USER MOD reduce.3.24.130724 H: found=0, std=0, add=963, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 961 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 73 THR OG1 : rot 87:sc= -0.726 USER MOD Set 1.2: A 92 HIS : no HD1:sc= 0.0274 K(o=-0.7,f=-2.9!) USER MOD Set 2.1: A 63 ASN : amide:sc= -6.13! K(o=-6.2!,f=-2.1) USER MOD Set 2.2: A 65 LYS NZ :NH3+ 133:sc= -0.054 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= -5.25! C(o=-5.2!,f=-7.3!) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 24 HIS : no HD1:sc= -3.52! C(o=-3.5!,f=-3.7!) USER MOD Single : A 27 MET CE :methyl -171:sc= -1.3 (180deg=-1.52) USER MOD Single : A 28 THR OG1 : rot -79:sc= 0.233 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= -0.0861 X(o=-0.086,f=0) USER MOD Single : A 34 CYS SG : rot -140:sc= 0 USER MOD Single : A 40 SER OG : rot -53:sc= 0.00139 USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 45 THR OG1 : rot -160:sc= -0.297 USER MOD Single : A 46 GLN : amide:sc= 0.514 K(o=0.51,f=-0.74) USER MOD Single : A 47 LYS NZ :NH3+ 159:sc= -0.448 (180deg=-1.03) USER MOD Single : A 54 ASN : amide:sc= -3.13! C(o=-3.1!,f=-10!) USER MOD Single : A 56 THR OG1 : rot 60:sc= 0.899 USER MOD Single : A 58 GLN : amide:sc= -3.43! C(o=-3.4!,f=-5.1!) USER MOD Single : A 67 GLN : amide:sc= -2.87! K(o=-2.9!,f=-3.6) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0.00607 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 GLN : amide:sc= -6.85! C(o=-6.8!,f=-4.4!) USER MOD Single : A 81 TYR OH : rot -109:sc= 0.102 USER MOD Single : A 82 ASN : amide:sc= -11.1! C(o=-11!,f=-26!) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 HIS : no HD1:sc= -1.44 K(o=-1.4,f=-0.37) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 HIS : no HD1:sc= -4.44! K(o=-4.4!,f=-2.4) USER MOD Single : A 102 ASN : amide:sc= -3.95! C(o=-3.9!,f=-6.8!) USER MOD Single : A 106 TYR OH : rot -84:sc= 0.00595 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 THR OG1 : rot 138:sc= -0.801 USER MOD Single : A 115 LYS NZ :NH3+ -155:sc= -0.049 (180deg=-0.875) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= -0.101 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc=-0.00238 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -14.202 12.797 -1.090 1.00 0.00 N ATOM 2 CA GLY A 1 -14.102 11.924 -2.245 1.00 0.00 C ATOM 3 C GLY A 1 -15.433 11.305 -2.621 1.00 0.00 C ATOM 4 O GLY A 1 -15.857 10.317 -2.022 1.00 0.00 O ATOM 0 H1 GLY A 1 -13.266 13.195 -0.874 1.00 0.00 H new ATOM 0 H2 GLY A 1 -14.868 13.569 -1.295 1.00 0.00 H new ATOM 0 H3 GLY A 1 -14.544 12.253 -0.272 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -13.716 12.491 -3.092 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -13.382 11.132 -2.037 1.00 0.00 H new ATOM 8 N SER A 2 -16.095 11.889 -3.615 1.00 0.00 N ATOM 9 CA SER A 2 -17.389 11.391 -4.067 1.00 0.00 C ATOM 10 C SER A 2 -17.222 10.429 -5.239 1.00 0.00 C ATOM 11 O SER A 2 -16.192 10.426 -5.913 1.00 0.00 O ATOM 12 CB SER A 2 -18.293 12.557 -4.474 1.00 0.00 C ATOM 13 OG SER A 2 -18.943 13.117 -3.346 1.00 0.00 O ATOM 0 H SER A 2 -15.757 12.707 -4.122 1.00 0.00 H new ATOM 0 HA SER A 2 -17.852 10.852 -3.241 1.00 0.00 H new ATOM 0 HB2 SER A 2 -17.700 13.323 -4.974 1.00 0.00 H new ATOM 0 HB3 SER A 2 -19.037 12.211 -5.192 1.00 0.00 H new ATOM 0 HG SER A 2 -19.513 13.861 -3.633 1.00 0.00 H new ATOM 19 N SER A 3 -18.244 9.612 -5.476 1.00 0.00 N ATOM 20 CA SER A 3 -18.210 8.641 -6.564 1.00 0.00 C ATOM 21 C SER A 3 -18.283 9.340 -7.918 1.00 0.00 C ATOM 22 O SER A 3 -19.273 9.995 -8.239 1.00 0.00 O ATOM 23 CB SER A 3 -19.367 7.649 -6.426 1.00 0.00 C ATOM 24 OG SER A 3 -19.362 6.711 -7.488 1.00 0.00 O ATOM 0 H SER A 3 -19.105 9.603 -4.930 1.00 0.00 H new ATOM 0 HA SER A 3 -17.266 8.098 -6.505 1.00 0.00 H new ATOM 0 HB2 SER A 3 -19.290 7.125 -5.473 1.00 0.00 H new ATOM 0 HB3 SER A 3 -20.314 8.189 -6.417 1.00 0.00 H new ATOM 0 HG SER A 3 -20.109 6.087 -7.377 1.00 0.00 H new ATOM 30 N GLY A 4 -17.224 9.196 -8.709 1.00 0.00 N ATOM 31 CA GLY A 4 -17.186 9.818 -10.020 1.00 0.00 C ATOM 32 C GLY A 4 -16.748 8.856 -11.106 1.00 0.00 C ATOM 33 O GLY A 4 -16.962 7.649 -11.000 1.00 0.00 O ATOM 0 H GLY A 4 -16.391 8.660 -8.465 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -18.174 10.209 -10.262 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -16.504 10.668 -9.996 1.00 0.00 H new ATOM 37 N SER A 5 -16.132 9.392 -12.155 1.00 0.00 N ATOM 38 CA SER A 5 -15.667 8.574 -13.269 1.00 0.00 C ATOM 39 C SER A 5 -14.794 9.391 -14.216 1.00 0.00 C ATOM 40 O SER A 5 -14.758 10.619 -14.141 1.00 0.00 O ATOM 41 CB SER A 5 -16.857 7.988 -14.031 1.00 0.00 C ATOM 42 OG SER A 5 -17.439 8.954 -14.889 1.00 0.00 O ATOM 0 H SER A 5 -15.943 10.389 -12.257 1.00 0.00 H new ATOM 0 HA SER A 5 -15.068 7.759 -12.863 1.00 0.00 H new ATOM 0 HB2 SER A 5 -16.531 7.128 -14.615 1.00 0.00 H new ATOM 0 HB3 SER A 5 -17.604 7.628 -13.324 1.00 0.00 H new ATOM 0 HG SER A 5 -18.196 8.554 -15.366 1.00 0.00 H new ATOM 48 N SER A 6 -14.092 8.700 -15.108 1.00 0.00 N ATOM 49 CA SER A 6 -13.216 9.360 -16.069 1.00 0.00 C ATOM 50 C SER A 6 -13.633 9.033 -17.499 1.00 0.00 C ATOM 51 O SER A 6 -13.705 9.914 -18.354 1.00 0.00 O ATOM 52 CB SER A 6 -11.763 8.938 -15.840 1.00 0.00 C ATOM 53 OG SER A 6 -10.871 9.764 -16.568 1.00 0.00 O ATOM 0 H SER A 6 -14.113 7.683 -15.185 1.00 0.00 H new ATOM 0 HA SER A 6 -13.302 10.437 -15.922 1.00 0.00 H new ATOM 0 HB2 SER A 6 -11.528 8.993 -14.777 1.00 0.00 H new ATOM 0 HB3 SER A 6 -11.631 7.899 -16.143 1.00 0.00 H new ATOM 0 HG SER A 6 -9.949 9.475 -16.404 1.00 0.00 H new ATOM 59 N GLY A 7 -13.907 7.756 -17.752 1.00 0.00 N ATOM 60 CA GLY A 7 -14.314 7.333 -19.079 1.00 0.00 C ATOM 61 C GLY A 7 -13.836 5.934 -19.414 1.00 0.00 C ATOM 62 O GLY A 7 -13.117 5.314 -18.632 1.00 0.00 O ATOM 0 H GLY A 7 -13.854 7.007 -17.061 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -15.401 7.369 -19.151 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -13.922 8.034 -19.816 1.00 0.00 H new ATOM 66 N GLU A 8 -14.238 5.436 -20.579 1.00 0.00 N ATOM 67 CA GLU A 8 -13.848 4.100 -21.014 1.00 0.00 C ATOM 68 C GLU A 8 -12.444 4.111 -21.612 1.00 0.00 C ATOM 69 O GLU A 8 -12.257 3.805 -22.789 1.00 0.00 O ATOM 70 CB GLU A 8 -14.847 3.561 -22.039 1.00 0.00 C ATOM 71 CG GLU A 8 -15.076 4.496 -23.215 1.00 0.00 C ATOM 72 CD GLU A 8 -16.026 3.916 -24.245 1.00 0.00 C ATOM 73 OE1 GLU A 8 -17.118 3.453 -23.852 1.00 0.00 O ATOM 74 OE2 GLU A 8 -15.678 3.925 -25.444 1.00 0.00 O ATOM 0 H GLU A 8 -14.833 5.937 -21.238 1.00 0.00 H new ATOM 0 HA GLU A 8 -13.847 3.447 -20.141 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -14.489 2.602 -22.413 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -15.799 3.375 -21.543 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -15.476 5.442 -22.850 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -14.120 4.716 -23.691 1.00 0.00 H new ATOM 81 N GLU A 9 -11.460 4.467 -20.791 1.00 0.00 N ATOM 82 CA GLU A 9 -10.074 4.520 -21.240 1.00 0.00 C ATOM 83 C GLU A 9 -9.225 3.486 -20.504 1.00 0.00 C ATOM 84 O GLU A 9 -8.437 3.812 -19.616 1.00 0.00 O ATOM 85 CB GLU A 9 -9.496 5.920 -21.020 1.00 0.00 C ATOM 86 CG GLU A 9 -9.622 6.413 -19.589 1.00 0.00 C ATOM 87 CD GLU A 9 -10.914 7.168 -19.344 1.00 0.00 C ATOM 88 OE1 GLU A 9 -11.387 7.851 -20.276 1.00 0.00 O ATOM 89 OE2 GLU A 9 -11.451 7.077 -18.220 1.00 0.00 O ATOM 0 H GLU A 9 -11.597 4.722 -19.813 1.00 0.00 H new ATOM 0 HA GLU A 9 -10.055 4.290 -22.305 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -8.443 5.918 -21.303 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -10.003 6.621 -21.683 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -9.568 5.562 -18.910 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -8.777 7.061 -19.356 1.00 0.00 H new ATOM 96 N PRO A 10 -9.389 2.210 -20.882 1.00 0.00 N ATOM 97 CA PRO A 10 -8.647 1.102 -20.272 1.00 0.00 C ATOM 98 C PRO A 10 -7.167 1.124 -20.640 1.00 0.00 C ATOM 99 O PRO A 10 -6.415 0.219 -20.278 1.00 0.00 O ATOM 100 CB PRO A 10 -9.324 -0.141 -20.853 1.00 0.00 C ATOM 101 CG PRO A 10 -9.910 0.315 -22.145 1.00 0.00 C ATOM 102 CD PRO A 10 -10.311 1.749 -21.934 1.00 0.00 C ATOM 0 HA PRO A 10 -8.670 1.147 -19.183 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -8.607 -0.947 -21.006 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -10.094 -0.523 -20.182 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -9.186 0.227 -22.955 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -10.771 -0.295 -22.420 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -10.204 2.335 -22.847 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -11.352 1.833 -21.621 1.00 0.00 H new ATOM 110 N SER A 11 -6.756 2.162 -21.361 1.00 0.00 N ATOM 111 CA SER A 11 -5.366 2.299 -21.781 1.00 0.00 C ATOM 112 C SER A 11 -4.560 3.076 -20.745 1.00 0.00 C ATOM 113 O SER A 11 -3.562 2.583 -20.222 1.00 0.00 O ATOM 114 CB SER A 11 -5.288 3.003 -23.137 1.00 0.00 C ATOM 115 OG SER A 11 -6.011 2.289 -24.125 1.00 0.00 O ATOM 0 H SER A 11 -7.366 2.921 -21.667 1.00 0.00 H new ATOM 0 HA SER A 11 -4.940 1.300 -21.873 1.00 0.00 H new ATOM 0 HB2 SER A 11 -5.687 4.013 -23.049 1.00 0.00 H new ATOM 0 HB3 SER A 11 -4.246 3.097 -23.442 1.00 0.00 H new ATOM 0 HG SER A 11 -5.947 2.760 -24.982 1.00 0.00 H new ATOM 121 N GLY A 12 -5.002 4.295 -20.453 1.00 0.00 N ATOM 122 CA GLY A 12 -4.311 5.122 -19.481 1.00 0.00 C ATOM 123 C GLY A 12 -4.244 4.475 -18.112 1.00 0.00 C ATOM 124 O GLY A 12 -5.145 3.729 -17.725 1.00 0.00 O ATOM 0 H GLY A 12 -5.827 4.725 -20.872 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -3.300 5.324 -19.834 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -4.818 6.083 -19.401 1.00 0.00 H new ATOM 128 N VAL A 13 -3.174 4.758 -17.376 1.00 0.00 N ATOM 129 CA VAL A 13 -2.993 4.197 -16.042 1.00 0.00 C ATOM 130 C VAL A 13 -4.124 4.620 -15.111 1.00 0.00 C ATOM 131 O VAL A 13 -4.662 3.805 -14.363 1.00 0.00 O ATOM 132 CB VAL A 13 -1.648 4.630 -15.429 1.00 0.00 C ATOM 133 CG1 VAL A 13 -1.509 4.092 -14.013 1.00 0.00 C ATOM 134 CG2 VAL A 13 -0.492 4.165 -16.301 1.00 0.00 C ATOM 0 H VAL A 13 -2.419 5.373 -17.681 1.00 0.00 H new ATOM 0 HA VAL A 13 -3.001 3.112 -16.150 1.00 0.00 H new ATOM 0 HB VAL A 13 -1.623 5.719 -15.382 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -0.553 4.408 -13.596 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -2.320 4.479 -13.396 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -1.555 3.003 -14.031 1.00 0.00 H new ATOM 0 HG21 VAL A 13 0.451 4.479 -15.853 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -0.511 3.078 -16.381 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -0.586 4.604 -17.294 1.00 0.00 H new ATOM 144 N GLU A 14 -4.478 5.901 -15.162 1.00 0.00 N ATOM 145 CA GLU A 14 -5.544 6.432 -14.321 1.00 0.00 C ATOM 146 C GLU A 14 -6.760 5.510 -14.339 1.00 0.00 C ATOM 147 O GLU A 14 -7.308 5.167 -13.292 1.00 0.00 O ATOM 148 CB GLU A 14 -5.945 7.832 -14.791 1.00 0.00 C ATOM 149 CG GLU A 14 -4.802 8.833 -14.766 1.00 0.00 C ATOM 150 CD GLU A 14 -5.118 10.099 -15.537 1.00 0.00 C ATOM 151 OE1 GLU A 14 -5.699 9.993 -16.638 1.00 0.00 O ATOM 152 OE2 GLU A 14 -4.785 11.195 -15.041 1.00 0.00 O ATOM 0 H GLU A 14 -4.042 6.589 -15.776 1.00 0.00 H new ATOM 0 HA GLU A 14 -5.170 6.493 -13.299 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -6.338 7.767 -15.806 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -6.753 8.200 -14.159 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -4.572 9.090 -13.732 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -3.909 8.370 -15.186 1.00 0.00 H new ATOM 159 N GLY A 15 -7.178 5.114 -15.537 1.00 0.00 N ATOM 160 CA GLY A 15 -8.327 4.237 -15.669 1.00 0.00 C ATOM 161 C GLY A 15 -8.324 3.119 -14.646 1.00 0.00 C ATOM 162 O GLY A 15 -9.380 2.625 -14.253 1.00 0.00 O ATOM 0 H GLY A 15 -6.742 5.385 -16.418 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -9.241 4.822 -15.561 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -8.340 3.808 -16.671 1.00 0.00 H new ATOM 166 N ALA A 16 -7.133 2.718 -14.214 1.00 0.00 N ATOM 167 CA ALA A 16 -6.997 1.651 -13.230 1.00 0.00 C ATOM 168 C ALA A 16 -7.708 2.010 -11.929 1.00 0.00 C ATOM 169 O ALA A 16 -8.547 1.254 -11.441 1.00 0.00 O ATOM 170 CB ALA A 16 -5.527 1.360 -12.967 1.00 0.00 C ATOM 0 H ALA A 16 -6.249 3.116 -14.530 1.00 0.00 H new ATOM 0 HA ALA A 16 -7.467 0.755 -13.635 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -5.440 0.561 -12.230 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -5.045 1.052 -13.895 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -5.041 2.258 -12.587 1.00 0.00 H new ATOM 176 N ALA A 17 -7.366 3.168 -11.374 1.00 0.00 N ATOM 177 CA ALA A 17 -7.973 3.627 -10.131 1.00 0.00 C ATOM 178 C ALA A 17 -9.462 3.302 -10.094 1.00 0.00 C ATOM 179 O ALA A 17 -9.988 2.869 -9.068 1.00 0.00 O ATOM 180 CB ALA A 17 -7.753 5.123 -9.957 1.00 0.00 C ATOM 0 H ALA A 17 -6.672 3.805 -11.765 1.00 0.00 H new ATOM 0 HA ALA A 17 -7.493 3.102 -9.306 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -8.212 5.452 -9.025 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -6.684 5.333 -9.929 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -8.206 5.657 -10.792 1.00 0.00 H new ATOM 186 N PHE A 18 -10.138 3.514 -11.219 1.00 0.00 N ATOM 187 CA PHE A 18 -11.568 3.245 -11.314 1.00 0.00 C ATOM 188 C PHE A 18 -11.913 1.906 -10.671 1.00 0.00 C ATOM 189 O PHE A 18 -12.903 1.790 -9.948 1.00 0.00 O ATOM 190 CB PHE A 18 -12.012 3.250 -12.778 1.00 0.00 C ATOM 191 CG PHE A 18 -13.436 2.812 -12.974 1.00 0.00 C ATOM 192 CD1 PHE A 18 -13.775 1.470 -12.919 1.00 0.00 C ATOM 193 CD2 PHE A 18 -14.434 3.743 -13.214 1.00 0.00 C ATOM 194 CE1 PHE A 18 -15.084 1.064 -13.098 1.00 0.00 C ATOM 195 CE2 PHE A 18 -15.744 3.343 -13.393 1.00 0.00 C ATOM 196 CZ PHE A 18 -16.070 2.002 -13.337 1.00 0.00 C ATOM 0 H PHE A 18 -9.718 3.871 -12.077 1.00 0.00 H new ATOM 0 HA PHE A 18 -12.098 4.032 -10.778 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -11.890 4.255 -13.183 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -11.356 2.594 -13.351 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -13.008 0.733 -12.734 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -14.185 4.793 -13.262 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -15.336 0.015 -13.051 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -16.513 4.079 -13.577 1.00 0.00 H new ATOM 0 HZ PHE A 18 -17.093 1.687 -13.480 1.00 0.00 H new ATOM 206 N GLN A 19 -11.090 0.897 -10.939 1.00 0.00 N ATOM 207 CA GLN A 19 -11.309 -0.435 -10.388 1.00 0.00 C ATOM 208 C GLN A 19 -11.563 -0.367 -8.885 1.00 0.00 C ATOM 209 O GLN A 19 -12.379 -1.116 -8.349 1.00 0.00 O ATOM 210 CB GLN A 19 -10.104 -1.333 -10.673 1.00 0.00 C ATOM 211 CG GLN A 19 -8.977 -1.176 -9.666 1.00 0.00 C ATOM 212 CD GLN A 19 -7.956 -2.294 -9.754 1.00 0.00 C ATOM 213 OE1 GLN A 19 -7.183 -2.371 -10.709 1.00 0.00 O ATOM 214 NE2 GLN A 19 -7.949 -3.169 -8.754 1.00 0.00 N ATOM 0 H GLN A 19 -10.266 0.977 -11.534 1.00 0.00 H new ATOM 0 HA GLN A 19 -12.191 -0.859 -10.869 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -10.430 -2.373 -10.681 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -9.723 -1.110 -11.670 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -8.479 -0.220 -9.830 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -9.395 -1.149 -8.660 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -8.608 -3.067 -7.982 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -7.285 -3.943 -8.758 1.00 0.00 H new ATOM 223 N SER A 20 -10.858 0.536 -8.211 1.00 0.00 N ATOM 224 CA SER A 20 -11.004 0.699 -6.770 1.00 0.00 C ATOM 225 C SER A 20 -11.926 1.871 -6.446 1.00 0.00 C ATOM 226 O SER A 20 -11.796 2.506 -5.400 1.00 0.00 O ATOM 227 CB SER A 20 -9.636 0.917 -6.119 1.00 0.00 C ATOM 228 OG SER A 20 -8.809 -0.223 -6.277 1.00 0.00 O ATOM 0 H SER A 20 -10.180 1.166 -8.640 1.00 0.00 H new ATOM 0 HA SER A 20 -11.449 -0.212 -6.370 1.00 0.00 H new ATOM 0 HB2 SER A 20 -9.152 1.786 -6.565 1.00 0.00 H new ATOM 0 HB3 SER A 20 -9.765 1.133 -5.058 1.00 0.00 H new ATOM 0 HG SER A 20 -7.940 -0.058 -5.854 1.00 0.00 H new ATOM 234 N ARG A 21 -12.857 2.150 -7.352 1.00 0.00 N ATOM 235 CA ARG A 21 -13.801 3.245 -7.164 1.00 0.00 C ATOM 236 C ARG A 21 -13.166 4.380 -6.366 1.00 0.00 C ATOM 237 O ARG A 21 -13.784 4.935 -5.457 1.00 0.00 O ATOM 238 CB ARG A 21 -15.059 2.747 -6.450 1.00 0.00 C ATOM 239 CG ARG A 21 -15.910 1.813 -7.296 1.00 0.00 C ATOM 240 CD ARG A 21 -17.328 1.711 -6.757 1.00 0.00 C ATOM 241 NE ARG A 21 -17.468 0.632 -5.784 1.00 0.00 N ATOM 242 CZ ARG A 21 -18.390 0.619 -4.827 1.00 0.00 C ATOM 243 NH1 ARG A 21 -19.249 1.622 -4.717 1.00 0.00 N ATOM 244 NH2 ARG A 21 -18.453 -0.400 -3.979 1.00 0.00 N ATOM 0 H ARG A 21 -12.978 1.633 -8.223 1.00 0.00 H new ATOM 0 HA ARG A 21 -14.077 3.625 -8.148 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -14.767 2.231 -5.535 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -15.662 3.605 -6.153 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -15.935 2.173 -8.324 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -15.455 0.823 -7.316 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -17.608 2.656 -6.292 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -18.019 1.545 -7.584 1.00 0.00 H new ATOM 0 HE ARG A 21 -16.822 -0.156 -5.842 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -19.203 2.406 -5.368 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -19.956 1.610 -3.982 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -17.794 -1.174 -4.062 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -19.161 -0.409 -3.245 1.00 0.00 H new ATOM 258 N LEU A 22 -11.929 4.718 -6.711 1.00 0.00 N ATOM 259 CA LEU A 22 -11.208 5.786 -6.026 1.00 0.00 C ATOM 260 C LEU A 22 -10.541 6.723 -7.029 1.00 0.00 C ATOM 261 O LEU A 22 -10.194 6.333 -8.144 1.00 0.00 O ATOM 262 CB LEU A 22 -10.157 5.197 -5.084 1.00 0.00 C ATOM 263 CG LEU A 22 -9.041 4.389 -5.746 1.00 0.00 C ATOM 264 CD1 LEU A 22 -8.054 5.313 -6.443 1.00 0.00 C ATOM 265 CD2 LEU A 22 -8.328 3.523 -4.717 1.00 0.00 C ATOM 0 H LEU A 22 -11.404 4.268 -7.461 1.00 0.00 H new ATOM 0 HA LEU A 22 -11.928 6.360 -5.443 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -9.703 6.013 -4.522 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -10.663 4.556 -4.362 1.00 0.00 H new ATOM 0 HG LEU A 22 -9.487 3.736 -6.496 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -7.267 4.720 -6.908 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -8.574 5.890 -7.208 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -7.613 5.992 -5.713 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -7.537 2.955 -5.206 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -7.895 4.158 -3.944 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -9.042 2.835 -4.263 1.00 0.00 H new ATOM 277 N PRO A 23 -10.355 7.988 -6.624 1.00 0.00 N ATOM 278 CA PRO A 23 -9.726 9.006 -7.471 1.00 0.00 C ATOM 279 C PRO A 23 -8.237 8.749 -7.676 1.00 0.00 C ATOM 280 O PRO A 23 -7.522 8.394 -6.738 1.00 0.00 O ATOM 281 CB PRO A 23 -9.941 10.302 -6.686 1.00 0.00 C ATOM 282 CG PRO A 23 -10.077 9.869 -5.268 1.00 0.00 C ATOM 283 CD PRO A 23 -10.744 8.522 -5.308 1.00 0.00 C ATOM 0 HA PRO A 23 -10.153 9.023 -8.474 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -9.101 10.985 -6.812 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -10.833 10.828 -7.027 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -9.102 9.808 -4.784 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -10.672 10.582 -4.698 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -10.402 7.880 -4.497 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -11.827 8.607 -5.213 1.00 0.00 H new ATOM 291 N HIS A 24 -7.774 8.930 -8.909 1.00 0.00 N ATOM 292 CA HIS A 24 -6.369 8.719 -9.237 1.00 0.00 C ATOM 293 C HIS A 24 -5.572 10.010 -9.073 1.00 0.00 C ATOM 294 O HIS A 24 -4.375 10.052 -9.356 1.00 0.00 O ATOM 295 CB HIS A 24 -6.230 8.198 -10.668 1.00 0.00 C ATOM 296 CG HIS A 24 -7.161 8.858 -11.638 1.00 0.00 C ATOM 297 ND1 HIS A 24 -8.138 8.172 -12.329 1.00 0.00 N ATOM 298 CD2 HIS A 24 -7.262 10.150 -12.030 1.00 0.00 C ATOM 299 CE1 HIS A 24 -8.798 9.013 -13.105 1.00 0.00 C ATOM 300 NE2 HIS A 24 -8.286 10.220 -12.942 1.00 0.00 N ATOM 0 H HIS A 24 -8.352 9.222 -9.697 1.00 0.00 H new ATOM 0 HA HIS A 24 -5.968 7.976 -8.547 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -5.204 8.348 -11.003 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -6.414 7.124 -10.674 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -6.651 10.972 -11.689 1.00 0.00 H new ATOM 0 HE1 HIS A 24 -9.617 8.757 -13.761 1.00 0.00 H new ATOM 0 HE2 HIS A 24 -8.600 11.066 -13.417 1.00 0.00 H new ATOM 309 N ASP A 25 -6.245 11.060 -8.617 1.00 0.00 N ATOM 310 CA ASP A 25 -5.600 12.352 -8.415 1.00 0.00 C ATOM 311 C ASP A 25 -5.307 12.588 -6.937 1.00 0.00 C ATOM 312 O ASP A 25 -4.360 13.293 -6.587 1.00 0.00 O ATOM 313 CB ASP A 25 -6.483 13.477 -8.958 1.00 0.00 C ATOM 314 CG ASP A 25 -6.772 13.323 -10.439 1.00 0.00 C ATOM 315 OD1 ASP A 25 -5.835 12.989 -11.194 1.00 0.00 O ATOM 316 OD2 ASP A 25 -7.934 13.536 -10.841 1.00 0.00 O ATOM 0 H ASP A 25 -7.237 11.042 -8.380 1.00 0.00 H new ATOM 0 HA ASP A 25 -4.655 12.347 -8.958 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -7.423 13.495 -8.407 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -5.994 14.435 -8.784 1.00 0.00 H new ATOM 321 N ARG A 26 -6.125 11.995 -6.074 1.00 0.00 N ATOM 322 CA ARG A 26 -5.955 12.143 -4.634 1.00 0.00 C ATOM 323 C ARG A 26 -6.032 10.788 -3.935 1.00 0.00 C ATOM 324 O ARG A 26 -6.230 9.758 -4.579 1.00 0.00 O ATOM 325 CB ARG A 26 -7.020 13.083 -4.066 1.00 0.00 C ATOM 326 CG ARG A 26 -8.418 12.486 -4.060 1.00 0.00 C ATOM 327 CD ARG A 26 -9.422 13.427 -3.413 1.00 0.00 C ATOM 328 NE ARG A 26 -9.279 13.465 -1.960 1.00 0.00 N ATOM 329 CZ ARG A 26 -9.680 14.484 -1.208 1.00 0.00 C ATOM 330 NH1 ARG A 26 -10.246 15.543 -1.769 1.00 0.00 N ATOM 331 NH2 ARG A 26 -9.516 14.444 0.108 1.00 0.00 N ATOM 0 H ARG A 26 -6.913 11.407 -6.347 1.00 0.00 H new ATOM 0 HA ARG A 26 -4.969 12.571 -4.453 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -6.746 13.355 -3.047 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -7.029 14.003 -4.650 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -8.727 12.270 -5.083 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -8.408 11.538 -3.523 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -9.290 14.431 -3.817 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -10.433 13.111 -3.670 1.00 0.00 H new ATOM 0 HE ARG A 26 -8.847 12.665 -1.497 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -10.375 15.577 -2.780 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -10.553 16.324 -1.189 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -9.082 13.630 0.543 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -9.824 15.227 0.684 1.00 0.00 H new ATOM 345 N MET A 27 -5.875 10.798 -2.616 1.00 0.00 N ATOM 346 CA MET A 27 -5.928 9.571 -1.831 1.00 0.00 C ATOM 347 C MET A 27 -7.274 9.433 -1.127 1.00 0.00 C ATOM 348 O MET A 27 -8.015 10.407 -0.984 1.00 0.00 O ATOM 349 CB MET A 27 -4.797 9.550 -0.801 1.00 0.00 C ATOM 350 CG MET A 27 -3.418 9.751 -1.408 1.00 0.00 C ATOM 351 SD MET A 27 -2.152 10.075 -0.165 1.00 0.00 S ATOM 352 CE MET A 27 -2.091 8.495 0.676 1.00 0.00 C ATOM 0 H MET A 27 -5.710 11.642 -2.068 1.00 0.00 H new ATOM 0 HA MET A 27 -5.806 8.729 -2.512 1.00 0.00 H new ATOM 0 HB2 MET A 27 -4.976 10.330 -0.061 1.00 0.00 H new ATOM 0 HB3 MET A 27 -4.817 8.597 -0.272 1.00 0.00 H new ATOM 0 HG2 MET A 27 -3.143 8.863 -1.978 1.00 0.00 H new ATOM 0 HG3 MET A 27 -3.453 10.583 -2.111 1.00 0.00 H new ATOM 0 HE1 MET A 27 -1.473 8.582 1.570 1.00 0.00 H new ATOM 0 HE2 MET A 27 -3.100 8.195 0.960 1.00 0.00 H new ATOM 0 HE3 MET A 27 -1.663 7.745 0.011 1.00 0.00 H new ATOM 362 N THR A 28 -7.587 8.217 -0.690 1.00 0.00 N ATOM 363 CA THR A 28 -8.845 7.952 -0.003 1.00 0.00 C ATOM 364 C THR A 28 -8.624 7.755 1.492 1.00 0.00 C ATOM 365 O THR A 28 -7.516 7.448 1.930 1.00 0.00 O ATOM 366 CB THR A 28 -9.546 6.705 -0.576 1.00 0.00 C ATOM 367 OG1 THR A 28 -8.703 5.558 -0.426 1.00 0.00 O ATOM 368 CG2 THR A 28 -9.886 6.903 -2.045 1.00 0.00 C ATOM 0 H THR A 28 -6.986 7.400 -0.800 1.00 0.00 H new ATOM 0 HA THR A 28 -9.481 8.823 -0.162 1.00 0.00 H new ATOM 0 HB THR A 28 -10.472 6.549 -0.023 1.00 0.00 H new ATOM 0 HG1 THR A 28 -8.015 5.565 -1.123 1.00 0.00 H new ATOM 0 HG21 THR A 28 -10.380 6.010 -2.428 1.00 0.00 H new ATOM 0 HG22 THR A 28 -10.551 7.760 -2.152 1.00 0.00 H new ATOM 0 HG23 THR A 28 -8.971 7.081 -2.609 1.00 0.00 H new ATOM 376 N SER A 29 -9.686 7.934 2.271 1.00 0.00 N ATOM 377 CA SER A 29 -9.607 7.778 3.719 1.00 0.00 C ATOM 378 C SER A 29 -8.639 6.661 4.093 1.00 0.00 C ATOM 379 O SER A 29 -7.827 6.809 5.006 1.00 0.00 O ATOM 380 CB SER A 29 -10.992 7.483 4.298 1.00 0.00 C ATOM 381 OG SER A 29 -11.730 8.678 4.489 1.00 0.00 O ATOM 0 H SER A 29 -10.611 8.187 1.924 1.00 0.00 H new ATOM 0 HA SER A 29 -9.236 8.712 4.140 1.00 0.00 H new ATOM 0 HB2 SER A 29 -11.536 6.819 3.627 1.00 0.00 H new ATOM 0 HB3 SER A 29 -10.888 6.960 5.249 1.00 0.00 H new ATOM 0 HG SER A 29 -12.612 8.462 4.858 1.00 0.00 H new ATOM 387 N GLN A 30 -8.731 5.542 3.381 1.00 0.00 N ATOM 388 CA GLN A 30 -7.864 4.399 3.638 1.00 0.00 C ATOM 389 C GLN A 30 -6.408 4.742 3.341 1.00 0.00 C ATOM 390 O GLN A 30 -5.566 4.744 4.238 1.00 0.00 O ATOM 391 CB GLN A 30 -8.301 3.200 2.794 1.00 0.00 C ATOM 392 CG GLN A 30 -9.473 2.435 3.385 1.00 0.00 C ATOM 393 CD GLN A 30 -10.810 3.071 3.058 1.00 0.00 C ATOM 394 OE1 GLN A 30 -11.552 3.479 3.952 1.00 0.00 O ATOM 395 NE2 GLN A 30 -11.125 3.159 1.771 1.00 0.00 N ATOM 0 H GLN A 30 -9.398 5.403 2.622 1.00 0.00 H new ATOM 0 HA GLN A 30 -7.949 4.141 4.694 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -8.571 3.547 1.797 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -7.456 2.521 2.678 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -9.460 1.412 3.010 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -9.357 2.379 4.467 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -10.480 2.808 1.063 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -12.012 3.578 1.490 1.00 0.00 H new ATOM 404 N GLU A 31 -6.120 5.032 2.076 1.00 0.00 N ATOM 405 CA GLU A 31 -4.765 5.376 1.661 1.00 0.00 C ATOM 406 C GLU A 31 -4.148 6.399 2.610 1.00 0.00 C ATOM 407 O GLU A 31 -2.984 6.285 2.992 1.00 0.00 O ATOM 408 CB GLU A 31 -4.769 5.925 0.233 1.00 0.00 C ATOM 409 CG GLU A 31 -5.165 4.897 -0.814 1.00 0.00 C ATOM 410 CD GLU A 31 -5.343 5.506 -2.191 1.00 0.00 C ATOM 411 OE1 GLU A 31 -4.323 5.833 -2.833 1.00 0.00 O ATOM 412 OE2 GLU A 31 -6.504 5.656 -2.627 1.00 0.00 O ATOM 0 H GLU A 31 -6.806 5.036 1.321 1.00 0.00 H new ATOM 0 HA GLU A 31 -4.162 4.469 1.692 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -5.457 6.769 0.179 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -3.776 6.307 -0.003 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -4.403 4.119 -0.861 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -6.094 4.415 -0.511 1.00 0.00 H new ATOM 419 N ALA A 32 -4.938 7.400 2.986 1.00 0.00 N ATOM 420 CA ALA A 32 -4.472 8.443 3.891 1.00 0.00 C ATOM 421 C ALA A 32 -4.111 7.865 5.255 1.00 0.00 C ATOM 422 O ALA A 32 -3.143 8.291 5.884 1.00 0.00 O ATOM 423 CB ALA A 32 -5.529 9.527 4.037 1.00 0.00 C ATOM 0 H ALA A 32 -5.904 7.510 2.677 1.00 0.00 H new ATOM 0 HA ALA A 32 -3.572 8.885 3.463 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -5.167 10.299 4.716 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -5.735 9.968 3.062 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -6.444 9.091 4.438 1.00 0.00 H new ATOM 429 N ALA A 33 -4.898 6.894 5.708 1.00 0.00 N ATOM 430 CA ALA A 33 -4.660 6.258 6.997 1.00 0.00 C ATOM 431 C ALA A 33 -3.434 5.353 6.946 1.00 0.00 C ATOM 432 O ALA A 33 -2.621 5.340 7.871 1.00 0.00 O ATOM 433 CB ALA A 33 -5.885 5.464 7.428 1.00 0.00 C ATOM 0 H ALA A 33 -5.705 6.531 5.201 1.00 0.00 H new ATOM 0 HA ALA A 33 -4.471 7.042 7.730 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -5.693 4.994 8.393 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -6.741 6.134 7.514 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -6.100 4.695 6.686 1.00 0.00 H new ATOM 439 N CYS A 34 -3.306 4.599 5.860 1.00 0.00 N ATOM 440 CA CYS A 34 -2.178 3.690 5.688 1.00 0.00 C ATOM 441 C CYS A 34 -0.883 4.466 5.467 1.00 0.00 C ATOM 442 O CYS A 34 0.164 4.116 6.012 1.00 0.00 O ATOM 443 CB CYS A 34 -2.430 2.748 4.511 1.00 0.00 C ATOM 444 SG CYS A 34 -3.267 1.210 4.962 1.00 0.00 S ATOM 0 H CYS A 34 -3.969 4.599 5.085 1.00 0.00 H new ATOM 0 HA CYS A 34 -2.076 3.101 6.599 1.00 0.00 H new ATOM 0 HB2 CYS A 34 -3.029 3.269 3.764 1.00 0.00 H new ATOM 0 HB3 CYS A 34 -1.476 2.506 4.043 1.00 0.00 H new ATOM 0 HG CYS A 34 -2.747 0.222 4.297 1.00 0.00 H new ATOM 450 N PHE A 35 -0.962 5.520 4.662 1.00 0.00 N ATOM 451 CA PHE A 35 0.204 6.344 4.366 1.00 0.00 C ATOM 452 C PHE A 35 -0.027 7.789 4.799 1.00 0.00 C ATOM 453 O PHE A 35 -0.474 8.633 4.022 1.00 0.00 O ATOM 454 CB PHE A 35 0.525 6.293 2.871 1.00 0.00 C ATOM 455 CG PHE A 35 0.622 4.897 2.326 1.00 0.00 C ATOM 456 CD1 PHE A 35 -0.514 4.122 2.163 1.00 0.00 C ATOM 457 CD2 PHE A 35 1.851 4.360 1.976 1.00 0.00 C ATOM 458 CE1 PHE A 35 -0.427 2.836 1.663 1.00 0.00 C ATOM 459 CE2 PHE A 35 1.944 3.075 1.475 1.00 0.00 C ATOM 460 CZ PHE A 35 0.804 2.313 1.317 1.00 0.00 C ATOM 0 H PHE A 35 -1.821 5.824 4.203 1.00 0.00 H new ATOM 0 HA PHE A 35 1.050 5.946 4.926 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -0.246 6.835 2.323 1.00 0.00 H new ATOM 0 HB3 PHE A 35 1.467 6.811 2.692 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -1.479 4.527 2.430 1.00 0.00 H new ATOM 0 HD2 PHE A 35 2.746 4.952 2.096 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -1.320 2.241 1.543 1.00 0.00 H new ATOM 0 HE2 PHE A 35 2.908 2.668 1.207 1.00 0.00 H new ATOM 0 HZ PHE A 35 0.874 1.310 0.924 1.00 0.00 H new ATOM 470 N PRO A 36 0.285 8.082 6.070 1.00 0.00 N ATOM 471 CA PRO A 36 0.120 9.424 6.636 1.00 0.00 C ATOM 472 C PRO A 36 1.116 10.424 6.059 1.00 0.00 C ATOM 473 O PRO A 36 0.762 11.563 5.756 1.00 0.00 O ATOM 474 CB PRO A 36 0.379 9.214 8.130 1.00 0.00 C ATOM 475 CG PRO A 36 1.246 8.004 8.197 1.00 0.00 C ATOM 476 CD PRO A 36 0.822 7.126 7.052 1.00 0.00 C ATOM 0 HA PRO A 36 -0.862 9.841 6.414 1.00 0.00 H new ATOM 0 HB2 PRO A 36 0.872 10.080 8.572 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -0.552 9.065 8.676 1.00 0.00 H new ATOM 0 HG2 PRO A 36 2.299 8.273 8.113 1.00 0.00 H new ATOM 0 HG3 PRO A 36 1.124 7.489 9.150 1.00 0.00 H new ATOM 0 HD2 PRO A 36 1.662 6.562 6.646 1.00 0.00 H new ATOM 0 HD3 PRO A 36 0.069 6.400 7.359 1.00 0.00 H new ATOM 484 N ASP A 37 2.363 9.989 5.909 1.00 0.00 N ATOM 485 CA ASP A 37 3.411 10.846 5.366 1.00 0.00 C ATOM 486 C ASP A 37 3.056 11.312 3.957 1.00 0.00 C ATOM 487 O ASP A 37 3.355 12.443 3.573 1.00 0.00 O ATOM 488 CB ASP A 37 4.748 10.104 5.349 1.00 0.00 C ATOM 489 CG ASP A 37 4.941 9.231 6.574 1.00 0.00 C ATOM 490 OD1 ASP A 37 4.593 9.683 7.685 1.00 0.00 O ATOM 491 OD2 ASP A 37 5.440 8.096 6.421 1.00 0.00 O ATOM 0 H ASP A 37 2.672 9.049 6.156 1.00 0.00 H new ATOM 0 HA ASP A 37 3.499 11.722 6.008 1.00 0.00 H new ATOM 0 HB2 ASP A 37 4.806 9.486 4.453 1.00 0.00 H new ATOM 0 HB3 ASP A 37 5.561 10.828 5.290 1.00 0.00 H new ATOM 496 N ILE A 38 2.419 10.433 3.191 1.00 0.00 N ATOM 497 CA ILE A 38 2.024 10.754 1.826 1.00 0.00 C ATOM 498 C ILE A 38 0.901 11.786 1.806 1.00 0.00 C ATOM 499 O ILE A 38 1.013 12.827 1.159 1.00 0.00 O ATOM 500 CB ILE A 38 1.565 9.498 1.062 1.00 0.00 C ATOM 501 CG1 ILE A 38 2.692 8.465 1.011 1.00 0.00 C ATOM 502 CG2 ILE A 38 1.114 9.868 -0.344 1.00 0.00 C ATOM 503 CD1 ILE A 38 3.899 8.925 0.225 1.00 0.00 C ATOM 0 H ILE A 38 2.165 9.492 3.493 1.00 0.00 H new ATOM 0 HA ILE A 38 2.904 11.168 1.333 1.00 0.00 H new ATOM 0 HB ILE A 38 0.719 9.059 1.590 1.00 0.00 H new ATOM 0 HG12 ILE A 38 3.001 8.226 2.029 1.00 0.00 H new ATOM 0 HG13 ILE A 38 2.310 7.545 0.569 1.00 0.00 H new ATOM 0 HG21 ILE A 38 0.793 8.970 -0.871 1.00 0.00 H new ATOM 0 HG22 ILE A 38 0.284 10.572 -0.286 1.00 0.00 H new ATOM 0 HG23 ILE A 38 1.942 10.328 -0.883 1.00 0.00 H new ATOM 0 HD11 ILE A 38 4.657 8.142 0.232 1.00 0.00 H new ATOM 0 HD12 ILE A 38 3.605 9.136 -0.803 1.00 0.00 H new ATOM 0 HD13 ILE A 38 4.306 9.828 0.679 1.00 0.00 H new ATOM 515 N ILE A 39 -0.179 11.491 2.522 1.00 0.00 N ATOM 516 CA ILE A 39 -1.321 12.394 2.589 1.00 0.00 C ATOM 517 C ILE A 39 -0.931 13.725 3.223 1.00 0.00 C ATOM 518 O ILE A 39 -1.421 14.782 2.823 1.00 0.00 O ATOM 519 CB ILE A 39 -2.481 11.776 3.391 1.00 0.00 C ATOM 520 CG1 ILE A 39 -3.671 12.737 3.430 1.00 0.00 C ATOM 521 CG2 ILE A 39 -2.025 11.431 4.801 1.00 0.00 C ATOM 522 CD1 ILE A 39 -4.455 12.781 2.137 1.00 0.00 C ATOM 0 H ILE A 39 -0.287 10.634 3.064 1.00 0.00 H new ATOM 0 HA ILE A 39 -1.650 12.565 1.564 1.00 0.00 H new ATOM 0 HB ILE A 39 -2.796 10.857 2.897 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -4.338 12.443 4.240 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -3.311 13.739 3.661 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -2.856 10.995 5.356 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -1.205 10.714 4.753 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -1.687 12.336 5.306 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -5.283 13.483 2.237 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -3.802 13.104 1.326 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -4.846 11.788 1.914 1.00 0.00 H new ATOM 534 N SER A 40 -0.046 13.667 4.213 1.00 0.00 N ATOM 535 CA SER A 40 0.408 14.868 4.904 1.00 0.00 C ATOM 536 C SER A 40 1.704 15.391 4.290 1.00 0.00 C ATOM 537 O SER A 40 2.555 15.944 4.985 1.00 0.00 O ATOM 538 CB SER A 40 0.616 14.578 6.391 1.00 0.00 C ATOM 539 OG SER A 40 0.497 15.761 7.163 1.00 0.00 O ATOM 0 H SER A 40 0.371 12.801 4.555 1.00 0.00 H new ATOM 0 HA SER A 40 -0.361 15.633 4.794 1.00 0.00 H new ATOM 0 HB2 SER A 40 -0.117 13.845 6.728 1.00 0.00 H new ATOM 0 HB3 SER A 40 1.601 14.137 6.544 1.00 0.00 H new ATOM 0 HG SER A 40 1.094 16.449 6.801 1.00 0.00 H new ATOM 545 N GLY A 41 1.845 15.212 2.980 1.00 0.00 N ATOM 546 CA GLY A 41 3.038 15.670 2.293 1.00 0.00 C ATOM 547 C GLY A 41 2.723 16.620 1.154 1.00 0.00 C ATOM 548 O GLY A 41 1.565 16.942 0.889 1.00 0.00 O ATOM 0 H GLY A 41 1.154 14.758 2.383 1.00 0.00 H new ATOM 0 HA2 GLY A 41 3.695 16.168 3.006 1.00 0.00 H new ATOM 0 HA3 GLY A 41 3.583 14.810 1.904 1.00 0.00 H new ATOM 552 N PRO A 42 3.772 17.085 0.459 1.00 0.00 N ATOM 553 CA PRO A 42 3.626 18.010 -0.668 1.00 0.00 C ATOM 554 C PRO A 42 2.989 17.347 -1.884 1.00 0.00 C ATOM 555 O PRO A 42 3.207 16.164 -2.142 1.00 0.00 O ATOM 556 CB PRO A 42 5.068 18.422 -0.977 1.00 0.00 C ATOM 557 CG PRO A 42 5.900 17.290 -0.482 1.00 0.00 C ATOM 558 CD PRO A 42 5.180 16.742 0.720 1.00 0.00 C ATOM 0 HA PRO A 42 2.971 18.847 -0.426 1.00 0.00 H new ATOM 0 HB2 PRO A 42 5.213 18.583 -2.045 1.00 0.00 H new ATOM 0 HB3 PRO A 42 5.329 19.354 -0.476 1.00 0.00 H new ATOM 0 HG2 PRO A 42 6.015 16.525 -1.250 1.00 0.00 H new ATOM 0 HG3 PRO A 42 6.901 17.629 -0.216 1.00 0.00 H new ATOM 0 HD2 PRO A 42 5.320 15.665 0.816 1.00 0.00 H new ATOM 0 HD3 PRO A 42 5.539 17.194 1.644 1.00 0.00 H new ATOM 566 N GLN A 43 2.203 18.118 -2.629 1.00 0.00 N ATOM 567 CA GLN A 43 1.534 17.604 -3.818 1.00 0.00 C ATOM 568 C GLN A 43 2.416 16.592 -4.544 1.00 0.00 C ATOM 569 O GLN A 43 1.945 15.537 -4.967 1.00 0.00 O ATOM 570 CB GLN A 43 1.172 18.752 -4.762 1.00 0.00 C ATOM 571 CG GLN A 43 0.315 18.322 -5.941 1.00 0.00 C ATOM 572 CD GLN A 43 -0.180 19.497 -6.762 1.00 0.00 C ATOM 573 OE1 GLN A 43 0.524 19.998 -7.639 1.00 0.00 O ATOM 574 NE2 GLN A 43 -1.399 19.944 -6.481 1.00 0.00 N ATOM 0 H GLN A 43 2.014 19.100 -2.430 1.00 0.00 H new ATOM 0 HA GLN A 43 0.620 17.102 -3.501 1.00 0.00 H new ATOM 0 HB2 GLN A 43 0.642 19.521 -4.199 1.00 0.00 H new ATOM 0 HB3 GLN A 43 2.089 19.206 -5.137 1.00 0.00 H new ATOM 0 HG2 GLN A 43 0.892 17.654 -6.581 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -0.540 17.753 -5.576 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -1.948 19.499 -5.746 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -1.786 20.732 -7.000 1.00 0.00 H new ATOM 583 N GLN A 44 3.696 16.923 -4.683 1.00 0.00 N ATOM 584 CA GLN A 44 4.642 16.043 -5.359 1.00 0.00 C ATOM 585 C GLN A 44 4.630 14.651 -4.736 1.00 0.00 C ATOM 586 O GLN A 44 4.380 13.656 -5.418 1.00 0.00 O ATOM 587 CB GLN A 44 6.052 16.631 -5.295 1.00 0.00 C ATOM 588 CG GLN A 44 7.094 15.795 -6.021 1.00 0.00 C ATOM 589 CD GLN A 44 7.213 16.156 -7.489 1.00 0.00 C ATOM 590 OE1 GLN A 44 7.428 17.317 -7.838 1.00 0.00 O ATOM 591 NE2 GLN A 44 7.074 15.161 -8.357 1.00 0.00 N ATOM 0 H GLN A 44 4.101 17.793 -4.337 1.00 0.00 H new ATOM 0 HA GLN A 44 4.339 15.957 -6.402 1.00 0.00 H new ATOM 0 HB2 GLN A 44 6.039 17.633 -5.724 1.00 0.00 H new ATOM 0 HB3 GLN A 44 6.346 16.736 -4.251 1.00 0.00 H new ATOM 0 HG2 GLN A 44 8.062 15.929 -5.538 1.00 0.00 H new ATOM 0 HG3 GLN A 44 6.835 14.740 -5.930 1.00 0.00 H new ATOM 0 HE21 GLN A 44 6.897 14.214 -8.023 1.00 0.00 H new ATOM 0 HE22 GLN A 44 7.145 15.344 -9.358 1.00 0.00 H new ATOM 600 N THR A 45 4.903 14.586 -3.437 1.00 0.00 N ATOM 601 CA THR A 45 4.926 13.316 -2.722 1.00 0.00 C ATOM 602 C THR A 45 3.648 12.523 -2.970 1.00 0.00 C ATOM 603 O THR A 45 3.697 11.351 -3.341 1.00 0.00 O ATOM 604 CB THR A 45 5.100 13.527 -1.206 1.00 0.00 C ATOM 605 OG1 THR A 45 6.351 14.173 -0.942 1.00 0.00 O ATOM 606 CG2 THR A 45 5.042 12.200 -0.465 1.00 0.00 C ATOM 0 H THR A 45 5.112 15.399 -2.858 1.00 0.00 H new ATOM 0 HA THR A 45 5.779 12.754 -3.103 1.00 0.00 H new ATOM 0 HB THR A 45 4.284 14.158 -0.853 1.00 0.00 H new ATOM 0 HG1 THR A 45 6.605 14.024 -0.007 1.00 0.00 H new ATOM 0 HG21 THR A 45 5.167 12.374 0.604 1.00 0.00 H new ATOM 0 HG22 THR A 45 4.078 11.725 -0.645 1.00 0.00 H new ATOM 0 HG23 THR A 45 5.840 11.549 -0.822 1.00 0.00 H new ATOM 614 N GLN A 46 2.506 13.171 -2.762 1.00 0.00 N ATOM 615 CA GLN A 46 1.214 12.524 -2.964 1.00 0.00 C ATOM 616 C GLN A 46 1.126 11.906 -4.355 1.00 0.00 C ATOM 617 O GLN A 46 0.697 10.763 -4.512 1.00 0.00 O ATOM 618 CB GLN A 46 0.080 13.532 -2.767 1.00 0.00 C ATOM 619 CG GLN A 46 -0.167 13.892 -1.311 1.00 0.00 C ATOM 620 CD GLN A 46 -1.284 14.904 -1.142 1.00 0.00 C ATOM 621 OE1 GLN A 46 -1.844 15.397 -2.121 1.00 0.00 O ATOM 622 NE2 GLN A 46 -1.614 15.219 0.105 1.00 0.00 N ATOM 0 H GLN A 46 2.449 14.142 -2.454 1.00 0.00 H new ATOM 0 HA GLN A 46 1.115 11.727 -2.227 1.00 0.00 H new ATOM 0 HB2 GLN A 46 0.312 14.440 -3.323 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -0.837 13.123 -3.192 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -0.413 12.988 -0.754 1.00 0.00 H new ATOM 0 HG3 GLN A 46 0.750 14.293 -0.879 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -1.123 14.786 0.887 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -2.358 15.894 0.281 1.00 0.00 H new ATOM 631 N LYS A 47 1.534 12.670 -5.363 1.00 0.00 N ATOM 632 CA LYS A 47 1.502 12.198 -6.742 1.00 0.00 C ATOM 633 C LYS A 47 2.431 11.002 -6.930 1.00 0.00 C ATOM 634 O LYS A 47 2.059 10.007 -7.551 1.00 0.00 O ATOM 635 CB LYS A 47 1.904 13.324 -7.698 1.00 0.00 C ATOM 636 CG LYS A 47 0.884 14.446 -7.778 1.00 0.00 C ATOM 637 CD LYS A 47 1.085 15.294 -9.023 1.00 0.00 C ATOM 638 CE LYS A 47 2.185 16.326 -8.822 1.00 0.00 C ATOM 639 NZ LYS A 47 3.537 15.751 -9.065 1.00 0.00 N ATOM 0 H LYS A 47 1.891 13.619 -5.250 1.00 0.00 H new ATOM 0 HA LYS A 47 0.483 11.884 -6.968 1.00 0.00 H new ATOM 0 HB2 LYS A 47 2.861 13.736 -7.379 1.00 0.00 H new ATOM 0 HB3 LYS A 47 2.053 12.908 -8.694 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -0.122 14.025 -7.782 1.00 0.00 H new ATOM 0 HG3 LYS A 47 0.963 15.075 -6.891 1.00 0.00 H new ATOM 0 HD2 LYS A 47 1.338 14.651 -9.866 1.00 0.00 H new ATOM 0 HD3 LYS A 47 0.152 15.799 -9.275 1.00 0.00 H new ATOM 0 HE2 LYS A 47 2.022 17.167 -9.496 1.00 0.00 H new ATOM 0 HE3 LYS A 47 2.134 16.718 -7.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 4.209 16.518 -9.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 3.851 15.233 -8.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 3.497 15.100 -9.875 1.00 0.00 H new ATOM 653 N VAL A 48 3.640 11.107 -6.388 1.00 0.00 N ATOM 654 CA VAL A 48 4.621 10.033 -6.494 1.00 0.00 C ATOM 655 C VAL A 48 4.031 8.703 -6.038 1.00 0.00 C ATOM 656 O VAL A 48 4.258 7.665 -6.660 1.00 0.00 O ATOM 657 CB VAL A 48 5.878 10.337 -5.658 1.00 0.00 C ATOM 658 CG1 VAL A 48 6.878 9.195 -5.762 1.00 0.00 C ATOM 659 CG2 VAL A 48 6.508 11.649 -6.102 1.00 0.00 C ATOM 0 H VAL A 48 3.964 11.925 -5.871 1.00 0.00 H new ATOM 0 HA VAL A 48 4.901 9.962 -7.545 1.00 0.00 H new ATOM 0 HB VAL A 48 5.583 10.436 -4.613 1.00 0.00 H new ATOM 0 HG11 VAL A 48 7.760 9.428 -5.165 1.00 0.00 H new ATOM 0 HG12 VAL A 48 6.421 8.277 -5.392 1.00 0.00 H new ATOM 0 HG13 VAL A 48 7.170 9.061 -6.803 1.00 0.00 H new ATOM 0 HG21 VAL A 48 7.395 11.848 -5.501 1.00 0.00 H new ATOM 0 HG22 VAL A 48 6.790 11.580 -7.153 1.00 0.00 H new ATOM 0 HG23 VAL A 48 5.791 12.460 -5.971 1.00 0.00 H new ATOM 669 N PHE A 49 3.271 8.742 -4.948 1.00 0.00 N ATOM 670 CA PHE A 49 2.648 7.539 -4.408 1.00 0.00 C ATOM 671 C PHE A 49 1.401 7.167 -5.206 1.00 0.00 C ATOM 672 O PHE A 49 1.165 5.995 -5.501 1.00 0.00 O ATOM 673 CB PHE A 49 2.282 7.746 -2.937 1.00 0.00 C ATOM 674 CG PHE A 49 1.109 6.922 -2.489 1.00 0.00 C ATOM 675 CD1 PHE A 49 -0.182 7.285 -2.838 1.00 0.00 C ATOM 676 CD2 PHE A 49 1.296 5.785 -1.720 1.00 0.00 C ATOM 677 CE1 PHE A 49 -1.265 6.529 -2.428 1.00 0.00 C ATOM 678 CE2 PHE A 49 0.218 5.025 -1.308 1.00 0.00 C ATOM 679 CZ PHE A 49 -1.064 5.398 -1.661 1.00 0.00 C ATOM 0 H PHE A 49 3.072 9.593 -4.422 1.00 0.00 H new ATOM 0 HA PHE A 49 3.365 6.722 -4.486 1.00 0.00 H new ATOM 0 HB2 PHE A 49 3.145 7.501 -2.318 1.00 0.00 H new ATOM 0 HB3 PHE A 49 2.060 8.800 -2.771 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -0.344 8.169 -3.437 1.00 0.00 H new ATOM 0 HD2 PHE A 49 2.296 5.489 -1.439 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -2.266 6.822 -2.707 1.00 0.00 H new ATOM 0 HE2 PHE A 49 0.378 4.140 -0.710 1.00 0.00 H new ATOM 0 HZ PHE A 49 -1.908 4.806 -1.338 1.00 0.00 H new ATOM 689 N LEU A 50 0.606 8.174 -5.552 1.00 0.00 N ATOM 690 CA LEU A 50 -0.618 7.954 -6.316 1.00 0.00 C ATOM 691 C LEU A 50 -0.305 7.369 -7.689 1.00 0.00 C ATOM 692 O LEU A 50 -1.196 6.887 -8.388 1.00 0.00 O ATOM 693 CB LEU A 50 -1.388 9.266 -6.471 1.00 0.00 C ATOM 694 CG LEU A 50 -2.360 9.612 -5.343 1.00 0.00 C ATOM 695 CD1 LEU A 50 -2.824 11.055 -5.460 1.00 0.00 C ATOM 696 CD2 LEU A 50 -3.551 8.665 -5.356 1.00 0.00 C ATOM 0 H LEU A 50 0.787 9.150 -5.316 1.00 0.00 H new ATOM 0 HA LEU A 50 -1.235 7.240 -5.770 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -0.667 10.078 -6.564 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -1.947 9.227 -7.406 1.00 0.00 H new ATOM 0 HG LEU A 50 -1.838 9.496 -4.393 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -3.515 11.282 -4.648 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -1.963 11.720 -5.400 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -3.327 11.199 -6.416 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -4.232 8.926 -4.546 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -4.072 8.749 -6.310 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -3.203 7.641 -5.221 1.00 0.00 H new ATOM 708 N PHE A 51 0.968 7.413 -8.069 1.00 0.00 N ATOM 709 CA PHE A 51 1.399 6.886 -9.359 1.00 0.00 C ATOM 710 C PHE A 51 1.924 5.461 -9.216 1.00 0.00 C ATOM 711 O PHE A 51 1.707 4.618 -10.087 1.00 0.00 O ATOM 712 CB PHE A 51 2.482 7.782 -9.964 1.00 0.00 C ATOM 713 CG PHE A 51 3.045 7.256 -11.253 1.00 0.00 C ATOM 714 CD1 PHE A 51 3.904 6.169 -11.256 1.00 0.00 C ATOM 715 CD2 PHE A 51 2.715 7.849 -12.461 1.00 0.00 C ATOM 716 CE1 PHE A 51 4.423 5.682 -12.441 1.00 0.00 C ATOM 717 CE2 PHE A 51 3.231 7.366 -13.649 1.00 0.00 C ATOM 718 CZ PHE A 51 4.087 6.282 -13.639 1.00 0.00 C ATOM 0 H PHE A 51 1.719 7.808 -7.502 1.00 0.00 H new ATOM 0 HA PHE A 51 0.536 6.872 -10.024 1.00 0.00 H new ATOM 0 HB2 PHE A 51 2.066 8.775 -10.137 1.00 0.00 H new ATOM 0 HB3 PHE A 51 3.292 7.897 -9.243 1.00 0.00 H new ATOM 0 HD1 PHE A 51 4.171 5.697 -10.322 1.00 0.00 H new ATOM 0 HD2 PHE A 51 2.047 8.698 -12.475 1.00 0.00 H new ATOM 0 HE1 PHE A 51 5.091 4.833 -12.430 1.00 0.00 H new ATOM 0 HE2 PHE A 51 2.965 7.836 -14.584 1.00 0.00 H new ATOM 0 HZ PHE A 51 4.493 5.904 -14.566 1.00 0.00 H new ATOM 728 N ILE A 52 2.616 5.199 -8.112 1.00 0.00 N ATOM 729 CA ILE A 52 3.171 3.877 -7.855 1.00 0.00 C ATOM 730 C ILE A 52 2.066 2.845 -7.659 1.00 0.00 C ATOM 731 O ILE A 52 2.168 1.713 -8.132 1.00 0.00 O ATOM 732 CB ILE A 52 4.081 3.880 -6.612 1.00 0.00 C ATOM 733 CG1 ILE A 52 5.283 4.800 -6.835 1.00 0.00 C ATOM 734 CG2 ILE A 52 4.542 2.467 -6.289 1.00 0.00 C ATOM 735 CD1 ILE A 52 5.899 5.312 -5.552 1.00 0.00 C ATOM 0 H ILE A 52 2.805 5.885 -7.382 1.00 0.00 H new ATOM 0 HA ILE A 52 3.764 3.609 -8.729 1.00 0.00 H new ATOM 0 HB ILE A 52 3.510 4.258 -5.764 1.00 0.00 H new ATOM 0 HG12 ILE A 52 6.042 4.262 -7.403 1.00 0.00 H new ATOM 0 HG13 ILE A 52 4.972 5.649 -7.443 1.00 0.00 H new ATOM 0 HG21 ILE A 52 5.184 2.486 -5.408 1.00 0.00 H new ATOM 0 HG22 ILE A 52 3.674 1.837 -6.092 1.00 0.00 H new ATOM 0 HG23 ILE A 52 5.098 2.064 -7.135 1.00 0.00 H new ATOM 0 HD11 ILE A 52 6.745 5.957 -5.787 1.00 0.00 H new ATOM 0 HD12 ILE A 52 5.155 5.879 -4.992 1.00 0.00 H new ATOM 0 HD13 ILE A 52 6.241 4.469 -4.951 1.00 0.00 H new ATOM 747 N ARG A 53 1.009 3.244 -6.960 1.00 0.00 N ATOM 748 CA ARG A 53 -0.117 2.354 -6.702 1.00 0.00 C ATOM 749 C ARG A 53 -0.944 2.143 -7.966 1.00 0.00 C ATOM 750 O ARG A 53 -1.428 1.042 -8.227 1.00 0.00 O ATOM 751 CB ARG A 53 -1.000 2.923 -5.590 1.00 0.00 C ATOM 752 CG ARG A 53 -2.389 2.307 -5.540 1.00 0.00 C ATOM 753 CD ARG A 53 -3.379 3.097 -6.382 1.00 0.00 C ATOM 754 NE ARG A 53 -4.039 4.147 -5.611 1.00 0.00 N ATOM 755 CZ ARG A 53 -4.562 5.240 -6.155 1.00 0.00 C ATOM 756 NH1 ARG A 53 -4.503 5.426 -7.466 1.00 0.00 N ATOM 757 NH2 ARG A 53 -5.146 6.151 -5.386 1.00 0.00 N ATOM 0 H ARG A 53 0.908 4.178 -6.562 1.00 0.00 H new ATOM 0 HA ARG A 53 0.280 1.390 -6.384 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -0.507 2.766 -4.630 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -1.094 4.000 -5.728 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -2.345 1.278 -5.898 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -2.735 2.271 -4.507 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -2.859 3.543 -7.230 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -4.130 2.420 -6.789 1.00 0.00 H new ATOM 0 HE ARG A 53 -4.102 4.035 -4.599 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -4.055 4.729 -8.060 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -4.906 6.267 -7.880 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -5.193 6.012 -4.377 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -5.547 6.990 -5.805 1.00 0.00 H new ATOM 771 N ASN A 54 -1.103 3.206 -8.748 1.00 0.00 N ATOM 772 CA ASN A 54 -1.873 3.138 -9.984 1.00 0.00 C ATOM 773 C ASN A 54 -1.201 2.212 -10.993 1.00 0.00 C ATOM 774 O ASN A 54 -1.855 1.373 -11.613 1.00 0.00 O ATOM 775 CB ASN A 54 -2.034 4.535 -10.587 1.00 0.00 C ATOM 776 CG ASN A 54 -3.291 5.232 -10.103 1.00 0.00 C ATOM 777 OD1 ASN A 54 -4.302 4.588 -9.820 1.00 0.00 O ATOM 778 ND2 ASN A 54 -3.234 6.555 -10.004 1.00 0.00 N ATOM 0 H ASN A 54 -0.709 4.125 -8.547 1.00 0.00 H new ATOM 0 HA ASN A 54 -2.858 2.736 -9.747 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -1.165 5.141 -10.331 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -2.060 4.458 -11.674 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -4.049 7.078 -9.683 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -2.375 7.048 -10.249 1.00 0.00 H new ATOM 785 N ARG A 55 0.109 2.370 -11.152 1.00 0.00 N ATOM 786 CA ARG A 55 0.870 1.549 -12.086 1.00 0.00 C ATOM 787 C ARG A 55 0.835 0.080 -11.672 1.00 0.00 C ATOM 788 O ARG A 55 0.581 -0.802 -12.493 1.00 0.00 O ATOM 789 CB ARG A 55 2.319 2.034 -12.161 1.00 0.00 C ATOM 790 CG ARG A 55 3.096 1.453 -13.332 1.00 0.00 C ATOM 791 CD ARG A 55 2.675 2.086 -14.649 1.00 0.00 C ATOM 792 NE ARG A 55 3.301 1.433 -15.795 1.00 0.00 N ATOM 793 CZ ARG A 55 3.458 2.017 -16.978 1.00 0.00 C ATOM 794 NH1 ARG A 55 3.038 3.260 -17.168 1.00 0.00 N ATOM 795 NH2 ARG A 55 4.038 1.357 -17.972 1.00 0.00 N ATOM 0 H ARG A 55 0.665 3.059 -10.646 1.00 0.00 H new ATOM 0 HA ARG A 55 0.411 1.643 -13.070 1.00 0.00 H new ATOM 0 HB2 ARG A 55 2.326 3.121 -12.235 1.00 0.00 H new ATOM 0 HB3 ARG A 55 2.829 1.774 -11.233 1.00 0.00 H new ATOM 0 HG2 ARG A 55 4.163 1.611 -13.176 1.00 0.00 H new ATOM 0 HG3 ARG A 55 2.936 0.376 -13.377 1.00 0.00 H new ATOM 0 HD2 ARG A 55 1.591 2.030 -14.748 1.00 0.00 H new ATOM 0 HD3 ARG A 55 2.941 3.143 -14.644 1.00 0.00 H new ATOM 0 HE ARG A 55 3.636 0.476 -15.681 1.00 0.00 H new ATOM 0 HH11 ARG A 55 2.593 3.770 -16.405 1.00 0.00 H new ATOM 0 HH12 ARG A 55 3.160 3.706 -18.077 1.00 0.00 H new ATOM 0 HH21 ARG A 55 4.363 0.401 -17.828 1.00 0.00 H new ATOM 0 HH22 ARG A 55 4.158 1.805 -18.880 1.00 0.00 H new ATOM 809 N THR A 56 1.092 -0.175 -10.393 1.00 0.00 N ATOM 810 CA THR A 56 1.091 -1.535 -9.870 1.00 0.00 C ATOM 811 C THR A 56 -0.145 -2.300 -10.327 1.00 0.00 C ATOM 812 O THR A 56 -0.060 -3.469 -10.706 1.00 0.00 O ATOM 813 CB THR A 56 1.147 -1.545 -8.330 1.00 0.00 C ATOM 814 OG1 THR A 56 2.351 -0.915 -7.879 1.00 0.00 O ATOM 815 CG2 THR A 56 1.083 -2.968 -7.796 1.00 0.00 C ATOM 0 H THR A 56 1.304 0.543 -9.700 1.00 0.00 H new ATOM 0 HA THR A 56 1.983 -2.024 -10.262 1.00 0.00 H new ATOM 0 HB THR A 56 0.286 -0.993 -7.954 1.00 0.00 H new ATOM 0 HG1 THR A 56 2.372 0.013 -8.194 1.00 0.00 H new ATOM 0 HG21 THR A 56 1.124 -2.950 -6.707 1.00 0.00 H new ATOM 0 HG22 THR A 56 0.152 -3.435 -8.116 1.00 0.00 H new ATOM 0 HG23 THR A 56 1.927 -3.540 -8.182 1.00 0.00 H new ATOM 823 N LEU A 57 -1.294 -1.633 -10.291 1.00 0.00 N ATOM 824 CA LEU A 57 -2.550 -2.251 -10.703 1.00 0.00 C ATOM 825 C LEU A 57 -2.584 -2.460 -12.214 1.00 0.00 C ATOM 826 O LEU A 57 -2.992 -3.517 -12.694 1.00 0.00 O ATOM 827 CB LEU A 57 -3.733 -1.383 -10.270 1.00 0.00 C ATOM 828 CG LEU A 57 -4.310 -1.678 -8.885 1.00 0.00 C ATOM 829 CD1 LEU A 57 -5.384 -0.663 -8.528 1.00 0.00 C ATOM 830 CD2 LEU A 57 -4.869 -3.092 -8.829 1.00 0.00 C ATOM 0 H LEU A 57 -1.382 -0.665 -9.981 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.624 -3.225 -10.219 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -3.421 -0.339 -10.297 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -4.530 -1.497 -11.005 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.506 -1.599 -8.153 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -5.783 -0.888 -7.539 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.952 0.338 -8.525 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -6.187 -0.710 -9.263 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -5.275 -3.284 -7.836 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -5.660 -3.200 -9.571 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -4.073 -3.806 -9.040 1.00 0.00 H new ATOM 842 N GLN A 58 -2.150 -1.446 -12.956 1.00 0.00 N ATOM 843 CA GLN A 58 -2.130 -1.521 -14.412 1.00 0.00 C ATOM 844 C GLN A 58 -1.454 -2.804 -14.882 1.00 0.00 C ATOM 845 O GLN A 58 -2.037 -3.585 -15.636 1.00 0.00 O ATOM 846 CB GLN A 58 -1.406 -0.306 -14.996 1.00 0.00 C ATOM 847 CG GLN A 58 -2.301 0.911 -15.167 1.00 0.00 C ATOM 848 CD GLN A 58 -3.396 0.691 -16.191 1.00 0.00 C ATOM 849 OE1 GLN A 58 -4.389 0.015 -15.920 1.00 0.00 O ATOM 850 NE2 GLN A 58 -3.221 1.262 -17.377 1.00 0.00 N ATOM 0 H GLN A 58 -1.808 -0.564 -12.574 1.00 0.00 H new ATOM 0 HA GLN A 58 -3.161 -1.525 -14.765 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -0.571 -0.044 -14.346 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -0.984 -0.576 -15.964 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -2.752 1.163 -14.207 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -1.694 1.764 -15.468 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -2.383 1.814 -17.559 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -3.925 1.149 -18.106 1.00 0.00 H new ATOM 859 N LEU A 59 -0.221 -3.016 -14.434 1.00 0.00 N ATOM 860 CA LEU A 59 0.535 -4.206 -14.809 1.00 0.00 C ATOM 861 C LEU A 59 -0.234 -5.475 -14.454 1.00 0.00 C ATOM 862 O LEU A 59 -0.186 -6.465 -15.183 1.00 0.00 O ATOM 863 CB LEU A 59 1.897 -4.209 -14.112 1.00 0.00 C ATOM 864 CG LEU A 59 2.712 -2.920 -14.225 1.00 0.00 C ATOM 865 CD1 LEU A 59 3.808 -2.888 -13.171 1.00 0.00 C ATOM 866 CD2 LEU A 59 3.305 -2.784 -15.619 1.00 0.00 C ATOM 0 H LEU A 59 0.276 -2.380 -13.811 1.00 0.00 H new ATOM 0 HA LEU A 59 0.686 -4.185 -15.888 1.00 0.00 H new ATOM 0 HB2 LEU A 59 1.741 -4.425 -13.055 1.00 0.00 H new ATOM 0 HB3 LEU A 59 2.490 -5.027 -14.521 1.00 0.00 H new ATOM 0 HG LEU A 59 2.046 -2.075 -14.052 1.00 0.00 H new ATOM 0 HD11 LEU A 59 4.378 -1.964 -13.266 1.00 0.00 H new ATOM 0 HD12 LEU A 59 3.360 -2.937 -12.179 1.00 0.00 H new ATOM 0 HD13 LEU A 59 4.473 -3.740 -13.312 1.00 0.00 H new ATOM 0 HD21 LEU A 59 3.882 -1.861 -15.681 1.00 0.00 H new ATOM 0 HD22 LEU A 59 3.957 -3.633 -15.821 1.00 0.00 H new ATOM 0 HD23 LEU A 59 2.502 -2.760 -16.355 1.00 0.00 H new ATOM 878 N TRP A 60 -0.942 -5.436 -13.331 1.00 0.00 N ATOM 879 CA TRP A 60 -1.724 -6.582 -12.881 1.00 0.00 C ATOM 880 C TRP A 60 -2.986 -6.744 -13.721 1.00 0.00 C ATOM 881 O TRP A 60 -3.459 -7.861 -13.938 1.00 0.00 O ATOM 882 CB TRP A 60 -2.095 -6.424 -11.405 1.00 0.00 C ATOM 883 CG TRP A 60 -3.358 -7.138 -11.031 1.00 0.00 C ATOM 884 CD1 TRP A 60 -4.615 -6.608 -10.980 1.00 0.00 C ATOM 885 CD2 TRP A 60 -3.485 -8.513 -10.653 1.00 0.00 C ATOM 886 NE1 TRP A 60 -5.517 -7.570 -10.594 1.00 0.00 N ATOM 887 CE2 TRP A 60 -4.849 -8.748 -10.388 1.00 0.00 C ATOM 888 CE3 TRP A 60 -2.581 -9.570 -10.515 1.00 0.00 C ATOM 889 CZ2 TRP A 60 -5.326 -9.995 -9.992 1.00 0.00 C ATOM 890 CZ3 TRP A 60 -3.056 -10.806 -10.122 1.00 0.00 C ATOM 891 CH2 TRP A 60 -4.418 -11.011 -9.865 1.00 0.00 C ATOM 0 H TRP A 60 -0.991 -4.624 -12.716 1.00 0.00 H new ATOM 0 HA TRP A 60 -1.113 -7.477 -13.001 1.00 0.00 H new ATOM 0 HB2 TRP A 60 -1.278 -6.800 -10.790 1.00 0.00 H new ATOM 0 HB3 TRP A 60 -2.204 -5.364 -11.177 1.00 0.00 H new ATOM 0 HD1 TRP A 60 -4.864 -5.582 -11.209 1.00 0.00 H new ATOM 0 HE1 TRP A 60 -6.521 -7.430 -10.479 1.00 0.00 H new ATOM 0 HE3 TRP A 60 -1.529 -9.423 -10.712 1.00 0.00 H new ATOM 0 HZ2 TRP A 60 -6.375 -10.155 -9.792 1.00 0.00 H new ATOM 0 HZ3 TRP A 60 -2.365 -11.629 -10.011 1.00 0.00 H new ATOM 0 HH2 TRP A 60 -4.758 -11.990 -9.561 1.00 0.00 H new ATOM 902 N LEU A 61 -3.526 -5.626 -14.191 1.00 0.00 N ATOM 903 CA LEU A 61 -4.734 -5.645 -15.008 1.00 0.00 C ATOM 904 C LEU A 61 -4.425 -6.109 -16.428 1.00 0.00 C ATOM 905 O LEU A 61 -5.298 -6.620 -17.129 1.00 0.00 O ATOM 906 CB LEU A 61 -5.373 -4.255 -15.042 1.00 0.00 C ATOM 907 CG LEU A 61 -6.388 -3.955 -13.938 1.00 0.00 C ATOM 908 CD1 LEU A 61 -6.894 -2.526 -14.052 1.00 0.00 C ATOM 909 CD2 LEU A 61 -7.547 -4.940 -13.999 1.00 0.00 C ATOM 0 H LEU A 61 -3.147 -4.695 -14.021 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.434 -6.350 -14.559 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -4.579 -3.511 -14.989 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -5.866 -4.127 -16.006 1.00 0.00 H new ATOM 0 HG LEU A 61 -5.892 -4.066 -12.974 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -7.615 -2.331 -13.258 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -6.056 -1.835 -13.959 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -7.374 -2.386 -15.021 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -8.260 -4.712 -13.207 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -8.042 -4.860 -14.967 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -7.170 -5.954 -13.867 1.00 0.00 H new ATOM 921 N ASP A 62 -3.176 -5.930 -16.844 1.00 0.00 N ATOM 922 CA ASP A 62 -2.749 -6.334 -18.179 1.00 0.00 C ATOM 923 C ASP A 62 -2.133 -7.729 -18.153 1.00 0.00 C ATOM 924 O ASP A 62 -2.165 -8.450 -19.150 1.00 0.00 O ATOM 925 CB ASP A 62 -1.744 -5.328 -18.742 1.00 0.00 C ATOM 926 CG ASP A 62 -2.418 -4.133 -19.386 1.00 0.00 C ATOM 927 OD1 ASP A 62 -3.370 -3.594 -18.784 1.00 0.00 O ATOM 928 OD2 ASP A 62 -1.995 -3.738 -20.493 1.00 0.00 O ATOM 0 H ASP A 62 -2.441 -5.508 -16.276 1.00 0.00 H new ATOM 0 HA ASP A 62 -3.627 -6.357 -18.824 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -1.091 -4.984 -17.940 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -1.111 -5.824 -19.478 1.00 0.00 H new ATOM 933 N ASN A 63 -1.573 -8.102 -17.008 1.00 0.00 N ATOM 934 CA ASN A 63 -0.947 -9.410 -16.853 1.00 0.00 C ATOM 935 C ASN A 63 -1.419 -10.091 -15.572 1.00 0.00 C ATOM 936 O ASN A 63 -0.624 -10.587 -14.773 1.00 0.00 O ATOM 937 CB ASN A 63 0.576 -9.272 -16.839 1.00 0.00 C ATOM 938 CG ASN A 63 1.274 -10.509 -17.370 1.00 0.00 C ATOM 939 OD1 ASN A 63 2.209 -10.415 -18.166 1.00 0.00 O ATOM 940 ND2 ASN A 63 0.821 -11.678 -16.932 1.00 0.00 N ATOM 0 H ASN A 63 -1.540 -7.517 -16.173 1.00 0.00 H new ATOM 0 HA ASN A 63 -1.241 -10.028 -17.701 1.00 0.00 H new ATOM 0 HB2 ASN A 63 0.865 -8.409 -17.439 1.00 0.00 H new ATOM 0 HB3 ASN A 63 0.911 -9.078 -15.820 1.00 0.00 H new ATOM 0 HD21 ASN A 63 1.250 -12.545 -17.255 1.00 0.00 H new ATOM 0 HD22 ASN A 63 0.044 -11.709 -16.272 1.00 0.00 H new ATOM 947 N PRO A 64 -2.745 -10.117 -15.369 1.00 0.00 N ATOM 948 CA PRO A 64 -3.353 -10.735 -14.187 1.00 0.00 C ATOM 949 C PRO A 64 -3.226 -12.254 -14.197 1.00 0.00 C ATOM 950 O PRO A 64 -3.679 -12.932 -13.274 1.00 0.00 O ATOM 951 CB PRO A 64 -4.823 -10.320 -14.287 1.00 0.00 C ATOM 952 CG PRO A 64 -5.051 -10.078 -15.739 1.00 0.00 C ATOM 953 CD PRO A 64 -3.752 -9.545 -16.279 1.00 0.00 C ATOM 0 HA PRO A 64 -2.868 -10.416 -13.265 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -5.482 -11.101 -13.908 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -5.022 -9.423 -13.700 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -5.337 -10.999 -16.248 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -5.860 -9.364 -15.893 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -3.586 -9.858 -17.310 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -3.730 -8.455 -16.270 1.00 0.00 H new ATOM 961 N LYS A 65 -2.607 -12.785 -15.246 1.00 0.00 N ATOM 962 CA LYS A 65 -2.419 -14.225 -15.376 1.00 0.00 C ATOM 963 C LYS A 65 -1.212 -14.690 -14.568 1.00 0.00 C ATOM 964 O LYS A 65 -0.857 -15.869 -14.589 1.00 0.00 O ATOM 965 CB LYS A 65 -2.238 -14.605 -16.848 1.00 0.00 C ATOM 966 CG LYS A 65 -1.108 -13.858 -17.535 1.00 0.00 C ATOM 967 CD LYS A 65 -0.523 -14.664 -18.683 1.00 0.00 C ATOM 968 CE LYS A 65 0.933 -14.304 -18.931 1.00 0.00 C ATOM 969 NZ LYS A 65 1.069 -13.007 -19.651 1.00 0.00 N ATOM 0 H LYS A 65 -2.227 -12.239 -16.019 1.00 0.00 H new ATOM 0 HA LYS A 65 -3.308 -14.720 -14.986 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -2.049 -15.676 -16.917 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -3.168 -14.410 -17.382 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -1.477 -12.904 -17.910 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -0.325 -13.634 -16.810 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -0.603 -15.728 -18.460 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -1.103 -14.484 -19.588 1.00 0.00 H new ATOM 0 HE2 LYS A 65 1.460 -14.248 -17.979 1.00 0.00 H new ATOM 0 HE3 LYS A 65 1.408 -15.094 -19.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 1.788 -12.422 -19.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 1.358 -13.184 -20.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 0.156 -12.508 -19.643 1.00 0.00 H new ATOM 983 N ILE A 66 -0.586 -13.759 -13.857 1.00 0.00 N ATOM 984 CA ILE A 66 0.578 -14.076 -13.040 1.00 0.00 C ATOM 985 C ILE A 66 0.607 -13.229 -11.772 1.00 0.00 C ATOM 986 O ILE A 66 0.031 -12.143 -11.726 1.00 0.00 O ATOM 987 CB ILE A 66 1.889 -13.857 -13.819 1.00 0.00 C ATOM 988 CG1 ILE A 66 2.087 -12.370 -14.120 1.00 0.00 C ATOM 989 CG2 ILE A 66 1.880 -14.668 -15.107 1.00 0.00 C ATOM 990 CD1 ILE A 66 3.404 -12.061 -14.797 1.00 0.00 C ATOM 0 H ILE A 66 -0.866 -12.778 -13.830 1.00 0.00 H new ATOM 0 HA ILE A 66 0.496 -15.129 -12.770 1.00 0.00 H new ATOM 0 HB ILE A 66 2.722 -14.197 -13.204 1.00 0.00 H new ATOM 0 HG12 ILE A 66 1.271 -12.024 -14.755 1.00 0.00 H new ATOM 0 HG13 ILE A 66 2.026 -11.808 -13.188 1.00 0.00 H new ATOM 0 HG21 ILE A 66 2.812 -14.503 -15.647 1.00 0.00 H new ATOM 0 HG22 ILE A 66 1.780 -15.727 -14.869 1.00 0.00 H new ATOM 0 HG23 ILE A 66 1.041 -14.355 -15.728 1.00 0.00 H new ATOM 0 HD11 ILE A 66 3.476 -10.989 -14.980 1.00 0.00 H new ATOM 0 HD12 ILE A 66 4.226 -12.376 -14.154 1.00 0.00 H new ATOM 0 HD13 ILE A 66 3.460 -12.596 -15.745 1.00 0.00 H new ATOM 1002 N GLN A 67 1.283 -13.735 -10.745 1.00 0.00 N ATOM 1003 CA GLN A 67 1.388 -13.024 -9.476 1.00 0.00 C ATOM 1004 C GLN A 67 2.351 -11.847 -9.589 1.00 0.00 C ATOM 1005 O GLN A 67 3.477 -11.996 -10.066 1.00 0.00 O ATOM 1006 CB GLN A 67 1.853 -13.975 -8.371 1.00 0.00 C ATOM 1007 CG GLN A 67 3.343 -14.270 -8.411 1.00 0.00 C ATOM 1008 CD GLN A 67 3.790 -14.843 -9.741 1.00 0.00 C ATOM 1009 OE1 GLN A 67 3.369 -15.931 -10.135 1.00 0.00 O ATOM 1010 NE2 GLN A 67 4.648 -14.111 -10.443 1.00 0.00 N ATOM 0 H GLN A 67 1.765 -14.633 -10.767 1.00 0.00 H new ATOM 0 HA GLN A 67 0.401 -12.638 -9.222 1.00 0.00 H new ATOM 0 HB2 GLN A 67 1.602 -13.543 -7.402 1.00 0.00 H new ATOM 0 HB3 GLN A 67 1.303 -14.912 -8.454 1.00 0.00 H new ATOM 0 HG2 GLN A 67 3.896 -13.353 -8.211 1.00 0.00 H new ATOM 0 HG3 GLN A 67 3.592 -14.972 -7.615 1.00 0.00 H new ATOM 0 HE21 GLN A 67 4.971 -13.215 -10.079 1.00 0.00 H new ATOM 0 HE22 GLN A 67 4.984 -14.445 -11.346 1.00 0.00 H new ATOM 1019 N LEU A 68 1.903 -10.677 -9.148 1.00 0.00 N ATOM 1020 CA LEU A 68 2.725 -9.473 -9.200 1.00 0.00 C ATOM 1021 C LEU A 68 3.538 -9.314 -7.919 1.00 0.00 C ATOM 1022 O LEU A 68 3.025 -8.856 -6.897 1.00 0.00 O ATOM 1023 CB LEU A 68 1.846 -8.240 -9.416 1.00 0.00 C ATOM 1024 CG LEU A 68 2.558 -6.993 -9.941 1.00 0.00 C ATOM 1025 CD1 LEU A 68 3.135 -7.249 -11.325 1.00 0.00 C ATOM 1026 CD2 LEU A 68 1.604 -5.807 -9.970 1.00 0.00 C ATOM 0 H LEU A 68 0.974 -10.536 -8.750 1.00 0.00 H new ATOM 0 HA LEU A 68 3.416 -9.570 -10.038 1.00 0.00 H new ATOM 0 HB2 LEU A 68 1.052 -8.502 -10.115 1.00 0.00 H new ATOM 0 HB3 LEU A 68 1.367 -7.989 -8.469 1.00 0.00 H new ATOM 0 HG LEU A 68 3.380 -6.757 -9.266 1.00 0.00 H new ATOM 0 HD11 LEU A 68 3.638 -6.350 -11.682 1.00 0.00 H new ATOM 0 HD12 LEU A 68 3.851 -8.069 -11.275 1.00 0.00 H new ATOM 0 HD13 LEU A 68 2.330 -7.511 -12.012 1.00 0.00 H new ATOM 0 HD21 LEU A 68 2.127 -4.928 -10.346 1.00 0.00 H new ATOM 0 HD22 LEU A 68 0.761 -6.034 -10.622 1.00 0.00 H new ATOM 0 HD23 LEU A 68 1.240 -5.608 -8.962 1.00 0.00 H new ATOM 1038 N THR A 69 4.811 -9.693 -7.981 1.00 0.00 N ATOM 1039 CA THR A 69 5.696 -9.591 -6.827 1.00 0.00 C ATOM 1040 C THR A 69 6.220 -8.169 -6.660 1.00 0.00 C ATOM 1041 O THR A 69 6.131 -7.352 -7.577 1.00 0.00 O ATOM 1042 CB THR A 69 6.891 -10.555 -6.949 1.00 0.00 C ATOM 1043 OG1 THR A 69 7.738 -10.151 -8.030 1.00 0.00 O ATOM 1044 CG2 THR A 69 6.414 -11.982 -7.177 1.00 0.00 C ATOM 0 H THR A 69 5.252 -10.073 -8.818 1.00 0.00 H new ATOM 0 HA THR A 69 5.107 -9.863 -5.951 1.00 0.00 H new ATOM 0 HB THR A 69 7.453 -10.522 -6.016 1.00 0.00 H new ATOM 0 HG1 THR A 69 8.496 -10.768 -8.100 1.00 0.00 H new ATOM 0 HG21 THR A 69 7.275 -12.645 -7.260 1.00 0.00 H new ATOM 0 HG22 THR A 69 5.794 -12.297 -6.338 1.00 0.00 H new ATOM 0 HG23 THR A 69 5.831 -12.028 -8.097 1.00 0.00 H new ATOM 1052 N PHE A 70 6.767 -7.880 -5.484 1.00 0.00 N ATOM 1053 CA PHE A 70 7.305 -6.555 -5.197 1.00 0.00 C ATOM 1054 C PHE A 70 8.434 -6.206 -6.162 1.00 0.00 C ATOM 1055 O PHE A 70 8.521 -5.080 -6.649 1.00 0.00 O ATOM 1056 CB PHE A 70 7.813 -6.490 -3.755 1.00 0.00 C ATOM 1057 CG PHE A 70 8.833 -5.411 -3.527 1.00 0.00 C ATOM 1058 CD1 PHE A 70 8.438 -4.110 -3.263 1.00 0.00 C ATOM 1059 CD2 PHE A 70 10.188 -5.699 -3.576 1.00 0.00 C ATOM 1060 CE1 PHE A 70 9.375 -3.115 -3.054 1.00 0.00 C ATOM 1061 CE2 PHE A 70 11.129 -4.708 -3.367 1.00 0.00 C ATOM 1062 CZ PHE A 70 10.722 -3.415 -3.105 1.00 0.00 C ATOM 0 H PHE A 70 6.849 -8.545 -4.715 1.00 0.00 H new ATOM 0 HA PHE A 70 6.503 -5.828 -5.326 1.00 0.00 H new ATOM 0 HB2 PHE A 70 6.967 -6.326 -3.087 1.00 0.00 H new ATOM 0 HB3 PHE A 70 8.248 -7.453 -3.488 1.00 0.00 H new ATOM 0 HD1 PHE A 70 7.386 -3.870 -3.220 1.00 0.00 H new ATOM 0 HD2 PHE A 70 10.512 -6.709 -3.780 1.00 0.00 H new ATOM 0 HE1 PHE A 70 9.054 -2.104 -2.851 1.00 0.00 H new ATOM 0 HE2 PHE A 70 12.182 -4.945 -3.409 1.00 0.00 H new ATOM 0 HZ PHE A 70 11.456 -2.640 -2.940 1.00 0.00 H new ATOM 1072 N GLU A 71 9.297 -7.181 -6.432 1.00 0.00 N ATOM 1073 CA GLU A 71 10.421 -6.976 -7.337 1.00 0.00 C ATOM 1074 C GLU A 71 9.937 -6.539 -8.717 1.00 0.00 C ATOM 1075 O GLU A 71 10.298 -5.468 -9.203 1.00 0.00 O ATOM 1076 CB GLU A 71 11.248 -8.258 -7.458 1.00 0.00 C ATOM 1077 CG GLU A 71 12.110 -8.544 -6.239 1.00 0.00 C ATOM 1078 CD GLU A 71 13.235 -9.516 -6.535 1.00 0.00 C ATOM 1079 OE1 GLU A 71 13.624 -9.633 -7.716 1.00 0.00 O ATOM 1080 OE2 GLU A 71 13.726 -10.161 -5.585 1.00 0.00 O ATOM 0 H GLU A 71 9.239 -8.120 -6.037 1.00 0.00 H new ATOM 0 HA GLU A 71 11.047 -6.185 -6.923 1.00 0.00 H new ATOM 0 HB2 GLU A 71 10.576 -9.100 -7.623 1.00 0.00 H new ATOM 0 HB3 GLU A 71 11.889 -8.185 -8.337 1.00 0.00 H new ATOM 0 HG2 GLU A 71 12.531 -7.609 -5.869 1.00 0.00 H new ATOM 0 HG3 GLU A 71 11.485 -8.949 -5.443 1.00 0.00 H new ATOM 1087 N ALA A 72 9.117 -7.378 -9.342 1.00 0.00 N ATOM 1088 CA ALA A 72 8.581 -7.078 -10.664 1.00 0.00 C ATOM 1089 C ALA A 72 8.042 -5.653 -10.729 1.00 0.00 C ATOM 1090 O ALA A 72 8.502 -4.839 -11.530 1.00 0.00 O ATOM 1091 CB ALA A 72 7.490 -8.074 -11.030 1.00 0.00 C ATOM 0 H ALA A 72 8.810 -8.270 -8.954 1.00 0.00 H new ATOM 0 HA ALA A 72 9.394 -7.164 -11.385 1.00 0.00 H new ATOM 0 HB1 ALA A 72 7.099 -7.838 -12.020 1.00 0.00 H new ATOM 0 HB2 ALA A 72 7.904 -9.082 -11.035 1.00 0.00 H new ATOM 0 HB3 ALA A 72 6.684 -8.016 -10.298 1.00 0.00 H new ATOM 1097 N THR A 73 7.063 -5.356 -9.879 1.00 0.00 N ATOM 1098 CA THR A 73 6.461 -4.030 -9.841 1.00 0.00 C ATOM 1099 C THR A 73 7.527 -2.943 -9.775 1.00 0.00 C ATOM 1100 O THR A 73 7.419 -1.911 -10.439 1.00 0.00 O ATOM 1101 CB THR A 73 5.513 -3.878 -8.635 1.00 0.00 C ATOM 1102 OG1 THR A 73 4.526 -4.915 -8.655 1.00 0.00 O ATOM 1103 CG2 THR A 73 4.830 -2.519 -8.652 1.00 0.00 C ATOM 0 H THR A 73 6.671 -6.017 -9.208 1.00 0.00 H new ATOM 0 HA THR A 73 5.888 -3.917 -10.761 1.00 0.00 H new ATOM 0 HB THR A 73 6.104 -3.958 -7.723 1.00 0.00 H new ATOM 0 HG1 THR A 73 4.877 -5.709 -8.200 1.00 0.00 H new ATOM 0 HG21 THR A 73 4.166 -2.435 -7.792 1.00 0.00 H new ATOM 0 HG22 THR A 73 5.583 -1.733 -8.607 1.00 0.00 H new ATOM 0 HG23 THR A 73 4.250 -2.415 -9.569 1.00 0.00 H new ATOM 1111 N LEU A 74 8.557 -3.180 -8.970 1.00 0.00 N ATOM 1112 CA LEU A 74 9.646 -2.220 -8.818 1.00 0.00 C ATOM 1113 C LEU A 74 10.422 -2.065 -10.122 1.00 0.00 C ATOM 1114 O LEU A 74 10.572 -0.958 -10.637 1.00 0.00 O ATOM 1115 CB LEU A 74 10.590 -2.663 -7.699 1.00 0.00 C ATOM 1116 CG LEU A 74 11.959 -1.983 -7.666 1.00 0.00 C ATOM 1117 CD1 LEU A 74 11.878 -0.656 -6.928 1.00 0.00 C ATOM 1118 CD2 LEU A 74 12.992 -2.893 -7.020 1.00 0.00 C ATOM 0 H LEU A 74 8.661 -4.028 -8.413 1.00 0.00 H new ATOM 0 HA LEU A 74 9.212 -1.254 -8.558 1.00 0.00 H new ATOM 0 HB2 LEU A 74 10.096 -2.487 -6.743 1.00 0.00 H new ATOM 0 HB3 LEU A 74 10.743 -3.739 -7.785 1.00 0.00 H new ATOM 0 HG LEU A 74 12.270 -1.786 -8.692 1.00 0.00 H new ATOM 0 HD11 LEU A 74 12.862 -0.187 -6.915 1.00 0.00 H new ATOM 0 HD12 LEU A 74 11.170 -0.000 -7.435 1.00 0.00 H new ATOM 0 HD13 LEU A 74 11.544 -0.829 -5.905 1.00 0.00 H new ATOM 0 HD21 LEU A 74 13.960 -2.392 -7.006 1.00 0.00 H new ATOM 0 HD22 LEU A 74 12.687 -3.123 -5.999 1.00 0.00 H new ATOM 0 HD23 LEU A 74 13.071 -3.818 -7.592 1.00 0.00 H new ATOM 1130 N GLN A 75 10.909 -3.183 -10.650 1.00 0.00 N ATOM 1131 CA GLN A 75 11.668 -3.171 -11.895 1.00 0.00 C ATOM 1132 C GLN A 75 10.922 -2.401 -12.980 1.00 0.00 C ATOM 1133 O GLN A 75 11.484 -1.515 -13.623 1.00 0.00 O ATOM 1134 CB GLN A 75 11.942 -4.600 -12.365 1.00 0.00 C ATOM 1135 CG GLN A 75 12.899 -5.363 -11.464 1.00 0.00 C ATOM 1136 CD GLN A 75 14.353 -5.116 -11.815 1.00 0.00 C ATOM 1137 OE1 GLN A 75 14.934 -5.822 -12.640 1.00 0.00 O ATOM 1138 NE2 GLN A 75 14.951 -4.109 -11.188 1.00 0.00 N ATOM 0 H GLN A 75 10.792 -4.108 -10.236 1.00 0.00 H new ATOM 0 HA GLN A 75 12.618 -2.670 -11.706 1.00 0.00 H new ATOM 0 HB2 GLN A 75 10.998 -5.143 -12.421 1.00 0.00 H new ATOM 0 HB3 GLN A 75 12.353 -4.569 -13.374 1.00 0.00 H new ATOM 0 HG2 GLN A 75 12.725 -5.073 -10.428 1.00 0.00 H new ATOM 0 HG3 GLN A 75 12.688 -6.430 -11.537 1.00 0.00 H new ATOM 0 HE21 GLN A 75 14.432 -3.549 -10.511 1.00 0.00 H new ATOM 0 HE22 GLN A 75 15.929 -3.896 -11.383 1.00 0.00 H new ATOM 1147 N GLN A 76 9.654 -2.747 -13.178 1.00 0.00 N ATOM 1148 CA GLN A 76 8.831 -2.088 -14.186 1.00 0.00 C ATOM 1149 C GLN A 76 8.693 -0.599 -13.888 1.00 0.00 C ATOM 1150 O GLN A 76 8.717 0.232 -14.798 1.00 0.00 O ATOM 1151 CB GLN A 76 7.448 -2.738 -14.251 1.00 0.00 C ATOM 1152 CG GLN A 76 7.485 -4.212 -14.624 1.00 0.00 C ATOM 1153 CD GLN A 76 6.255 -4.963 -14.156 1.00 0.00 C ATOM 1154 OE1 GLN A 76 5.467 -5.453 -14.965 1.00 0.00 O ATOM 1155 NE2 GLN A 76 6.083 -5.059 -12.842 1.00 0.00 N ATOM 0 H GLN A 76 9.174 -3.479 -12.654 1.00 0.00 H new ATOM 0 HA GLN A 76 9.324 -2.202 -15.152 1.00 0.00 H new ATOM 0 HB2 GLN A 76 6.959 -2.629 -13.283 1.00 0.00 H new ATOM 0 HB3 GLN A 76 6.838 -2.203 -14.979 1.00 0.00 H new ATOM 0 HG2 GLN A 76 7.574 -4.307 -15.706 1.00 0.00 H new ATOM 0 HG3 GLN A 76 8.373 -4.671 -14.190 1.00 0.00 H new ATOM 0 HE21 GLN A 76 6.761 -4.638 -12.207 1.00 0.00 H new ATOM 0 HE22 GLN A 76 5.273 -5.554 -12.468 1.00 0.00 H new ATOM 1164 N LEU A 77 8.547 -0.268 -12.610 1.00 0.00 N ATOM 1165 CA LEU A 77 8.404 1.122 -12.192 1.00 0.00 C ATOM 1166 C LEU A 77 9.566 1.967 -12.703 1.00 0.00 C ATOM 1167 O LEU A 77 10.610 1.438 -13.083 1.00 0.00 O ATOM 1168 CB LEU A 77 8.326 1.211 -10.667 1.00 0.00 C ATOM 1169 CG LEU A 77 6.921 1.209 -10.065 1.00 0.00 C ATOM 1170 CD1 LEU A 77 6.959 0.730 -8.622 1.00 0.00 C ATOM 1171 CD2 LEU A 77 6.300 2.595 -10.153 1.00 0.00 C ATOM 0 H LEU A 77 8.525 -0.943 -11.845 1.00 0.00 H new ATOM 0 HA LEU A 77 7.480 1.511 -12.620 1.00 0.00 H new ATOM 0 HB2 LEU A 77 8.881 0.373 -10.245 1.00 0.00 H new ATOM 0 HB3 LEU A 77 8.834 2.122 -10.350 1.00 0.00 H new ATOM 0 HG LEU A 77 6.302 0.519 -10.639 1.00 0.00 H new ATOM 0 HD11 LEU A 77 5.950 0.735 -8.210 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.361 -0.283 -8.585 1.00 0.00 H new ATOM 0 HD13 LEU A 77 7.594 1.394 -8.035 1.00 0.00 H new ATOM 0 HD21 LEU A 77 5.300 2.574 -9.720 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.918 3.306 -9.605 1.00 0.00 H new ATOM 0 HD23 LEU A 77 6.236 2.899 -11.198 1.00 0.00 H new ATOM 1183 N GLU A 78 9.378 3.283 -12.708 1.00 0.00 N ATOM 1184 CA GLU A 78 10.412 4.201 -13.171 1.00 0.00 C ATOM 1185 C GLU A 78 10.578 5.368 -12.202 1.00 0.00 C ATOM 1186 O GLU A 78 9.624 6.090 -11.914 1.00 0.00 O ATOM 1187 CB GLU A 78 10.069 4.728 -14.566 1.00 0.00 C ATOM 1188 CG GLU A 78 8.727 5.436 -14.637 1.00 0.00 C ATOM 1189 CD GLU A 78 8.457 6.040 -16.002 1.00 0.00 C ATOM 1190 OE1 GLU A 78 9.205 6.955 -16.405 1.00 0.00 O ATOM 1191 OE2 GLU A 78 7.498 5.596 -16.667 1.00 0.00 O ATOM 0 H GLU A 78 8.519 3.737 -12.397 1.00 0.00 H new ATOM 0 HA GLU A 78 11.353 3.653 -13.218 1.00 0.00 H new ATOM 0 HB2 GLU A 78 10.851 5.416 -14.887 1.00 0.00 H new ATOM 0 HB3 GLU A 78 10.069 3.895 -15.270 1.00 0.00 H new ATOM 0 HG2 GLU A 78 7.934 4.729 -14.394 1.00 0.00 H new ATOM 0 HG3 GLU A 78 8.695 6.223 -13.883 1.00 0.00 H new ATOM 1198 N ALA A 79 11.797 5.545 -11.702 1.00 0.00 N ATOM 1199 CA ALA A 79 12.089 6.623 -10.766 1.00 0.00 C ATOM 1200 C ALA A 79 11.464 7.935 -11.228 1.00 0.00 C ATOM 1201 O ALA A 79 11.103 8.102 -12.393 1.00 0.00 O ATOM 1202 CB ALA A 79 13.593 6.783 -10.599 1.00 0.00 C ATOM 0 H ALA A 79 12.598 4.956 -11.930 1.00 0.00 H new ATOM 0 HA ALA A 79 11.653 6.362 -9.802 1.00 0.00 H new ATOM 0 HB1 ALA A 79 13.797 7.592 -9.897 1.00 0.00 H new ATOM 0 HB2 ALA A 79 14.017 5.855 -10.216 1.00 0.00 H new ATOM 0 HB3 ALA A 79 14.043 7.017 -11.564 1.00 0.00 H new ATOM 1208 N PRO A 80 11.332 8.890 -10.295 1.00 0.00 N ATOM 1209 CA PRO A 80 11.758 8.702 -8.905 1.00 0.00 C ATOM 1210 C PRO A 80 10.874 7.711 -8.157 1.00 0.00 C ATOM 1211 O PRO A 80 11.119 7.403 -6.990 1.00 0.00 O ATOM 1212 CB PRO A 80 11.622 10.102 -8.301 1.00 0.00 C ATOM 1213 CG PRO A 80 10.590 10.777 -9.136 1.00 0.00 C ATOM 1214 CD PRO A 80 10.756 10.225 -10.525 1.00 0.00 C ATOM 0 HA PRO A 80 12.765 8.290 -8.839 1.00 0.00 H new ATOM 0 HB2 PRO A 80 11.316 10.054 -7.256 1.00 0.00 H new ATOM 0 HB3 PRO A 80 12.570 10.640 -8.331 1.00 0.00 H new ATOM 0 HG2 PRO A 80 9.588 10.579 -8.754 1.00 0.00 H new ATOM 0 HG3 PRO A 80 10.727 11.858 -9.127 1.00 0.00 H new ATOM 0 HD2 PRO A 80 9.803 10.166 -11.051 1.00 0.00 H new ATOM 0 HD3 PRO A 80 11.415 10.848 -11.129 1.00 0.00 H new ATOM 1222 N TYR A 81 9.846 7.213 -8.834 1.00 0.00 N ATOM 1223 CA TYR A 81 8.924 6.258 -8.232 1.00 0.00 C ATOM 1224 C TYR A 81 9.681 5.096 -7.596 1.00 0.00 C ATOM 1225 O TYR A 81 9.552 4.836 -6.401 1.00 0.00 O ATOM 1226 CB TYR A 81 7.946 5.729 -9.283 1.00 0.00 C ATOM 1227 CG TYR A 81 7.313 6.816 -10.123 1.00 0.00 C ATOM 1228 CD1 TYR A 81 6.995 8.051 -9.571 1.00 0.00 C ATOM 1229 CD2 TYR A 81 7.032 6.608 -11.467 1.00 0.00 C ATOM 1230 CE1 TYR A 81 6.416 9.046 -10.333 1.00 0.00 C ATOM 1231 CE2 TYR A 81 6.455 7.598 -12.238 1.00 0.00 C ATOM 1232 CZ TYR A 81 6.149 8.816 -11.667 1.00 0.00 C ATOM 1233 OH TYR A 81 5.572 9.804 -12.431 1.00 0.00 O ATOM 0 H TYR A 81 9.630 7.455 -9.801 1.00 0.00 H new ATOM 0 HA TYR A 81 8.365 6.774 -7.452 1.00 0.00 H new ATOM 0 HB2 TYR A 81 8.471 5.034 -9.939 1.00 0.00 H new ATOM 0 HB3 TYR A 81 7.160 5.163 -8.783 1.00 0.00 H new ATOM 0 HD1 TYR A 81 7.204 8.236 -8.528 1.00 0.00 H new ATOM 0 HD2 TYR A 81 7.269 5.655 -11.917 1.00 0.00 H new ATOM 0 HE1 TYR A 81 6.173 9.999 -9.887 1.00 0.00 H new ATOM 0 HE2 TYR A 81 6.245 7.420 -13.282 1.00 0.00 H new ATOM 0 HH TYR A 81 4.645 9.560 -12.636 1.00 0.00 H new ATOM 1243 N ASN A 82 10.474 4.401 -8.406 1.00 0.00 N ATOM 1244 CA ASN A 82 11.254 3.267 -7.924 1.00 0.00 C ATOM 1245 C ASN A 82 12.374 3.731 -6.998 1.00 0.00 C ATOM 1246 O ASN A 82 12.834 2.981 -6.138 1.00 0.00 O ATOM 1247 CB ASN A 82 11.840 2.487 -9.102 1.00 0.00 C ATOM 1248 CG ASN A 82 12.703 3.355 -9.998 1.00 0.00 C ATOM 1249 OD1 ASN A 82 13.152 4.429 -9.595 1.00 0.00 O ATOM 1250 ND2 ASN A 82 12.939 2.893 -11.220 1.00 0.00 N ATOM 0 H ASN A 82 10.593 4.603 -9.399 1.00 0.00 H new ATOM 0 HA ASN A 82 10.588 2.614 -7.360 1.00 0.00 H new ATOM 0 HB2 ASN A 82 12.435 1.656 -8.724 1.00 0.00 H new ATOM 0 HB3 ASN A 82 11.029 2.057 -9.689 1.00 0.00 H new ATOM 0 HD21 ASN A 82 13.513 3.433 -11.867 1.00 0.00 H new ATOM 0 HD22 ASN A 82 12.547 1.998 -11.511 1.00 0.00 H new ATOM 1257 N SER A 83 12.809 4.974 -7.182 1.00 0.00 N ATOM 1258 CA SER A 83 13.878 5.538 -6.366 1.00 0.00 C ATOM 1259 C SER A 83 13.668 5.207 -4.891 1.00 0.00 C ATOM 1260 O SER A 83 14.575 4.719 -4.218 1.00 0.00 O ATOM 1261 CB SER A 83 13.946 7.055 -6.555 1.00 0.00 C ATOM 1262 OG SER A 83 15.143 7.583 -6.010 1.00 0.00 O ATOM 0 H SER A 83 12.438 5.609 -7.889 1.00 0.00 H new ATOM 0 HA SER A 83 14.820 5.096 -6.689 1.00 0.00 H new ATOM 0 HB2 SER A 83 13.889 7.295 -7.617 1.00 0.00 H new ATOM 0 HB3 SER A 83 13.087 7.523 -6.075 1.00 0.00 H new ATOM 0 HG SER A 83 15.164 8.553 -6.145 1.00 0.00 H new ATOM 1268 N ASP A 84 12.465 5.477 -4.397 1.00 0.00 N ATOM 1269 CA ASP A 84 12.133 5.207 -3.002 1.00 0.00 C ATOM 1270 C ASP A 84 11.427 3.862 -2.862 1.00 0.00 C ATOM 1271 O ASP A 84 10.198 3.787 -2.901 1.00 0.00 O ATOM 1272 CB ASP A 84 11.250 6.322 -2.441 1.00 0.00 C ATOM 1273 CG ASP A 84 12.056 7.515 -1.965 1.00 0.00 C ATOM 1274 OD1 ASP A 84 12.962 7.322 -1.128 1.00 0.00 O ATOM 1275 OD2 ASP A 84 11.780 8.641 -2.429 1.00 0.00 O ATOM 0 H ASP A 84 11.703 5.882 -4.941 1.00 0.00 H new ATOM 0 HA ASP A 84 13.062 5.170 -2.433 1.00 0.00 H new ATOM 0 HB2 ASP A 84 10.547 6.645 -3.208 1.00 0.00 H new ATOM 0 HB3 ASP A 84 10.660 5.932 -1.612 1.00 0.00 H new ATOM 1280 N THR A 85 12.211 2.801 -2.699 1.00 0.00 N ATOM 1281 CA THR A 85 11.661 1.459 -2.555 1.00 0.00 C ATOM 1282 C THR A 85 10.703 1.382 -1.372 1.00 0.00 C ATOM 1283 O THR A 85 9.643 0.761 -1.458 1.00 0.00 O ATOM 1284 CB THR A 85 12.776 0.413 -2.368 1.00 0.00 C ATOM 1285 OG1 THR A 85 13.667 0.827 -1.327 1.00 0.00 O ATOM 1286 CG2 THR A 85 13.554 0.215 -3.660 1.00 0.00 C ATOM 0 H THR A 85 13.229 2.845 -2.663 1.00 0.00 H new ATOM 0 HA THR A 85 11.117 1.239 -3.474 1.00 0.00 H new ATOM 0 HB THR A 85 12.313 -0.534 -2.093 1.00 0.00 H new ATOM 0 HG1 THR A 85 14.372 0.156 -1.213 1.00 0.00 H new ATOM 0 HG21 THR A 85 14.336 -0.528 -3.504 1.00 0.00 H new ATOM 0 HG22 THR A 85 12.878 -0.129 -4.443 1.00 0.00 H new ATOM 0 HG23 THR A 85 14.006 1.160 -3.961 1.00 0.00 H new ATOM 1294 N VAL A 86 11.082 2.016 -0.267 1.00 0.00 N ATOM 1295 CA VAL A 86 10.255 2.020 0.934 1.00 0.00 C ATOM 1296 C VAL A 86 8.788 2.250 0.590 1.00 0.00 C ATOM 1297 O VAL A 86 7.896 1.651 1.193 1.00 0.00 O ATOM 1298 CB VAL A 86 10.714 3.104 1.928 1.00 0.00 C ATOM 1299 CG1 VAL A 86 10.253 4.479 1.468 1.00 0.00 C ATOM 1300 CG2 VAL A 86 10.196 2.798 3.325 1.00 0.00 C ATOM 0 H VAL A 86 11.956 2.534 -0.179 1.00 0.00 H new ATOM 0 HA VAL A 86 10.367 1.040 1.399 1.00 0.00 H new ATOM 0 HB VAL A 86 11.803 3.105 1.962 1.00 0.00 H new ATOM 0 HG11 VAL A 86 10.586 5.232 2.182 1.00 0.00 H new ATOM 0 HG12 VAL A 86 10.677 4.696 0.488 1.00 0.00 H new ATOM 0 HG13 VAL A 86 9.165 4.496 1.404 1.00 0.00 H new ATOM 0 HG21 VAL A 86 10.529 3.573 4.015 1.00 0.00 H new ATOM 0 HG22 VAL A 86 9.106 2.769 3.311 1.00 0.00 H new ATOM 0 HG23 VAL A 86 10.580 1.832 3.652 1.00 0.00 H new ATOM 1310 N LEU A 87 8.543 3.119 -0.384 1.00 0.00 N ATOM 1311 CA LEU A 87 7.183 3.429 -0.810 1.00 0.00 C ATOM 1312 C LEU A 87 6.603 2.293 -1.647 1.00 0.00 C ATOM 1313 O LEU A 87 5.440 1.921 -1.487 1.00 0.00 O ATOM 1314 CB LEU A 87 7.162 4.730 -1.613 1.00 0.00 C ATOM 1315 CG LEU A 87 5.828 5.476 -1.648 1.00 0.00 C ATOM 1316 CD1 LEU A 87 5.424 5.913 -0.248 1.00 0.00 C ATOM 1317 CD2 LEU A 87 5.912 6.677 -2.580 1.00 0.00 C ATOM 0 H LEU A 87 9.269 3.622 -0.894 1.00 0.00 H new ATOM 0 HA LEU A 87 6.568 3.550 0.082 1.00 0.00 H new ATOM 0 HB2 LEU A 87 7.919 5.399 -1.203 1.00 0.00 H new ATOM 0 HB3 LEU A 87 7.457 4.506 -2.638 1.00 0.00 H new ATOM 0 HG LEU A 87 5.065 4.798 -2.030 1.00 0.00 H new ATOM 0 HD11 LEU A 87 4.472 6.442 -0.293 1.00 0.00 H new ATOM 0 HD12 LEU A 87 5.322 5.036 0.392 1.00 0.00 H new ATOM 0 HD13 LEU A 87 6.188 6.574 0.161 1.00 0.00 H new ATOM 0 HD21 LEU A 87 4.953 7.196 -2.592 1.00 0.00 H new ATOM 0 HD22 LEU A 87 6.688 7.357 -2.228 1.00 0.00 H new ATOM 0 HD23 LEU A 87 6.155 6.339 -3.588 1.00 0.00 H new ATOM 1329 N VAL A 88 7.422 1.743 -2.538 1.00 0.00 N ATOM 1330 CA VAL A 88 6.991 0.647 -3.398 1.00 0.00 C ATOM 1331 C VAL A 88 6.683 -0.603 -2.582 1.00 0.00 C ATOM 1332 O VAL A 88 5.850 -1.422 -2.971 1.00 0.00 O ATOM 1333 CB VAL A 88 8.062 0.307 -4.452 1.00 0.00 C ATOM 1334 CG1 VAL A 88 7.616 -0.870 -5.305 1.00 0.00 C ATOM 1335 CG2 VAL A 88 8.360 1.522 -5.319 1.00 0.00 C ATOM 0 H VAL A 88 8.387 2.038 -2.683 1.00 0.00 H new ATOM 0 HA VAL A 88 6.085 0.979 -3.905 1.00 0.00 H new ATOM 0 HB VAL A 88 8.979 0.024 -3.935 1.00 0.00 H new ATOM 0 HG11 VAL A 88 8.385 -1.096 -6.044 1.00 0.00 H new ATOM 0 HG12 VAL A 88 7.457 -1.741 -4.669 1.00 0.00 H new ATOM 0 HG13 VAL A 88 6.686 -0.618 -5.815 1.00 0.00 H new ATOM 0 HG21 VAL A 88 9.119 1.264 -6.058 1.00 0.00 H new ATOM 0 HG22 VAL A 88 7.449 1.838 -5.828 1.00 0.00 H new ATOM 0 HG23 VAL A 88 8.726 2.335 -4.692 1.00 0.00 H new ATOM 1345 N HIS A 89 7.359 -0.743 -1.446 1.00 0.00 N ATOM 1346 CA HIS A 89 7.157 -1.894 -0.573 1.00 0.00 C ATOM 1347 C HIS A 89 5.876 -1.739 0.242 1.00 0.00 C ATOM 1348 O HIS A 89 5.162 -2.712 0.485 1.00 0.00 O ATOM 1349 CB HIS A 89 8.353 -2.067 0.364 1.00 0.00 C ATOM 1350 CG HIS A 89 8.190 -3.188 1.343 1.00 0.00 C ATOM 1351 ND1 HIS A 89 8.997 -4.306 1.349 1.00 0.00 N ATOM 1352 CD2 HIS A 89 7.306 -3.360 2.354 1.00 0.00 C ATOM 1353 CE1 HIS A 89 8.616 -5.117 2.320 1.00 0.00 C ATOM 1354 NE2 HIS A 89 7.592 -4.566 2.945 1.00 0.00 N ATOM 0 H HIS A 89 8.051 -0.074 -1.109 1.00 0.00 H new ATOM 0 HA HIS A 89 7.064 -2.782 -1.199 1.00 0.00 H new ATOM 0 HB2 HIS A 89 9.248 -2.244 -0.232 1.00 0.00 H new ATOM 0 HB3 HIS A 89 8.513 -1.138 0.911 1.00 0.00 H new ATOM 0 HD2 HIS A 89 6.522 -2.676 2.642 1.00 0.00 H new ATOM 0 HE1 HIS A 89 9.066 -6.069 2.561 1.00 0.00 H new ATOM 0 HE2 HIS A 89 7.094 -4.970 3.738 1.00 0.00 H new ATOM 1363 N ARG A 90 5.592 -0.510 0.661 1.00 0.00 N ATOM 1364 CA ARG A 90 4.399 -0.229 1.450 1.00 0.00 C ATOM 1365 C ARG A 90 3.154 -0.214 0.567 1.00 0.00 C ATOM 1366 O ARG A 90 2.121 -0.781 0.922 1.00 0.00 O ATOM 1367 CB ARG A 90 4.542 1.113 2.170 1.00 0.00 C ATOM 1368 CG ARG A 90 5.664 1.137 3.195 1.00 0.00 C ATOM 1369 CD ARG A 90 6.153 2.554 3.454 1.00 0.00 C ATOM 1370 NE ARG A 90 6.973 2.639 4.659 1.00 0.00 N ATOM 1371 CZ ARG A 90 7.572 3.753 5.063 1.00 0.00 C ATOM 1372 NH1 ARG A 90 7.443 4.871 4.362 1.00 0.00 N ATOM 1373 NH2 ARG A 90 8.302 3.751 6.171 1.00 0.00 N ATOM 0 H ARG A 90 6.172 0.307 0.467 1.00 0.00 H new ATOM 0 HA ARG A 90 4.289 -1.021 2.191 1.00 0.00 H new ATOM 0 HB2 ARG A 90 4.719 1.895 1.432 1.00 0.00 H new ATOM 0 HB3 ARG A 90 3.602 1.351 2.667 1.00 0.00 H new ATOM 0 HG2 ARG A 90 5.315 0.695 4.128 1.00 0.00 H new ATOM 0 HG3 ARG A 90 6.493 0.524 2.843 1.00 0.00 H new ATOM 0 HD2 ARG A 90 6.731 2.900 2.597 1.00 0.00 H new ATOM 0 HD3 ARG A 90 5.296 3.221 3.551 1.00 0.00 H new ATOM 0 HE ARG A 90 7.092 1.796 5.221 1.00 0.00 H new ATOM 0 HH11 ARG A 90 6.882 4.877 3.510 1.00 0.00 H new ATOM 0 HH12 ARG A 90 7.904 5.725 4.675 1.00 0.00 H new ATOM 0 HH21 ARG A 90 8.403 2.893 6.713 1.00 0.00 H new ATOM 0 HH22 ARG A 90 8.762 4.607 6.480 1.00 0.00 H new ATOM 1387 N VAL A 91 3.261 0.440 -0.586 1.00 0.00 N ATOM 1388 CA VAL A 91 2.145 0.529 -1.520 1.00 0.00 C ATOM 1389 C VAL A 91 1.772 -0.846 -2.063 1.00 0.00 C ATOM 1390 O VAL A 91 0.642 -1.306 -1.893 1.00 0.00 O ATOM 1391 CB VAL A 91 2.474 1.463 -2.700 1.00 0.00 C ATOM 1392 CG1 VAL A 91 1.330 1.482 -3.701 1.00 0.00 C ATOM 1393 CG2 VAL A 91 2.780 2.866 -2.200 1.00 0.00 C ATOM 0 H VAL A 91 4.109 0.916 -0.895 1.00 0.00 H new ATOM 0 HA VAL A 91 1.300 0.939 -0.966 1.00 0.00 H new ATOM 0 HB VAL A 91 3.361 1.082 -3.206 1.00 0.00 H new ATOM 0 HG11 VAL A 91 1.581 2.147 -4.527 1.00 0.00 H new ATOM 0 HG12 VAL A 91 1.164 0.475 -4.083 1.00 0.00 H new ATOM 0 HG13 VAL A 91 0.424 1.838 -3.211 1.00 0.00 H new ATOM 0 HG21 VAL A 91 3.010 3.512 -3.047 1.00 0.00 H new ATOM 0 HG22 VAL A 91 1.914 3.260 -1.668 1.00 0.00 H new ATOM 0 HG23 VAL A 91 3.636 2.833 -1.526 1.00 0.00 H new ATOM 1403 N HIS A 92 2.728 -1.498 -2.716 1.00 0.00 N ATOM 1404 CA HIS A 92 2.500 -2.822 -3.284 1.00 0.00 C ATOM 1405 C HIS A 92 1.849 -3.747 -2.259 1.00 0.00 C ATOM 1406 O HIS A 92 1.095 -4.651 -2.617 1.00 0.00 O ATOM 1407 CB HIS A 92 3.818 -3.426 -3.768 1.00 0.00 C ATOM 1408 CG HIS A 92 3.653 -4.739 -4.470 1.00 0.00 C ATOM 1409 ND1 HIS A 92 3.609 -5.946 -3.806 1.00 0.00 N ATOM 1410 CD2 HIS A 92 3.520 -5.029 -5.785 1.00 0.00 C ATOM 1411 CE1 HIS A 92 3.457 -6.923 -4.683 1.00 0.00 C ATOM 1412 NE2 HIS A 92 3.400 -6.393 -5.891 1.00 0.00 N ATOM 0 H HIS A 92 3.668 -1.131 -2.865 1.00 0.00 H new ATOM 0 HA HIS A 92 1.825 -2.715 -4.133 1.00 0.00 H new ATOM 0 HB2 HIS A 92 4.305 -2.722 -4.442 1.00 0.00 H new ATOM 0 HB3 HIS A 92 4.482 -3.561 -2.914 1.00 0.00 H new ATOM 0 HD2 HIS A 92 3.510 -4.320 -6.600 1.00 0.00 H new ATOM 0 HE1 HIS A 92 3.391 -7.976 -4.451 1.00 0.00 H new ATOM 0 HE2 HIS A 92 3.285 -6.912 -6.761 1.00 0.00 H new ATOM 1421 N SER A 93 2.147 -3.514 -0.985 1.00 0.00 N ATOM 1422 CA SER A 93 1.595 -4.329 0.090 1.00 0.00 C ATOM 1423 C SER A 93 0.111 -4.036 0.286 1.00 0.00 C ATOM 1424 O SER A 93 -0.737 -4.907 0.087 1.00 0.00 O ATOM 1425 CB SER A 93 2.354 -4.073 1.394 1.00 0.00 C ATOM 1426 OG SER A 93 2.274 -5.193 2.259 1.00 0.00 O ATOM 0 H SER A 93 2.768 -2.767 -0.672 1.00 0.00 H new ATOM 0 HA SER A 93 1.707 -5.377 -0.187 1.00 0.00 H new ATOM 0 HB2 SER A 93 3.399 -3.854 1.173 1.00 0.00 H new ATOM 0 HB3 SER A 93 1.942 -3.195 1.892 1.00 0.00 H new ATOM 0 HG SER A 93 2.768 -5.005 3.084 1.00 0.00 H new ATOM 1432 N TYR A 94 -0.196 -2.805 0.678 1.00 0.00 N ATOM 1433 CA TYR A 94 -1.577 -2.396 0.904 1.00 0.00 C ATOM 1434 C TYR A 94 -2.501 -2.990 -0.154 1.00 0.00 C ATOM 1435 O TYR A 94 -3.630 -3.387 0.141 1.00 0.00 O ATOM 1436 CB TYR A 94 -1.688 -0.871 0.895 1.00 0.00 C ATOM 1437 CG TYR A 94 -3.037 -0.364 0.437 1.00 0.00 C ATOM 1438 CD1 TYR A 94 -3.385 -0.376 -0.908 1.00 0.00 C ATOM 1439 CD2 TYR A 94 -3.963 0.125 1.350 1.00 0.00 C ATOM 1440 CE1 TYR A 94 -4.616 0.087 -1.331 1.00 0.00 C ATOM 1441 CE2 TYR A 94 -5.197 0.589 0.936 1.00 0.00 C ATOM 1442 CZ TYR A 94 -5.519 0.568 -0.405 1.00 0.00 C ATOM 1443 OH TYR A 94 -6.747 1.029 -0.822 1.00 0.00 O ATOM 0 H TYR A 94 0.493 -2.072 0.846 1.00 0.00 H new ATOM 0 HA TYR A 94 -1.884 -2.770 1.881 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -1.490 -0.495 1.899 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -0.916 -0.463 0.243 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -2.681 -0.754 -1.635 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -3.714 0.143 2.401 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -4.870 0.073 -2.381 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -5.906 0.966 1.659 1.00 0.00 H new ATOM 0 HH TYR A 94 -7.264 1.331 -0.046 1.00 0.00 H new ATOM 1453 N LEU A 95 -2.015 -3.050 -1.389 1.00 0.00 N ATOM 1454 CA LEU A 95 -2.795 -3.597 -2.494 1.00 0.00 C ATOM 1455 C LEU A 95 -3.016 -5.095 -2.315 1.00 0.00 C ATOM 1456 O LEU A 95 -4.151 -5.553 -2.189 1.00 0.00 O ATOM 1457 CB LEU A 95 -2.089 -3.329 -3.824 1.00 0.00 C ATOM 1458 CG LEU A 95 -2.014 -1.865 -4.262 1.00 0.00 C ATOM 1459 CD1 LEU A 95 -0.902 -1.669 -5.279 1.00 0.00 C ATOM 1460 CD2 LEU A 95 -3.349 -1.411 -4.833 1.00 0.00 C ATOM 0 H LEU A 95 -1.084 -2.726 -1.651 1.00 0.00 H new ATOM 0 HA LEU A 95 -3.767 -3.103 -2.500 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -1.074 -3.720 -3.759 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -2.599 -3.895 -4.604 1.00 0.00 H new ATOM 0 HG LEU A 95 -1.789 -1.254 -3.387 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -0.864 -0.622 -5.579 1.00 0.00 H new ATOM 0 HD12 LEU A 95 0.052 -1.954 -4.835 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -1.095 -2.290 -6.154 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -3.278 -0.367 -5.139 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -3.604 -2.026 -5.696 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -4.124 -1.514 -4.073 1.00 0.00 H new ATOM 1472 N GLU A 96 -1.923 -5.852 -2.304 1.00 0.00 N ATOM 1473 CA GLU A 96 -1.999 -7.299 -2.139 1.00 0.00 C ATOM 1474 C GLU A 96 -2.628 -7.662 -0.796 1.00 0.00 C ATOM 1475 O GLU A 96 -3.643 -8.355 -0.742 1.00 0.00 O ATOM 1476 CB GLU A 96 -0.605 -7.921 -2.246 1.00 0.00 C ATOM 1477 CG GLU A 96 -0.584 -9.417 -1.983 1.00 0.00 C ATOM 1478 CD GLU A 96 0.814 -9.944 -1.724 1.00 0.00 C ATOM 1479 OE1 GLU A 96 1.418 -9.551 -0.704 1.00 0.00 O ATOM 1480 OE2 GLU A 96 1.304 -10.751 -2.542 1.00 0.00 O ATOM 0 H GLU A 96 -0.976 -5.488 -2.407 1.00 0.00 H new ATOM 0 HA GLU A 96 -2.629 -7.697 -2.935 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -0.207 -7.730 -3.243 1.00 0.00 H new ATOM 0 HB3 GLU A 96 0.060 -7.427 -1.537 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -1.217 -9.640 -1.124 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -1.012 -9.939 -2.839 1.00 0.00 H new ATOM 1487 N ARG A 97 -2.016 -7.187 0.284 1.00 0.00 N ATOM 1488 CA ARG A 97 -2.514 -7.462 1.626 1.00 0.00 C ATOM 1489 C ARG A 97 -4.035 -7.347 1.677 1.00 0.00 C ATOM 1490 O ARG A 97 -4.720 -8.241 2.174 1.00 0.00 O ATOM 1491 CB ARG A 97 -1.885 -6.498 2.634 1.00 0.00 C ATOM 1492 CG ARG A 97 -0.508 -6.929 3.111 1.00 0.00 C ATOM 1493 CD ARG A 97 -0.601 -7.947 4.237 1.00 0.00 C ATOM 1494 NE ARG A 97 0.717 -8.398 4.677 1.00 0.00 N ATOM 1495 CZ ARG A 97 1.409 -9.353 4.066 1.00 0.00 C ATOM 1496 NH1 ARG A 97 0.912 -9.954 2.994 1.00 0.00 N ATOM 1497 NH2 ARG A 97 2.601 -9.708 4.527 1.00 0.00 N ATOM 0 H ARG A 97 -1.175 -6.610 0.256 1.00 0.00 H new ATOM 0 HA ARG A 97 -2.236 -8.483 1.887 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -1.810 -5.510 2.181 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -2.546 -6.404 3.496 1.00 0.00 H new ATOM 0 HG2 ARG A 97 0.049 -7.357 2.278 1.00 0.00 H new ATOM 0 HG3 ARG A 97 0.049 -6.057 3.453 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -1.134 -7.507 5.080 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -1.185 -8.805 3.903 1.00 0.00 H new ATOM 0 HE ARG A 97 1.128 -7.955 5.499 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -0.004 -9.683 2.636 1.00 0.00 H new ATOM 0 HH12 ARG A 97 1.446 -10.687 2.527 1.00 0.00 H new ATOM 0 HH21 ARG A 97 2.987 -9.248 5.351 1.00 0.00 H new ATOM 0 HH22 ARG A 97 3.132 -10.441 4.057 1.00 0.00 H new ATOM 1511 N HIS A 98 -4.556 -6.240 1.158 1.00 0.00 N ATOM 1512 CA HIS A 98 -5.996 -6.007 1.144 1.00 0.00 C ATOM 1513 C HIS A 98 -6.705 -7.040 0.273 1.00 0.00 C ATOM 1514 O HIS A 98 -7.781 -7.525 0.619 1.00 0.00 O ATOM 1515 CB HIS A 98 -6.301 -4.598 0.635 1.00 0.00 C ATOM 1516 CG HIS A 98 -6.039 -3.525 1.647 1.00 0.00 C ATOM 1517 ND1 HIS A 98 -6.692 -2.311 1.643 1.00 0.00 N ATOM 1518 CD2 HIS A 98 -5.189 -3.491 2.700 1.00 0.00 C ATOM 1519 CE1 HIS A 98 -6.254 -1.575 2.649 1.00 0.00 C ATOM 1520 NE2 HIS A 98 -5.342 -2.268 3.306 1.00 0.00 N ATOM 0 H HIS A 98 -4.003 -5.491 0.742 1.00 0.00 H new ATOM 0 HA HIS A 98 -6.365 -6.104 2.165 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -5.699 -4.403 -0.253 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -7.346 -4.550 0.329 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -4.516 -4.278 3.006 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -6.585 -0.576 2.893 1.00 0.00 H new ATOM 0 HE2 HIS A 98 -4.834 -1.947 4.130 1.00 0.00 H new ATOM 1529 N GLY A 99 -6.094 -7.371 -0.861 1.00 0.00 N ATOM 1530 CA GLY A 99 -6.681 -8.343 -1.764 1.00 0.00 C ATOM 1531 C GLY A 99 -7.151 -7.718 -3.062 1.00 0.00 C ATOM 1532 O GLY A 99 -8.183 -8.108 -3.610 1.00 0.00 O ATOM 0 H GLY A 99 -5.203 -6.983 -1.170 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -5.948 -9.120 -1.983 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -7.524 -8.829 -1.272 1.00 0.00 H new ATOM 1536 N LEU A 100 -6.394 -6.745 -3.557 1.00 0.00 N ATOM 1537 CA LEU A 100 -6.739 -6.063 -4.799 1.00 0.00 C ATOM 1538 C LEU A 100 -5.871 -6.557 -5.951 1.00 0.00 C ATOM 1539 O LEU A 100 -6.170 -6.306 -7.119 1.00 0.00 O ATOM 1540 CB LEU A 100 -6.578 -4.550 -4.636 1.00 0.00 C ATOM 1541 CG LEU A 100 -7.069 -3.962 -3.313 1.00 0.00 C ATOM 1542 CD1 LEU A 100 -7.507 -2.518 -3.501 1.00 0.00 C ATOM 1543 CD2 LEU A 100 -8.209 -4.797 -2.748 1.00 0.00 C ATOM 0 H LEU A 100 -5.537 -6.411 -3.117 1.00 0.00 H new ATOM 0 HA LEU A 100 -7.780 -6.288 -5.030 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -5.523 -4.303 -4.751 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -7.111 -4.058 -5.449 1.00 0.00 H new ATOM 0 HG LEU A 100 -6.244 -3.981 -2.601 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -7.853 -2.116 -2.549 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -6.665 -1.926 -3.860 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -8.317 -2.475 -4.229 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -8.546 -4.363 -1.806 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -9.036 -4.811 -3.457 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -7.863 -5.816 -2.575 1.00 0.00 H new ATOM 1555 N ILE A 101 -4.796 -7.262 -5.615 1.00 0.00 N ATOM 1556 CA ILE A 101 -3.886 -7.794 -6.621 1.00 0.00 C ATOM 1557 C ILE A 101 -3.443 -9.210 -6.268 1.00 0.00 C ATOM 1558 O ILE A 101 -3.217 -9.527 -5.101 1.00 0.00 O ATOM 1559 CB ILE A 101 -2.640 -6.903 -6.782 1.00 0.00 C ATOM 1560 CG1 ILE A 101 -1.902 -6.775 -5.448 1.00 0.00 C ATOM 1561 CG2 ILE A 101 -3.035 -5.532 -7.309 1.00 0.00 C ATOM 1562 CD1 ILE A 101 -0.420 -6.514 -5.600 1.00 0.00 C ATOM 0 H ILE A 101 -4.534 -7.478 -4.653 1.00 0.00 H new ATOM 0 HA ILE A 101 -4.434 -7.811 -7.563 1.00 0.00 H new ATOM 0 HB ILE A 101 -1.969 -7.369 -7.503 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -2.348 -5.965 -4.872 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -2.044 -7.691 -4.874 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -2.144 -4.913 -7.418 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -3.521 -5.641 -8.278 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -3.723 -5.058 -6.609 1.00 0.00 H new ATOM 0 HD11 ILE A 101 0.038 -6.435 -4.614 1.00 0.00 H new ATOM 0 HD12 ILE A 101 0.040 -7.336 -6.149 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -0.269 -5.583 -6.146 1.00 0.00 H new ATOM 1574 N ASN A 102 -3.318 -10.056 -7.285 1.00 0.00 N ATOM 1575 CA ASN A 102 -2.899 -11.439 -7.082 1.00 0.00 C ATOM 1576 C ASN A 102 -3.934 -12.206 -6.264 1.00 0.00 C ATOM 1577 O ASN A 102 -3.613 -12.792 -5.231 1.00 0.00 O ATOM 1578 CB ASN A 102 -1.541 -11.484 -6.379 1.00 0.00 C ATOM 1579 CG ASN A 102 -0.491 -10.657 -7.095 1.00 0.00 C ATOM 1580 OD1 ASN A 102 -0.793 -9.943 -8.051 1.00 0.00 O ATOM 1581 ND2 ASN A 102 0.751 -10.750 -6.635 1.00 0.00 N ATOM 0 H ASN A 102 -3.501 -9.809 -8.258 1.00 0.00 H new ATOM 0 HA ASN A 102 -2.810 -11.913 -8.059 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -1.652 -11.120 -5.358 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -1.203 -12.518 -6.314 1.00 0.00 H new ATOM 0 HD21 ASN A 102 1.500 -10.217 -7.077 1.00 0.00 H new ATOM 0 HD22 ASN A 102 0.956 -11.355 -5.840 1.00 0.00 H new ATOM 1588 N PHE A 103 -5.176 -12.197 -6.735 1.00 0.00 N ATOM 1589 CA PHE A 103 -6.259 -12.891 -6.047 1.00 0.00 C ATOM 1590 C PHE A 103 -6.876 -13.960 -6.945 1.00 0.00 C ATOM 1591 O PHE A 103 -8.071 -14.241 -6.863 1.00 0.00 O ATOM 1592 CB PHE A 103 -7.334 -11.896 -5.608 1.00 0.00 C ATOM 1593 CG PHE A 103 -7.724 -10.922 -6.683 1.00 0.00 C ATOM 1594 CD1 PHE A 103 -8.165 -11.371 -7.917 1.00 0.00 C ATOM 1595 CD2 PHE A 103 -7.649 -9.556 -6.460 1.00 0.00 C ATOM 1596 CE1 PHE A 103 -8.525 -10.478 -8.908 1.00 0.00 C ATOM 1597 CE2 PHE A 103 -8.008 -8.658 -7.447 1.00 0.00 C ATOM 1598 CZ PHE A 103 -8.445 -9.119 -8.673 1.00 0.00 C ATOM 0 H PHE A 103 -5.458 -11.717 -7.590 1.00 0.00 H new ATOM 0 HA PHE A 103 -5.843 -13.377 -5.165 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -8.219 -12.447 -5.289 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -6.973 -11.343 -4.741 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -8.228 -12.432 -8.107 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -7.306 -9.189 -5.504 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -8.868 -10.842 -9.865 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -7.947 -7.596 -7.260 1.00 0.00 H new ATOM 0 HZ PHE A 103 -8.724 -8.419 -9.447 1.00 0.00 H new ATOM 1608 N GLY A 104 -6.050 -14.554 -7.802 1.00 0.00 N ATOM 1609 CA GLY A 104 -6.532 -15.584 -8.703 1.00 0.00 C ATOM 1610 C GLY A 104 -5.422 -16.499 -9.183 1.00 0.00 C ATOM 1611 O GLY A 104 -5.474 -17.711 -8.974 1.00 0.00 O ATOM 0 H GLY A 104 -5.056 -14.340 -7.888 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -7.295 -16.177 -8.198 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -7.010 -15.116 -9.563 1.00 0.00 H new ATOM 1615 N ILE A 105 -4.417 -15.918 -9.830 1.00 0.00 N ATOM 1616 CA ILE A 105 -3.291 -16.689 -10.342 1.00 0.00 C ATOM 1617 C ILE A 105 -2.888 -17.788 -9.364 1.00 0.00 C ATOM 1618 O ILE A 105 -2.446 -18.863 -9.770 1.00 0.00 O ATOM 1619 CB ILE A 105 -2.072 -15.790 -10.618 1.00 0.00 C ATOM 1620 CG1 ILE A 105 -1.538 -15.202 -9.310 1.00 0.00 C ATOM 1621 CG2 ILE A 105 -2.442 -14.681 -11.592 1.00 0.00 C ATOM 1622 CD1 ILE A 105 -2.496 -14.240 -8.644 1.00 0.00 C ATOM 0 H ILE A 105 -4.360 -14.916 -10.012 1.00 0.00 H new ATOM 0 HA ILE A 105 -3.617 -17.141 -11.279 1.00 0.00 H new ATOM 0 HB ILE A 105 -1.286 -16.396 -11.069 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -1.315 -16.016 -8.620 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -0.599 -14.687 -9.510 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -1.570 -14.054 -11.777 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -2.780 -15.119 -12.531 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -3.241 -14.075 -11.166 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -2.051 -13.863 -7.723 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -2.700 -13.406 -9.316 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -3.428 -14.756 -8.412 1.00 0.00 H new ATOM 1634 N TYR A 106 -3.044 -17.511 -8.074 1.00 0.00 N ATOM 1635 CA TYR A 106 -2.695 -18.475 -7.038 1.00 0.00 C ATOM 1636 C TYR A 106 -3.710 -18.441 -5.899 1.00 0.00 C ATOM 1637 O TYR A 106 -4.250 -17.387 -5.564 1.00 0.00 O ATOM 1638 CB TYR A 106 -1.294 -18.188 -6.496 1.00 0.00 C ATOM 1639 CG TYR A 106 -1.192 -16.884 -5.739 1.00 0.00 C ATOM 1640 CD1 TYR A 106 -1.856 -16.705 -4.531 1.00 0.00 C ATOM 1641 CD2 TYR A 106 -0.434 -15.829 -6.231 1.00 0.00 C ATOM 1642 CE1 TYR A 106 -1.767 -15.515 -3.836 1.00 0.00 C ATOM 1643 CE2 TYR A 106 -0.337 -14.635 -5.542 1.00 0.00 C ATOM 1644 CZ TYR A 106 -1.006 -14.483 -4.346 1.00 0.00 C ATOM 1645 OH TYR A 106 -0.914 -13.295 -3.657 1.00 0.00 O ATOM 0 H TYR A 106 -3.410 -16.627 -7.721 1.00 0.00 H new ATOM 0 HA TYR A 106 -2.708 -19.470 -7.483 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -0.994 -19.004 -5.839 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -0.589 -18.172 -7.327 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -2.452 -17.511 -4.129 1.00 0.00 H new ATOM 0 HD2 TYR A 106 0.089 -15.944 -7.169 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -2.290 -15.393 -2.899 1.00 0.00 H new ATOM 0 HE2 TYR A 106 0.259 -13.826 -5.938 1.00 0.00 H new ATOM 0 HH TYR A 106 -1.680 -12.727 -3.881 1.00 0.00 H new ATOM 1655 N LYS A 107 -3.963 -19.603 -5.306 1.00 0.00 N ATOM 1656 CA LYS A 107 -4.910 -19.709 -4.203 1.00 0.00 C ATOM 1657 C LYS A 107 -4.359 -19.043 -2.947 1.00 0.00 C ATOM 1658 O LYS A 107 -3.627 -19.663 -2.175 1.00 0.00 O ATOM 1659 CB LYS A 107 -5.228 -21.179 -3.917 1.00 0.00 C ATOM 1660 CG LYS A 107 -5.905 -21.892 -5.075 1.00 0.00 C ATOM 1661 CD LYS A 107 -5.617 -23.383 -5.056 1.00 0.00 C ATOM 1662 CE LYS A 107 -4.201 -23.684 -5.525 1.00 0.00 C ATOM 1663 NZ LYS A 107 -3.793 -25.078 -5.200 1.00 0.00 N ATOM 0 H LYS A 107 -3.525 -20.485 -5.571 1.00 0.00 H new ATOM 0 HA LYS A 107 -5.826 -19.195 -4.493 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -4.303 -21.701 -3.671 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -5.871 -21.239 -3.039 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -6.981 -21.728 -5.025 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -5.561 -21.466 -6.017 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -5.756 -23.769 -4.046 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -6.331 -23.901 -5.696 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -4.134 -23.528 -6.602 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -3.508 -22.985 -5.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -2.823 -25.243 -5.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -3.832 -25.220 -4.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -4.439 -25.746 -5.666 1.00 0.00 H new ATOM 1677 N ARG A 108 -4.718 -17.779 -2.747 1.00 0.00 N ATOM 1678 CA ARG A 108 -4.259 -17.030 -1.583 1.00 0.00 C ATOM 1679 C ARG A 108 -4.373 -17.871 -0.315 1.00 0.00 C ATOM 1680 O ARG A 108 -5.222 -18.758 -0.222 1.00 0.00 O ATOM 1681 CB ARG A 108 -5.069 -15.741 -1.428 1.00 0.00 C ATOM 1682 CG ARG A 108 -4.561 -14.832 -0.321 1.00 0.00 C ATOM 1683 CD ARG A 108 -3.246 -14.171 -0.702 1.00 0.00 C ATOM 1684 NE ARG A 108 -2.771 -13.259 0.335 1.00 0.00 N ATOM 1685 CZ ARG A 108 -3.288 -12.055 0.547 1.00 0.00 C ATOM 1686 NH1 ARG A 108 -4.293 -11.620 -0.201 1.00 0.00 N ATOM 1687 NH2 ARG A 108 -2.802 -11.282 1.510 1.00 0.00 N ATOM 0 H ARG A 108 -5.325 -17.252 -3.375 1.00 0.00 H new ATOM 0 HA ARG A 108 -3.210 -16.776 -1.736 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -5.052 -15.195 -2.371 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -6.109 -15.997 -1.227 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -5.306 -14.066 -0.107 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -4.427 -15.410 0.593 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -2.493 -14.939 -0.882 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -3.373 -13.623 -1.636 1.00 0.00 H new ATOM 0 HE ARG A 108 -2.000 -13.564 0.929 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -4.671 -12.211 -0.941 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -4.688 -10.694 -0.036 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -2.030 -11.613 2.089 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -3.201 -10.357 1.671 1.00 0.00 H new ATOM 1701 N ILE A 109 -3.513 -17.587 0.657 1.00 0.00 N ATOM 1702 CA ILE A 109 -3.518 -18.316 1.918 1.00 0.00 C ATOM 1703 C ILE A 109 -4.929 -18.757 2.293 1.00 0.00 C ATOM 1704 O ILE A 109 -5.186 -19.943 2.501 1.00 0.00 O ATOM 1705 CB ILE A 109 -2.937 -17.465 3.063 1.00 0.00 C ATOM 1706 CG1 ILE A 109 -1.547 -16.948 2.689 1.00 0.00 C ATOM 1707 CG2 ILE A 109 -2.878 -18.277 4.349 1.00 0.00 C ATOM 1708 CD1 ILE A 109 -1.557 -15.547 2.119 1.00 0.00 C ATOM 0 H ILE A 109 -2.804 -16.857 0.595 1.00 0.00 H new ATOM 0 HA ILE A 109 -2.891 -19.196 1.776 1.00 0.00 H new ATOM 0 HB ILE A 109 -3.590 -16.608 3.227 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -0.911 -16.967 3.574 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -1.100 -17.625 1.961 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -2.465 -17.662 5.149 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -3.883 -18.600 4.621 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -2.244 -19.151 4.199 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -0.538 -15.246 1.876 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -2.166 -15.526 1.215 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -1.974 -14.858 2.854 1.00 0.00 H new ATOM 1720 N LYS A 110 -5.841 -17.795 2.375 1.00 0.00 N ATOM 1721 CA LYS A 110 -7.228 -18.083 2.721 1.00 0.00 C ATOM 1722 C LYS A 110 -8.137 -16.920 2.336 1.00 0.00 C ATOM 1723 O LYS A 110 -7.895 -15.767 2.693 1.00 0.00 O ATOM 1724 CB LYS A 110 -7.353 -18.367 4.219 1.00 0.00 C ATOM 1725 CG LYS A 110 -8.778 -18.636 4.671 1.00 0.00 C ATOM 1726 CD LYS A 110 -8.813 -19.367 6.003 1.00 0.00 C ATOM 1727 CE LYS A 110 -8.833 -18.394 7.171 1.00 0.00 C ATOM 1728 NZ LYS A 110 -10.221 -18.005 7.546 1.00 0.00 N ATOM 0 H LYS A 110 -5.645 -16.808 2.207 1.00 0.00 H new ATOM 0 HA LYS A 110 -7.540 -18.966 2.163 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -6.733 -19.227 4.470 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -6.959 -17.517 4.775 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -9.317 -17.693 4.759 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -9.294 -19.229 3.916 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -9.695 -20.006 6.045 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -7.943 -20.018 6.085 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -8.339 -18.848 8.030 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -8.264 -17.502 6.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -10.191 -17.341 8.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -10.685 -17.549 6.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -10.757 -18.853 7.820 1.00 0.00 H new ATOM 1742 N PRO A 111 -9.210 -17.227 1.592 1.00 0.00 N ATOM 1743 CA PRO A 111 -10.178 -16.221 1.145 1.00 0.00 C ATOM 1744 C PRO A 111 -11.012 -15.668 2.295 1.00 0.00 C ATOM 1745 O PRO A 111 -10.841 -16.067 3.448 1.00 0.00 O ATOM 1746 CB PRO A 111 -11.065 -16.994 0.164 1.00 0.00 C ATOM 1747 CG PRO A 111 -10.956 -18.416 0.595 1.00 0.00 C ATOM 1748 CD PRO A 111 -9.561 -18.581 1.131 1.00 0.00 C ATOM 0 HA PRO A 111 -9.689 -15.352 0.705 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -12.097 -16.646 0.205 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -10.725 -16.865 -0.864 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -11.698 -18.650 1.359 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -11.135 -19.092 -0.241 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -9.527 -19.304 1.946 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -8.874 -18.934 0.362 1.00 0.00 H new ATOM 1756 N LEU A 112 -11.916 -14.748 1.975 1.00 0.00 N ATOM 1757 CA LEU A 112 -12.778 -14.140 2.983 1.00 0.00 C ATOM 1758 C LEU A 112 -13.940 -13.399 2.329 1.00 0.00 C ATOM 1759 O LEU A 112 -13.829 -12.874 1.221 1.00 0.00 O ATOM 1760 CB LEU A 112 -11.973 -13.177 3.858 1.00 0.00 C ATOM 1761 CG LEU A 112 -11.654 -11.815 3.240 1.00 0.00 C ATOM 1762 CD1 LEU A 112 -12.769 -10.823 3.532 1.00 0.00 C ATOM 1763 CD2 LEU A 112 -10.322 -11.293 3.759 1.00 0.00 C ATOM 0 H LEU A 112 -12.071 -14.407 1.026 1.00 0.00 H new ATOM 0 HA LEU A 112 -13.183 -14.936 3.607 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -12.523 -13.013 4.784 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -11.034 -13.661 4.127 1.00 0.00 H new ATOM 0 HG LEU A 112 -11.577 -11.936 2.159 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -12.525 -9.859 3.085 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -13.704 -11.192 3.111 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -12.878 -10.705 4.610 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -10.111 -10.323 3.309 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -10.370 -11.187 4.843 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -9.530 -11.994 3.498 1.00 0.00 H new ATOM 1775 N PRO A 113 -15.082 -13.354 3.031 1.00 0.00 N ATOM 1776 CA PRO A 113 -16.287 -12.677 2.540 1.00 0.00 C ATOM 1777 C PRO A 113 -16.129 -11.161 2.511 1.00 0.00 C ATOM 1778 O PRO A 113 -15.851 -10.535 3.534 1.00 0.00 O ATOM 1779 CB PRO A 113 -17.360 -13.084 3.552 1.00 0.00 C ATOM 1780 CG PRO A 113 -16.606 -13.391 4.800 1.00 0.00 C ATOM 1781 CD PRO A 113 -15.286 -13.958 4.358 1.00 0.00 C ATOM 0 HA PRO A 113 -16.522 -12.957 1.513 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -18.079 -12.281 3.711 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -17.922 -13.951 3.206 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -16.463 -12.493 5.401 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -17.150 -14.105 5.419 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -14.484 -13.694 5.047 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -15.314 -15.046 4.304 1.00 0.00 H new ATOM 1789 N THR A 114 -16.308 -10.574 1.331 1.00 0.00 N ATOM 1790 CA THR A 114 -16.185 -9.131 1.169 1.00 0.00 C ATOM 1791 C THR A 114 -17.497 -8.427 1.498 1.00 0.00 C ATOM 1792 O THR A 114 -18.579 -8.957 1.246 1.00 0.00 O ATOM 1793 CB THR A 114 -15.764 -8.761 -0.266 1.00 0.00 C ATOM 1794 OG1 THR A 114 -15.539 -7.350 -0.362 1.00 0.00 O ATOM 1795 CG2 THR A 114 -16.829 -9.179 -1.268 1.00 0.00 C ATOM 0 H THR A 114 -16.539 -11.076 0.474 1.00 0.00 H new ATOM 0 HA THR A 114 -15.413 -8.800 1.864 1.00 0.00 H new ATOM 0 HB THR A 114 -14.841 -9.293 -0.498 1.00 0.00 H new ATOM 0 HG1 THR A 114 -14.733 -7.183 -0.894 1.00 0.00 H new ATOM 0 HG21 THR A 114 -16.509 -8.907 -2.274 1.00 0.00 H new ATOM 0 HG22 THR A 114 -16.977 -10.258 -1.213 1.00 0.00 H new ATOM 0 HG23 THR A 114 -17.766 -8.672 -1.036 1.00 0.00 H new ATOM 1803 N LYS A 115 -17.394 -7.229 2.063 1.00 0.00 N ATOM 1804 CA LYS A 115 -18.571 -6.450 2.426 1.00 0.00 C ATOM 1805 C LYS A 115 -18.776 -5.290 1.457 1.00 0.00 C ATOM 1806 O LYS A 115 -18.177 -4.225 1.611 1.00 0.00 O ATOM 1807 CB LYS A 115 -18.436 -5.917 3.854 1.00 0.00 C ATOM 1808 CG LYS A 115 -19.606 -5.056 4.296 1.00 0.00 C ATOM 1809 CD LYS A 115 -19.801 -5.110 5.802 1.00 0.00 C ATOM 1810 CE LYS A 115 -19.000 -4.025 6.507 1.00 0.00 C ATOM 1811 NZ LYS A 115 -17.535 -4.281 6.434 1.00 0.00 N ATOM 0 H LYS A 115 -16.506 -6.776 2.280 1.00 0.00 H new ATOM 0 HA LYS A 115 -19.440 -7.105 2.370 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -18.336 -6.759 4.539 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -17.518 -5.334 3.930 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -19.437 -4.024 3.987 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -20.515 -5.393 3.798 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -20.859 -4.994 6.037 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -19.497 -6.088 6.175 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -19.223 -3.058 6.056 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -19.307 -3.968 7.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -17.060 -3.812 7.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -17.359 -5.305 6.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -17.161 -3.905 5.539 1.00 0.00 H new ATOM 1825 N LYS A 116 -19.628 -5.502 0.459 1.00 0.00 N ATOM 1826 CA LYS A 116 -19.914 -4.473 -0.534 1.00 0.00 C ATOM 1827 C LYS A 116 -21.358 -3.993 -0.419 1.00 0.00 C ATOM 1828 O LYS A 116 -22.297 -4.781 -0.536 1.00 0.00 O ATOM 1829 CB LYS A 116 -19.656 -5.010 -1.943 1.00 0.00 C ATOM 1830 CG LYS A 116 -18.191 -4.984 -2.345 1.00 0.00 C ATOM 1831 CD LYS A 116 -17.867 -6.080 -3.346 1.00 0.00 C ATOM 1832 CE LYS A 116 -16.370 -6.338 -3.425 1.00 0.00 C ATOM 1833 NZ LYS A 116 -15.645 -5.204 -4.061 1.00 0.00 N ATOM 0 H LYS A 116 -20.132 -6.377 0.317 1.00 0.00 H new ATOM 0 HA LYS A 116 -19.252 -3.628 -0.346 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -20.023 -6.034 -2.005 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -20.231 -4.421 -2.658 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -17.949 -4.013 -2.777 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -17.568 -5.104 -1.459 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -18.381 -6.998 -3.061 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -18.241 -5.798 -4.330 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -15.977 -6.504 -2.422 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -16.188 -7.250 -3.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -14.628 -5.418 -4.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -16.002 -5.062 -5.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -15.797 -4.339 -3.505 1.00 0.00 H new ATOM 1847 N THR A 117 -21.528 -2.695 -0.189 1.00 0.00 N ATOM 1848 CA THR A 117 -22.856 -2.109 -0.058 1.00 0.00 C ATOM 1849 C THR A 117 -23.548 -2.007 -1.413 1.00 0.00 C ATOM 1850 O THR A 117 -24.710 -2.383 -1.557 1.00 0.00 O ATOM 1851 CB THR A 117 -22.793 -0.709 0.580 1.00 0.00 C ATOM 1852 OG1 THR A 117 -22.034 0.175 -0.253 1.00 0.00 O ATOM 1853 CG2 THR A 117 -22.165 -0.773 1.964 1.00 0.00 C ATOM 0 H THR A 117 -20.762 -2.029 -0.090 1.00 0.00 H new ATOM 0 HA THR A 117 -23.430 -2.770 0.592 1.00 0.00 H new ATOM 0 HB THR A 117 -23.811 -0.332 0.677 1.00 0.00 H new ATOM 0 HG1 THR A 117 -22.000 1.064 0.159 1.00 0.00 H new ATOM 0 HG21 THR A 117 -22.131 0.228 2.395 1.00 0.00 H new ATOM 0 HG22 THR A 117 -22.761 -1.424 2.604 1.00 0.00 H new ATOM 0 HG23 THR A 117 -21.152 -1.169 1.886 1.00 0.00 H new ATOM 1861 N GLY A 118 -22.824 -1.496 -2.405 1.00 0.00 N ATOM 1862 CA GLY A 118 -23.386 -1.354 -3.735 1.00 0.00 C ATOM 1863 C GLY A 118 -22.999 -0.043 -4.391 1.00 0.00 C ATOM 1864 O GLY A 118 -22.298 0.773 -3.795 1.00 0.00 O ATOM 0 H GLY A 118 -21.859 -1.178 -2.311 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -23.049 -2.182 -4.359 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -24.472 -1.420 -3.676 1.00 0.00 H new ATOM 1868 N SER A 119 -23.457 0.158 -5.623 1.00 0.00 N ATOM 1869 CA SER A 119 -23.151 1.377 -6.362 1.00 0.00 C ATOM 1870 C SER A 119 -23.738 2.599 -5.663 1.00 0.00 C ATOM 1871 O SER A 119 -24.905 2.937 -5.855 1.00 0.00 O ATOM 1872 CB SER A 119 -23.693 1.282 -7.790 1.00 0.00 C ATOM 1873 OG SER A 119 -23.242 2.369 -8.579 1.00 0.00 O ATOM 0 H SER A 119 -24.041 -0.507 -6.130 1.00 0.00 H new ATOM 0 HA SER A 119 -22.067 1.488 -6.399 1.00 0.00 H new ATOM 0 HB2 SER A 119 -23.374 0.343 -8.242 1.00 0.00 H new ATOM 0 HB3 SER A 119 -24.783 1.271 -7.769 1.00 0.00 H new ATOM 0 HG SER A 119 -23.600 2.285 -9.487 1.00 0.00 H new ATOM 1879 N GLY A 120 -22.919 3.258 -4.849 1.00 0.00 N ATOM 1880 CA GLY A 120 -23.374 4.435 -4.132 1.00 0.00 C ATOM 1881 C GLY A 120 -24.000 5.466 -5.050 1.00 0.00 C ATOM 1882 O GLY A 120 -23.980 5.333 -6.274 1.00 0.00 O ATOM 0 H GLY A 120 -21.949 2.998 -4.673 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -24.100 4.138 -3.375 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -22.532 4.885 -3.606 1.00 0.00 H new ATOM 1886 N PRO A 121 -24.574 6.523 -4.455 1.00 0.00 N ATOM 1887 CA PRO A 121 -25.221 7.601 -5.209 1.00 0.00 C ATOM 1888 C PRO A 121 -24.217 8.455 -5.976 1.00 0.00 C ATOM 1889 O PRO A 121 -23.157 8.802 -5.456 1.00 0.00 O ATOM 1890 CB PRO A 121 -25.908 8.431 -4.121 1.00 0.00 C ATOM 1891 CG PRO A 121 -25.118 8.166 -2.887 1.00 0.00 C ATOM 1892 CD PRO A 121 -24.635 6.746 -3.001 1.00 0.00 C ATOM 0 HA PRO A 121 -25.904 7.216 -5.966 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -25.906 9.492 -4.372 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -26.949 8.135 -3.996 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -24.280 8.858 -2.804 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -25.731 8.299 -1.995 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -23.659 6.614 -2.533 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -25.318 6.049 -2.516 1.00 0.00 H new ATOM 1900 N SER A 122 -24.559 8.789 -7.217 1.00 0.00 N ATOM 1901 CA SER A 122 -23.686 9.600 -8.057 1.00 0.00 C ATOM 1902 C SER A 122 -23.141 10.795 -7.281 1.00 0.00 C ATOM 1903 O SER A 122 -21.982 11.177 -7.441 1.00 0.00 O ATOM 1904 CB SER A 122 -24.441 10.084 -9.297 1.00 0.00 C ATOM 1905 OG SER A 122 -25.480 10.980 -8.943 1.00 0.00 O ATOM 0 H SER A 122 -25.434 8.511 -7.662 1.00 0.00 H new ATOM 0 HA SER A 122 -22.847 8.979 -8.371 1.00 0.00 H new ATOM 0 HB2 SER A 122 -23.748 10.577 -9.979 1.00 0.00 H new ATOM 0 HB3 SER A 122 -24.859 9.229 -9.829 1.00 0.00 H new ATOM 0 HG SER A 122 -25.946 11.276 -9.752 1.00 0.00 H new ATOM 1911 N SER A 123 -23.987 11.382 -6.440 1.00 0.00 N ATOM 1912 CA SER A 123 -23.593 12.537 -5.642 1.00 0.00 C ATOM 1913 C SER A 123 -24.114 12.413 -4.213 1.00 0.00 C ATOM 1914 O SER A 123 -25.134 11.769 -3.966 1.00 0.00 O ATOM 1915 CB SER A 123 -24.116 13.826 -6.278 1.00 0.00 C ATOM 1916 OG SER A 123 -23.589 14.967 -5.624 1.00 0.00 O ATOM 0 H SER A 123 -24.949 11.077 -6.294 1.00 0.00 H new ATOM 0 HA SER A 123 -22.504 12.572 -5.612 1.00 0.00 H new ATOM 0 HB2 SER A 123 -23.845 13.850 -7.334 1.00 0.00 H new ATOM 0 HB3 SER A 123 -25.205 13.844 -6.228 1.00 0.00 H new ATOM 0 HG SER A 123 -23.937 15.778 -6.050 1.00 0.00 H new ATOM 1922 N GLY A 124 -23.407 13.034 -3.275 1.00 0.00 N ATOM 1923 CA GLY A 124 -23.813 12.982 -1.883 1.00 0.00 C ATOM 1924 C GLY A 124 -22.735 12.405 -0.986 1.00 0.00 C ATOM 1925 O GLY A 124 -22.859 12.429 0.238 1.00 0.00 O ATOM 0 H GLY A 124 -22.560 13.573 -3.454 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -24.065 13.987 -1.543 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -24.717 12.379 -1.794 1.00 0.00 H new TER 1929 GLY A 124