -11.403 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -0.341 -3.016 -9.038 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -1.271 -2.424 -7.641 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -2.107 -3.230 -8.989 1.00 0.00 H new ATOM 0 HD11 ILE A 22 0.106 -1.640 -12.473 1.00 0.00 H new ATOM 0 HD12 ILE A 22 0.682 -0.712 -11.068 1.00 0.00 H new ATOM 0 HD13 ILE A 22 0.457 -2.473 -10.940 1.00 0.00 H new ATOM 324 N ILE A 23 -2.672 0.822 -7.023 1.00 0.00 N ATOM 325 CA ILE A 23 -2.773 1.124 -5.605 1.00 0.00 C ATOM 326 C ILE A 23 -4.216 1.509 -5.271 1.00 0.00 C ATOM 327 O ILE A 23 -4.776 1.033 -4.285 1.00 0.00 O ATOM 328 CB ILE A 23 -1.746 2.187 -5.209 1.00 0.00 C ATOM 329 CG1 ILE A 23 -0.322 1.637 -5.308 1.00 0.00 C ATOM 330 CG2 ILE A 23 -2.048 2.750 -3.819 1.00 0.00 C ATOM 331 CD1 ILE A 23 -0.196 0.304 -4.567 1.00 0.00 C ATOM 0 H ILE A 23 -2.394 1.610 -7.608 1.00 0.00 H new ATOM 0 HA ILE A 23 -2.532 0.243 -5.010 1.00 0.00 H new ATOM 0 HB ILE A 23 -1.821 3.014 -5.915 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -0.053 1.502 -6.355 1.00 0.00 H new ATOM 0 HG13 ILE A 23 0.380 2.358 -4.889 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -1.303 3.503 -3.562 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -3.039 3.204 -3.818 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -2.017 1.944 -3.086 1.00 0.00 H new ATOM 0 HD11 ILE A 23 0.826 -0.065 -4.653 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -0.442 0.448 -3.515 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -0.882 -0.422 -5.004 1.00 0.00 H new ATOM 343 N HIS A 24 -4.776 2.366 -6.112 1.00 0.00 N ATOM 344 CA HIS A 24 -6.142 2.820 -5.918 1.00 0.00 C ATOM 345 C HIS A 24 -7.043 1.621 -5.613 1.00 0.00 C ATOM 346 O HIS A 24 -7.996 1.736 -4.844 1.00 0.00 O ATOM 347 CB HIS A 24 -6.622 3.630 -7.124 1.00 0.00 C ATOM 348 CG HIS A 24 -7.030 5.045 -6.790 1.00 0.00 C ATOM 349 ND1 HIS A 24 -8.347 5.471 -6.813 1.00 0.00 N ATOM 350 CD2 HIS A 24 -6.282 6.126 -6.425 1.00 0.00 C ATOM 351 CE1 HIS A 24 -8.378 6.752 -6.476 1.00 0.00 C ATOM 352 NE2 HIS A 24 -7.098 7.156 -6.237 1.00 0.00 N ATOM 0 H HIS A 24 -4.308 2.758 -6.929 1.00 0.00 H new ATOM 0 HA HIS A 24 -6.187 3.492 -5.061 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -5.827 3.658 -7.869 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -7.469 3.117 -7.580 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -5.208 6.141 -6.309 1.00 0.00 H new ATOM 0 HE1 HIS A 24 -9.262 7.368 -6.403 1.00 0.00 H new ATOM 0 HE2 HIS A 24 -6.814 8.095 -5.959 1.00 0.00 H new ATOM 360 N ASN A 25 -6.709 0.499 -6.233 1.00 0.00 N ATOM 361 CA ASN A 25 -7.475 -0.720 -6.037 1.00 0.00 C ATOM 362 C ASN A 25 -6.992 -1.424 -4.767 1.00 0.00 C ATOM 363 O ASN A 25 -7.787 -2.024 -4.045 1.00 0.00 O ATOM 364 CB ASN A 25 -7.288 -1.683 -7.211 1.00 0.00 C ATOM 365 CG ASN A 25 -8.344 -1.443 -8.292 1.00 0.00 C ATOM 366 OD1 ASN A 25 -9.526 -1.310 -8.022 1.00 0.00 O ATOM 367 ND2 ASN A 25 -7.853 -1.395 -9.527 1.00 0.00 N ATOM 0 H ASN A 25 -5.919 0.408 -6.871 1.00 0.00 H new ATOM 0 HA ASN A 25 -8.527 -0.447 -5.958 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -6.292 -1.555 -7.636 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -7.353 -2.712 -6.856 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -8.477 -1.239 -10.318 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -6.852 -1.514 -9.683 1.00 0.00 H new ATOM 374 N ALA A 26 -5.692 -1.326 -4.534 1.00 0.00 N ATOM 375 CA ALA A 26 -5.093 -1.945 -3.363 1.00 0.00 C ATOM 376 C ALA A 26 -5.760 -1.393 -2.102 1.00 0.00 C ATOM 377 O ALA A 26 -5.874 -2.094 -1.098 1.00 0.00 O ATOM 378 CB ALA A 26 -3.582 -1.707 -3.376 1.00 0.00 C ATOM 0 H ALA A 26 -5.036 -0.828 -5.136 1.00 0.00 H new ATOM 0 HA ALA A 26 -5.253 -3.023 -3.375 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -3.133 -2.171 -2.498 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -3.153 -2.144 -4.277 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -3.382 -0.636 -3.362 1.00 0.00 H new ATOM 384 N LEU A 27 -6.182 -0.140 -2.195 1.00 0.00 N ATOM 385 CA LEU A 27 -6.835 0.515 -1.074 1.00 0.00 C ATOM 386 C LEU A 27 -8.254 -0.035 -0.923 1.00 0.00 C ATOM 387 O LEU A 27 -8.640 -0.480 0.157 1.00 0.00 O ATOM 388 CB LEU A 27 -6.778 2.035 -1.235 1.00 0.00 C ATOM 389 CG LEU A 27 -5.396 2.629 -1.514 1.00 0.00 C ATOM 390 CD1 LEU A 27 -5.420 4.154 -1.395 1.00 0.00 C ATOM 391 CD2 LEU A 27 -4.335 2.000 -0.608 1.00 0.00 C ATOM 0 H LEU A 27 -6.084 0.439 -3.029 1.00 0.00 H new ATOM 0 HA LEU A 27 -6.308 0.296 -0.145 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -7.445 2.319 -2.049 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -7.171 2.492 -0.327 1.00 0.00 H new ATOM 0 HG LEU A 27 -5.124 2.391 -2.542 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -4.425 4.551 -1.598 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -6.128 4.564 -2.115 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -5.724 4.436 -0.387 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -3.362 2.440 -0.827 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -4.591 2.186 0.435 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -4.295 0.925 -0.786 1.00 0.00 H new ATOM 403 N SER A 28 -8.993 0.014 -2.022 1.00 0.00 N ATOM 404 CA SER A 28 -10.362 -0.474 -2.025 1.00 0.00 C ATOM 405 C SER A 28 -10.372 -2.004 -2.017 1.00 0.00 C ATOM 406 O SER A 28 -11.436 -2.621 -1.976 1.00 0.00 O ATOM 407 CB SER A 28 -11.132 0.055 -3.237 1.00 0.00 C ATOM 408 OG SER A 28 -12.016 1.116 -2.886 1.00 0.00 O ATOM 0 H SER A 28 -8.670 0.384 -2.916 1.00 0.00 H new ATOM 0 HA SER A 28 -10.857 -0.109 -1.125 1.00 0.00 H new ATOM 0 HB2 SER A 28 -10.426 0.405 -3.990 1.00 0.00 H new ATOM 0 HB3 SER A 28 -11.702 -0.758 -3.687 1.00 0.00 H new ATOM 0 HG SER A 28 -12.488 1.427 -3.687 1.00 0.00 H new ATOM 414 N HIS A 29 -9.176 -2.572 -2.056 1.00 0.00 N ATOM 415 CA HIS A 29 -9.034 -4.018 -2.053 1.00 0.00 C ATOM 416 C HIS A 29 -9.157 -4.543 -0.621 1.00 0.00 C ATOM 417 O HIS A 29 -9.881 -5.505 -0.369 1.00 0.00 O ATOM 418 CB HIS A 29 -7.727 -4.437 -2.728 1.00 0.00 C ATOM 419 CG HIS A 29 -7.876 -4.794 -4.187 1.00 0.00 C ATOM 420 ND1 HIS A 29 -7.230 -5.874 -4.765 1.00 0.00 N ATOM 421 CD2 HIS A 29 -8.603 -4.205 -5.179 1.00 0.00 C ATOM 422 CE1 HIS A 29 -7.560 -5.922 -6.047 1.00 0.00 C ATOM 423 NE2 HIS A 29 -8.411 -4.887 -6.302 1.00 0.00 N ATOM 0 H HIS A 29 -8.296 -2.057 -2.090 1.00 0.00 H new ATOM 0 HA HIS A 29 -9.837 -4.467 -2.638 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -7.006 -3.625 -2.635 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -7.313 -5.293 -2.195 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -9.229 -3.332 -5.070 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -7.216 -6.652 -6.764 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -8.831 -4.672 -7.206 1.00 0.00 H new ATOM 431 N CYS A 30 -8.439 -3.888 0.279 1.00 0.00 N ATOM 432 CA CYS A 30 -8.459 -4.277 1.679 1.00 0.00 C ATOM 433 C CYS A 30 -7.517 -3.348 2.448 1.00 0.00 C ATOM 434 O CYS A 30 -7.812 -2.954 3.575 1.00 0.00 O ATOM 435 CB CYS A 30 -8.085 -5.749 1.863 1.00 0.00 C ATOM 436 SG CYS A 30 -9.594 -6.750 2.127 1.00 0.00 S ATOM 0 H CYS A 30 -7.840 -3.091 0.066 1.00 0.00 H new ATOM 0 HA CYS A 30 -9.470 -4.176 2.073 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -7.549 -6.109 0.985 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -7.413 -5.858 2.714 1.00 0.00 H new ATOM 0 HG CYS A 30 -10.367 -6.652 1.087 1.00 0.00 H new ATOM 442 N CYS A 31 -6.402 -3.026 1.809 1.00 0.00 N ATOM 443 CA CYS A 31 -5.415 -2.152 2.419 1.00 0.00 C ATOM 444 C CYS A 31 -6.154 -1.021 3.137 1.00 0.00 C ATOM 445 O CYS A 31 -5.851 -0.708 4.287 1.00 0.00 O ATOM 446 CB CYS A 31 -4.418 -1.618 1.388 1.00 0.00 C ATOM 447 SG CYS A 31 -3.482 -3.005 0.647 1.00 0.00 S ATOM 0 H CYS A 31 -6.160 -3.355 0.874 1.00 0.00 H new ATOM 0 HA CYS A 31 -4.824 -2.715 3.141 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -4.947 -1.068 0.609 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -3.731 -0.917 1.863 1.00 0.00 H new ATOM 0 HG CYS A 31 -4.024 -3.337 -0.487 1.00 0.00 H new ATOM 453 N LEU A 32 -7.110 -0.438 2.428 1.00 0.00 N ATOM 454 CA LEU A 32 -7.894 0.652 2.983 1.00 0.00 C ATOM 455 C LEU A 32 -9.358 0.481 2.573 1.00 0.00 C ATOM 456 O LEU A 32 -10.090 1.462 2.446 1.00 0.00 O ATOM 457 CB LEU A 32 -7.297 2.002 2.581 1.00 0.00 C ATOM 458 CG LEU A 32 -6.180 2.535 3.480 1.00 0.00 C ATOM 459 CD1 LEU A 32 -5.479 3.731 2.833 1.00 0.00 C ATOM 460 CD2 LEU A 32 -6.711 2.869 4.875 1.00 0.00 C ATOM 0 H LEU A 32 -7.359 -0.700 1.474 1.00 0.00 H new ATOM 0 HA LEU A 32 -7.862 0.628 4.072 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -6.910 1.918 1.565 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -8.100 2.739 2.556 1.00 0.00 H new ATOM 0 HG LEU A 32 -5.434 1.749 3.599 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -4.689 4.091 3.493 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -5.045 3.427 1.880 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -6.202 4.529 2.664 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -5.897 3.246 5.494 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -7.488 3.629 4.796 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.127 1.970 5.331 1.00 0.00 H new ATOM 472 N ALA A 33 -9.743 -0.772 2.378 1.00 0.00 N ATOM 473 CA ALA A 33 -11.106 -1.084 1.985 1.00 0.00 C ATOM 474 C ALA A 33 -11.941 -1.367 3.235 1.00 0.00 C ATOM 475 O ALA A 33 -11.544 -2.164 4.084 1.00 0.00 O ATOM 476 CB ALA A 33 -11.100 -2.262 1.009 1.00 0.00 C ATOM 0 H ALA A 33 -9.134 -1.583 2.485 1.00 0.00 H new ATOM 0 HA ALA A 33 -11.560 -0.237 1.470 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -12.123 -2.496 0.714 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -10.519 -1.999 0.125 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -10.654 -3.132 1.491 1.00 0.00 H new ATOM 482 N GLY A 34 -13.082 -0.698 3.310 1.00 0.00 N ATOM 483 CA GLY A 34 -13.976 -0.867 4.443 1.00 0.00 C ATOM 484 C GLY A 34 -14.775 0.410 4.707 1.00 0.00 C ATOM 485 O GLY A 34 -14.720 1.355 3.921 1.00 0.00 O ATOM 0 H GLY A 34 -13.408 -0.038 2.604 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -14.659 -1.694 4.251 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -13.399 -1.129 5.330 1.00 0.00 H new ATOM 489 N LYS A 35 -15.500 0.399 5.816 1.00 0.00 N ATOM 490 CA LYS A 35 -16.310 1.545 6.193 1.00 0.00 C ATOM 491 C LYS A 35 -15.464 2.507 7.031 1.00 0.00 C ATOM 492 O LYS A 35 -15.366 3.691 6.712 1.00 0.00 O ATOM 493 CB LYS A 35 -17.593 1.088 6.890 1.00 0.00 C ATOM 494 CG LYS A 35 -18.454 2.287 7.293 1.00 0.00 C ATOM 495 CD LYS A 35 -18.194 2.684 8.748 1.00 0.00 C ATOM 496 CE LYS A 35 -19.146 3.797 9.191 1.00 0.00 C ATOM 497 NZ LYS A 35 -18.489 4.676 10.183 1.00 0.00 N ATOM 0 H LYS A 35 -15.543 -0.386 6.466 1.00 0.00 H new ATOM 0 HA LYS A 35 -16.633 2.092 5.307 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -18.160 0.436 6.226 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -17.342 0.502 7.774 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -18.238 3.131 6.638 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -19.508 2.043 7.162 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -18.319 1.815 9.394 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -17.162 3.017 8.859 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -19.457 4.383 8.326 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -20.048 3.362 9.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -19.149 5.426 10.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -18.214 4.116 11.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -17.642 5.105 9.759 1.00 0.00 H new ATOM 511 N VAL A 36 -14.876 1.963 8.085 1.00 0.00 N ATOM 512 CA VAL A 36 -14.042 2.758 8.971 1.00 0.00 C ATOM 513 C VAL A 36 -13.003 3.515 8.142 1.00 0.00 C ATOM 514 O VAL A 36 -12.642 4.643 8.473 1.00 0.00 O ATOM 515 CB VAL A 36 -13.416 1.864 10.043 1.00 0.00 C ATOM 516 CG1 VAL A 36 -14.483 1.326 10.999 1.00 0.00 C ATOM 517 CG2 VAL A 36 -12.621 0.721 9.409 1.00 0.00 C ATOM 0 H VAL A 36 -14.960 0.981 8.346 1.00 0.00 H new ATOM 0 HA VAL A 36 -14.642 3.500 9.497 1.00 0.00 H new ATOM 0 HB VAL A 36 -12.722 2.472 10.623 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -14.012 0.693 11.751 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -14.986 2.160 11.489 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -15.212 0.741 10.438 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -12.187 0.101 10.193 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -13.284 0.114 8.793 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -11.825 1.132 8.789 1.00 0.00 H new ATOM 527 N ASN A 37 -12.550 2.863 7.081 1.00 0.00 N ATOM 528 CA ASN A 37 -11.559 3.461 6.202 1.00 0.00 C ATOM 529 C ASN A 37 -12.265 4.102 5.006 1.00 0.00 C ATOM 530 O ASN A 37 -11.670 4.256 3.940 1.00 0.00 O ATOM 531 CB ASN A 37 -10.588 2.405 5.669 1.00 0.00 C ATOM 532 CG ASN A 37 -9.494 2.099 6.694 1.00 0.00 C ATOM 533 OD1 ASN A 37 -9.149 2.913 7.534 1.00 0.00 O ATOM 534 ND2 ASN A 37 -8.970 0.882 6.577 1.00 0.00 N ATOM 0 H ASN A 37 -12.851 1.927 6.810 1.00 0.00 H new ATOM 0 HA ASN A 37 -11.004 4.205 6.774 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -11.133 1.492 5.430 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -10.135 2.757 4.742 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -8.232 0.581 7.214 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -9.306 0.250 5.850 1.00 0.00 H new ATOM 541 N GLU A 38 -13.522 4.457 5.222 1.00 0.00 N ATOM 542 CA GLU A 38 -14.315 5.078 4.175 1.00 0.00 C ATOM 543 C GLU A 38 -13.958 6.560 4.047 1.00 0.00 C ATOM 544 O GLU A 38 -13.850 7.083 2.939 1.00 0.00 O ATOM 545 CB GLU A 38 -15.811 4.895 4.439 1.00 0.00 C ATOM 546 CG GLU A 38 -16.642 5.407 3.260 1.00 0.00 C ATOM 547 CD GLU A 38 -18.077 5.714 3.694 1.00 0.00 C ATOM 548 OE1 GLU A 38 -18.275 6.807 4.267 1.00 0.00 O ATOM 549 OE2 GLU A 38 -18.944 4.850 3.442 1.00 0.00 O ATOM 0 H GLU A 38 -14.012 4.327 6.107 1.00 0.00 H new ATOM 0 HA GLU A 38 -14.083 4.586 3.230 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -16.027 3.841 4.611 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -16.092 5.430 5.346 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -16.182 6.306 2.849 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -16.650 4.661 2.465 1.00 0.00 H new ATOM 556 N PRO A 39 -13.780 7.213 5.227 1.00 0.00 N ATOM 557 CA PRO A 39 -13.438 8.624 5.257 1.00 0.00 C ATOM 558 C PRO A 39 -11.972 8.841 4.876 1.00 0.00 C ATOM 559 O PRO A 39 -11.643 9.800 4.180 1.00 0.00 O ATOM 560 CB PRO A 39 -13.757 9.077 6.673 1.00 0.00 C ATOM 561 CG PRO A 39 -13.825 7.809 7.509 1.00 0.00 C ATOM 562 CD PRO A 39 -13.900 6.626 6.558 1.00 0.00 C ATOM 0 HA PRO A 39 -14.002 9.209 4.530 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -12.989 9.753 7.050 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -14.702 9.618 6.707 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -12.948 7.728 8.151 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -14.697 7.829 8.162 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -13.099 5.912 6.750 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -14.841 6.087 6.670 1.00 0.00 H new ATOM 570 N GLN A 40 -11.130 7.934 5.350 1.00 0.00 N ATOM 571 CA GLN A 40 -9.707 8.014 5.068 1.00 0.00 C ATOM 572 C GLN A 40 -9.434 7.648 3.608 1.00 0.00 C ATOM 573 O GLN A 40 -8.818 8.420 2.876 1.00 0.00 O ATOM 574 CB GLN A 40 -8.909 7.117 6.017 1.00 0.00 C ATOM 575 CG GLN A 40 -7.588 6.683 5.380 1.00 0.00 C ATOM 576 CD GLN A 40 -6.481 6.579 6.430 1.00 0.00 C ATOM 577 OE1 GLN A 40 -6.613 7.030 7.556 1.00 0.00 O ATOM 578 NE2 GLN A 40 -5.384 5.960 6.001 1.00 0.00 N ATOM 0 H GLN A 40 -11.406 7.140 5.928 1.00 0.00 H new ATOM 0 HA GLN A 40 -9.381 9.041 5.232 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -8.711 7.651 6.947 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -9.499 6.237 6.274 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -7.717 5.720 4.886 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -7.298 7.399 4.611 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -5.339 5.606 5.046 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -4.588 5.840 6.628 1.00 0.00 H new ATOM 587 N LYS A 41 -9.906 6.469 3.229 1.00 0.00 N ATOM 588 CA LYS A 41 -9.720 5.991 1.869 1.00 0.00 C ATOM 589 C LYS A 41 -9.898 7.157 0.895 1.00 0.00 C ATOM 590 O LYS A 41 -9.038 7.402 0.050 1.00 0.00 O ATOM 591 CB LYS A 41 -10.646 4.807 1.586 1.00 0.00 C ATOM 592 CG LYS A 41 -10.593 4.409 0.110 1.00 0.00 C ATOM 593 CD LYS A 41 -11.794 3.540 -0.268 1.00 0.00 C ATOM 594 CE LYS A 41 -13.087 4.358 -0.255 1.00 0.00 C ATOM 595 NZ LYS A 41 -13.482 4.726 -1.633 1.00 0.00 N ATOM 0 H LYS A 41 -10.417 5.831 3.840 1.00 0.00 H new ATOM 0 HA LYS A 41 -8.707 5.613 1.733 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -10.356 3.958 2.206 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -11.669 5.067 1.860 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -10.578 5.304 -0.511 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -9.669 3.866 -0.091 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -11.640 3.112 -1.258 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -11.879 2.707 0.430 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -13.884 3.782 0.216 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -12.948 5.259 0.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -14.518 4.805 -1.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -13.051 5.638 -1.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -13.155 3.994 -2.295 1.00 0.00 H new ATOM 609 N ASN A 42 -11.020 7.846 1.044 1.00 0.00 N ATOM 610 CA ASN A 42 -11.322 8.980 0.187 1.00 0.00 C ATOM 611 C ASN A 42 -10.157 9.971 0.232 1.00 0.00 C ATOM 612 O ASN A 42 -9.714 10.461 -0.805 1.00 0.00 O ATOM 613 CB ASN A 42 -12.581 9.708 0.661 1.00 0.00 C ATOM 614 CG ASN A 42 -13.833 9.120 0.006 1.00 0.00 C ATOM 615 OD1 ASN A 42 -14.138 9.372 -1.148 1.00 0.00 O ATOM 616 ND2 ASN A 42 -14.539 8.326 0.805 1.00 0.00 N ATOM 0 H ASN A 42 -11.731 7.641 1.746 1.00 0.00 H new ATOM 0 HA ASN A 42 -11.481 8.606 -0.825 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -12.663 9.632 1.745 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -12.504 10.769 0.421 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -15.393 7.886 0.462 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -14.227 8.157 1.761 1.00 0.00 H new ATOM 623 N ARG A 43 -9.695 10.237 1.445 1.00 0.00 N ATOM 624 CA ARG A 43 -8.591 11.162 1.639 1.00 0.00 C ATOM 625 C ARG A 43 -7.350 10.671 0.890 1.00 0.00 C ATOM 626 O ARG A 43 -6.615 11.469 0.311 1.00 0.00 O ATOM 627 CB ARG A 43 -8.254 11.314 3.124 1.00 0.00 C ATOM 628 CG ARG A 43 -9.312 12.153 3.843 1.00 0.00 C ATOM 629 CD ARG A 43 -8.751 13.521 4.239 1.00 0.00 C ATOM 630 NE ARG A 43 -9.804 14.329 4.893 1.00 0.00 N ATOM 631 CZ ARG A 43 -9.559 15.387 5.679 1.00 0.00 C ATOM 632 NH1 ARG A 43 -8.296 15.769 5.913 1.00 0.00 N ATOM 633 NH2 ARG A 43 -10.577 16.061 6.232 1.00 0.00 N ATOM 0 H ARG A 43 -10.065 9.828 2.303 1.00 0.00 H new ATOM 0 HA ARG A 43 -8.898 12.131 1.246 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -8.188 10.330 3.588 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -7.277 11.784 3.233 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -10.179 12.285 3.195 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -9.656 11.626 4.733 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -7.905 13.395 4.915 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -8.378 14.040 3.356 1.00 0.00 H new ATOM 0 HE ARG A 43 -10.777 14.065 4.736 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -7.522 15.255 5.493 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -8.109 16.574 6.511 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -11.538 15.769 6.055 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -10.391 16.866 6.830 1.00 0.00 H new ATOM 647 N ILE A 44 -7.156 9.361 0.925 1.00 0.00 N ATOM 648 CA ILE A 44 -6.018 8.755 0.256 1.00 0.00 C ATOM 649 C ILE A 44 -6.204 8.863 -1.259 1.00 0.00 C ATOM 650 O ILE A 44 -5.383 9.467 -1.947 1.00 0.00 O ATOM 651 CB ILE A 44 -5.807 7.322 0.749 1.00 0.00 C ATOM 652 CG1 ILE A 44 -5.987 7.232 2.266 1.00 0.00 C ATOM 653 CG2 ILE A 44 -4.449 6.781 0.300 1.00 0.00 C ATOM 654 CD1 ILE A 44 -5.253 8.373 2.974 1.00 0.00 C ATOM 0 H ILE A 44 -7.768 8.702 1.406 1.00 0.00 H new ATOM 0 HA ILE A 44 -5.102 9.291 0.504 1.00 0.00 H new ATOM 0 HB ILE A 44 -6.570 6.690 0.296 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -7.048 7.269 2.513 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -5.610 6.274 2.624 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -4.325 5.761 0.664 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -4.397 6.787 -0.789 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -3.655 7.409 0.704 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -5.397 8.286 4.051 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -4.189 8.319 2.745 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -5.650 9.329 2.631 1.00 0.00 H new ATOM 666 N LEU A 45 -7.289 8.269 -1.733 1.00 0.00 N ATOM 667 CA LEU A 45 -7.594 8.290 -3.153 1.00 0.00 C ATOM 668 C LEU A 45 -7.331 9.693 -3.706 1.00 0.00 C ATOM 669 O LEU A 45 -6.688 9.844 -4.743 1.00 0.00 O ATOM 670 CB LEU A 45 -9.018 7.789 -3.404 1.00 0.00 C ATOM 671 CG LEU A 45 -9.207 6.270 -3.385 1.00 0.00 C ATOM 672 CD1 LEU A 45 -8.205 5.605 -2.439 1.00 0.00 C ATOM 673 CD2 LEU A 45 -10.651 5.902 -3.042 1.00 0.00 C ATOM 0 H LEU A 45 -7.968 7.770 -1.158 1.00 0.00 H new ATOM 0 HA LEU A 45 -6.940 7.605 -3.692 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -9.674 8.226 -2.651 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -9.349 8.165 -4.372 1.00 0.00 H new ATOM 0 HG LEU A 45 -9.007 5.888 -4.386 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -8.361 4.526 -2.444 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -7.190 5.827 -2.769 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -8.349 5.988 -1.429 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -10.758 4.817 -3.035 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -10.904 6.298 -2.058 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -11.322 6.328 -3.788 1.00 0.00 H new ATOM 685 N GLU A 46 -7.841 10.682 -2.987 1.00 0.00 N ATOM 686 CA GLU A 46 -7.668 12.067 -3.392 1.00 0.00 C ATOM 687 C GLU A 46 -6.181 12.415 -3.473 1.00 0.00 C ATOM 688 O GLU A 46 -5.666 12.709 -4.551 1.00 0.00 O ATOM 689 CB GLU A 46 -8.402 13.013 -2.439 1.00 0.00 C ATOM 690 CG GLU A 46 -9.868 12.604 -2.282 1.00 0.00 C ATOM 691 CD GLU A 46 -10.792 13.589 -3.001 1.00 0.00 C ATOM 692 OE1 GLU A 46 -10.916 13.451 -4.237 1.00 0.00 O ATOM 693 OE2 GLU A 46 -11.353 14.457 -2.299 1.00 0.00 O ATOM 0 H GLU A 46 -8.374 10.552 -2.127 1.00 0.00 H new ATOM 0 HA GLU A 46 -8.104 12.192 -4.383 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.912 13.006 -1.465 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -8.344 14.034 -2.818 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -10.015 11.602 -2.685 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -10.127 12.563 -1.224 1.00 0.00 H new ATOM 700 N GLU A 47 -5.532 12.371 -2.319 1.00 0.00 N ATOM 701 CA GLU A 47 -4.113 12.678 -2.245 1.00 0.00 C ATOM 702 C GLU A 47 -3.383 12.110 -3.464 1.00 0.00 C ATOM 703 O GLU A 47 -2.575 12.798 -4.085 1.00 0.00 O ATOM 704 CB GLU A 47 -3.505 12.150 -0.945 1.00 0.00 C ATOM 705 CG GLU A 47 -3.810 13.088 0.224 1.00 0.00 C ATOM 706 CD GLU A 47 -3.091 14.428 0.055 1.00 0.00 C ATOM 707 OE1 GLU A 47 -1.914 14.391 -0.363 1.00 0.00 O ATOM 708 OE2 GLU A 47 -3.735 15.458 0.348 1.00 0.00 O ATOM 0 H GLU A 47 -5.962 12.127 -1.427 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.994 13.762 -2.248 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -3.900 11.157 -0.732 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -2.426 12.046 -1.060 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -4.885 13.254 0.290 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.501 12.621 1.159 1.00 0.00 H new ATOM 715 N ILE A 48 -3.694 10.858 -3.769 1.00 0.00 N ATOM 716 CA ILE A 48 -3.078 10.189 -4.902 1.00 0.00 C ATOM 717 C ILE A 48 -3.427 10.944 -6.186 1.00 0.00 C ATOM 718 O ILE A 48 -2.543 11.279 -6.973 1.00 0.00 O ATOM 719 CB ILE A 48 -3.473 8.711 -4.931 1.00 0.00 C ATOM 720 CG1 ILE A 48 -3.106 8.020 -3.616 1.00 0.00 C ATOM 721 CG2 ILE A 48 -2.859 8.004 -6.141 1.00 0.00 C ATOM 722 CD1 ILE A 48 -3.543 6.554 -3.627 1.00 0.00 C ATOM 0 H ILE A 48 -4.364 10.290 -3.251 1.00 0.00 H new ATOM 0 HA ILE A 48 -1.992 10.203 -4.808 1.00 0.00 H new ATOM 0 HB ILE A 48 -4.556 8.648 -5.036 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -2.029 8.081 -3.457 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -3.581 8.539 -2.783 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -3.155 6.955 -6.138 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -3.212 8.478 -7.057 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -1.772 8.075 -6.091 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -3.270 6.086 -2.681 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -4.623 6.497 -3.762 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -3.047 6.033 -4.446 1.00 0.00 H new ATOM 734 N GLU A 49 -4.717 11.190 -6.358 1.00 0.00 N ATOM 735 CA GLU A 49 -5.194 11.899 -7.534 1.00 0.00 C ATOM 736 C GLU A 49 -4.681 13.341 -7.528 1.00 0.00 C ATOM 737 O GLU A 49 -4.605 13.981 -8.576 1.00 0.00 O ATOM 738 CB GLU A 49 -6.721 11.861 -7.616 1.00 0.00 C ATOM 739 CG GLU A 49 -7.223 10.430 -7.815 1.00 0.00 C ATOM 740 CD GLU A 49 -8.703 10.418 -8.204 1.00 0.00 C ATOM 741 OE1 GLU A 49 -9.048 11.159 -9.150 1.00 0.00 O ATOM 742 OE2 GLU A 49 -9.457 9.667 -7.546 1.00 0.00 O ATOM 0 H GLU A 49 -5.447 10.911 -5.703 1.00 0.00 H new ATOM 0 HA GLU A 49 -4.803 11.398 -8.420 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -7.148 12.277 -6.703 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -7.060 12.487 -8.441 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -6.635 9.939 -8.591 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -7.080 9.859 -6.897 1.00 0.00 H new ATOM 749 N LYS A 50 -4.342 13.810 -6.336 1.00 0.00 N ATOM 750 CA LYS A 50 -3.839 15.164 -6.180 1.00 0.00 C ATOM 751 C LYS A 50 -2.312 15.151 -6.280 1.00 0.00 C ATOM 752 O LYS A 50 -1.691 16.191 -6.492 1.00 0.00 O ATOM 753 CB LYS A 50 -4.364 15.785 -4.884 1.00 0.00 C ATOM 754 CG LYS A 50 -3.247 15.919 -3.848 1.00 0.00 C ATOM 755 CD LYS A 50 -3.806 16.354 -2.492 1.00 0.00 C ATOM 756 CE LYS A 50 -4.446 17.741 -2.582 1.00 0.00 C ATOM 757 NZ LYS A 50 -3.676 18.720 -1.784 1.00 0.00 N ATOM 0 H LYS A 50 -4.406 13.276 -5.469 1.00 0.00 H new ATOM 0 HA LYS A 50 -4.207 15.801 -6.984 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -4.790 16.766 -5.093 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -5.167 15.168 -4.480 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -2.728 14.966 -3.743 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -2.512 16.646 -4.193 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -4.546 15.630 -2.150 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -3.006 16.366 -1.752 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -4.486 18.063 -3.623 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -5.474 17.698 -2.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -4.124 19.656 -1.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -3.659 18.420 -0.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -2.702 18.774 -2.146 1.00 0.00 H new ATOM 771 N SER A 51 -1.751 13.961 -6.124 1.00 0.00 N ATOM 772 CA SER A 51 -0.309 13.798 -6.194 1.00 0.00 C ATOM 773 C SER A 51 0.136 13.693 -7.654 1.00 0.00 C ATOM 774 O SER A 51 -0.524 13.042 -8.462 1.00 0.00 O ATOM 775 CB SER A 51 0.145 12.565 -5.411 1.00 0.00 C ATOM 776 OG SER A 51 1.515 12.253 -5.652 1.00 0.00 O ATOM 0 H SER A 51 -2.269 13.100 -5.949 1.00 0.00 H new ATOM 0 HA SER A 51 0.156 14.674 -5.741 1.00 0.00 H new ATOM 0 HB2 SER A 51 -0.005 12.737 -4.345 1.00 0.00 H new ATOM 0 HB3 SER A 51 -0.475 11.712 -5.687 1.00 0.00 H new ATOM 0 HG SER A 51 2.012 12.290 -4.808 1.00 0.00 H new ATOM 782 N LYS A 52 1.251 14.344 -7.948 1.00 0.00 N ATOM 783 CA LYS A 52 1.791 14.332 -9.297 1.00 0.00 C ATOM 784 C LYS A 52 2.798 13.188 -9.428 1.00 0.00 C ATOM 785 O LYS A 52 3.706 13.247 -10.257 1.00 0.00 O ATOM 786 CB LYS A 52 2.369 15.703 -9.655 1.00 0.00 C ATOM 787 CG LYS A 52 1.419 16.475 -10.573 1.00 0.00 C ATOM 788 CD LYS A 52 1.944 16.499 -12.010 1.00 0.00 C ATOM 789 CE LYS A 52 2.861 17.702 -12.240 1.00 0.00 C ATOM 790 NZ LYS A 52 2.360 18.529 -13.360 1.00 0.00 N ATOM 0 H LYS A 52 1.796 14.883 -7.275 1.00 0.00 H new ATOM 0 HA LYS A 52 0.999 14.146 -10.023 1.00 0.00 H new ATOM 0 HB2 LYS A 52 2.547 16.276 -8.745 1.00 0.00 H new ATOM 0 HB3 LYS A 52 3.334 15.578 -10.146 1.00 0.00 H new ATOM 0 HG2 LYS A 52 0.431 16.014 -10.551 1.00 0.00 H new ATOM 0 HG3 LYS A 52 1.303 17.495 -10.207 1.00 0.00 H new ATOM 0 HD2 LYS A 52 2.488 15.578 -12.217 1.00 0.00 H new ATOM 0 HD3 LYS A 52 1.106 16.538 -12.706 1.00 0.00 H new ATOM 0 HE2 LYS A 52 2.916 18.303 -11.333 1.00 0.00 H new ATOM 0 HE3 LYS A 52 3.873 17.359 -12.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 2.994 19.341 -13.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 2.330 17.957 -14.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 1.403 18.871 -13.138 1.00 0.00 H new ATOM 804 N ALA A 53 2.604 12.173 -8.599 1.00 0.00 N ATOM 805 CA ALA A 53 3.484 11.017 -8.612 1.00 0.00 C ATOM 806 C ALA A 53 2.805 9.873 -9.368 1.00 0.00 C ATOM 807 O ALA A 53 1.580 9.840 -9.480 1.00 0.00 O ATOM 808 CB ALA A 53 3.844 10.633 -7.175 1.00 0.00 C ATOM 0 H ALA A 53 1.850 12.127 -7.914 1.00 0.00 H new ATOM 0 HA ALA A 53 4.414 11.249 -9.131 1.00 0.00 H new ATOM 0 HB1 ALA A 53 4.504 9.766 -7.185 1.00 0.00 H new ATOM 0 HB2 ALA A 53 4.350 11.469 -6.691 1.00 0.00 H new ATOM 0 HB3 ALA A 53 2.935 10.391 -6.624 1.00 0.00 H new ATOM 814 N ASN A 54 3.629 8.965 -9.867 1.00 0.00 N ATOM 815 CA ASN A 54 3.124 7.823 -10.610 1.00 0.00 C ATOM 816 C ASN A 54 3.458 6.537 -9.850 1.00 0.00 C ATOM 817 O ASN A 54 3.005 5.456 -10.222 1.00 0.00 O ATOM 818 CB ASN A 54 3.770 7.736 -11.994 1.00 0.00 C ATOM 819 CG ASN A 54 5.294 7.813 -11.893 1.00 0.00 C ATOM 820 OD1 ASN A 54 5.986 6.816 -11.768 1.00 0.00 O ATOM 821 ND2 ASN A 54 5.778 9.051 -11.955 1.00 0.00 N ATOM 0 H ASN A 54 4.644 8.996 -9.772 1.00 0.00 H new ATOM 0 HA ASN A 54 2.047 7.944 -10.723 1.00 0.00 H new ATOM 0 HB2 ASN A 54 3.481 6.802 -12.476 1.00 0.00 H new ATOM 0 HB3 ASN A 54 3.402 8.547 -12.623 1.00 0.00 H new ATOM 0 HD21 ASN A 54 6.784 9.209 -11.897 1.00 0.00 H new ATOM 0 HD22 ASN A 54 5.143 9.842 -12.060 1.00 0.00 H new ATOM 828 N HIS A 55 4.250 6.698 -8.800 1.00 0.00 N ATOM 829 CA HIS A 55 4.650 5.563 -7.985 1.00 0.00 C ATOM 830 C HIS A 55 4.145 5.756 -6.553 1.00 0.00 C ATOM 831 O HIS A 55 4.404 6.786 -5.933 1.00 0.00 O ATOM 832 CB HIS A 55 6.164 5.351 -8.055 1.00 0.00 C ATOM 833 CG HIS A 55 6.595 3.922 -7.830 1.00 0.00 C ATOM 834 ND1 HIS A 55 7.834 3.442 -8.218 1.00 0.00 N ATOM 835 CD2 HIS A 55 5.940 2.874 -7.252 1.00 0.00 C ATOM 836 CE1 HIS A 55 7.910 2.162 -7.885 1.00 0.00 C ATOM 837 NE2 HIS A 55 6.735 1.812 -7.287 1.00 0.00 N ATOM 0 H HIS A 55 4.625 7.596 -8.495 1.00 0.00 H new ATOM 0 HA HIS A 55 4.195 4.653 -8.375 1.00 0.00 H new ATOM 0 HB2 HIS A 55 6.522 5.678 -9.031 1.00 0.00 H new ATOM 0 HB3 HIS A 55 6.644 5.986 -7.311 1.00 0.00 H new ATOM 0 HD2 HIS A 55 4.944 2.904 -6.836 1.00 0.00 H new ATOM 0 HE1 HIS A 55 8.754 1.510 -8.057 1.00 0.00 H new ATOM 0 HE2 HIS A 55 6.505 0.886 -6.926 1.00 0.00 H new ATOM 845 N PHE A 56 3.433 4.748 -6.071 1.00 0.00 N ATOM 846 CA PHE A 56 2.889 4.793 -4.725 1.00 0.00 C ATOM 847 C PHE A 56 3.038 3.440 -4.027 1.00 0.00 C ATOM 848 O PHE A 56 2.542 2.426 -4.517 1.00 0.00 O ATOM 849 CB PHE A 56 1.401 5.125 -4.854 1.00 0.00 C ATOM 850 CG PHE A 56 1.118 6.437 -5.589 1.00 0.00 C ATOM 851 CD1 PHE A 56 1.305 6.517 -6.934 1.00 0.00 C ATOM 852 CD2 PHE A 56 0.678 7.523 -4.898 1.00 0.00 C ATOM 853 CE1 PHE A 56 1.042 7.734 -7.616 1.00 0.00 C ATOM 854 CE2 PHE A 56 0.416 8.740 -5.580 1.00 0.00 C ATOM 855 CZ PHE A 56 0.603 8.820 -6.925 1.00 0.00 C ATOM 0 H PHE A 56 3.220 3.895 -6.589 1.00 0.00 H new ATOM 0 HA PHE A 56 3.422 5.537 -4.134 1.00 0.00 H new ATOM 0 HB2 PHE A 56 0.902 4.311 -5.380 1.00 0.00 H new ATOM 0 HB3 PHE A 56 0.963 5.177 -3.857 1.00 0.00 H new ATOM 0 HD1 PHE A 56 1.654 5.655 -7.483 1.00 0.00 H new ATOM 0 HD2 PHE A 56 0.528 7.459 -3.830 1.00 0.00 H new ATOM 0 HE1 PHE A 56 1.191 7.797 -8.684 1.00 0.00 H new ATOM 0 HE2 PHE A 56 0.068 9.603 -5.031 1.00 0.00 H new ATOM 0 HZ PHE A 56 0.403 9.746 -7.444 1.00 0.00 H new ATOM 865 N LEU A 57 3.724 3.466 -2.894 1.00 0.00 N ATOM 866 CA LEU A 57 3.945 2.254 -2.124 1.00 0.00 C ATOM 867 C LEU A 57 3.002 2.241 -0.919 1.00 0.00 C ATOM 868 O LEU A 57 2.507 3.287 -0.503 1.00 0.00 O ATOM 869 CB LEU A 57 5.423 2.119 -1.750 1.00 0.00 C ATOM 870 CG LEU A 57 6.352 1.618 -2.857 1.00 0.00 C ATOM 871 CD1 LEU A 57 6.779 2.765 -3.775 1.00 0.00 C ATOM 872 CD2 LEU A 57 7.554 0.875 -2.270 1.00 0.00 C ATOM 0 H LEU A 57 4.134 4.308 -2.490 1.00 0.00 H new ATOM 0 HA LEU A 57 3.710 1.374 -2.723 1.00 0.00 H new ATOM 0 HB2 LEU A 57 5.782 3.092 -1.414 1.00 0.00 H new ATOM 0 HB3 LEU A 57 5.502 1.439 -0.902 1.00 0.00 H new ATOM 0 HG LEU A 57 5.800 0.904 -3.469 1.00 0.00 H new ATOM 0 HD11 LEU A 57 7.439 2.382 -4.553 1.00 0.00 H new ATOM 0 HD12 LEU A 57 5.897 3.211 -4.234 1.00 0.00 H new ATOM 0 HD13 LEU A 57 7.306 3.521 -3.192 1.00 0.00 H new ATOM 0 HD21 LEU A 57 8.198 0.529 -3.078 1.00 0.00 H new ATOM 0 HD22 LEU A 57 8.115 1.547 -1.621 1.00 0.00 H new ATOM 0 HD23 LEU A 57 7.206 0.019 -1.692 1.00 0.00 H new ATOM 884 N ILE A 58 2.782 1.045 -0.393 1.00 0.00 N ATOM 885 CA ILE A 58 1.907 0.882 0.755 1.00 0.00 C ATOM 886 C ILE A 58 2.746 0.517 1.982 1.00 0.00 C ATOM 887 O ILE A 58 3.429 -0.505 1.989 1.00 0.00 O ATOM 888 CB ILE A 58 0.799 -0.126 0.446 1.00 0.00 C ATOM 889 CG1 ILE A 58 -0.139 0.406 -0.640 1.00 0.00 C ATOM 890 CG2 ILE A 58 0.042 -0.517 1.717 1.00 0.00 C ATOM 891 CD1 ILE A 58 -0.819 -0.743 -1.387 1.00 0.00 C ATOM 0 H ILE A 58 3.195 0.180 -0.741 1.00 0.00 H new ATOM 0 HA ILE A 58 1.399 1.819 0.982 1.00 0.00 H new ATOM 0 HB ILE A 58 1.262 -1.033 0.056 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -0.895 1.050 -0.190 1.00 0.00 H new ATOM 0 HG13 ILE A 58 0.424 1.019 -1.344 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -0.740 -1.235 1.469 1.00 0.00 H new ATOM 0 HG22 ILE A 58 0.734 -0.967 2.429 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -0.408 0.371 2.160 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -1.480 -0.338 -2.153 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -0.061 -1.371 -1.856 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -1.401 -1.340 -0.685 1.00 0.00 H new ATOM 903 N LEU A 59 2.666 1.374 2.990 1.00 0.00 N ATOM 904 CA LEU A 59 3.409 1.154 4.219 1.00 0.00 C ATOM 905 C LEU A 59 2.551 0.340 5.190 1.00 0.00 C ATOM 906 O LEU A 59 1.404 0.693 5.457 1.00 0.00 O ATOM 907 CB LEU A 59 3.895 2.485 4.796 1.00 0.00 C ATOM 908 CG LEU A 59 4.952 2.392 5.899 1.00 0.00 C ATOM 909 CD1 LEU A 59 6.308 1.979 5.324 1.00 0.00 C ATOM 910 CD2 LEU A 59 5.038 3.700 6.687 1.00 0.00 C ATOM 0 H LEU A 59 2.098 2.221 2.980 1.00 0.00 H new ATOM 0 HA LEU A 59 4.308 0.571 4.021 1.00 0.00 H new ATOM 0 HB2 LEU A 59 4.300 3.085 3.981 1.00 0.00 H new ATOM 0 HB3 LEU A 59 3.033 3.024 5.190 1.00 0.00 H new ATOM 0 HG LEU A 59 4.648 1.614 6.599 1.00 0.00 H new ATOM 0 HD11 LEU A 59 7.042 1.920 6.128 1.00 0.00 H new ATOM 0 HD12 LEU A 59 6.218 1.005 4.843 1.00 0.00 H new ATOM 0 HD13 LEU A 59 6.632 2.717 4.590 1.00 0.00 H new ATOM 0 HD21 LEU A 59 5.796 3.607 7.464 1.00 0.00 H new ATOM 0 HD22 LEU A 59 5.307 4.514 6.013 1.00 0.00 H new ATOM 0 HD23 LEU A 59 4.072 3.913 7.146 1.00 0.00 H new ATOM 922 N PHE A 60 3.141 -0.736 5.691 1.00 0.00 N ATOM 923 CA PHE A 60 2.446 -1.603 6.626 1.00 0.00 C ATOM 924 C PHE A 60 3.098 -1.553 8.009 1.00 0.00 C ATOM 925 O PHE A 60 4.236 -1.108 8.147 1.00 0.00 O ATOM 926 CB PHE A 60 2.550 -3.027 6.077 1.00 0.00 C ATOM 927 CG PHE A 60 1.889 -3.217 4.710 1.00 0.00 C ATOM 928 CD1 PHE A 60 0.577 -3.566 4.632 1.00 0.00 C ATOM 929 CD2 PHE A 60 2.614 -3.038 3.574 1.00 0.00 C ATOM 930 CE1 PHE A 60 -0.037 -3.742 3.363 1.00 0.00 C ATOM 931 CE2 PHE A 60 2.001 -3.214 2.305 1.00 0.00 C ATOM 932 CZ PHE A 60 0.688 -3.562 2.227 1.00 0.00 C ATOM 0 H PHE A 60 4.093 -1.026 5.467 1.00 0.00 H new ATOM 0 HA PHE A 60 1.410 -1.282 6.731 1.00 0.00 H new ATOM 0 HB2 PHE A 60 3.602 -3.300 6.001 1.00 0.00 H new ATOM 0 HB3 PHE A 60 2.093 -3.714 6.789 1.00 0.00 H new ATOM 0 HD1 PHE A 60 0.002 -3.709 5.535 1.00 0.00 H new ATOM 0 HD2 PHE A 60 3.656 -2.762 3.637 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -1.079 -4.019 3.301 1.00 0.00 H new ATOM 0 HE2 PHE A 60 2.577 -3.072 1.402 1.00 0.00 H new ATOM 0 HZ PHE A 60 0.221 -3.695 1.262 1.00 0.00 H new ATOM 942 N ARG A 61 2.349 -2.017 8.999 1.00 0.00 N ATOM 943 CA ARG A 61 2.840 -2.031 10.366 1.00 0.00 C ATOM 944 C ARG A 61 4.178 -2.769 10.442 1.00 0.00 C ATOM 945 O ARG A 61 5.120 -2.290 11.072 1.00 0.00 O ATOM 946 CB ARG A 61 1.838 -2.708 11.304 1.00 0.00 C ATOM 947 CG ARG A 61 2.368 -2.744 12.739 1.00 0.00 C ATOM 948 CD ARG A 61 1.615 -1.751 13.626 1.00 0.00 C ATOM 949 NE ARG A 61 1.868 -2.054 15.053 1.00 0.00 N ATOM 950 CZ ARG A 61 1.723 -1.167 16.046 1.00 0.00 C ATOM 951 NH1 ARG A 61 1.326 0.083 15.776 1.00 0.00 N ATOM 952 NH2 ARG A 61 1.975 -1.531 17.311 1.00 0.00 N ATOM 0 H ARG A 61 1.405 -2.386 8.881 1.00 0.00 H new ATOM 0 HA ARG A 61 2.974 -0.996 10.681 1.00 0.00 H new ATOM 0 HB2 ARG A 61 0.889 -2.172 11.276 1.00 0.00 H new ATOM 0 HB3 ARG A 61 1.641 -3.723 10.960 1.00 0.00 H new ATOM 0 HG2 ARG A 61 2.264 -3.751 13.144 1.00 0.00 H new ATOM 0 HG3 ARG A 61 3.432 -2.507 12.744 1.00 0.00 H new ATOM 0 HD2 ARG A 61 1.934 -0.734 13.400 1.00 0.00 H new ATOM 0 HD3 ARG A 61 0.546 -1.803 13.419 1.00 0.00 H new ATOM 0 HE ARG A 61 2.172 -2.997 15.295 1.00 0.00 H new ATOM 0 HH11 ARG A 61 1.134 0.360 14.813 1.00 0.00 H new ATOM 0 HH12 ARG A 61 1.216 0.758 16.533 1.00 0.00 H new ATOM 0 HH21 ARG A 61 2.277 -2.483 17.517 1.00 0.00 H new ATOM 0 HH22 ARG A 61 1.865 -0.856 18.068 1.00 0.00 H new ATOM 966 N ASP A 62 4.219 -3.923 9.791 1.00 0.00 N ATOM 967 CA ASP A 62 5.426 -4.731 9.777 1.00 0.00 C ATOM 968 C ASP A 62 5.441 -5.596 8.515 1.00 0.00 C ATOM 969 O ASP A 62 6.429 -5.616 7.783 1.00 0.00 O ATOM 970 CB ASP A 62 5.480 -5.663 10.990 1.00 0.00 C ATOM 971 CG ASP A 62 6.775 -5.595 11.801 1.00 0.00 C ATOM 972 OD1 ASP A 62 7.651 -4.794 11.406 1.00 0.00 O ATOM 973 OD2 ASP A 62 6.861 -6.345 12.797 1.00 0.00 O ATOM 0 H ASP A 62 3.436 -4.317 9.270 1.00 0.00 H new ATOM 0 HA ASP A 62 6.283 -4.057 9.802 1.00 0.00 H new ATOM 0 HB2 ASP A 62 4.644 -5.427 11.648 1.00 0.00 H new ATOM 0 HB3 ASP A 62 5.337 -6.688 10.648 1.00 0.00 H new ATOM 978 N SER A 63 4.333 -6.290 8.299 1.00 0.00 N ATOM 979 CA SER A 63 4.206 -7.155 7.139 1.00 0.00 C ATOM 980 C SER A 63 2.729 -7.436 6.854 1.00 0.00 C ATOM 981 O SER A 63 2.050 -8.078 7.655 1.00 0.00 O ATOM 982 CB SER A 63 4.965 -8.467 7.344 1.00 0.00 C ATOM 983 OG SER A 63 6.297 -8.397 6.843 1.00 0.00 O ATOM 0 H SER A 63 3.515 -6.271 8.908 1.00 0.00 H new ATOM 0 HA SER A 63 4.644 -6.643 6.282 1.00 0.00 H new ATOM 0 HB2 SER A 63 4.990 -8.709 8.406 1.00 0.00 H new ATOM 0 HB3 SER A 63 4.432 -9.276 6.845 1.00 0.00 H new ATOM 0 HG SER A 63 6.670 -7.510 7.028 1.00 0.00 H new ATOM 989 N SER A 64 2.275 -6.940 5.713 1.00 0.00 N ATOM 990 CA SER A 64 0.891 -7.130 5.313 1.00 0.00 C ATOM 991 C SER A 64 -0.034 -6.929 6.515 1.00 0.00 C ATOM 992 O SER A 64 -1.008 -7.660 6.683 1.00 0.00 O ATOM 993 CB SER A 64 0.678 -8.518 4.706 1.00 0.00 C ATOM 994 OG SER A 64 1.194 -9.551 5.541 1.00 0.00 O ATOM 0 H SER A 64 2.841 -6.407 5.053 1.00 0.00 H new ATOM 0 HA SER A 64 0.651 -6.389 4.550 1.00 0.00 H new ATOM 0 HB2 SER A 64 -0.387 -8.682 4.542 1.00 0.00 H new ATOM 0 HB3 SER A 64 1.162 -8.565 3.730 1.00 0.00 H new ATOM 0 HG SER A 64 0.863 -9.429 6.455 1.00 0.00 H new ATOM 1000 N CYS A 65 0.305 -5.933 7.321 1.00 0.00 N ATOM 1001 CA CYS A 65 -0.483 -5.627 8.503 1.00 0.00 C ATOM 1002 C CYS A 65 -1.367 -4.418 8.191 1.00 0.00 C ATOM 1003 O CYS A 65 -1.194 -3.350 8.776 1.00 0.00 O ATOM 1004 CB CYS A 65 0.404 -5.384 9.727 1.00 0.00 C ATOM 1005 SG CYS A 65 0.612 -6.940 10.667 1.00 0.00 S ATOM 0 H CYS A 65 1.114 -5.328 7.179 1.00 0.00 H new ATOM 0 HA CYS A 65 -1.112 -6.481 8.755 1.00 0.00 H new ATOM 0 HB2 CYS A 65 1.377 -5.007 9.412 1.00 0.00 H new ATOM 0 HB3 CYS A 65 -0.043 -4.621 10.365 1.00 0.00 H new ATOM 0 HG CYS A 65 1.368 -6.724 11.702 1.00 0.00 H new ATOM 1011 N GLN A 66 -2.296 -4.627 7.270 1.00 0.00 N ATOM 1012 CA GLN A 66 -3.208 -3.568 6.873 1.00 0.00 C ATOM 1013 C GLN A 66 -2.426 -2.309 6.493 1.00 0.00 C ATOM 1014 O GLN A 66 -1.209 -2.254 6.664 1.00 0.00 O ATOM 1015 CB GLN A 66 -4.219 -3.270 7.983 1.00 0.00 C ATOM 1016 CG GLN A 66 -4.705 -4.563 8.642 1.00 0.00 C ATOM 1017 CD GLN A 66 -4.300 -4.611 10.117 1.00 0.00 C ATOM 1018 OE1 GLN A 66 -4.238 -3.605 10.804 1.00 0.00 O ATOM 1019 NE2 GLN A 66 -4.028 -5.835 10.563 1.00 0.00 N ATOM 0 H GLN A 66 -2.437 -5.514 6.787 1.00 0.00 H new ATOM 0 HA GLN A 66 -3.765 -3.904 5.999 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -3.762 -2.625 8.733 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -5.069 -2.726 7.570 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -5.789 -4.634 8.556 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -4.287 -5.422 8.118 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -4.100 -6.635 9.934 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -3.748 -5.973 11.534 1.00 0.00 H new ATOM 1028 N PHE A 67 -3.157 -1.328 5.983 1.00 0.00 N ATOM 1029 CA PHE A 67 -2.547 -0.074 5.576 1.00 0.00 C ATOM 1030 C PHE A 67 -2.192 0.783 6.793 1.00 0.00 C ATOM 1031 O PHE A 67 -2.877 0.732 7.814 1.00 0.00 O ATOM 1032 CB PHE A 67 -3.579 0.671 4.727 1.00 0.00 C ATOM 1033 CG PHE A 67 -3.110 2.042 4.238 1.00 0.00 C ATOM 1034 CD1 PHE A 67 -3.238 3.131 5.043 1.00 0.00 C ATOM 1035 CD2 PHE A 67 -2.564 2.173 2.999 1.00 0.00 C ATOM 1036 CE1 PHE A 67 -2.803 4.405 4.589 1.00 0.00 C ATOM 1037 CE2 PHE A 67 -2.129 3.446 2.545 1.00 0.00 C ATOM 1038 CZ PHE A 67 -2.257 4.535 3.350 1.00 0.00 C ATOM 0 H PHE A 67 -4.166 -1.377 5.843 1.00 0.00 H new ATOM 0 HA PHE A 67 -1.629 -0.270 5.022 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -3.835 0.057 3.864 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -4.491 0.797 5.310 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -3.670 3.027 6.027 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -2.461 1.308 2.360 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -2.906 5.270 5.227 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -1.697 3.550 1.561 1.00 0.00 H new ATOM 0 HZ PHE A 67 -1.925 5.503 3.005 1.00 0.00 H new ATOM 1048 N ARG A 68 -1.122 1.550 6.644 1.00 0.00 N ATOM 1049 CA ARG A 68 -0.668 2.417 7.719 1.00 0.00 C ATOM 1050 C ARG A 68 -0.474 3.844 7.203 1.00 0.00 C ATOM 1051 O ARG A 68 -0.871 4.805 7.860 1.00 0.00 O ATOM 1052 CB ARG A 68 0.648 1.913 8.313 1.00 0.00 C ATOM 1053 CG ARG A 68 0.431 0.629 9.116 1.00 0.00 C ATOM 1054 CD ARG A 68 -0.214 0.930 10.470 1.00 0.00 C ATOM 1055 NE ARG A 68 -1.230 -0.099 10.786 1.00 0.00 N ATOM 1056 CZ ARG A 68 -1.924 -0.142 11.931 1.00 0.00 C ATOM 1057 NH1 ARG A 68 -1.717 0.785 12.876 1.00 0.00 N ATOM 1058 NH2 ARG A 68 -2.826 -1.113 12.133 1.00 0.00 N ATOM 0 H ARG A 68 -0.556 1.589 5.796 1.00 0.00 H new ATOM 0 HA ARG A 68 -1.431 2.409 8.497 1.00 0.00 H new ATOM 0 HB2 ARG A 68 1.365 1.729 7.513 1.00 0.00 H new ATOM 0 HB3 ARG A 68 1.078 2.680 8.957 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -0.203 -0.054 8.551 1.00 0.00 H new ATOM 0 HG3 ARG A 68 1.386 0.126 9.268 1.00 0.00 H new ATOM 0 HD2 ARG A 68 0.548 0.951 11.249 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -0.677 1.916 10.450 1.00 0.00 H new ATOM 0 HE ARG A 68 -1.413 -0.820 10.088 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -1.031 1.524 12.724 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -2.246 0.752 13.748 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -2.984 -1.820 11.415 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -3.354 -1.145 13.005 1.00 0.00 H new ATOM 1072 N ALA A 69 0.137 3.938 6.031 1.00 0.00 N ATOM 1073 CA ALA A 69 0.389 5.232 5.419 1.00 0.00 C ATOM 1074 C ALA A 69 0.887 5.026 3.987 1.00 0.00 C ATOM 1075 O ALA A 69 1.714 4.151 3.733 1.00 0.00 O ATOM 1076 CB ALA A 69 1.385 6.016 6.276 1.00 0.00 C ATOM 0 H ALA A 69 0.465 3.139 5.489 1.00 0.00 H new ATOM 0 HA ALA A 69 -0.529 5.818 5.367 1.00 0.00 H new ATOM 0 HB1 ALA A 69 1.574 6.987 5.818 1.00 0.00 H new ATOM 0 HB2 ALA A 69 0.971 6.161 7.274 1.00 0.00 H new ATOM 0 HB3 ALA A 69 2.320 5.460 6.348 1.00 0.00 H new ATOM 1082 N LEU A 70 0.362 5.846 3.089 1.00 0.00 N ATOM 1083 CA LEU A 70 0.743 5.765 1.689 1.00 0.00 C ATOM 1084 C LEU A 70 1.959 6.660 1.443 1.00 0.00 C ATOM 1085 O LEU A 70 2.144 7.664 2.129 1.00 0.00 O ATOM 1086 CB LEU A 70 -0.452 6.089 0.789 1.00 0.00 C ATOM 1087 CG LEU A 70 -0.233 5.892 -0.712 1.00 0.00 C ATOM 1088 CD1 LEU A 70 -0.421 4.426 -1.107 1.00 0.00 C ATOM 1089 CD2 LEU A 70 -1.135 6.824 -1.524 1.00 0.00 C ATOM 0 H LEU A 70 -0.324 6.570 3.303 1.00 0.00 H new ATOM 0 HA LEU A 70 1.039 4.748 1.433 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -1.293 5.468 1.098 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -0.741 7.126 0.961 1.00 0.00 H new ATOM 0 HG LEU A 70 0.798 6.158 -0.944 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -0.260 4.314 -2.179 1.00 0.00 H new ATOM 0 HD12 LEU A 70 0.296 3.809 -0.566 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -1.434 4.109 -0.858 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -0.960 6.664 -2.588 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -2.179 6.613 -1.292 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -0.910 7.860 -1.271 1.00 0.00 H new ATOM 1101 N TYR A 71 2.756 6.264 0.461 1.00 0.00 N ATOM 1102 CA TYR A 71 3.949 7.018 0.116 1.00 0.00 C ATOM 1103 C TYR A 71 4.218 6.960 -1.389 1.00 0.00 C ATOM 1104 O TYR A 71 3.859 5.987 -2.050 1.00 0.00 O ATOM 1105 CB TYR A 71 5.105 6.341 0.855 1.00 0.00 C ATOM 1106 CG TYR A 71 5.192 6.704 2.339 1.00 0.00 C ATOM 1107 CD1 TYR A 71 4.277 6.184 3.232 1.00 0.00 C ATOM 1108 CD2 TYR A 71 6.186 7.551 2.784 1.00 0.00 C ATOM 1109 CE1 TYR A 71 4.360 6.525 4.628 1.00 0.00 C ATOM 1110 CE2 TYR A 71 6.269 7.893 4.181 1.00 0.00 C ATOM 1111 CZ TYR A 71 5.352 7.363 5.034 1.00 0.00 C ATOM 1112 OH TYR A 71 5.429 7.685 6.353 1.00 0.00 O ATOM 0 H TYR A 71 2.599 5.431 -0.106 1.00 0.00 H new ATOM 0 HA TYR A 71 3.833 8.066 0.392 1.00 0.00 H new ATOM 0 HB2 TYR A 71 4.999 5.260 0.761 1.00 0.00 H new ATOM 0 HB3 TYR A 71 6.042 6.613 0.369 1.00 0.00 H new ATOM 0 HD1 TYR A 71 3.499 5.521 2.883 1.00 0.00 H new ATOM 0 HD2 TYR A 71 6.902 7.958 2.085 1.00 0.00 H new ATOM 0 HE1 TYR A 71 3.651 6.125 5.337 1.00 0.00 H new ATOM 0 HE2 TYR A 71 7.042 8.555 4.543 1.00 0.00 H new ATOM 0 HH TYR A 71 6.340 7.978 6.566 1.00 0.00 H new ATOM 1122 N THR A 72 4.847 8.015 -1.886 1.00 0.00 N ATOM 1123 CA THR A 72 5.169 8.096 -3.301 1.00 0.00 C ATOM 1124 C THR A 72 6.682 8.011 -3.510 1.00 0.00 C ATOM 1125 O THR A 72 7.439 8.773 -2.912 1.00 0.00 O ATOM 1126 CB THR A 72 4.551 9.382 -3.853 1.00 0.00 C ATOM 1127 OG1 THR A 72 4.684 10.318 -2.786 1.00 0.00 O ATOM 1128 CG2 THR A 72 3.039 9.265 -4.058 1.00 0.00 C ATOM 0 H THR A 72 5.142 8.821 -1.334 1.00 0.00 H new ATOM 0 HA THR A 72 4.749 7.254 -3.851 1.00 0.00 H new ATOM 0 HB THR A 72 5.028 9.635 -4.800 1.00 0.00 H new ATOM 0 HG1 THR A 72 4.310 11.181 -3.060 1.00 0.00 H new ATOM 0 HG21 THR A 72 2.651 10.205 -4.451 1.00 0.00 H new ATOM 0 HG22 THR A 72 2.829 8.462 -4.764 1.00 0.00 H new ATOM 0 HG23 THR A 72 2.559 9.045 -3.105 1.00 0.00 H new ATOM 1136 N LEU A 73 7.077 7.076 -4.362 1.00 0.00 N ATOM 1137 CA LEU A 73 8.487 6.881 -4.657 1.00 0.00 C ATOM 1138 C LEU A 73 8.973 8.010 -5.568 1.00 0.00 C ATOM 1139 O LEU A 73 8.315 8.346 -6.552 1.00 0.00 O ATOM 1140 CB LEU A 73 8.726 5.482 -5.230 1.00 0.00 C ATOM 1141 CG LEU A 73 10.115 5.226 -5.816 1.00 0.00 C ATOM 1142 CD1 LEU A 73 11.210 5.735 -4.876 1.00 0.00 C ATOM 1143 CD2 LEU A 73 10.300 3.747 -6.163 1.00 0.00 C ATOM 0 H LEU A 73 6.446 6.446 -4.857 1.00 0.00 H new ATOM 0 HA LEU A 73 9.078 6.931 -3.743 1.00 0.00 H new ATOM 0 HB2 LEU A 73 8.546 4.752 -4.441 1.00 0.00 H new ATOM 0 HB3 LEU A 73 7.985 5.298 -6.008 1.00 0.00 H new ATOM 0 HG LEU A 73 10.202 5.789 -6.746 1.00 0.00 H new ATOM 0 HD11 LEU A 73 12.188 5.540 -5.317 1.00 0.00 H new ATOM 0 HD12 LEU A 73 11.088 6.807 -4.722 1.00 0.00 H new ATOM 0 HD13 LEU A 73 11.135 5.221 -3.918 1.00 0.00 H new ATOM 0 HD21 LEU A 73 11.296 3.592 -6.578 1.00 0.00 H new ATOM 0 HD22 LEU A 73 10.185 3.145 -5.262 1.00 0.00 H new ATOM 0 HD23 LEU A 73 9.551 3.449 -6.897 1.00 0.00 H new ATOM 1155 N SER A 74 10.122 8.564 -5.209 1.00 0.00 N ATOM 1156 CA SER A 74 10.704 9.648 -5.981 1.00 0.00 C ATOM 1157 C SER A 74 11.572 9.081 -7.107 1.00 0.00 C ATOM 1158 O SER A 74 12.518 8.338 -6.851 1.00 0.00 O ATOM 1159 CB SER A 74 11.531 10.577 -5.090 1.00 0.00 C ATOM 1160 OG SER A 74 10.773 11.076 -3.992 1.00 0.00 O ATOM 0 H SER A 74 10.665 8.282 -4.393 1.00 0.00 H new ATOM 0 HA SER A 74 9.893 10.233 -6.415 1.00 0.00 H new ATOM 0 HB2 SER A 74 12.402 10.039 -4.715 1.00 0.00 H new ATOM 0 HB3 SER A 74 11.903 11.412 -5.683 1.00 0.00 H new ATOM 0 HG SER A 74 11.336 11.664 -3.446 1.00 0.00 H new ATOM 1166 N GLY A 75 11.218 9.453 -8.328 1.00 0.00 N ATOM 1167 CA GLY A 75 11.952 8.991 -9.494 1.00 0.00 C ATOM 1168 C GLY A 75 13.360 9.589 -9.527 1.00 0.00 C ATOM 1169 O GLY A 75 14.223 9.115 -10.265 1.00 0.00 O ATOM 0 H GLY A 75 10.432 10.069 -8.535 1.00 0.00 H new ATOM 0 HA2 GLY A 75 12.015 7.903 -9.481 1.00 0.00 H new ATOM 0 HA3 GLY A 75 11.414 9.268 -10.400 1.00 0.00 H new ATOM 1173 N GLU A 76 13.549 10.623 -8.720 1.00 0.00 N ATOM 1174 CA GLU A 76 14.836 11.291 -8.648 1.00 0.00 C ATOM 1175 C GLU A 76 15.812 10.475 -7.798 1.00 0.00 C ATOM 1176 O GLU A 76 17.019 10.500 -8.035 1.00 0.00 O ATOM 1177 CB GLU A 76 14.687 12.712 -8.099 1.00 0.00 C ATOM 1178 CG GLU A 76 14.073 12.696 -6.698 1.00 0.00 C ATOM 1179 CD GLU A 76 12.727 13.423 -6.681 1.00 0.00 C ATOM 1180 OE1 GLU A 76 11.813 12.942 -7.385 1.00 0.00 O ATOM 1181 OE2 GLU A 76 12.643 14.444 -5.964 1.00 0.00 O ATOM 0 H GLU A 76 12.831 11.014 -8.110 1.00 0.00 H new ATOM 0 HA GLU A 76 15.240 11.367 -9.658 1.00 0.00 H new ATOM 0 HB2 GLU A 76 15.662 13.198 -8.067 1.00 0.00 H new ATOM 0 HB3 GLU A 76 14.060 13.301 -8.768 1.00 0.00 H new ATOM 0 HG2 GLU A 76 13.938 11.666 -6.368 1.00 0.00 H new ATOM 0 HG3 GLU A 76 14.755 13.170 -5.993 1.00 0.00 H new ATOM 1188 N THR A 77 15.253 9.769 -6.826 1.00 0.00 N ATOM 1189 CA THR A 77 16.058 8.946 -5.940 1.00 0.00 C ATOM 1190 C THR A 77 15.357 7.614 -5.665 1.00 0.00 C ATOM 1191 O THR A 77 14.659 7.086 -6.530 1.00 0.00 O ATOM 1192 CB THR A 77 16.343 9.755 -4.673 1.00 0.00 C ATOM 1193 OG1 THR A 77 15.085 9.810 -4.006 1.00 0.00 O ATOM 1194 CG2 THR A 77 16.670 11.219 -4.974 1.00 0.00 C ATOM 0 H THR A 77 14.252 9.750 -6.633 1.00 0.00 H new ATOM 0 HA THR A 77 17.012 8.686 -6.399 1.00 0.00 H new ATOM 0 HB THR A 77 17.174 9.302 -4.132 1.00 0.00 H new ATOM 0 HG1 THR A 77 15.206 10.188 -3.110 1.00 0.00 H new ATOM 0 HG21 THR A 77 16.864 11.748 -4.041 1.00 0.00 H new ATOM 0 HG22 THR A 77 17.553 11.271 -5.611 1.00 0.00 H new ATOM 0 HG23 THR A 77 15.826 11.683 -5.485 1.00 0.00 H new ATOM 1202 N GLU A 78 15.567 7.109 -4.458 1.00 0.00 N ATOM 1203 CA GLU A 78 14.964 5.849 -4.059 1.00 0.00 C ATOM 1204 C GLU A 78 14.182 6.024 -2.756 1.00 0.00 C ATOM 1205 O GLU A 78 13.637 5.060 -2.220 1.00 0.00 O ATOM 1206 CB GLU A 78 16.024 4.754 -3.920 1.00 0.00 C ATOM 1207 CG GLU A 78 17.064 4.853 -5.038 1.00 0.00 C ATOM 1208 CD GLU A 78 18.219 3.877 -4.800 1.00 0.00 C ATOM 1209 OE1 GLU A 78 18.991 4.132 -3.850 1.00 0.00 O ATOM 1210 OE2 GLU A 78 18.303 2.898 -5.573 1.00 0.00 O ATOM 0 H GLU A 78 16.146 7.550 -3.744 1.00 0.00 H new ATOM 0 HA GLU A 78 14.268 5.538 -4.838 1.00 0.00 H new ATOM 0 HB2 GLU A 78 16.517 4.840 -2.951 1.00 0.00 H new ATOM 0 HB3 GLU A 78 15.546 3.775 -3.948 1.00 0.00 H new ATOM 0 HG2 GLU A 78 16.593 4.638 -5.997 1.00 0.00 H new ATOM 0 HG3 GLU A 78 17.449 5.871 -5.093 1.00 0.00 H new ATOM 1217 N GLU A 79 14.153 7.261 -2.283 1.00 0.00 N ATOM 1218 CA GLU A 79 13.447 7.575 -1.052 1.00 0.00 C ATOM 1219 C GLU A 79 11.938 7.627 -1.304 1.00 0.00 C ATOM 1220 O GLU A 79 11.500 7.753 -2.446 1.00 0.00 O ATOM 1221 CB GLU A 79 13.948 8.890 -0.452 1.00 0.00 C ATOM 1222 CG GLU A 79 15.345 8.721 0.148 1.00 0.00 C ATOM 1223 CD GLU A 79 16.393 8.524 -0.949 1.00 0.00 C ATOM 1224 OE1 GLU A 79 16.838 9.553 -1.501 1.00 0.00 O ATOM 1225 OE2 GLU A 79 16.726 7.348 -1.210 1.00 0.00 O ATOM 0 H GLU A 79 14.607 8.058 -2.730 1.00 0.00 H new ATOM 0 HA GLU A 79 13.648 6.784 -0.329 1.00 0.00 H new ATOM 0 HB2 GLU A 79 13.970 9.661 -1.223 1.00 0.00 H new ATOM 0 HB3 GLU A 79 13.256 9.229 0.319 1.00 0.00 H new ATOM 0 HG2 GLU A 79 15.597 9.598 0.744 1.00 0.00 H new ATOM 0 HG3 GLU A 79 15.354 7.865 0.822 1.00 0.00 H new ATOM 1232 N LEU A 80 11.185 7.528 -0.218 1.00 0.00 N ATOM 1233 CA LEU A 80 9.736 7.563 -0.307 1.00 0.00 C ATOM 1234 C LEU A 80 9.199 8.665 0.609 1.00 0.00 C ATOM 1235 O LEU A 80 9.540 8.717 1.789 1.00 0.00 O ATOM 1236 CB LEU A 80 9.148 6.181 -0.016 1.00 0.00 C ATOM 1237 CG LEU A 80 9.507 5.076 -1.011 1.00 0.00 C ATOM 1238 CD1 LEU A 80 10.037 3.837 -0.288 1.00 0.00 C ATOM 1239 CD2 LEU A 80 8.318 4.746 -1.916 1.00 0.00 C ATOM 0 H LEU A 80 11.552 7.424 0.728 1.00 0.00 H new ATOM 0 HA LEU A 80 9.423 7.810 -1.321 1.00 0.00 H new ATOM 0 HB2 LEU A 80 9.476 5.870 0.976 1.00 0.00 H new ATOM 0 HB3 LEU A 80 8.062 6.270 0.021 1.00 0.00 H new ATOM 0 HG LEU A 80 10.309 5.442 -1.652 1.00 0.00 H new ATOM 0 HD11 LEU A 80 10.284 3.067 -1.019 1.00 0.00 H new ATOM 0 HD12 LEU A 80 10.930 4.100 0.278 1.00 0.00 H new ATOM 0 HD13 LEU A 80 9.274 3.459 0.393 1.00 0.00 H new ATOM 0 HD21 LEU A 80 8.600 3.958 -2.614 1.00 0.00 H new ATOM 0 HD22 LEU A 80 7.480 4.409 -1.307 1.00 0.00 H new ATOM 0 HD23 LEU A 80 8.027 5.636 -2.473 1.00 0.00 H new ATOM 1251 N SER A 81 8.368 9.519 0.029 1.00 0.00 N ATOM 1252 CA SER A 81 7.781 10.617 0.779 1.00 0.00 C ATOM 1253 C SER A 81 6.427 10.194 1.352 1.00 0.00 C ATOM 1254 O SER A 81 5.723 9.381 0.755 1.00 0.00 O ATOM 1255 CB SER A 81 7.621 11.860 -0.100 1.00 0.00 C ATOM 1256 OG SER A 81 7.350 13.027 0.672 1.00 0.00 O ATOM 0 H SER A 81 8.087 9.473 -0.951 1.00 0.00 H new ATOM 0 HA SER A 81 8.453 10.869 1.600 1.00 0.00 H new ATOM 0 HB2 SER A 81 8.530 12.013 -0.681 1.00 0.00 H new ATOM 0 HB3 SER A 81 6.811 11.699 -0.811 1.00 0.00 H new ATOM 0 HG SER A 81 7.256 13.799 0.076 1.00 0.00 H new ATOM 1262 N ARG A 82 6.103 10.765 2.503 1.00 0.00 N ATOM 1263 CA ARG A 82 4.846 10.458 3.163 1.00 0.00 C ATOM 1264 C ARG A 82 3.701 11.241 2.517 1.00 0.00 C ATOM 1265 O ARG A 82 3.501 12.417 2.819 1.00 0.00 O ATOM 1266 CB ARG A 82 4.909 10.797 4.653 1.00 0.00 C ATOM 1267 CG ARG A 82 3.628 10.365 5.369 1.00 0.00 C ATOM 1268 CD ARG A 82 3.427 11.159 6.661 1.00 0.00 C ATOM 1269 NE ARG A 82 2.028 11.634 6.750 1.00 0.00 N ATOM 1270 CZ ARG A 82 1.611 12.589 7.593 1.00 0.00 C ATOM 1271 NH1 ARG A 82 2.483 13.178 8.423 1.00 0.00 N ATOM 1272 NH2 ARG A 82 0.322 12.956 7.605 1.00 0.00 N ATOM 0 H ARG A 82 6.690 11.439 2.995 1.00 0.00 H new ATOM 0 HA ARG A 82 4.667 9.389 3.052 1.00 0.00 H new ATOM 0 HB2 ARG A 82 5.768 10.302 5.106 1.00 0.00 H new ATOM 0 HB3 ARG A 82 5.056 11.870 4.780 1.00 0.00 H new ATOM 0 HG2 ARG A 82 2.772 10.512 4.711 1.00 0.00 H new ATOM 0 HG3 ARG A 82 3.676 9.300 5.596 1.00 0.00 H new ATOM 0 HD2 ARG A 82 3.663 10.534 7.522 1.00 0.00 H new ATOM 0 HD3 ARG A 82 4.110 12.008 6.686 1.00 0.00 H new ATOM 0 HE ARG A 82 1.338 11.208 6.131 1.00 0.00 H new ATOM 0 HH11 ARG A 82 3.464 12.900 8.413 1.00 0.00 H new ATOM 0 HH12 ARG A 82 2.165 13.905 9.064 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -0.342 12.509 6.973 1.00 0.00 H new ATOM 0 HH22 ARG A 82 0.005 13.683 8.247 1.00 0.00 H new ATOM 1286 N LEU A 83 2.980 10.559 1.640 1.00 0.00 N ATOM 1287 CA LEU A 83 1.861 11.176 0.949 1.00 0.00 C ATOM 1288 C LEU A 83 0.742 11.460 1.952 1.00 0.00 C ATOM 1289 O LEU A 83 0.328 12.606 2.118 1.00 0.00 O ATOM 1290 CB LEU A 83 1.421 10.314 -0.236 1.00 0.00 C ATOM 1291 CG LEU A 83 0.295 10.885 -1.100 1.00 0.00 C ATOM 1292 CD1 LEU A 83 0.657 12.276 -1.623 1.00 0.00 C ATOM 1293 CD2 LEU A 83 -0.069 9.923 -2.232 1.00 0.00 C ATOM 0 H LEU A 83 3.149 9.584 1.392 1.00 0.00 H new ATOM 0 HA LEU A 83 2.158 12.134 0.523 1.00 0.00 H new ATOM 0 HB2 LEU A 83 2.288 10.138 -0.873 1.00 0.00 H new ATOM 0 HB3 LEU A 83 1.103 9.343 0.145 1.00 0.00 H new ATOM 0 HG LEU A 83 -0.592 10.997 -0.476 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -0.160 12.659 -2.234 1.00 0.00 H new ATOM 0 HD12 LEU A 83 0.827 12.948 -0.782 1.00 0.00 H new ATOM 0 HD13 LEU A 83 1.563 12.214 -2.226 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -0.872 10.353 -2.831 1.00 0.00 H new ATOM 0 HD22 LEU A 83 0.804 9.756 -2.862 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -0.399 8.974 -1.811 1.00 0.00 H new ATOM 1305 N ALA A 84 0.283 10.396 2.595 1.00 0.00 N ATOM 1306 CA ALA A 84 -0.781 10.516 3.578 1.00 0.00 C ATOM 1307 C ALA A 84 -0.656 9.384 4.599 1.00 0.00 C ATOM 1308 O ALA A 84 -0.256 8.273 4.254 1.00 0.00 O ATOM 1309 CB ALA A 84 -2.135 10.514 2.867 1.00 0.00 C ATOM 0 H ALA A 84 0.629 9.447 2.454 1.00 0.00 H new ATOM 0 HA ALA A 84 -0.699 11.458 4.120 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -2.933 10.604 3.604 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -2.184 11.355 2.175 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -2.255 9.582 2.315 1.00 0.00 H new ATOM 1315 N GLY A 85 -1.007 9.704 5.836 1.00 0.00 N ATOM 1316 CA GLY A 85 -0.939 8.727 6.910 1.00 0.00 C ATOM 1317 C GLY A 85 -0.472 9.377 8.213 1.00 0.00 C ATOM 1318 O GLY A 85 -0.862 10.501 8.525 1.00 0.00 O ATOM 0 H GLY A 85 -1.339 10.626 6.119 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -1.919 8.274 7.057 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -0.255 7.925 6.634 1.00 0.00 H new ATOM 1322 N TYR A 86 0.357 8.641 8.940 1.00 0.00 N ATOM 1323 CA TYR A 86 0.881 9.132 10.203 1.00 0.00 C ATOM 1324 C TYR A 86 2.242 8.504 10.513 1.00 0.00 C ATOM 1325 O TYR A 86 2.669 8.478 11.666 1.00 0.00 O ATOM 1326 CB TYR A 86 -0.123 8.698 11.273 1.00 0.00 C ATOM 1327 CG TYR A 86 -0.143 7.191 11.533 1.00 0.00 C ATOM 1328 CD1 TYR A 86 -0.492 6.321 10.520 1.00 0.00 C ATOM 1329 CD2 TYR A 86 0.186 6.701 12.780 1.00 0.00 C ATOM 1330 CE1 TYR A 86 -0.511 4.902 10.764 1.00 0.00 C ATOM 1331 CE2 TYR A 86 0.167 5.282 13.025 1.00 0.00 C ATOM 1332 CZ TYR A 86 -0.181 4.452 12.004 1.00 0.00 C ATOM 1333 OH TYR A 86 -0.200 3.112 12.235 1.00 0.00 O ATOM 0 H TYR A 86 0.678 7.709 8.678 1.00 0.00 H new ATOM 0 HA TYR A 86 1.015 10.213 10.169 1.00 0.00 H new ATOM 0 HB2 TYR A 86 0.109 9.214 12.205 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -1.121 9.018 10.971 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -0.751 6.705 9.544 1.00 0.00 H new ATOM 0 HD2 TYR A 86 0.458 7.382 13.573 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -0.781 4.211 9.980 1.00 0.00 H new ATOM 0 HE2 TYR A 86 0.423 4.886 13.996 1.00 0.00 H new ATOM 0 HH TYR A 86 0.278 2.917 13.068 1.00 0.00 H new ATOM 1343 N GLY A 87 2.884 8.013 9.463 1.00 0.00 N ATOM 1344 CA GLY A 87 4.187 7.387 9.608 1.00 0.00 C ATOM 1345 C GLY A 87 5.307 8.426 9.517 1.00 0.00 C ATOM 1346 O GLY A 87 5.097 9.599 9.821 1.00 0.00 O ATOM 0 H GLY A 87 2.526 8.036 8.508 1.00 0.00 H new ATOM 0 HA2 GLY A 87 4.242 6.871 10.566 1.00 0.00 H new ATOM 0 HA3 GLY A 87 4.321 6.633 8.832 1.00 0.00 H new ATOM 1350 N PRO A 88 6.504 7.944 9.086 1.00 0.00 N ATOM 1351 CA PRO A 88 7.657 8.817 8.951 1.00 0.00 C ATOM 1352 C PRO A 88 7.530 9.706 7.713 1.00 0.00 C ATOM 1353 O PRO A 88 7.244 9.218 6.620 1.00 0.00 O ATOM 1354 CB PRO A 88 8.854 7.881 8.890 1.00 0.00 C ATOM 1355 CG PRO A 88 8.296 6.515 8.526 1.00 0.00 C ATOM 1356 CD PRO A 88 6.789 6.560 8.717 1.00 0.00 C ATOM 0 HA PRO A 88 7.756 9.515 9.782 1.00 0.00 H new ATOM 0 HB2 PRO A 88 9.576 8.219 8.147 1.00 0.00 H new ATOM 0 HB3 PRO A 88 9.374 7.848 9.848 1.00 0.00 H new ATOM 0 HG2 PRO A 88 8.542 6.265 7.494 1.00 0.00 H new ATOM 0 HG3 PRO A 88 8.737 5.742 9.156 1.00 0.00 H new ATOM 0 HD2 PRO A 88 6.265 6.278 7.804 1.00 0.00 H new ATOM 0 HD3 PRO A 88 6.468 5.868 9.496 1.00 0.00 H new ATOM 1364 N ARG A 89 7.749 10.995 7.924 1.00 0.00 N ATOM 1365 CA ARG A 89 7.663 11.957 6.838 1.00 0.00 C ATOM 1366 C ARG A 89 8.218 11.352 5.548 1.00 0.00 C ATOM 1367 O ARG A 89 7.570 11.406 4.504 1.00 0.00 O ATOM 1368 CB ARG A 89 8.439 13.234 7.170 1.00 0.00 C ATOM 1369 CG ARG A 89 8.168 14.325 6.133 1.00 0.00 C ATOM 1370 CD ARG A 89 7.842 15.657 6.811 1.00 0.00 C ATOM 1371 NE ARG A 89 7.823 16.745 5.807 1.00 0.00 N ATOM 1372 CZ ARG A 89 7.531 18.022 6.088 1.00 0.00 C ATOM 1373 NH1 ARG A 89 7.231 18.379 7.344 1.00 0.00 N ATOM 1374 NH2 ARG A 89 7.539 18.941 5.114 1.00 0.00 N ATOM 0 H ARG A 89 7.986 11.396 8.831 1.00 0.00 H new ATOM 0 HA ARG A 89 6.612 12.210 6.702 1.00 0.00 H new ATOM 0 HB2 ARG A 89 8.154 13.590 8.160 1.00 0.00 H new ATOM 0 HB3 ARG A 89 9.507 13.017 7.204 1.00 0.00 H new ATOM 0 HG2 ARG A 89 9.039 14.444 5.489 1.00 0.00 H new ATOM 0 HG3 ARG A 89 7.338 14.026 5.493 1.00 0.00 H new ATOM 0 HD2 ARG A 89 6.875 15.594 7.309 1.00 0.00 H new ATOM 0 HD3 ARG A 89 8.583 15.874 7.580 1.00 0.00 H new ATOM 0 HE ARG A 89 8.046 16.507 4.841 1.00 0.00 H new ATOM 0 HH11 ARG A 89 7.225 17.679 8.086 1.00 0.00 H new ATOM 0 HH12 ARG A 89 7.009 19.351 7.559 1.00 0.00 H new ATOM 0 HH21 ARG A 89 7.767 18.669 4.158 1.00 0.00 H new ATOM 0 HH22 ARG A 89 7.317 19.913 5.328 1.00 0.00 H new ATOM 1388 N THR A 90 9.413 10.790 5.661 1.00 0.00 N ATOM 1389 CA THR A 90 10.063 10.175 4.516 1.00 0.00 C ATOM 1390 C THR A 90 10.596 8.790 4.886 1.00 0.00 C ATOM 1391 O THR A 90 10.742 8.471 6.066 1.00 0.00 O ATOM 1392 CB THR A 90 11.148 11.132 4.019 1.00 0.00 C ATOM 1393 OG1 THR A 90 10.422 12.251 3.520 1.00 0.00 O ATOM 1394 CG2 THR A 90 11.889 10.591 2.794 1.00 0.00 C ATOM 0 H THR A 90 9.948 10.748 6.528 1.00 0.00 H new ATOM 0 HA THR A 90 9.358 10.010 3.702 1.00 0.00 H new ATOM 0 HB THR A 90 11.862 11.320 4.821 1.00 0.00 H new ATOM 0 HG1 THR A 90 11.049 12.922 3.179 1.00 0.00 H new ATOM 0 HG21 THR A 90 12.648 11.308 2.482 1.00 0.00 H new ATOM 0 HG22 THR A 90 12.366 9.644 3.046 1.00 0.00 H new ATOM 0 HG23 THR A 90 11.181 10.435 1.980 1.00 0.00 H new ATOM 1402 N VAL A 91 10.874 8.003 3.857 1.00 0.00 N ATOM 1403 CA VAL A 91 11.388 6.660 4.059 1.00 0.00 C ATOM 1404 C VAL A 91 12.563 6.420 3.109 1.00 0.00 C ATOM 1405 O VAL A 91 12.574 6.928 1.988 1.00 0.00 O ATOM 1406 CB VAL A 91 10.263 5.637 3.888 1.00 0.00 C ATOM 1407 CG1 VAL A 91 10.824 4.218 3.776 1.00 0.00 C ATOM 1408 CG2 VAL A 91 9.252 5.739 5.032 1.00 0.00 C ATOM 0 H VAL A 91 10.753 8.271 2.880 1.00 0.00 H new ATOM 0 HA VAL A 91 11.763 6.544 5.076 1.00 0.00 H new ATOM 0 HB VAL A 91 9.741 5.864 2.958 1.00 0.00 H new ATOM 0 HG11 VAL A 91 10.003 3.511 3.655 1.00 0.00 H new ATOM 0 HG12 VAL A 91 11.487 4.156 2.913 1.00 0.00 H new ATOM 0 HG13 VAL A 91 11.382 3.975 4.680 1.00 0.00 H new ATOM 0 HG21 VAL A 91 8.463 5.001 4.887 1.00 0.00 H new ATOM 0 HG22 VAL A 91 9.755 5.550 5.980 1.00 0.00 H new ATOM 0 HG23 VAL A 91 8.817 6.738 5.045 1.00 0.00 H new ATOM 1418 N THR A 92 13.524 5.646 3.591 1.00 0.00 N ATOM 1419 CA THR A 92 14.701 5.332 2.798 1.00 0.00 C ATOM 1420 C THR A 92 14.829 3.820 2.608 1.00 0.00 C ATOM 1421 O THR A 92 14.192 3.045 3.321 1.00 0.00 O ATOM 1422 CB THR A 92 15.915 5.964 3.483 1.00 0.00 C ATOM 1423 OG1 THR A 92 16.053 5.225 4.694 1.00 0.00 O ATOM 1424 CG2 THR A 92 15.645 7.396 3.949 1.00 0.00 C ATOM 0 H THR A 92 13.512 5.227 4.521 1.00 0.00 H new ATOM 0 HA THR A 92 14.623 5.748 1.793 1.00 0.00 H new ATOM 0 HB THR A 92 16.762 5.960 2.797 1.00 0.00 H new ATOM 0 HG1 THR A 92 16.819 5.567 5.201 1.00 0.00 H new ATOM 0 HG21 THR A 92 16.538 7.797 4.428 1.00 0.00 H new ATOM 0 HG22 THR A 92 15.384 8.015 3.090 1.00 0.00 H new ATOM 0 HG23 THR A 92 14.820 7.397 4.661 1.00 0.00 H new ATOM 1432 N PRO A 93 15.679 3.434 1.619 1.00 0.00 N ATOM 1433 CA PRO A 93 15.899 2.028 1.327 1.00 0.00 C ATOM 1434 C PRO A 93 16.787 1.379 2.390 1.00 0.00 C ATOM 1435 O PRO A 93 16.978 0.164 2.388 1.00 0.00 O ATOM 1436 CB PRO A 93 16.520 2.007 -0.060 1.00 0.00 C ATOM 1437 CG PRO A 93 17.052 3.410 -0.300 1.00 0.00 C ATOM 1438 CD PRO A 93 16.450 4.324 0.756 1.00 0.00 C ATOM 0 HA PRO A 93 14.978 1.446 1.345 1.00 0.00 H new ATOM 0 HB2 PRO A 93 17.321 1.270 -0.118 1.00 0.00 H new ATOM 0 HB3 PRO A 93 15.782 1.735 -0.814 1.00 0.00 H new ATOM 0 HG2 PRO A 93 18.140 3.421 -0.239 1.00 0.00 H new ATOM 0 HG3 PRO A 93 16.785 3.754 -1.299 1.00 0.00 H new ATOM 0 HD2 PRO A 93 17.225 4.846 1.317 1.00 0.00 H new ATOM 0 HD3 PRO A 93 15.815 5.086 0.305 1.00 0.00 H new ATOM 1446 N ALA A 94 17.308 2.219 3.273 1.00 0.00 N ATOM 1447 CA ALA A 94 18.172 1.743 4.340 1.00 0.00 C ATOM 1448 C ALA A 94 17.320 1.387 5.560 1.00 0.00 C ATOM 1449 O ALA A 94 17.768 0.658 6.444 1.00 0.00 O ATOM 1450 CB ALA A 94 19.227 2.805 4.655 1.00 0.00 C ATOM 0 H ALA A 94 17.148 3.226 3.271 1.00 0.00 H new ATOM 0 HA ALA A 94 18.700 0.840 4.032 1.00 0.00 H new ATOM 0 HB1 ALA A 94 19.875 2.448 5.455 1.00 0.00 H new ATOM 0 HB2 ALA A 94 19.824 3.000 3.764 1.00 0.00 H new ATOM 0 HB3 ALA A 94 18.734 3.725 4.970 1.00 0.00 H new ATOM 1456 N MET A 95 16.106 1.919 5.570 1.00 0.00 N ATOM 1457 CA MET A 95 15.187 1.667 6.667 1.00 0.00 C ATOM 1458 C MET A 95 14.176 0.580 6.297 1.00 0.00 C ATOM 1459 O MET A 95 13.619 -0.079 7.173 1.00 0.00 O ATOM 1460 CB MET A 95 14.444 2.958 7.017 1.00 0.00 C ATOM 1461 CG MET A 95 15.391 3.982 7.648 1.00 0.00 C ATOM 1462 SD MET A 95 14.505 4.988 8.826 1.00 0.00 S ATOM 1463 CE MET A 95 12.899 5.035 8.047 1.00 0.00 C ATOM 0 H MET A 95 15.738 2.524 4.836 1.00 0.00 H new ATOM 0 HA MET A 95 15.762 1.324 7.527 1.00 0.00 H new ATOM 0 HB2 MET A 95 13.995 3.379 6.117 1.00 0.00 H new ATOM 0 HB3 MET A 95 13.629 2.737 7.707 1.00 0.00 H new ATOM 0 HG2 MET A 95 16.216 3.470 8.143 1.00 0.00 H new ATOM 0 HG3 MET A 95 15.826 4.613 6.873 1.00 0.00 H new ATOM 0 HE1 MET A 95 12.275 5.779 8.543 1.00 0.00 H new ATOM 0 HE2 MET A 95 13.012 5.300 6.996 1.00 0.00 H new ATOM 0 HE3 MET A 95 12.428 4.055 8.126 1.00 0.00 H new ATOM 1473 N VAL A 96 13.970 0.427 4.997 1.00 0.00 N ATOM 1474 CA VAL A 96 13.035 -0.569 4.500 1.00 0.00 C ATOM 1475 C VAL A 96 13.545 -1.965 4.861 1.00 0.00 C ATOM 1476 O VAL A 96 14.742 -2.236 4.769 1.00 0.00 O ATOM 1477 CB VAL A 96 12.820 -0.381 2.997 1.00 0.00 C ATOM 1478 CG1 VAL A 96 14.013 -0.914 2.202 1.00 0.00 C ATOM 1479 CG2 VAL A 96 11.518 -1.042 2.542 1.00 0.00 C ATOM 0 H VAL A 96 14.434 0.976 4.273 1.00 0.00 H new ATOM 0 HA VAL A 96 12.060 -0.447 4.972 1.00 0.00 H new ATOM 0 HB VAL A 96 12.738 0.688 2.802 1.00 0.00 H new ATOM 0 HG11 VAL A 96 13.835 -0.768 1.137 1.00 0.00 H new ATOM 0 HG12 VAL A 96 14.915 -0.377 2.496 1.00 0.00 H new ATOM 0 HG13 VAL A 96 14.141 -1.977 2.406 1.00 0.00 H new ATOM 0 HG21 VAL A 96 11.390 -0.893 1.470 1.00 0.00 H new ATOM 0 HG22 VAL A 96 11.557 -2.110 2.758 1.00 0.00 H new ATOM 0 HG23 VAL A 96 10.678 -0.595 3.073 1.00 0.00 H new ATOM 1489 N GLU A 97 12.612 -2.816 5.264 1.00 0.00 N ATOM 1490 CA GLU A 97 12.952 -4.177 5.639 1.00 0.00 C ATOM 1491 C GLU A 97 12.776 -5.117 4.444 1.00 0.00 C ATOM 1492 O GLU A 97 13.659 -5.919 4.145 1.00 0.00 O ATOM 1493 CB GLU A 97 12.114 -4.644 6.831 1.00 0.00 C ATOM 1494 CG GLU A 97 12.418 -6.102 7.178 1.00 0.00 C ATOM 1495 CD GLU A 97 11.159 -6.823 7.666 1.00 0.00 C ATOM 1496 OE1 GLU A 97 10.241 -6.989 6.835 1.00 0.00 O ATOM 1497 OE2 GLU A 97 11.145 -7.192 8.861 1.00 0.00 O ATOM 0 H GLU A 97 11.621 -2.588 5.339 1.00 0.00 H new ATOM 0 HA GLU A 97 13.999 -4.198 5.942 1.00 0.00 H new ATOM 0 HB2 GLU A 97 12.319 -4.011 7.694 1.00 0.00 H new ATOM 0 HB3 GLU A 97 11.054 -4.535 6.600 1.00 0.00 H new ATOM 0 HG2 GLU A 97 12.817 -6.613 6.302 1.00 0.00 H new ATOM 0 HG3 GLU A 97 13.187 -6.143 7.949 1.00 0.00 H new ATOM 1504 N GLY A 98 11.630 -4.985 3.792 1.00 0.00 N ATOM 1505 CA GLY A 98 11.327 -5.812 2.637 1.00 0.00 C ATOM 1506 C GLY A 98 10.390 -5.084 1.672 1.00 0.00 C ATOM 1507 O GLY A 98 9.682 -4.158 2.067 1.00 0.00 O ATOM 0 H GLY A 98 10.900 -4.318 4.042 1.00 0.00 H new ATOM 0 HA2 GLY A 98 12.251 -6.077 2.122 1.00 0.00 H new ATOM 0 HA3 GLY A 98 10.866 -6.744 2.964 1.00 0.00 H new ATOM 1511 N ILE A 99 10.415 -5.528 0.424 1.00 0.00 N ATOM 1512 CA ILE A 99 9.577 -4.930 -0.601 1.00 0.00 C ATOM 1513 C ILE A 99 8.686 -6.009 -1.220 1.00 0.00 C ATOM 1514 O ILE A 99 9.072 -7.175 -1.284 1.00 0.00 O ATOM 1515 CB ILE A 99 10.433 -4.179 -1.623 1.00 0.00 C ATOM 1516 CG1 ILE A 99 11.795 -4.852 -1.797 1.00 0.00 C ATOM 1517 CG2 ILE A 99 10.568 -2.702 -1.246 1.00 0.00 C ATOM 1518 CD1 ILE A 99 12.563 -4.241 -2.971 1.00 0.00 C ATOM 0 H ILE A 99 11.003 -6.296 0.099 1.00 0.00 H new ATOM 0 HA ILE A 99 8.916 -4.183 -0.163 1.00 0.00 H new ATOM 0 HB ILE A 99 9.927 -4.220 -2.588 1.00 0.00 H new ATOM 0 HG12 ILE A 99 12.377 -4.745 -0.882 1.00 0.00 H new ATOM 0 HG13 ILE A 99 11.658 -5.920 -1.964 1.00 0.00 H new ATOM 0 HG21 ILE A 99 11.181 -2.191 -1.989 1.00 0.00 H new ATOM 0 HG22 ILE A 99 9.580 -2.243 -1.214 1.00 0.00 H new ATOM 0 HG23 ILE A 99 11.039 -2.618 -0.267 1.00 0.00 H new ATOM 0 HD11 ILE A 99 13.528 -4.738 -3.073 1.00 0.00 H new ATOM 0 HD12 ILE A 99 11.989 -4.372 -3.889 1.00 0.00 H new ATOM 0 HD13 ILE A 99 12.720 -3.178 -2.789 1.00 0.00 H new ATOM 1530 N TYR A 100 7.512 -5.582 -1.659 1.00 0.00 N ATOM 1531 CA TYR A 100 6.563 -6.497 -2.271 1.00 0.00 C ATOM 1532 C TYR A 100 5.779 -5.808 -3.390 1.00 0.00 C ATOM 1533 O TYR A 100 5.561 -4.599 -3.345 1.00 0.00 O ATOM 1534 CB TYR A 100 5.593 -6.903 -1.160 1.00 0.00 C ATOM 1535 CG TYR A 100 6.279 -7.366 0.127 1.00 0.00 C ATOM 1536 CD1 TYR A 100 6.897 -6.445 0.949 1.00 0.00 C ATOM 1537 CD2 TYR A 100 6.280 -8.703 0.466 1.00 0.00 C ATOM 1538 CE1 TYR A 100 7.542 -6.880 2.160 1.00 0.00 C ATOM 1539 CE2 TYR A 100 6.926 -9.138 1.678 1.00 0.00 C ATOM 1540 CZ TYR A 100 7.525 -8.205 2.465 1.00 0.00 C ATOM 1541 OH TYR A 100 8.135 -8.616 3.609 1.00 0.00 O ATOM 0 H TYR A 100 7.196 -4.614 -1.603 1.00 0.00 H new ATOM 0 HA TYR A 100 7.081 -7.351 -2.707 1.00 0.00 H new ATOM 0 HB2 TYR A 100 4.945 -6.057 -0.930 1.00 0.00 H new ATOM 0 HB3 TYR A 100 4.952 -7.705 -1.527 1.00 0.00 H new ATOM 0 HD1 TYR A 100 6.897 -5.398 0.683 1.00 0.00 H new ATOM 0 HD2 TYR A 100 5.797 -9.424 -0.177 1.00 0.00 H new ATOM 0 HE1 TYR A 100 8.029 -6.170 2.812 1.00 0.00 H new ATOM 0 HE2 TYR A 100 6.934 -10.182 1.955 1.00 0.00 H new ATOM 0 HH TYR A 100 8.042 -9.588 3.698 1.00 0.00 H new ATOM 1551 N LYS A 101 5.378 -6.608 -4.367 1.00 0.00 N ATOM 1552 CA LYS A 101 4.623 -6.090 -5.495 1.00 0.00 C ATOM 1553 C LYS A 101 3.126 -6.234 -5.211 1.00 0.00 C ATOM 1554 O LYS A 101 2.726 -6.455 -4.069 1.00 0.00 O ATOM 1555 CB LYS A 101 5.070 -6.765 -6.794 1.00 0.00 C ATOM 1556 CG LYS A 101 4.818 -8.273 -6.743 1.00 0.00 C ATOM 1557 CD LYS A 101 6.105 -9.054 -7.018 1.00 0.00 C ATOM 1558 CE LYS A 101 6.051 -9.736 -8.386 1.00 0.00 C ATOM 1559 NZ LYS A 101 7.382 -10.267 -8.754 1.00 0.00 N ATOM 0 H LYS A 101 5.562 -7.611 -4.401 1.00 0.00 H new ATOM 0 HA LYS A 101 4.821 -5.027 -5.630 1.00 0.00 H new ATOM 0 HB2 LYS A 101 4.532 -6.331 -7.637 1.00 0.00 H new ATOM 0 HB3 LYS A 101 6.130 -6.575 -6.960 1.00 0.00 H new ATOM 0 HG2 LYS A 101 4.425 -8.547 -5.764 1.00 0.00 H new ATOM 0 HG3 LYS A 101 4.060 -8.544 -7.478 1.00 0.00 H new ATOM 0 HD2 LYS A 101 6.960 -8.379 -6.978 1.00 0.00 H new ATOM 0 HD3 LYS A 101 6.253 -9.803 -6.240 1.00 0.00 H new ATOM 0 HE2 LYS A 101 5.323 -10.547 -8.366 1.00 0.00 H new ATOM 0 HE3 LYS A 101 5.716 -9.024 -9.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 7.327 -10.727 -9.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 8.068 -9.487 -8.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 7.687 -10.962 -8.043 1.00 0.00 H new ATOM 1573 N TYR A 102 2.341 -6.103 -6.270 1.00 0.00 N ATOM 1574 CA TYR A 102 0.897 -6.216 -6.149 1.00 0.00 C ATOM 1575 C TYR A 102 0.294 -6.889 -7.383 1.00 0.00 C ATOM 1576 O TYR A 102 0.301 -6.316 -8.472 1.00 0.00 O ATOM 1577 CB TYR A 102 0.369 -4.783 -6.054 1.00 0.00 C ATOM 1578 CG TYR A 102 -1.158 -4.684 -6.016 1.00 0.00 C ATOM 1579 CD1 TYR A 102 -1.884 -4.777 -7.186 1.00 0.00 C ATOM 1580 CD2 TYR A 102 -1.808 -4.503 -4.812 1.00 0.00 C ATOM 1581 CE1 TYR A 102 -3.321 -4.683 -7.151 1.00 0.00 C ATOM 1582 CE2 TYR A 102 -3.245 -4.409 -4.777 1.00 0.00 C ATOM 1583 CZ TYR A 102 -3.930 -4.504 -5.948 1.00 0.00 C ATOM 1584 OH TYR A 102 -5.287 -4.416 -5.915 1.00 0.00 O ATOM 0 H TYR A 102 2.677 -5.920 -7.215 1.00 0.00 H new ATOM 0 HA TYR A 102 0.630 -6.818 -5.281 1.00 0.00 H new ATOM 0 HB2 TYR A 102 0.776 -4.315 -5.157 1.00 0.00 H new ATOM 0 HB3 TYR A 102 0.739 -4.213 -6.906 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -1.375 -4.920 -8.128 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -1.240 -4.432 -3.896 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -3.901 -4.753 -8.059 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -3.767 -4.266 -3.842 1.00 0.00 H new ATOM 0 HH TYR A 102 -5.634 -4.978 -5.191 1.00 0.00 H new ATOM 1594 N ASN A 103 -0.213 -8.094 -7.173 1.00 0.00 N ATOM 1595 CA ASN A 103 -0.819 -8.851 -8.256 1.00 0.00 C ATOM 1596 C ASN A 103 -2.168 -8.226 -8.617 1.00 0.00 C ATOM 1597 O ASN A 103 -3.168 -8.464 -7.941 1.00 0.00 O ATOM 1598 CB ASN A 103 -1.067 -10.303 -7.842 1.00 0.00 C ATOM 1599 CG ASN A 103 -0.044 -11.239 -8.488 1.00 0.00 C ATOM 1600 OD1 ASN A 103 -0.197 -11.686 -9.613 1.00 0.00 O ATOM 1601 ND2 ASN A 103 1.004 -11.511 -7.716 1.00 0.00 N ATOM 0 H ASN A 103 -0.217 -8.566 -6.269 1.00 0.00 H new ATOM 0 HA ASN A 103 -0.136 -8.830 -9.105 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -1.011 -10.390 -6.757 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -2.074 -10.601 -8.134 1.00 0.00 H new ATOM 0 HD21 ASN A 103 1.742 -12.127 -8.056 1.00 0.00 H new ATOM 0 HD22 ASN A 103 1.070 -11.103 -6.783 1.00 0.00 H new ATOM 1608 N SER A 104 -2.152 -7.437 -9.681 1.00 0.00 N ATOM 1609 CA SER A 104 -3.362 -6.775 -10.140 1.00 0.00 C ATOM 1610 C SER A 104 -4.177 -7.726 -11.019 1.00 0.00 C ATOM 1611 O SER A 104 -5.204 -7.338 -11.574 1.00 0.00 O ATOM 1612 CB SER A 104 -3.031 -5.494 -10.908 1.00 0.00 C ATOM 1613 OG SER A 104 -3.572 -4.338 -10.275 1.00 0.00 O ATOM 0 H SER A 104 -1.321 -7.241 -10.239 1.00 0.00 H new ATOM 0 HA SER A 104 -3.954 -6.500 -9.267 1.00 0.00 H new ATOM 0 HB2 SER A 104 -1.949 -5.390 -10.990 1.00 0.00 H new ATOM 0 HB3 SER A 104 -3.422 -5.568 -11.923 1.00 0.00 H new ATOM 0 HG SER A 104 -3.625 -3.605 -10.923 1.00 0.00 H new ATOM 1619 N ASP A 105 -3.689 -8.954 -11.119 1.00 0.00 N ATOM 1620 CA ASP A 105 -4.359 -9.963 -11.921 1.00 0.00 C ATOM 1621 C ASP A 105 -4.821 -11.105 -11.013 1.00 0.00 C ATOM 1622 O ASP A 105 -5.908 -11.650 -11.200 1.00 0.00 O ATOM 1623 CB ASP A 105 -3.414 -10.548 -12.973 1.00 0.00 C ATOM 1624 CG ASP A 105 -3.721 -10.141 -14.415 1.00 0.00 C ATOM 1625 OD1 ASP A 105 -4.901 -9.819 -14.675 1.00 0.00 O ATOM 1626 OD2 ASP A 105 -2.770 -10.160 -15.225 1.00 0.00 O ATOM 0 H ASP A 105 -2.837 -9.273 -10.657 1.00 0.00 H new ATOM 0 HA ASP A 105 -5.205 -9.490 -12.420 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -2.395 -10.243 -12.734 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -3.446 -11.635 -12.904 1.00 0.00 H new ATOM 1631 N ARG A 106 -3.973 -11.433 -10.050 1.00 0.00 N ATOM 1632 CA ARG A 106 -4.281 -12.501 -9.114 1.00 0.00 C ATOM 1633 C ARG A 106 -4.949 -11.931 -7.861 1.00 0.00 C ATOM 1634 O ARG A 106 -5.447 -12.681 -7.023 1.00 0.00 O ATOM 1635 CB ARG A 106 -3.015 -13.259 -8.708 1.00 0.00 C ATOM 1636 CG ARG A 106 -2.733 -14.412 -9.674 1.00 0.00 C ATOM 1637 CD ARG A 106 -2.427 -15.703 -8.912 1.00 0.00 C ATOM 1638 NE ARG A 106 -0.983 -16.014 -9.003 1.00 0.00 N ATOM 1639 CZ ARG A 106 -0.463 -17.232 -8.800 1.00 0.00 C ATOM 1640 NH1 ARG A 106 -1.266 -18.261 -8.493 1.00 0.00 N ATOM 1641 NH2 ARG A 106 0.859 -17.422 -8.903 1.00 0.00 N ATOM 0 H ARG A 106 -3.073 -10.978 -9.897 1.00 0.00 H new ATOM 0 HA ARG A 106 -4.962 -13.192 -9.611 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -2.166 -12.575 -8.694 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -3.128 -13.647 -7.696 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -3.594 -14.565 -10.325 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -1.890 -14.156 -10.316 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -2.719 -15.596 -7.867 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -3.011 -16.526 -9.324 1.00 0.00 H new ATOM 0 HE ARG A 106 -0.344 -15.254 -9.235 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -2.273 -18.116 -8.414 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -0.870 -19.188 -8.338 1.00 0.00 H new ATOM 0 HH21 ARG A 106 1.470 -16.639 -9.136 1.00 0.00 H new ATOM 0 HH22 ARG A 106 1.255 -18.349 -8.748 1.00 0.00 H new ATOM 1655 N LYS A 107 -4.940 -10.609 -7.773 1.00 0.00 N ATOM 1656 CA LYS A 107 -5.539 -9.930 -6.636 1.00 0.00 C ATOM 1657 C LYS A 107 -4.826 -10.365 -5.354 1.00 0.00 C ATOM 1658 O LYS A 107 -5.463 -10.555 -4.320 1.00 0.00 O ATOM 1659 CB LYS A 107 -7.051 -10.165 -6.609 1.00 0.00 C ATOM 1660 CG LYS A 107 -7.731 -9.493 -7.804 1.00 0.00 C ATOM 1661 CD LYS A 107 -9.229 -9.805 -7.828 1.00 0.00 C ATOM 1662 CE LYS A 107 -9.859 -9.365 -9.151 1.00 0.00 C ATOM 1663 NZ LYS A 107 -11.067 -10.170 -9.443 1.00 0.00 N ATOM 0 H LYS A 107 -4.527 -9.990 -8.471 1.00 0.00 H new ATOM 0 HA LYS A 107 -5.408 -8.851 -6.723 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -7.257 -11.235 -6.623 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -7.467 -9.773 -5.681 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -7.581 -8.415 -7.753 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -7.269 -9.836 -8.730 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -9.384 -10.874 -7.685 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -9.723 -9.298 -6.999 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -10.122 -8.308 -9.102 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -9.136 -9.476 -9.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -11.482 -9.859 -10.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -10.807 -11.175 -9.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -11.762 -10.043 -8.680 1.00 0.00 H new ATOM 1677 N ARG A 108 -3.514 -10.508 -5.464 1.00 0.00 N ATOM 1678 CA ARG A 108 -2.707 -10.916 -4.327 1.00 0.00 C ATOM 1679 C ARG A 108 -1.447 -10.053 -4.232 1.00 0.00 C ATOM 1680 O ARG A 108 -1.287 -9.098 -4.990 1.00 0.00 O ATOM 1681 CB ARG A 108 -2.303 -12.387 -4.438 1.00 0.00 C ATOM 1682 CG ARG A 108 -3.534 -13.296 -4.441 1.00 0.00 C ATOM 1683 CD ARG A 108 -4.050 -13.525 -3.019 1.00 0.00 C ATOM 1684 NE ARG A 108 -4.706 -14.848 -2.927 1.00 0.00 N ATOM 1685 CZ ARG A 108 -5.467 -15.239 -1.894 1.00 0.00 C ATOM 1686 NH1 ARG A 108 -5.670 -14.411 -0.861 1.00 0.00 N ATOM 1687 NH2 ARG A 108 -6.023 -16.458 -1.896 1.00 0.00 N ATOM 0 H ARG A 108 -2.989 -10.348 -6.324 1.00 0.00 H new ATOM 0 HA ARG A 108 -3.310 -10.784 -3.429 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -1.730 -12.542 -5.352 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -1.652 -12.653 -3.605 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -4.320 -12.848 -5.049 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -3.283 -14.253 -4.899 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -3.224 -13.469 -2.310 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -4.756 -12.740 -2.748 1.00 0.00 H new ATOM 0 HE ARG A 108 -4.571 -15.503 -3.697 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -5.246 -13.483 -0.860 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -6.249 -14.708 -0.075 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -5.867 -17.088 -2.683 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -6.602 -16.756 -1.111 1.00 0.00 H new ATOM 1701 N PHE A 109 -0.585 -10.421 -3.296 1.00 0.00 N ATOM 1702 CA PHE A 109 0.655 -9.693 -3.092 1.00 0.00 C ATOM 1703 C PHE A 109 1.857 -10.640 -3.116 1.00 0.00 C ATOM 1704 O PHE A 109 1.771 -11.770 -2.638 1.00 0.00 O ATOM 1705 CB PHE A 109 0.567 -9.034 -1.714 1.00 0.00 C ATOM 1706 CG PHE A 109 -0.170 -7.694 -1.712 1.00 0.00 C ATOM 1707 CD1 PHE A 109 0.510 -6.544 -1.967 1.00 0.00 C ATOM 1708 CD2 PHE A 109 -1.504 -7.651 -1.454 1.00 0.00 C ATOM 1709 CE1 PHE A 109 -0.174 -5.299 -1.965 1.00 0.00 C ATOM 1710 CE2 PHE A 109 -2.188 -6.407 -1.451 1.00 0.00 C ATOM 1711 CZ PHE A 109 -1.508 -5.257 -1.707 1.00 0.00 C ATOM 0 H PHE A 109 -0.721 -11.215 -2.670 1.00 0.00 H new ATOM 0 HA PHE A 109 0.789 -8.958 -3.886 1.00 0.00 H new ATOM 0 HB2 PHE A 109 0.063 -9.715 -1.028 1.00 0.00 H new ATOM 0 HB3 PHE A 109 1.576 -8.883 -1.330 1.00 0.00 H new ATOM 0 HD1 PHE A 109 1.570 -6.577 -2.171 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -2.044 -8.564 -1.251 1.00 0.00 H new ATOM 0 HE1 PHE A 109 0.366 -4.386 -2.168 1.00 0.00 H new ATOM 0 HE2 PHE A 109 -3.248 -6.374 -1.246 1.00 0.00 H new ATOM 0 HZ PHE A 109 -2.028 -4.310 -1.705 1.00 0.00 H new ATOM 1721 N THR A 110 2.950 -10.144 -3.677 1.00 0.00 N ATOM 1722 CA THR A 110 4.168 -10.931 -3.769 1.00 0.00 C ATOM 1723 C THR A 110 5.370 -10.110 -3.300 1.00 0.00 C ATOM 1724 O THR A 110 5.340 -8.881 -3.337 1.00 0.00 O ATOM 1725 CB THR A 110 4.298 -11.433 -5.208 1.00 0.00 C ATOM 1726 OG1 THR A 110 3.094 -12.161 -5.433 1.00 0.00 O ATOM 1727 CG2 THR A 110 5.402 -12.481 -5.365 1.00 0.00 C ATOM 0 H THR A 110 3.018 -9.206 -4.073 1.00 0.00 H new ATOM 0 HA THR A 110 4.130 -11.798 -3.109 1.00 0.00 H new ATOM 0 HB THR A 110 4.501 -10.590 -5.869 1.00 0.00 H new ATOM 0 HG1 THR A 110 3.095 -12.521 -6.345 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.452 -12.804 -6.405 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.359 -12.048 -5.073 1.00 0.00 H new ATOM 0 HG23 THR A 110 5.183 -13.339 -4.729 1.00 0.00 H new ATOM 1735 N GLN A 111 6.401 -10.823 -2.869 1.00 0.00 N ATOM 1736 CA GLN A 111 7.612 -10.176 -2.393 1.00 0.00 C ATOM 1737 C GLN A 111 8.615 -10.018 -3.538 1.00 0.00 C ATOM 1738 O GLN A 111 8.577 -10.773 -4.509 1.00 0.00 O ATOM 1739 CB GLN A 111 8.228 -10.953 -1.228 1.00 0.00 C ATOM 1740 CG GLN A 111 9.701 -10.585 -1.041 1.00 0.00 C ATOM 1741 CD GLN A 111 10.263 -11.207 0.239 1.00 0.00 C ATOM 1742 OE1 GLN A 111 10.096 -12.384 0.513 1.00 0.00 O ATOM 1743 NE2 GLN A 111 10.937 -10.353 1.005 1.00 0.00 N ATOM 0 H GLN A 111 6.422 -11.842 -2.840 1.00 0.00 H new ATOM 0 HA GLN A 111 7.350 -9.184 -2.026 1.00 0.00 H new ATOM 0 HB2 GLN A 111 7.677 -10.739 -0.312 1.00 0.00 H new ATOM 0 HB3 GLN A 111 8.138 -12.024 -1.412 1.00 0.00 H new ATOM 0 HG2 GLN A 111 10.277 -10.929 -1.900 1.00 0.00 H new ATOM 0 HG3 GLN A 111 9.806 -9.501 -0.999 1.00 0.00 H new ATOM 0 HE21 GLN A 111 11.039 -9.380 0.716 1.00 0.00 H new ATOM 0 HE22 GLN A 111 11.351 -10.671 1.881 1.00 0.00 H new ATOM 1752 N ILE A 112 9.487 -9.033 -3.386 1.00 0.00 N ATOM 1753 CA ILE A 112 10.499 -8.767 -4.396 1.00 0.00 C ATOM 1754 C ILE A 112 11.822 -9.403 -3.965 1.00 0.00 C ATOM 1755 O ILE A 112 12.163 -9.395 -2.783 1.00 0.00 O ATOM 1756 CB ILE A 112 10.598 -7.266 -4.671 1.00 0.00 C ATOM 1757 CG1 ILE A 112 9.255 -6.573 -4.431 1.00 0.00 C ATOM 1758 CG2 ILE A 112 11.135 -7.001 -6.079 1.00 0.00 C ATOM 1759 CD1 ILE A 112 8.225 -6.995 -5.480 1.00 0.00 C ATOM 0 H ILE A 112 9.515 -8.409 -2.580 1.00 0.00 H new ATOM 0 HA ILE A 112 10.220 -9.224 -5.346 1.00 0.00 H new ATOM 0 HB ILE A 112 11.311 -6.837 -3.967 1.00 0.00 H new ATOM 0 HG12 ILE A 112 8.887 -6.820 -3.435 1.00 0.00 H new ATOM 0 HG13 ILE A 112 9.389 -5.492 -4.462 1.00 0.00 H new ATOM 0 HG21 ILE A 112 11.196 -5.926 -6.249 1.00 0.00 H new ATOM 0 HG22 ILE A 112 12.127 -7.441 -6.179 1.00 0.00 H new ATOM 0 HG23 ILE A 112 10.465 -7.447 -6.814 1.00 0.00 H new ATOM 0 HD11 ILE A 112 7.280 -6.488 -5.286 1.00 0.00 H new ATOM 0 HD12 ILE A 112 8.585 -6.725 -6.473 1.00 0.00 H new ATOM 0 HD13 ILE A 112 8.075 -8.073 -5.430 1.00 0.00 H new ATOM 1771 N PRO A 113 12.551 -9.952 -4.974 1.00 0.00 N ATOM 1772 CA PRO A 113 13.829 -10.591 -4.711 1.00 0.00 C ATOM 1773 C PRO A 113 14.918 -9.549 -4.446 1.00 0.00 C ATOM 1774 O PRO A 113 16.051 -9.900 -4.119 1.00 0.00 O ATOM 1775 CB PRO A 113 14.106 -11.438 -5.942 1.00 0.00 C ATOM 1776 CG PRO A 113 13.209 -10.886 -7.038 1.00 0.00 C ATOM 1777 CD PRO A 113 12.178 -9.980 -6.385 1.00 0.00 C ATOM 0 HA PRO A 113 13.813 -11.209 -3.813 1.00 0.00 H new ATOM 0 HB2 PRO A 113 15.156 -11.378 -6.229 1.00 0.00 H new ATOM 0 HB3 PRO A 113 13.887 -12.489 -5.751 1.00 0.00 H new ATOM 0 HG2 PRO A 113 13.797 -10.331 -7.769 1.00 0.00 H new ATOM 0 HG3 PRO A 113 12.718 -11.698 -7.575 1.00 0.00 H new ATOM 0 HD2 PRO A 113 12.197 -8.981 -6.820 1.00 0.00 H new ATOM 0 HD3 PRO A 113 11.168 -10.367 -6.520 1.00 0.00 H new ATOM 1785 N ALA A 114 14.536 -8.289 -4.595 1.00 0.00 N ATOM 1786 CA ALA A 114 15.466 -7.194 -4.376 1.00 0.00 C ATOM 1787 C ALA A 114 15.076 -6.449 -3.098 1.00 0.00 C ATOM 1788 O ALA A 114 13.909 -6.443 -2.710 1.00 0.00 O ATOM 1789 CB ALA A 114 15.478 -6.281 -5.603 1.00 0.00 C ATOM 0 H ALA A 114 13.595 -8.002 -4.865 1.00 0.00 H new ATOM 0 HA ALA A 114 16.480 -7.572 -4.242 1.00 0.00 H new ATOM 0 HB1 ALA A 114 16.176 -5.460 -5.439 1.00 0.00 H new ATOM 0 HB2 ALA A 114 15.789 -6.852 -6.478 1.00 0.00 H new ATOM 0 HB3 ALA A 114 14.478 -5.880 -5.768 1.00 0.00 H new ATOM 1795 N LYS A 115 16.076 -5.838 -2.479 1.00 0.00 N ATOM 1796 CA LYS A 115 15.852 -5.091 -1.252 1.00 0.00 C ATOM 1797 C LYS A 115 15.846 -3.594 -1.566 1.00 0.00 C ATOM 1798 O LYS A 115 15.731 -2.767 -0.663 1.00 0.00 O ATOM 1799 CB LYS A 115 16.874 -5.492 -0.187 1.00 0.00 C ATOM 1800 CG LYS A 115 16.221 -6.336 0.910 1.00 0.00 C ATOM 1801 CD LYS A 115 16.446 -7.829 0.660 1.00 0.00 C ATOM 1802 CE LYS A 115 15.191 -8.637 0.997 1.00 0.00 C ATOM 1803 NZ LYS A 115 15.353 -10.046 0.575 1.00 0.00 N ATOM 0 H LYS A 115 17.043 -5.845 -2.804 1.00 0.00 H new ATOM 0 HA LYS A 115 14.876 -5.333 -0.831 1.00 0.00 H new ATOM 0 HB2 LYS A 115 17.685 -6.055 -0.650 1.00 0.00 H new ATOM 0 HB3 LYS A 115 17.317 -4.598 0.252 1.00 0.00 H new ATOM 0 HG2 LYS A 115 16.634 -6.060 1.880 1.00 0.00 H new ATOM 0 HG3 LYS A 115 15.152 -6.127 0.947 1.00 0.00 H new ATOM 0 HD2 LYS A 115 16.717 -7.990 -0.383 1.00 0.00 H new ATOM 0 HD3 LYS A 115 17.282 -8.181 1.264 1.00 0.00 H new ATOM 0 HE2 LYS A 115 14.999 -8.592 2.069 1.00 0.00 H new ATOM 0 HE3 LYS A 115 14.325 -8.200 0.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 14.492 -10.580 0.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 15.514 -10.085 -0.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 16.167 -10.465 1.069 1.00 0.00 H new ATOM 1817 N THR A 116 15.972 -3.290 -2.850 1.00 0.00 N ATOM 1818 CA THR A 116 15.983 -1.907 -3.294 1.00 0.00 C ATOM 1819 C THR A 116 14.668 -1.563 -3.997 1.00 0.00 C ATOM 1820 O THR A 116 13.875 -2.450 -4.307 1.00 0.00 O ATOM 1821 CB THR A 116 17.216 -1.704 -4.177 1.00 0.00 C ATOM 1822 OG1 THR A 116 18.308 -2.072 -3.339 1.00 0.00 O ATOM 1823 CG2 THR A 116 17.471 -0.229 -4.496 1.00 0.00 C ATOM 0 H THR A 116 16.067 -3.978 -3.597 1.00 0.00 H new ATOM 0 HA THR A 116 16.053 -1.220 -2.450 1.00 0.00 H new ATOM 0 HB THR A 116 17.092 -2.260 -5.106 1.00 0.00 H new ATOM 0 HG1 THR A 116 19.148 -1.972 -3.834 1.00 0.00 H new ATOM 0 HG21 THR A 116 18.357 -0.141 -5.125 1.00 0.00 H new ATOM 0 HG22 THR A 116 16.610 0.184 -5.022 1.00 0.00 H new ATOM 0 HG23 THR A 116 17.628 0.322 -3.569 1.00 0.00 H new ATOM 1831 N MET A 117 14.479 -0.272 -4.228 1.00 0.00 N ATOM 1832 CA MET A 117 13.274 0.201 -4.889 1.00 0.00 C ATOM 1833 C MET A 117 13.240 -0.245 -6.352 1.00 0.00 C ATOM 1834 O MET A 117 14.283 -0.503 -6.951 1.00 0.00 O ATOM 1835 CB MET A 117 13.219 1.729 -4.820 1.00 0.00 C ATOM 1836 CG MET A 117 12.382 2.194 -3.626 1.00 0.00 C ATOM 1837 SD MET A 117 13.023 1.486 -2.118 1.00 0.00 S ATOM 1838 CE MET A 117 11.591 0.572 -1.571 1.00 0.00 C ATOM 0 H MET A 117 15.140 0.461 -3.969 1.00 0.00 H new ATOM 0 HA MET A 117 12.411 -0.226 -4.378 1.00 0.00 H new ATOM 0 HB2 MET A 117 14.229 2.130 -4.738 1.00 0.00 H new ATOM 0 HB3 MET A 117 12.793 2.123 -5.743 1.00 0.00 H new ATOM 0 HG2 MET A 117 12.398 3.282 -3.562 1.00 0.00 H new ATOM 0 HG3 MET A 117 11.342 1.898 -3.763 1.00 0.00 H new ATOM 0 HE1 MET A 117 11.911 -0.294 -0.991 1.00 0.00 H new ATOM 0 HE2 MET A 117 10.965 1.213 -0.950 1.00 0.00 H new ATOM 0 HE3 MET A 117 11.020 0.237 -2.437 1.00 0.00 H new ATOM 1848 N SER A 118 12.030 -0.323 -6.886 1.00 0.00 N ATOM 1849 CA SER A 118 11.846 -0.734 -8.267 1.00 0.00 C ATOM 1850 C SER A 118 10.367 -0.640 -8.649 1.00 0.00 C ATOM 1851 O SER A 118 9.493 -0.764 -7.793 1.00 0.00 O ATOM 1852 CB SER A 118 12.363 -2.156 -8.493 1.00 0.00 C ATOM 1853 OG SER A 118 12.804 -2.358 -9.833 1.00 0.00 O ATOM 0 H SER A 118 11.167 -0.108 -6.387 1.00 0.00 H new ATOM 0 HA SER A 118 12.422 -0.062 -8.903 1.00 0.00 H new ATOM 0 HB2 SER A 118 13.186 -2.356 -7.807 1.00 0.00 H new ATOM 0 HB3 SER A 118 11.573 -2.870 -8.260 1.00 0.00 H new ATOM 0 HG SER A 118 13.128 -3.277 -9.936 1.00 0.00 H new ATOM 1859 N MET A 119 10.133 -0.422 -9.935 1.00 0.00 N ATOM 1860 CA MET A 119 8.776 -0.310 -10.440 1.00 0.00 C ATOM 1861 C MET A 119 7.995 -1.605 -10.204 1.00 0.00 C ATOM 1862 O MET A 119 6.773 -1.631 -10.346 1.00 0.00 O ATOM 1863 CB MET A 119 8.812 -0.002 -11.938 1.00 0.00 C ATOM 1864 CG MET A 119 9.564 1.302 -12.212 1.00 0.00 C ATOM 1865 SD MET A 119 8.408 2.599 -12.618 1.00 0.00 S ATOM 1866 CE MET A 119 7.894 3.081 -10.979 1.00 0.00 C ATOM 0 H MET A 119 10.861 -0.320 -10.642 1.00 0.00 H new ATOM 0 HA MET A 119 8.275 0.498 -9.906 1.00 0.00 H new ATOM 0 HB2 MET A 119 9.294 -0.822 -12.470 1.00 0.00 H new ATOM 0 HB3 MET A 119 7.795 0.073 -12.322 1.00 0.00 H new ATOM 0 HG2 MET A 119 10.148 1.585 -11.337 1.00 0.00 H new ATOM 0 HG3 MET A 119 10.267 1.160 -13.033 1.00 0.00 H new ATOM 0 HE1 MET A 119 7.415 4.059 -11.021 1.00 0.00 H new ATOM 0 HE2 MET A 119 7.188 2.348 -10.589 1.00 0.00 H new ATOM 0 HE3 MET A 119 8.764 3.131 -10.325 1.00 0.00 H new ATOM 1876 N SER A 120 8.731 -2.646 -9.846 1.00 0.00 N ATOM 1877 CA SER A 120 8.123 -3.940 -9.588 1.00 0.00 C ATOM 1878 C SER A 120 7.768 -4.066 -8.106 1.00 0.00 C ATOM 1879 O SER A 120 7.706 -5.171 -7.570 1.00 0.00 O ATOM 1880 CB SER A 120 9.053 -5.080 -10.010 1.00 0.00 C ATOM 1881 OG SER A 120 8.950 -5.366 -11.402 1.00 0.00 O ATOM 0 H SER A 120 9.744 -2.620 -9.728 1.00 0.00 H new ATOM 0 HA SER A 120 7.211 -4.013 -10.181 1.00 0.00 H new ATOM 0 HB2 SER A 120 10.083 -4.816 -9.770 1.00 0.00 H new ATOM 0 HB3 SER A 120 8.812 -5.975 -9.437 1.00 0.00 H new ATOM 0 HG SER A 120 9.560 -6.098 -11.632 1.00 0.00 H new ATOM 1887 N VAL A 121 7.544 -2.917 -7.484 1.00 0.00 N ATOM 1888 CA VAL A 121 7.197 -2.884 -6.074 1.00 0.00 C ATOM 1889 C VAL A 121 5.876 -2.134 -5.895 1.00 0.00 C ATOM 1890 O VAL A 121 5.640 -1.121 -6.551 1.00 0.00 O ATOM 1891 CB VAL A 121 8.345 -2.274 -5.266 1.00 0.00 C ATOM 1892 CG1 VAL A 121 7.954 -2.110 -3.796 1.00 0.00 C ATOM 1893 CG2 VAL A 121 9.618 -3.110 -5.405 1.00 0.00 C ATOM 0 H VAL A 121 7.596 -2.002 -7.932 1.00 0.00 H new ATOM 0 HA VAL A 121 7.051 -3.895 -5.694 1.00 0.00 H new ATOM 0 HB VAL A 121 8.550 -1.283 -5.671 1.00 0.00 H new ATOM 0 HG11 VAL A 121 8.787 -1.675 -3.244 1.00 0.00 H new ATOM 0 HG12 VAL A 121 7.087 -1.454 -3.721 1.00 0.00 H new ATOM 0 HG13 VAL A 121 7.709 -3.085 -3.374 1.00 0.00 H new ATOM 0 HG21 VAL A 121 10.418 -2.655 -4.821 1.00 0.00 H new ATOM 0 HG22 VAL A 121 9.432 -4.120 -5.040 1.00 0.00 H new ATOM 0 HG23 VAL A 121 9.913 -3.152 -6.454 1.00 0.00 H new ATOM 1903 N ASP A 122 5.049 -2.661 -5.004 1.00 0.00 N ATOM 1904 CA ASP A 122 3.757 -2.054 -4.731 1.00 0.00 C ATOM 1905 C ASP A 122 3.470 -2.129 -3.230 1.00 0.00 C ATOM 1906 O ASP A 122 2.334 -1.935 -2.801 1.00 0.00 O ATOM 1907 CB ASP A 122 2.635 -2.793 -5.464 1.00 0.00 C ATOM 1908 CG ASP A 122 2.549 -2.511 -6.966 1.00 0.00 C ATOM 1909 OD1 ASP A 122 3.410 -3.049 -7.695 1.00 0.00 O ATOM 1910 OD2 ASP A 122 1.624 -1.763 -7.350 1.00 0.00 O ATOM 0 H ASP A 122 5.248 -3.502 -4.462 1.00 0.00 H new ATOM 0 HA ASP A 122 3.792 -1.020 -5.073 1.00 0.00 H new ATOM 0 HB2 ASP A 122 2.770 -3.865 -5.318 1.00 0.00 H new ATOM 0 HB3 ASP A 122 1.683 -2.526 -5.004 1.00 0.00 H new ATOM 1915 N ALA A 123 4.520 -2.411 -2.473 1.00 0.00 N ATOM 1916 CA ALA A 123 4.395 -2.514 -1.029 1.00 0.00 C ATOM 1917 C ALA A 123 5.790 -2.537 -0.401 1.00 0.00 C ATOM 1918 O ALA A 123 6.749 -2.988 -1.026 1.00 0.00 O ATOM 1919 CB ALA A 123 3.576 -3.757 -0.674 1.00 0.00 C ATOM 0 H ALA A 123 5.461 -2.571 -2.832 1.00 0.00 H new ATOM 0 HA ALA A 123 3.866 -1.650 -0.627 1.00 0.00 H new ATOM 0 HB1 ALA A 123 3.482 -3.834 0.409 1.00 0.00 H new ATOM 0 HB2 ALA A 123 2.584 -3.679 -1.119 1.00 0.00 H new ATOM 0 HB3 ALA A 123 4.077 -4.645 -1.059 1.00 0.00 H new ATOM 1925 N PHE A 124 5.860 -2.044 0.827 1.00 0.00 N ATOM 1926 CA PHE A 124 7.121 -2.002 1.546 1.00 0.00 C ATOM 1927 C PHE A 124 6.890 -1.834 3.049 1.00 0.00 C ATOM 1928 O PHE A 124 5.894 -1.245 3.466 1.00 0.00 O ATOM 1929 CB PHE A 124 7.895 -0.791 1.022 1.00 0.00 C ATOM 1930 CG PHE A 124 7.420 0.546 1.595 1.00 0.00 C ATOM 1931 CD1 PHE A 124 6.108 0.894 1.512 1.00 0.00 C ATOM 1932 CD2 PHE A 124 8.310 1.386 2.187 1.00 0.00 C ATOM 1933 CE1 PHE A 124 5.667 2.135 2.043 1.00 0.00 C ATOM 1934 CE2 PHE A 124 7.870 2.627 2.719 1.00 0.00 C ATOM 1935 CZ PHE A 124 6.558 2.975 2.636 1.00 0.00 C ATOM 0 H PHE A 124 5.063 -1.670 1.342 1.00 0.00 H new ATOM 0 HA PHE A 124 7.668 -2.932 1.392 1.00 0.00 H new ATOM 0 HB2 PHE A 124 8.952 -0.920 1.255 1.00 0.00 H new ATOM 0 HB3 PHE A 124 7.809 -0.760 -0.064 1.00 0.00 H new ATOM 0 HD1 PHE A 124 5.401 0.226 1.042 1.00 0.00 H new ATOM 0 HD2 PHE A 124 9.352 1.109 2.253 1.00 0.00 H new ATOM 0 HE1 PHE A 124 4.625 2.412 1.976 1.00 0.00 H new ATOM 0 HE2 PHE A 124 8.577 3.294 3.189 1.00 0.00 H new ATOM 0 HZ PHE A 124 6.223 3.919 3.041 1.00 0.00 H new ATOM 1945 N THR A 125 7.828 -2.361 3.823 1.00 0.00 N ATOM 1946 CA THR A 125 7.739 -2.277 5.270 1.00 0.00 C ATOM 1947 C THR A 125 9.068 -1.800 5.859 1.00 0.00 C ATOM 1948 O THR A 125 10.127 -2.326 5.519 1.00 0.00 O ATOM 1949 CB THR A 125 7.296 -3.643 5.798 1.00 0.00 C ATOM 1950 OG1 THR A 125 8.240 -4.553 5.240 1.00 0.00 O ATOM 1951 CG2 THR A 125 5.956 -4.090 5.211 1.00 0.00 C ATOM 0 H THR A 125 8.654 -2.848 3.474 1.00 0.00 H new ATOM 0 HA THR A 125 6.999 -1.539 5.578 1.00 0.00 H new ATOM 0 HB THR A 125 7.222 -3.606 6.885 1.00 0.00 H new ATOM 0 HG1 THR A 125 9.126 -4.135 5.223 1.00 0.00 H new ATOM 0 HG21 THR A 125 5.688 -5.065 5.618 1.00 0.00 H new ATOM 0 HG22 THR A 125 5.185 -3.364 5.470 1.00 0.00 H new ATOM 0 HG23 THR A 125 6.039 -4.160 4.126 1.00 0.00 H new ATOM 1959 N ILE A 126 8.970 -0.809 6.733 1.00 0.00 N ATOM 1960 CA ILE A 126 10.151 -0.255 7.373 1.00 0.00 C ATOM 1961 C ILE A 126 10.542 -1.134 8.562 1.00 0.00 C ATOM 1962 O ILE A 126 9.727 -1.911 9.058 1.00 0.00 O ATOM 1963 CB ILE A 126 9.923 1.212 7.741 1.00 0.00 C ATOM 1964 CG1 ILE A 126 8.730 1.361 8.687 1.00 0.00 C ATOM 1965 CG2 ILE A 126 9.771 2.076 6.487 1.00 0.00 C ATOM 1966 CD1 ILE A 126 8.760 2.714 9.400 1.00 0.00 C ATOM 0 H ILE A 126 8.090 -0.375 7.013 1.00 0.00 H new ATOM 0 HA ILE A 126 10.995 -0.259 6.683 1.00 0.00 H new ATOM 0 HB ILE A 126 10.804 1.570 8.274 1.00 0.00 H new ATOM 0 HG12 ILE A 126 7.801 1.263 8.125 1.00 0.00 H new ATOM 0 HG13 ILE A 126 8.743 0.558 9.424 1.00 0.00 H new ATOM 0 HG21 ILE A 126 9.610 3.114 6.778 1.00 0.00 H new ATOM 0 HG22 ILE A 126 10.676 2.004 5.884 1.00 0.00 H new ATOM 0 HG23 ILE A 126 8.918 1.726 5.905 1.00 0.00 H new ATOM 0 HD11 ILE A 126 7.901 2.793 10.066 1.00 0.00 H new ATOM 0 HD12 ILE A 126 9.678 2.799 9.981 1.00 0.00 H new ATOM 0 HD13 ILE A 126 8.722 3.515 8.662 1.00 0.00 H new ATOM 1978 N GLN A 127 11.788 -0.983 8.985 1.00 0.00 N ATOM 1979 CA GLN A 127 12.296 -1.753 10.108 1.00 0.00 C ATOM 1980 C GLN A 127 11.316 -1.692 11.281 1.00 0.00 C ATOM 1981 O GLN A 127 10.286 -1.025 11.199 1.00 0.00 O ATOM 1982 CB GLN A 127 13.683 -1.263 10.526 1.00 0.00 C ATOM 1983 CG GLN A 127 14.779 -2.170 9.962 1.00 0.00 C ATOM 1984 CD GLN A 127 15.589 -2.817 11.087 1.00 0.00 C ATOM 1985 OE1 GLN A 127 16.754 -2.522 11.297 1.00 0.00 O ATOM 1986 NE2 GLN A 127 14.909 -3.714 11.796 1.00 0.00 N ATOM 0 H GLN A 127 12.461 -0.339 8.570 1.00 0.00 H new ATOM 0 HA GLN A 127 12.393 -2.793 9.796 1.00 0.00 H new ATOM 0 HB2 GLN A 127 13.833 -0.243 10.173 1.00 0.00 H new ATOM 0 HB3 GLN A 127 13.751 -1.238 11.614 1.00 0.00 H new ATOM 0 HG2 GLN A 127 14.330 -2.945 9.340 1.00 0.00 H new ATOM 0 HG3 GLN A 127 15.441 -1.590 9.320 1.00 0.00 H new ATOM 0 HE21 GLN A 127 13.935 -3.914 11.567 1.00 0.00 H new ATOM 0 HE22 GLN A 127 15.361 -4.202 12.569 1.00 0.00 H new ATOM 1995 N GLY A 128 11.671 -2.398 12.345 1.00 0.00 N ATOM 1996 CA GLY A 128 10.836 -2.432 13.533 1.00 0.00 C ATOM 1997 C GLY A 128 11.229 -1.323 14.511 1.00 0.00 C ATOM 1998 O GLY A 128 10.403 -0.484 14.868 1.00 0.00 O ATOM 0 H GLY A 128 12.526 -2.951 12.409 1.00 0.00 H new ATOM 0 HA2 GLY A 128 9.790 -2.318 13.250 1.00 0.00 H new ATOM 0 HA3 GLY A 128 10.930 -3.402 14.021 1.00 0.00 H new ATOM 2002 N HIS A 129 12.489 -1.356 14.918 1.00 0.00 N ATOM 2003 CA HIS A 129 13.002 -0.364 15.848 1.00 0.00 C ATOM 2004 C HIS A 129 12.400 1.005 15.522 1.00 0.00 C ATOM 2005 O HIS A 129 12.204 1.829 16.413 1.00 0.00 O ATOM 2006 CB HIS A 129 14.532 -0.355 15.845 1.00 0.00 C ATOM 2007 CG HIS A 129 15.142 -0.207 14.471 1.00 0.00 C ATOM 2008 ND1 HIS A 129 15.786 0.946 14.058 1.00 0.00 N ATOM 2009 CD2 HIS A 129 15.201 -1.078 13.423 1.00 0.00 C ATOM 2010 CE1 HIS A 129 16.208 0.766 12.815 1.00 0.00 C ATOM 2011 NE2 HIS A 129 15.844 -0.489 12.423 1.00 0.00 N ATOM 0 H HIS A 129 13.170 -2.054 14.621 1.00 0.00 H new ATOM 0 HA HIS A 129 12.701 -0.623 16.863 1.00 0.00 H new ATOM 0 HB2 HIS A 129 14.882 0.462 16.477 1.00 0.00 H new ATOM 0 HB3 HIS A 129 14.892 -1.281 16.293 1.00 0.00 H new ATOM 0 HD1 HIS A 129 15.914 1.791 14.615 1.00 0.00 H new ATOM 0 HD2 HIS A 129 14.793 -2.078 13.409 1.00 0.00 H new ATOM 0 HE1 HIS A 129 16.746 1.487 12.217 1.00 0.00 H new ATOM 2019 N LEU A 130 12.125 1.204 14.241 1.00 0.00 N ATOM 2020 CA LEU A 130 11.550 2.459 13.786 1.00 0.00 C ATOM 2021 C LEU A 130 10.219 2.695 14.503 1.00 0.00 C ATOM 2022 O LEU A 130 10.069 3.670 15.236 1.00 0.00 O ATOM 2023 CB LEU A 130 11.438 2.475 12.260 1.00 0.00 C ATOM 2024 CG LEU A 130 12.656 1.955 11.493 1.00 0.00 C ATOM 2025 CD1 LEU A 130 12.550 2.291 10.004 1.00 0.00 C ATOM 2026 CD2 LEU A 130 13.956 2.478 12.108 1.00 0.00 C ATOM 0 H LEU A 130 12.290 0.518 13.504 1.00 0.00 H new ATOM 0 HA LEU A 130 12.203 3.293 14.043 1.00 0.00 H new ATOM 0 HB2 LEU A 130 10.571 1.880 11.973 1.00 0.00 H new ATOM 0 HB3 LEU A 130 11.242 3.499 11.940 1.00 0.00 H new ATOM 0 HG LEU A 130 12.675 0.868 11.577 1.00 0.00 H new ATOM 0 HD11 LEU A 130 13.428 1.911 9.482 1.00 0.00 H new ATOM 0 HD12 LEU A 130 11.653 1.830 9.590 1.00 0.00 H new ATOM 0 HD13 LEU A 130 12.493 3.372 9.878 1.00 0.00 H new ATOM 0 HD21 LEU A 130 14.806 2.093 11.544 1.00 0.00 H new ATOM 0 HD22 LEU A 130 13.962 3.567 12.075 1.00 0.00 H new ATOM 0 HD23 LEU A 130 14.028 2.146 13.144 1.00 0.00 H new ATOM 2038 N TRP A 131 9.286 1.784 14.265 1.00 0.00 N ATOM 2039 CA TRP A 131 7.973 1.881 14.879 1.00 0.00 C ATOM 2040 C TRP A 131 8.167 2.134 16.375 1.00 0.00 C ATOM 2041 O TRP A 131 7.761 3.174 16.891 1.00 0.00 O ATOM 2042 CB TRP A 131 7.138 0.632 14.587 1.00 0.00 C ATOM 2043 CG TRP A 131 6.885 0.387 13.098 1.00 0.00 C ATOM 2044 CD1 TRP A 131 7.402 -0.576 12.321 1.00 0.00 C ATOM 2045 CD2 TRP A 131 6.027 1.159 12.232 1.00 0.00 C ATOM 2046 NE1 TRP A 131 6.941 -0.480 11.024 1.00 0.00 N ATOM 2047 CE2 TRP A 131 6.078 0.608 10.968 1.00 0.00 C ATOM 2048 CE3 TRP A 131 5.234 2.287 12.509 1.00 0.00 C ATOM 2049 CZ2 TRP A 131 5.359 1.117 9.880 1.00 0.00 C ATOM 2050 CZ3 TRP A 131 4.521 2.783 11.411 1.00 0.00 C ATOM 2051 CH2 TRP A 131 4.562 2.240 10.132 1.00 0.00 C ATOM 0 H TRP A 131 9.414 0.976 13.656 1.00 0.00 H new ATOM 0 HA TRP A 131 7.410 2.713 14.456 1.00 0.00 H new ATOM 0 HB2 TRP A 131 7.644 -0.237 15.007 1.00 0.00 H new ATOM 0 HB3 TRP A 131 6.179 0.721 15.098 1.00 0.00 H new ATOM 0 HD1 TRP A 131 8.092 -1.331 12.667 1.00 0.00 H new ATOM 0 HE1 TRP A 131 7.188 -1.095 10.249 1.00 0.00 H new ATOM 0 HE3 TRP A 131 5.179 2.735 13.490 1.00 0.00 H new ATOM 0 HZ2 TRP A 131 5.416 0.668 8.900 1.00 0.00 H new ATOM 0 HZ3 TRP A 131 3.895 3.649 11.569 1.00 0.00 H new ATOM 0 HH2 TRP A 131 3.981 2.683 9.336 1.00 0.00 H new ATOM 2062 N GLN A 132 8.789 1.164 17.030 1.00 0.00 N ATOM 2063 CA GLN A 132 9.043 1.269 18.457 1.00 0.00 C ATOM 2064 C GLN A 132 9.754 2.586 18.775 1.00 0.00 C ATOM 2065 O GLN A 132 10.337 3.210 17.890 1.00 0.00 O ATOM 2066 CB GLN A 132 9.855 0.073 18.959 1.00 0.00 C ATOM 2067 CG GLN A 132 8.935 -1.036 19.474 1.00 0.00 C ATOM 2068 CD GLN A 132 8.425 -0.716 20.881 1.00 0.00 C ATOM 2069 OE1 GLN A 132 7.491 0.046 21.071 1.00 0.00 O ATOM 2070 NE2 GLN A 132 9.087 -1.338 21.851 1.00 0.00 N ATOM 0 H GLN A 132 9.124 0.302 16.599 1.00 0.00 H new ATOM 0 HA GLN A 132 8.085 1.261 18.978 1.00 0.00 H new ATOM 0 HB2 GLN A 132 10.479 -0.312 18.152 1.00 0.00 H new ATOM 0 HB3 GLN A 132 10.526 0.393 19.756 1.00 0.00 H new ATOM 0 HG2 GLN A 132 8.090 -1.157 18.796 1.00 0.00 H new ATOM 0 HG3 GLN A 132 9.473 -1.984 19.485 1.00 0.00 H new ATOM 0 HE21 GLN A 132 9.860 -1.963 21.622 1.00 0.00 H new ATOM 0 HE22 GLN A 132 8.822 -1.190 22.825 1.00 0.00 H new ATOM 2079 N SER A 133 9.682 2.969 20.041 1.00 0.00 N ATOM 2080 CA SER A 133 10.311 4.201 20.487 1.00 0.00 C ATOM 2081 C SER A 133 11.826 4.007 20.590 1.00 0.00 C ATOM 2082 O SER A 133 12.306 2.878 20.668 1.00 0.00 O ATOM 2083 CB SER A 133 9.741 4.655 21.832 1.00 0.00 C ATOM 2084 OG SER A 133 9.447 6.050 21.843 1.00 0.00 O ATOM 0 H SER A 133 9.198 2.448 20.772 1.00 0.00 H new ATOM 0 HA SER A 133 10.100 4.979 19.753 1.00 0.00 H new ATOM 0 HB2 SER A 133 8.834 4.091 22.050 1.00 0.00 H new ATOM 0 HB3 SER A 133 10.455 4.429 22.624 1.00 0.00 H new ATOM 0 HG SER A 133 9.084 6.301 22.718 1.00 0.00 H new ATOM 2090 N LYS A 134 12.535 5.126 20.588 1.00 0.00 N ATOM 2091 CA LYS A 134 13.984 5.094 20.681 1.00 0.00 C ATOM 2092 C LYS A 134 14.558 4.463 19.411 1.00 0.00 C ATOM 2093 O LYS A 134 14.023 3.477 18.907 1.00 0.00 O ATOM 2094 CB LYS A 134 14.423 4.393 21.968 1.00 0.00 C ATOM 2095 CG LYS A 134 15.943 4.215 22.005 1.00 0.00 C ATOM 2096 CD LYS A 134 16.642 5.536 22.332 1.00 0.00 C ATOM 2097 CE LYS A 134 18.138 5.457 22.021 1.00 0.00 C ATOM 2098 NZ LYS A 134 18.880 4.918 23.183 1.00 0.00 N ATOM 0 H LYS A 134 12.132 6.061 20.523 1.00 0.00 H new ATOM 0 HA LYS A 134 14.384 6.106 20.744 1.00 0.00 H new ATOM 0 HB2 LYS A 134 14.100 4.975 22.831 1.00 0.00 H new ATOM 0 HB3 LYS A 134 13.937 3.420 22.040 1.00 0.00 H new ATOM 0 HG2 LYS A 134 16.207 3.465 22.751 1.00 0.00 H new ATOM 0 HG3 LYS A 134 16.293 3.843 21.042 1.00 0.00 H new ATOM 0 HD2 LYS A 134 16.189 6.343 21.756 1.00 0.00 H new ATOM 0 HD3 LYS A 134 16.498 5.777 23.385 1.00 0.00 H new ATOM 0 HE2 LYS A 134 18.302 4.822 21.151 1.00 0.00 H new ATOM 0 HE3 LYS A 134 18.516 6.448 21.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 19.894 4.871 22.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 18.738 5.540 24.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 18.530 3.964 23.406 1.00 0.00 H new ATOM 2112 N LYS A 135 15.641 5.057 18.930 1.00 0.00 N ATOM 2113 CA LYS A 135 16.293 4.565 17.729 1.00 0.00 C ATOM 2114 C LYS A 135 15.475 4.980 16.504 1.00 0.00 C ATOM 2115 O LYS A 135 14.248 5.034 16.561 1.00 0.00 O ATOM 2116 CB LYS A 135 16.531 3.057 17.827 1.00 0.00 C ATOM 2117 CG LYS A 135 18.027 2.736 17.808 1.00 0.00 C ATOM 2118 CD LYS A 135 18.297 1.427 17.063 1.00 0.00 C ATOM 2119 CE LYS A 135 19.797 1.227 16.832 1.00 0.00 C ATOM 2120 NZ LYS A 135 20.032 0.467 15.585 1.00 0.00 N ATOM 0 H LYS A 135 16.083 5.874 19.351 1.00 0.00 H new ATOM 0 HA LYS A 135 17.281 5.013 17.621 1.00 0.00 H new ATOM 0 HB2 LYS A 135 16.085 2.674 18.745 1.00 0.00 H new ATOM 0 HB3 LYS A 135 16.036 2.552 16.997 1.00 0.00 H new ATOM 0 HG2 LYS A 135 18.571 3.550 17.329 1.00 0.00 H new ATOM 0 HG3 LYS A 135 18.400 2.661 18.830 1.00 0.00 H new ATOM 0 HD2 LYS A 135 17.899 0.590 17.636 1.00 0.00 H new ATOM 0 HD3 LYS A 135 17.776 1.435 16.106 1.00 0.00 H new ATOM 0 HE2 LYS A 135 20.294 2.195 16.774 1.00 0.00 H new ATOM 0 HE3 LYS A 135 20.233 0.695 17.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 21.054 0.340 15.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 19.574 -0.464 15.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 19.633 0.990 14.779 1.00 0.00 H new ATOM 2134 N SER A 136 16.189 5.262 15.423 1.00 0.00 N ATOM 2135 CA SER A 136 15.545 5.670 14.186 1.00 0.00 C ATOM 2136 C SER A 136 16.519 5.524 13.016 1.00 0.00 C ATOM 2137 O SER A 136 16.212 4.859 12.028 1.00 0.00 O ATOM 2138 CB SER A 136 15.038 7.111 14.278 1.00 0.00 C ATOM 2139 OG SER A 136 13.795 7.197 14.969 1.00 0.00 O ATOM 0 H SER A 136 17.207 5.216 15.379 1.00 0.00 H new ATOM 0 HA SER A 136 14.686 5.021 14.018 1.00 0.00 H new ATOM 0 HB2 SER A 136 15.780 7.724 14.789 1.00 0.00 H new ATOM 0 HB3 SER A 136 14.924 7.520 13.274 1.00 0.00 H new ATOM 0 HG SER A 136 13.694 6.421 15.559 1.00 0.00 H new ATOM 2145 N GLY A 137 17.674 6.155 13.166 1.00 0.00 N ATOM 2146 CA GLY A 137 18.695 6.104 12.134 1.00 0.00 C ATOM 2147 C GLY A 137 19.152 7.511 11.744 1.00 0.00 C ATOM 2148 O GLY A 137 18.484 8.494 12.061 1.00 0.00 O ATOM 0 H GLY A 137 17.925 6.705 13.988 1.00 0.00 H new ATOM 0 HA2 GLY A 137 19.548 5.526 12.490 1.00 0.00 H new ATOM 0 HA3 GLY A 137 18.305 5.588 11.257 1.00 0.00 H new ATOM 2152 N PRO A 138 20.316 7.564 11.043 1.00 0.00 N ATOM 2153 CA PRO A 138 20.870 8.834 10.606 1.00 0.00 C ATOM 2154 C PRO A 138 20.088 9.392 9.416 1.00 0.00 C ATOM 2155 O PRO A 138 19.249 8.701 8.840 1.00 0.00 O ATOM 2156 CB PRO A 138 22.324 8.537 10.276 1.00 0.00 C ATOM 2157 CG PRO A 138 22.410 7.030 10.095 1.00 0.00 C ATOM 2158 CD PRO A 138 21.134 6.420 10.650 1.00 0.00 C ATOM 0 HA PRO A 138 20.800 9.609 11.369 1.00 0.00 H new ATOM 0 HB2 PRO A 138 22.633 9.058 9.370 1.00 0.00 H new ATOM 0 HB3 PRO A 138 22.983 8.873 11.077 1.00 0.00 H new ATOM 0 HG2 PRO A 138 22.526 6.778 9.041 1.00 0.00 H new ATOM 0 HG3 PRO A 138 23.281 6.632 10.616 1.00 0.00 H new ATOM 0 HD2 PRO A 138 20.628 5.810 9.901 1.00 0.00 H new ATOM 0 HD3 PRO A 138 21.343 5.772 11.501 1.00 0.00 H new ATOM 2166 N SER A 139 20.392 10.638 9.081 1.00 0.00 N ATOM 2167 CA SER A 139 19.728 11.297 7.969 1.00 0.00 C ATOM 2168 C SER A 139 20.766 11.935 7.044 1.00 0.00 C ATOM 2169 O SER A 139 21.781 12.453 7.507 1.00 0.00 O ATOM 2170 CB SER A 139 18.740 12.354 8.466 1.00 0.00 C ATOM 2171 OG SER A 139 17.699 11.783 9.254 1.00 0.00 O ATOM 0 H SER A 139 21.089 11.208 9.560 1.00 0.00 H new ATOM 0 HA SER A 139 19.167 10.547 7.412 1.00 0.00 H new ATOM 0 HB2 SER A 139 19.273 13.100 9.055 1.00 0.00 H new ATOM 0 HB3 SER A 139 18.305 12.874 7.612 1.00 0.00 H new ATOM 0 HG SER A 139 17.090 12.490 9.554 1.00 0.00 H new ATOM 2177 N SER A 140 20.476 11.876 5.752 1.00 0.00 N ATOM 2178 CA SER A 140 21.372 12.441 4.757 1.00 0.00 C ATOM 2179 C SER A 140 20.567 12.965 3.566 1.00 0.00 C ATOM 2180 O SER A 140 19.563 12.369 3.181 1.00 0.00 O ATOM 2181 CB SER A 140 22.399 11.408 4.291 1.00 0.00 C ATOM 2182 OG SER A 140 21.808 10.396 3.479 1.00 0.00 O ATOM 0 H SER A 140 19.633 11.446 5.371 1.00 0.00 H new ATOM 0 HA SER A 140 21.913 13.269 5.214 1.00 0.00 H new ATOM 0 HB2 SER A 140 23.188 11.909 3.729 1.00 0.00 H new ATOM 0 HB3 SER A 140 22.869 10.947 5.160 1.00 0.00 H new ATOM 0 HG SER A 140 22.496 9.757 3.200 1.00 0.00 H new ATOM 2188 N GLY A 141 21.039 14.074 3.016 1.00 0.00 N ATOM 2189 CA GLY A 141 20.376 14.685 1.877 1.00 0.00 C ATOM 2190 C GLY A 141 21.143 15.917 1.392 1.00 0.00 C ATOM 2191 O GLY A 141 20.544 16.952 1.103 1.00 0.00 O ATOM 0 H GLY A 141 21.873 14.565 3.338 1.00 0.00 H new ATOM 0 HA2 GLY A 141 20.295 13.960 1.067 1.00 0.00 H new ATOM 0 HA3 GLY A 141 19.360 14.970 2.152 1.00 0.00 H new TER 2195 GLY A 141