USER MOD reduce.3.24.130724 H: found=0, std=0, add=748, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 748 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 84 GLN : amide:sc= -0.029 K(o=-2.3,f=-2.9) USER MOD Set 1.2: A 123 ASN : amide:sc= -2.31! C(o=-2.3!,f=-5.2!) USER MOD Set 2.1: A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= -0.0753 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 180:sc= -0.236 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= 0 K(o=0,f=-0.86) USER MOD Single : A 87 ASN : amide:sc= -2.35! C(o=-2.4!,f=-2.7!) USER MOD Single : A 91 HIS : no HE2:sc= 0.323 K(o=0.32,f=-2!) USER MOD Single : A 93 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= -0.116 K(o=-0.12,f=-2!) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 CYS SG : rot 180:sc= 0 USER MOD Single : A 112 GLN : amide:sc= -1.72 K(o=-1.7,f=-3.9!) USER MOD Single : A 114 ASN : amide:sc= -0.709 X(o=-0.71,f=-0.71) USER MOD Single : A 115 THR OG1 : rot -44:sc= 0.944 USER MOD Single : A 117 SER OG : rot 180:sc= -0.0338 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 126 TYR OH : rot 8:sc= 1.07 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 LYS NZ :NH3+ -168:sc= -0.02 (180deg=-0.183) USER MOD Single : A 131 GLN :FLIP amide:sc= -2.12! C(o=-5.7!,f=-2.1!) USER MOD Single : A 134 GLN : amide:sc= -0.0273 K(o=-0.027,f=-0.86) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 ASN : amide:sc= -0.25 K(o=-0.25,f=-1.2) USER MOD Single : A 143 GLN : amide:sc=-0.00252 K(o=-0.0025,f=-0.53) USER MOD Single : A 146 ASN : amide:sc= -0.112 X(o=-0.11,f=-0.11) USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 TYR OH : rot 180:sc= -0.123 USER MOD Single : A 158 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 161 GLN : amide:sc= -2.46! C(o=-2.5!,f=-2.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 66 12.864 -30.356 4.195 1.00 0.00 N ATOM 2 CA GLY A 66 13.023 -28.921 4.040 1.00 0.00 C ATOM 3 C GLY A 66 14.334 -28.552 3.375 1.00 0.00 C ATOM 4 O GLY A 66 15.345 -28.354 4.047 1.00 0.00 O ATOM 0 HA2 GLY A 66 12.196 -28.529 3.448 1.00 0.00 H new ATOM 0 HA3 GLY A 66 12.969 -28.445 5.019 1.00 0.00 H new ATOM 8 N SER A 67 14.317 -28.460 2.049 1.00 0.00 N ATOM 9 CA SER A 67 15.515 -28.117 1.291 1.00 0.00 C ATOM 10 C SER A 67 15.536 -26.630 0.952 1.00 0.00 C ATOM 11 O SER A 67 16.527 -25.941 1.195 1.00 0.00 O ATOM 12 CB SER A 67 15.586 -28.946 0.007 1.00 0.00 C ATOM 13 OG SER A 67 14.439 -28.739 -0.798 1.00 0.00 O ATOM 0 H SER A 67 13.487 -28.618 1.477 1.00 0.00 H new ATOM 0 HA SER A 67 16.384 -28.343 1.909 1.00 0.00 H new ATOM 0 HB2 SER A 67 16.481 -28.677 -0.554 1.00 0.00 H new ATOM 0 HB3 SER A 67 15.672 -30.003 0.257 1.00 0.00 H new ATOM 0 HG SER A 67 14.510 -29.279 -1.613 1.00 0.00 H new ATOM 19 N SER A 68 14.436 -26.142 0.388 1.00 0.00 N ATOM 20 CA SER A 68 14.328 -24.738 0.011 1.00 0.00 C ATOM 21 C SER A 68 13.124 -24.086 0.684 1.00 0.00 C ATOM 22 O SER A 68 11.990 -24.536 0.524 1.00 0.00 O ATOM 23 CB SER A 68 14.213 -24.603 -1.508 1.00 0.00 C ATOM 24 OG SER A 68 15.488 -24.674 -2.124 1.00 0.00 O ATOM 0 H SER A 68 13.607 -26.699 0.182 1.00 0.00 H new ATOM 0 HA SER A 68 15.231 -24.227 0.346 1.00 0.00 H new ATOM 0 HB2 SER A 68 13.572 -25.393 -1.899 1.00 0.00 H new ATOM 0 HB3 SER A 68 13.737 -23.654 -1.757 1.00 0.00 H new ATOM 0 HG SER A 68 15.388 -24.587 -3.095 1.00 0.00 H new ATOM 30 N GLY A 69 13.379 -23.021 1.437 1.00 0.00 N ATOM 31 CA GLY A 69 12.307 -22.323 2.123 1.00 0.00 C ATOM 32 C GLY A 69 12.822 -21.340 3.156 1.00 0.00 C ATOM 33 O GLY A 69 13.219 -21.733 4.253 1.00 0.00 O ATOM 0 H GLY A 69 14.309 -22.629 1.585 1.00 0.00 H new ATOM 0 HA2 GLY A 69 11.698 -21.791 1.392 1.00 0.00 H new ATOM 0 HA3 GLY A 69 11.658 -23.050 2.610 1.00 0.00 H new ATOM 37 N SER A 70 12.818 -20.058 2.804 1.00 0.00 N ATOM 38 CA SER A 70 13.294 -19.017 3.707 1.00 0.00 C ATOM 39 C SER A 70 14.774 -19.208 4.025 1.00 0.00 C ATOM 40 O SER A 70 15.202 -19.040 5.167 1.00 0.00 O ATOM 41 CB SER A 70 12.479 -19.022 5.001 1.00 0.00 C ATOM 42 OG SER A 70 11.116 -18.727 4.747 1.00 0.00 O ATOM 0 H SER A 70 12.491 -19.716 1.901 1.00 0.00 H new ATOM 0 HA SER A 70 13.168 -18.055 3.210 1.00 0.00 H new ATOM 0 HB2 SER A 70 12.560 -19.997 5.481 1.00 0.00 H new ATOM 0 HB3 SER A 70 12.889 -18.289 5.696 1.00 0.00 H new ATOM 0 HG SER A 70 10.616 -18.738 5.590 1.00 0.00 H new ATOM 48 N SER A 71 15.551 -19.560 3.006 1.00 0.00 N ATOM 49 CA SER A 71 16.983 -19.778 3.175 1.00 0.00 C ATOM 50 C SER A 71 17.760 -18.486 2.947 1.00 0.00 C ATOM 51 O SER A 71 17.185 -17.455 2.599 1.00 0.00 O ATOM 52 CB SER A 71 17.474 -20.859 2.210 1.00 0.00 C ATOM 53 OG SER A 71 17.164 -22.154 2.694 1.00 0.00 O ATOM 0 H SER A 71 15.213 -19.700 2.054 1.00 0.00 H new ATOM 0 HA SER A 71 17.156 -20.110 4.199 1.00 0.00 H new ATOM 0 HB2 SER A 71 17.015 -20.713 1.232 1.00 0.00 H new ATOM 0 HB3 SER A 71 18.551 -20.767 2.073 1.00 0.00 H new ATOM 0 HG SER A 71 17.487 -22.827 2.059 1.00 0.00 H new ATOM 59 N GLY A 72 19.073 -18.549 3.146 1.00 0.00 N ATOM 60 CA GLY A 72 19.909 -17.378 2.957 1.00 0.00 C ATOM 61 C GLY A 72 20.680 -17.419 1.653 1.00 0.00 C ATOM 62 O GLY A 72 20.124 -17.751 0.606 1.00 0.00 O ATOM 0 H GLY A 72 19.573 -19.390 3.435 1.00 0.00 H new ATOM 0 HA2 GLY A 72 19.286 -16.484 2.979 1.00 0.00 H new ATOM 0 HA3 GLY A 72 20.610 -17.299 3.788 1.00 0.00 H new ATOM 66 N SER A 73 21.963 -17.079 1.714 1.00 0.00 N ATOM 67 CA SER A 73 22.810 -17.073 0.526 1.00 0.00 C ATOM 68 C SER A 73 22.058 -16.508 -0.674 1.00 0.00 C ATOM 69 O SER A 73 22.207 -16.988 -1.798 1.00 0.00 O ATOM 70 CB SER A 73 23.299 -18.489 0.216 1.00 0.00 C ATOM 71 OG SER A 73 22.209 -19.374 0.022 1.00 0.00 O ATOM 0 H SER A 73 22.439 -16.804 2.573 1.00 0.00 H new ATOM 0 HA SER A 73 23.671 -16.435 0.726 1.00 0.00 H new ATOM 0 HB2 SER A 73 23.923 -18.474 -0.678 1.00 0.00 H new ATOM 0 HB3 SER A 73 23.923 -18.849 1.034 1.00 0.00 H new ATOM 0 HG SER A 73 22.548 -20.272 -0.176 1.00 0.00 H new ATOM 77 N VAL A 74 21.248 -15.482 -0.428 1.00 0.00 N ATOM 78 CA VAL A 74 20.472 -14.849 -1.488 1.00 0.00 C ATOM 79 C VAL A 74 21.365 -14.011 -2.396 1.00 0.00 C ATOM 80 O VAL A 74 22.349 -13.413 -1.961 1.00 0.00 O ATOM 81 CB VAL A 74 19.360 -13.954 -0.912 1.00 0.00 C ATOM 82 CG1 VAL A 74 18.382 -14.780 -0.089 1.00 0.00 C ATOM 83 CG2 VAL A 74 19.959 -12.833 -0.075 1.00 0.00 C ATOM 0 H VAL A 74 21.113 -15.072 0.496 1.00 0.00 H new ATOM 0 HA VAL A 74 20.017 -15.651 -2.070 1.00 0.00 H new ATOM 0 HB VAL A 74 18.812 -13.506 -1.741 1.00 0.00 H new ATOM 0 HG11 VAL A 74 17.603 -14.130 0.310 1.00 0.00 H new ATOM 0 HG12 VAL A 74 17.929 -15.544 -0.721 1.00 0.00 H new ATOM 0 HG13 VAL A 74 18.913 -15.258 0.734 1.00 0.00 H new ATOM 0 HG21 VAL A 74 19.159 -12.210 0.325 1.00 0.00 H new ATOM 0 HG22 VAL A 74 20.532 -13.260 0.748 1.00 0.00 H new ATOM 0 HG23 VAL A 74 20.616 -12.225 -0.697 1.00 0.00 H new ATOM 93 N PRO A 75 21.014 -13.964 -3.690 1.00 0.00 N ATOM 94 CA PRO A 75 21.770 -13.200 -4.688 1.00 0.00 C ATOM 95 C PRO A 75 21.629 -11.694 -4.494 1.00 0.00 C ATOM 96 O PRO A 75 20.966 -11.237 -3.563 1.00 0.00 O ATOM 97 CB PRO A 75 21.140 -13.629 -6.015 1.00 0.00 C ATOM 98 CG PRO A 75 19.759 -14.058 -5.658 1.00 0.00 C ATOM 99 CD PRO A 75 19.853 -14.652 -4.279 1.00 0.00 C ATOM 0 HA PRO A 75 22.840 -13.396 -4.626 1.00 0.00 H new ATOM 0 HB2 PRO A 75 21.127 -12.807 -6.731 1.00 0.00 H new ATOM 0 HB3 PRO A 75 21.701 -14.443 -6.475 1.00 0.00 H new ATOM 0 HG2 PRO A 75 19.072 -13.212 -5.672 1.00 0.00 H new ATOM 0 HG3 PRO A 75 19.380 -14.789 -6.373 1.00 0.00 H new ATOM 0 HD2 PRO A 75 18.945 -14.474 -3.702 1.00 0.00 H new ATOM 0 HD3 PRO A 75 20.001 -15.731 -4.316 1.00 0.00 H new ATOM 107 N LYS A 76 22.258 -10.927 -5.378 1.00 0.00 N ATOM 108 CA LYS A 76 22.201 -9.472 -5.306 1.00 0.00 C ATOM 109 C LYS A 76 20.795 -8.966 -5.611 1.00 0.00 C ATOM 110 O LYS A 76 20.496 -8.580 -6.741 1.00 0.00 O ATOM 111 CB LYS A 76 23.201 -8.853 -6.286 1.00 0.00 C ATOM 112 CG LYS A 76 24.650 -9.006 -5.854 1.00 0.00 C ATOM 113 CD LYS A 76 25.015 -8.010 -4.766 1.00 0.00 C ATOM 114 CE LYS A 76 26.516 -7.770 -4.712 1.00 0.00 C ATOM 115 NZ LYS A 76 27.263 -9.008 -4.353 1.00 0.00 N ATOM 0 H LYS A 76 22.813 -11.289 -6.153 1.00 0.00 H new ATOM 0 HA LYS A 76 22.463 -9.173 -4.291 1.00 0.00 H new ATOM 0 HB2 LYS A 76 23.072 -9.315 -7.265 1.00 0.00 H new ATOM 0 HB3 LYS A 76 22.975 -7.793 -6.402 1.00 0.00 H new ATOM 0 HG2 LYS A 76 24.817 -10.020 -5.491 1.00 0.00 H new ATOM 0 HG3 LYS A 76 25.304 -8.863 -6.714 1.00 0.00 H new ATOM 0 HD2 LYS A 76 24.501 -7.066 -4.948 1.00 0.00 H new ATOM 0 HD3 LYS A 76 24.670 -8.381 -3.801 1.00 0.00 H new ATOM 0 HE2 LYS A 76 26.861 -7.406 -5.680 1.00 0.00 H new ATOM 0 HE3 LYS A 76 26.733 -6.990 -3.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 28.282 -8.803 -4.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 26.953 -9.342 -3.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 27.076 -9.744 -5.063 1.00 0.00 H new ATOM 129 N ARG A 77 19.937 -8.969 -4.596 1.00 0.00 N ATOM 130 CA ARG A 77 18.563 -8.510 -4.757 1.00 0.00 C ATOM 131 C ARG A 77 17.909 -8.267 -3.399 1.00 0.00 C ATOM 132 O ARG A 77 17.645 -9.208 -2.651 1.00 0.00 O ATOM 133 CB ARG A 77 17.750 -9.534 -5.551 1.00 0.00 C ATOM 134 CG ARG A 77 16.286 -9.158 -5.710 1.00 0.00 C ATOM 135 CD ARG A 77 15.516 -10.225 -6.472 1.00 0.00 C ATOM 136 NE ARG A 77 15.875 -10.252 -7.888 1.00 0.00 N ATOM 137 CZ ARG A 77 15.404 -11.148 -8.748 1.00 0.00 C ATOM 138 NH1 ARG A 77 14.560 -12.085 -8.339 1.00 0.00 N ATOM 139 NH2 ARG A 77 15.777 -11.107 -10.021 1.00 0.00 N ATOM 0 H ARG A 77 20.169 -9.284 -3.654 1.00 0.00 H new ATOM 0 HA ARG A 77 18.583 -7.568 -5.306 1.00 0.00 H new ATOM 0 HB2 ARG A 77 18.195 -9.652 -6.539 1.00 0.00 H new ATOM 0 HB3 ARG A 77 17.816 -10.502 -5.054 1.00 0.00 H new ATOM 0 HG2 ARG A 77 15.837 -9.016 -4.727 1.00 0.00 H new ATOM 0 HG3 ARG A 77 16.209 -8.207 -6.236 1.00 0.00 H new ATOM 0 HD2 ARG A 77 15.714 -11.201 -6.029 1.00 0.00 H new ATOM 0 HD3 ARG A 77 14.446 -10.041 -6.373 1.00 0.00 H new ATOM 0 HE ARG A 77 16.522 -9.544 -8.235 1.00 0.00 H new ATOM 0 HH11 ARG A 77 14.271 -12.119 -7.362 1.00 0.00 H new ATOM 0 HH12 ARG A 77 14.200 -12.772 -9.002 1.00 0.00 H new ATOM 0 HH21 ARG A 77 16.426 -10.387 -10.339 1.00 0.00 H new ATOM 0 HH22 ARG A 77 15.415 -11.795 -10.681 1.00 0.00 H new ATOM 153 N GLN A 78 17.652 -7.001 -3.090 1.00 0.00 N ATOM 154 CA GLN A 78 17.030 -6.635 -1.823 1.00 0.00 C ATOM 155 C GLN A 78 16.234 -5.341 -1.960 1.00 0.00 C ATOM 156 O GLN A 78 16.778 -4.304 -2.339 1.00 0.00 O ATOM 157 CB GLN A 78 18.094 -6.481 -0.735 1.00 0.00 C ATOM 158 CG GLN A 78 18.734 -7.795 -0.319 1.00 0.00 C ATOM 159 CD GLN A 78 19.918 -7.601 0.608 1.00 0.00 C ATOM 160 OE1 GLN A 78 20.209 -6.483 1.035 1.00 0.00 O ATOM 161 NE2 GLN A 78 20.607 -8.690 0.925 1.00 0.00 N ATOM 0 H GLN A 78 17.865 -6.211 -3.699 1.00 0.00 H new ATOM 0 HA GLN A 78 16.344 -7.433 -1.540 1.00 0.00 H new ATOM 0 HB2 GLN A 78 18.871 -5.805 -1.092 1.00 0.00 H new ATOM 0 HB3 GLN A 78 17.642 -6.014 0.140 1.00 0.00 H new ATOM 0 HG2 GLN A 78 17.988 -8.417 0.176 1.00 0.00 H new ATOM 0 HG3 GLN A 78 19.059 -8.334 -1.209 1.00 0.00 H new ATOM 0 HE21 GLN A 78 20.330 -9.596 0.548 1.00 0.00 H new ATOM 0 HE22 GLN A 78 21.413 -8.621 1.546 1.00 0.00 H new ATOM 170 N ARG A 79 14.944 -5.410 -1.650 1.00 0.00 N ATOM 171 CA ARG A 79 14.073 -4.244 -1.740 1.00 0.00 C ATOM 172 C ARG A 79 14.103 -3.651 -3.145 1.00 0.00 C ATOM 173 O ARG A 79 14.333 -2.453 -3.318 1.00 0.00 O ATOM 174 CB ARG A 79 14.494 -3.187 -0.718 1.00 0.00 C ATOM 175 CG ARG A 79 13.879 -3.389 0.657 1.00 0.00 C ATOM 176 CD ARG A 79 14.727 -4.314 1.516 1.00 0.00 C ATOM 177 NE ARG A 79 13.953 -4.918 2.597 1.00 0.00 N ATOM 178 CZ ARG A 79 14.503 -5.508 3.653 1.00 0.00 C ATOM 179 NH1 ARG A 79 15.822 -5.571 3.769 1.00 0.00 N ATOM 180 NH2 ARG A 79 13.732 -6.035 4.596 1.00 0.00 N ATOM 0 H ARG A 79 14.478 -6.261 -1.334 1.00 0.00 H new ATOM 0 HA ARG A 79 13.054 -4.564 -1.522 1.00 0.00 H new ATOM 0 HB2 ARG A 79 15.580 -3.196 -0.626 1.00 0.00 H new ATOM 0 HB3 ARG A 79 14.214 -2.202 -1.091 1.00 0.00 H new ATOM 0 HG2 ARG A 79 13.772 -2.425 1.154 1.00 0.00 H new ATOM 0 HG3 ARG A 79 12.877 -3.806 0.551 1.00 0.00 H new ATOM 0 HD2 ARG A 79 15.153 -5.100 0.892 1.00 0.00 H new ATOM 0 HD3 ARG A 79 15.562 -3.754 1.937 1.00 0.00 H new ATOM 0 HE ARG A 79 12.935 -4.885 2.538 1.00 0.00 H new ATOM 0 HH11 ARG A 79 16.417 -5.166 3.047 1.00 0.00 H new ATOM 0 HH12 ARG A 79 16.241 -6.024 4.581 1.00 0.00 H new ATOM 0 HH21 ARG A 79 12.717 -5.987 4.510 1.00 0.00 H new ATOM 0 HH22 ARG A 79 14.155 -6.488 5.406 1.00 0.00 H new ATOM 194 N ILE A 80 13.871 -4.495 -4.144 1.00 0.00 N ATOM 195 CA ILE A 80 13.871 -4.054 -5.533 1.00 0.00 C ATOM 196 C ILE A 80 12.678 -3.149 -5.822 1.00 0.00 C ATOM 197 O ILE A 80 12.660 -2.428 -6.820 1.00 0.00 O ATOM 198 CB ILE A 80 13.842 -5.249 -6.504 1.00 0.00 C ATOM 199 CG1 ILE A 80 13.861 -4.758 -7.953 1.00 0.00 C ATOM 200 CG2 ILE A 80 12.615 -6.111 -6.247 1.00 0.00 C ATOM 201 CD1 ILE A 80 12.484 -4.486 -8.516 1.00 0.00 C ATOM 0 H ILE A 80 13.680 -5.489 -4.017 1.00 0.00 H new ATOM 0 HA ILE A 80 14.794 -3.495 -5.686 1.00 0.00 H new ATOM 0 HB ILE A 80 14.731 -5.857 -6.335 1.00 0.00 H new ATOM 0 HG12 ILE A 80 14.455 -3.846 -8.012 1.00 0.00 H new ATOM 0 HG13 ILE A 80 14.358 -5.503 -8.574 1.00 0.00 H new ATOM 0 HG21 ILE A 80 12.609 -6.951 -6.941 1.00 0.00 H new ATOM 0 HG22 ILE A 80 12.641 -6.486 -5.224 1.00 0.00 H new ATOM 0 HG23 ILE A 80 11.714 -5.514 -6.392 1.00 0.00 H new ATOM 0 HD11 ILE A 80 12.574 -4.141 -9.546 1.00 0.00 H new ATOM 0 HD12 ILE A 80 11.893 -5.401 -8.490 1.00 0.00 H new ATOM 0 HD13 ILE A 80 11.992 -3.719 -7.918 1.00 0.00 H new ATOM 213 N ARG A 81 11.683 -3.192 -4.942 1.00 0.00 N ATOM 214 CA ARG A 81 10.485 -2.375 -5.103 1.00 0.00 C ATOM 215 C ARG A 81 9.773 -2.186 -3.767 1.00 0.00 C ATOM 216 O ARG A 81 9.489 -3.153 -3.059 1.00 0.00 O ATOM 217 CB ARG A 81 9.535 -3.020 -6.113 1.00 0.00 C ATOM 218 CG ARG A 81 8.686 -2.017 -6.877 1.00 0.00 C ATOM 219 CD ARG A 81 8.304 -2.544 -8.252 1.00 0.00 C ATOM 220 NE ARG A 81 7.923 -1.468 -9.164 1.00 0.00 N ATOM 221 CZ ARG A 81 7.218 -1.660 -10.273 1.00 0.00 C ATOM 222 NH1 ARG A 81 6.818 -2.880 -10.605 1.00 0.00 N ATOM 223 NH2 ARG A 81 6.911 -0.631 -11.052 1.00 0.00 N ATOM 0 H ARG A 81 11.682 -3.783 -4.111 1.00 0.00 H new ATOM 0 HA ARG A 81 10.789 -1.396 -5.474 1.00 0.00 H new ATOM 0 HB2 ARG A 81 10.117 -3.606 -6.824 1.00 0.00 H new ATOM 0 HB3 ARG A 81 8.878 -3.715 -5.589 1.00 0.00 H new ATOM 0 HG2 ARG A 81 7.784 -1.794 -6.308 1.00 0.00 H new ATOM 0 HG3 ARG A 81 9.234 -1.081 -6.984 1.00 0.00 H new ATOM 0 HD2 ARG A 81 9.143 -3.097 -8.674 1.00 0.00 H new ATOM 0 HD3 ARG A 81 7.476 -3.246 -8.154 1.00 0.00 H new ATOM 0 HE ARG A 81 8.214 -0.517 -8.937 1.00 0.00 H new ATOM 0 HH11 ARG A 81 7.052 -3.673 -10.008 1.00 0.00 H new ATOM 0 HH12 ARG A 81 6.277 -3.025 -11.457 1.00 0.00 H new ATOM 0 HH21 ARG A 81 7.216 0.309 -10.799 1.00 0.00 H new ATOM 0 HH22 ARG A 81 6.370 -0.780 -11.904 1.00 0.00 H new ATOM 237 N LYS A 82 9.487 -0.934 -3.427 1.00 0.00 N ATOM 238 CA LYS A 82 8.808 -0.616 -2.176 1.00 0.00 C ATOM 239 C LYS A 82 7.518 0.154 -2.439 1.00 0.00 C ATOM 240 O LYS A 82 7.425 0.922 -3.397 1.00 0.00 O ATOM 241 CB LYS A 82 9.727 0.202 -1.266 1.00 0.00 C ATOM 242 CG LYS A 82 9.392 0.074 0.210 1.00 0.00 C ATOM 243 CD LYS A 82 10.136 1.105 1.042 1.00 0.00 C ATOM 244 CE LYS A 82 11.582 0.697 1.273 1.00 0.00 C ATOM 245 NZ LYS A 82 11.711 -0.282 2.388 1.00 0.00 N ATOM 0 H LYS A 82 9.715 -0.122 -4.001 1.00 0.00 H new ATOM 0 HA LYS A 82 8.557 -1.553 -1.679 1.00 0.00 H new ATOM 0 HB2 LYS A 82 10.758 -0.115 -1.425 1.00 0.00 H new ATOM 0 HB3 LYS A 82 9.669 1.252 -1.554 1.00 0.00 H new ATOM 0 HG2 LYS A 82 8.318 0.196 0.352 1.00 0.00 H new ATOM 0 HG3 LYS A 82 9.647 -0.927 0.556 1.00 0.00 H new ATOM 0 HD2 LYS A 82 10.106 2.071 0.538 1.00 0.00 H new ATOM 0 HD3 LYS A 82 9.634 1.230 2.002 1.00 0.00 H new ATOM 0 HE2 LYS A 82 11.987 0.262 0.359 1.00 0.00 H new ATOM 0 HE3 LYS A 82 12.178 1.582 1.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 12.712 -0.535 2.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 11.348 0.142 3.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 11.163 -1.137 2.164 1.00 0.00 H new ATOM 259 N LEU A 83 6.524 -0.056 -1.582 1.00 0.00 N ATOM 260 CA LEU A 83 5.239 0.620 -1.720 1.00 0.00 C ATOM 261 C LEU A 83 4.970 1.529 -0.525 1.00 0.00 C ATOM 262 O LEU A 83 5.235 1.160 0.619 1.00 0.00 O ATOM 263 CB LEU A 83 4.113 -0.407 -1.858 1.00 0.00 C ATOM 264 CG LEU A 83 4.101 -1.220 -3.153 1.00 0.00 C ATOM 265 CD1 LEU A 83 3.214 -2.446 -3.004 1.00 0.00 C ATOM 266 CD2 LEU A 83 3.633 -0.360 -4.318 1.00 0.00 C ATOM 0 H LEU A 83 6.584 -0.689 -0.784 1.00 0.00 H new ATOM 0 HA LEU A 83 5.275 1.235 -2.619 1.00 0.00 H new ATOM 0 HB2 LEU A 83 4.175 -1.099 -1.018 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.160 0.115 -1.771 1.00 0.00 H new ATOM 0 HG LEU A 83 5.118 -1.554 -3.359 1.00 0.00 H new ATOM 0 HD11 LEU A 83 3.217 -3.013 -3.935 1.00 0.00 H new ATOM 0 HD12 LEU A 83 3.592 -3.073 -2.196 1.00 0.00 H new ATOM 0 HD13 LEU A 83 2.196 -2.133 -2.774 1.00 0.00 H new ATOM 0 HD21 LEU A 83 3.631 -0.955 -5.231 1.00 0.00 H new ATOM 0 HD22 LEU A 83 2.625 0.004 -4.120 1.00 0.00 H new ATOM 0 HD23 LEU A 83 4.308 0.488 -4.439 1.00 0.00 H new ATOM 278 N GLN A 84 4.442 2.717 -0.799 1.00 0.00 N ATOM 279 CA GLN A 84 4.136 3.678 0.254 1.00 0.00 C ATOM 280 C GLN A 84 2.629 3.839 0.423 1.00 0.00 C ATOM 281 O GLN A 84 1.915 4.132 -0.536 1.00 0.00 O ATOM 282 CB GLN A 84 4.773 5.032 -0.061 1.00 0.00 C ATOM 283 CG GLN A 84 4.326 6.147 0.871 1.00 0.00 C ATOM 284 CD GLN A 84 5.371 7.234 1.024 1.00 0.00 C ATOM 285 OE1 GLN A 84 5.320 8.261 0.346 1.00 0.00 O ATOM 286 NE2 GLN A 84 6.328 7.014 1.918 1.00 0.00 N ATOM 0 H GLN A 84 4.217 3.037 -1.741 1.00 0.00 H new ATOM 0 HA GLN A 84 4.550 3.299 1.188 1.00 0.00 H new ATOM 0 HB2 GLN A 84 5.857 4.936 -0.005 1.00 0.00 H new ATOM 0 HB3 GLN A 84 4.530 5.308 -1.087 1.00 0.00 H new ATOM 0 HG2 GLN A 84 3.404 6.586 0.490 1.00 0.00 H new ATOM 0 HG3 GLN A 84 4.098 5.727 1.851 1.00 0.00 H new ATOM 0 HE21 GLN A 84 6.332 6.149 2.458 1.00 0.00 H new ATOM 0 HE22 GLN A 84 7.059 7.710 2.064 1.00 0.00 H new ATOM 295 N ILE A 85 2.152 3.645 1.648 1.00 0.00 N ATOM 296 CA ILE A 85 0.730 3.770 1.942 1.00 0.00 C ATOM 297 C ILE A 85 0.454 4.989 2.815 1.00 0.00 C ATOM 298 O ILE A 85 1.140 5.221 3.811 1.00 0.00 O ATOM 299 CB ILE A 85 0.189 2.513 2.650 1.00 0.00 C ATOM 300 CG1 ILE A 85 0.501 1.263 1.825 1.00 0.00 C ATOM 301 CG2 ILE A 85 -1.309 2.640 2.884 1.00 0.00 C ATOM 302 CD1 ILE A 85 0.020 -0.020 2.467 1.00 0.00 C ATOM 0 H ILE A 85 2.729 3.401 2.453 1.00 0.00 H new ATOM 0 HA ILE A 85 0.219 3.887 0.986 1.00 0.00 H new ATOM 0 HB ILE A 85 0.681 2.419 3.618 1.00 0.00 H new ATOM 0 HG12 ILE A 85 0.041 1.362 0.842 1.00 0.00 H new ATOM 0 HG13 ILE A 85 1.578 1.200 1.669 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -1.676 1.744 3.385 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -1.507 3.512 3.508 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -1.818 2.755 1.927 1.00 0.00 H new ATOM 0 HD11 ILE A 85 0.275 -0.865 1.827 1.00 0.00 H new ATOM 0 HD12 ILE A 85 0.499 -0.143 3.438 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -1.061 0.022 2.599 1.00 0.00 H new ATOM 314 N ARG A 86 -0.556 5.765 2.435 1.00 0.00 N ATOM 315 CA ARG A 86 -0.924 6.961 3.184 1.00 0.00 C ATOM 316 C ARG A 86 -2.431 7.014 3.417 1.00 0.00 C ATOM 317 O ARG A 86 -3.160 6.097 3.042 1.00 0.00 O ATOM 318 CB ARG A 86 -0.468 8.216 2.437 1.00 0.00 C ATOM 319 CG ARG A 86 1.030 8.459 2.513 1.00 0.00 C ATOM 320 CD ARG A 86 1.515 9.314 1.352 1.00 0.00 C ATOM 321 NE ARG A 86 2.847 9.861 1.595 1.00 0.00 N ATOM 322 CZ ARG A 86 3.483 10.654 0.739 1.00 0.00 C ATOM 323 NH1 ARG A 86 2.911 10.990 -0.409 1.00 0.00 N ATOM 324 NH2 ARG A 86 4.693 11.112 1.032 1.00 0.00 N ATOM 0 H ARG A 86 -1.134 5.587 1.613 1.00 0.00 H new ATOM 0 HA ARG A 86 -0.425 6.921 4.152 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -0.761 8.132 1.391 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -0.989 9.082 2.846 1.00 0.00 H new ATOM 0 HG2 ARG A 86 1.273 8.951 3.455 1.00 0.00 H new ATOM 0 HG3 ARG A 86 1.555 7.504 2.508 1.00 0.00 H new ATOM 0 HD2 ARG A 86 1.530 8.715 0.442 1.00 0.00 H new ATOM 0 HD3 ARG A 86 0.813 10.131 1.185 1.00 0.00 H new ATOM 0 HE ARG A 86 3.315 9.621 2.469 1.00 0.00 H new ATOM 0 HH11 ARG A 86 1.981 10.640 -0.637 1.00 0.00 H new ATOM 0 HH12 ARG A 86 3.401 11.599 -1.064 1.00 0.00 H new ATOM 0 HH21 ARG A 86 5.136 10.856 1.914 1.00 0.00 H new ATOM 0 HH22 ARG A 86 5.181 11.721 0.375 1.00 0.00 H new ATOM 338 N ASN A 87 -2.890 8.095 4.040 1.00 0.00 N ATOM 339 CA ASN A 87 -4.310 8.267 4.325 1.00 0.00 C ATOM 340 C ASN A 87 -4.823 7.152 5.230 1.00 0.00 C ATOM 341 O ASN A 87 -5.952 6.684 5.077 1.00 0.00 O ATOM 342 CB ASN A 87 -5.114 8.293 3.023 1.00 0.00 C ATOM 343 CG ASN A 87 -5.300 9.698 2.486 1.00 0.00 C ATOM 344 OD1 ASN A 87 -4.475 10.580 2.723 1.00 0.00 O ATOM 345 ND2 ASN A 87 -6.390 9.914 1.758 1.00 0.00 N ATOM 0 H ASN A 87 -2.300 8.864 4.357 1.00 0.00 H new ATOM 0 HA ASN A 87 -4.438 9.218 4.842 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -4.607 7.685 2.274 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -6.091 7.840 3.193 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -6.569 10.840 1.371 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -7.048 9.153 1.586 1.00 0.00 H new ATOM 352 N ILE A 88 -3.986 6.730 6.172 1.00 0.00 N ATOM 353 CA ILE A 88 -4.356 5.671 7.103 1.00 0.00 C ATOM 354 C ILE A 88 -4.984 6.245 8.368 1.00 0.00 C ATOM 355 O ILE A 88 -4.459 7.172 8.986 1.00 0.00 O ATOM 356 CB ILE A 88 -3.137 4.813 7.492 1.00 0.00 C ATOM 357 CG1 ILE A 88 -2.498 4.201 6.244 1.00 0.00 C ATOM 358 CG2 ILE A 88 -3.547 3.725 8.473 1.00 0.00 C ATOM 359 CD1 ILE A 88 -1.115 3.637 6.489 1.00 0.00 C ATOM 0 H ILE A 88 -3.048 7.105 6.311 1.00 0.00 H new ATOM 0 HA ILE A 88 -5.085 5.042 6.592 1.00 0.00 H new ATOM 0 HB ILE A 88 -2.400 5.453 7.977 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -3.144 3.408 5.867 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -2.439 4.962 5.465 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -2.675 3.127 8.738 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -3.961 4.182 9.372 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -4.299 3.085 8.013 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -0.723 3.220 5.562 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -0.455 4.431 6.837 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -1.170 2.853 7.245 1.00 0.00 H new ATOM 371 N PRO A 89 -6.135 5.682 8.765 1.00 0.00 N ATOM 372 CA PRO A 89 -6.859 6.121 9.962 1.00 0.00 C ATOM 373 C PRO A 89 -6.125 5.760 11.249 1.00 0.00 C ATOM 374 O PRO A 89 -5.820 4.596 11.512 1.00 0.00 O ATOM 375 CB PRO A 89 -8.185 5.362 9.872 1.00 0.00 C ATOM 376 CG PRO A 89 -7.875 4.153 9.059 1.00 0.00 C ATOM 377 CD PRO A 89 -6.818 4.574 8.077 1.00 0.00 C ATOM 0 HA PRO A 89 -6.973 7.205 9.995 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -8.553 5.090 10.861 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -8.957 5.969 9.400 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -7.519 3.339 9.690 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -8.764 3.791 8.543 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -6.132 3.758 7.851 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -7.254 4.896 7.131 1.00 0.00 H new ATOM 385 N PRO A 90 -5.833 6.779 12.070 1.00 0.00 N ATOM 386 CA PRO A 90 -5.131 6.592 13.344 1.00 0.00 C ATOM 387 C PRO A 90 -5.990 5.875 14.380 1.00 0.00 C ATOM 388 O PRO A 90 -5.563 5.660 15.514 1.00 0.00 O ATOM 389 CB PRO A 90 -4.832 8.024 13.797 1.00 0.00 C ATOM 390 CG PRO A 90 -5.877 8.856 13.137 1.00 0.00 C ATOM 391 CD PRO A 90 -6.165 8.191 11.820 1.00 0.00 C ATOM 0 HA PRO A 90 -4.243 5.970 13.232 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -4.881 8.114 14.882 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -3.831 8.334 13.496 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -6.776 8.912 13.751 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -5.527 9.878 12.990 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -7.208 8.313 11.528 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -5.558 8.610 11.017 1.00 0.00 H new ATOM 399 N HIS A 91 -7.204 5.506 13.982 1.00 0.00 N ATOM 400 CA HIS A 91 -8.123 4.811 14.876 1.00 0.00 C ATOM 401 C HIS A 91 -7.920 3.301 14.798 1.00 0.00 C ATOM 402 O HIS A 91 -8.084 2.590 15.791 1.00 0.00 O ATOM 403 CB HIS A 91 -9.570 5.161 14.527 1.00 0.00 C ATOM 404 CG HIS A 91 -9.769 6.602 14.171 1.00 0.00 C ATOM 405 ND1 HIS A 91 -10.674 7.026 13.222 1.00 0.00 N ATOM 406 CD2 HIS A 91 -9.173 7.721 14.646 1.00 0.00 C ATOM 407 CE1 HIS A 91 -10.626 8.342 13.126 1.00 0.00 C ATOM 408 NE2 HIS A 91 -9.723 8.789 13.980 1.00 0.00 N ATOM 0 H HIS A 91 -7.574 5.677 13.047 1.00 0.00 H new ATOM 0 HA HIS A 91 -7.914 5.136 15.895 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -9.894 4.541 13.691 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -10.209 4.913 15.374 1.00 0.00 H new ATOM 0 HD1 HIS A 91 -11.286 6.418 12.678 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -8.408 7.766 15.407 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -11.223 8.949 12.462 1.00 0.00 H new ATOM 416 N LEU A 92 -7.563 2.818 13.614 1.00 0.00 N ATOM 417 CA LEU A 92 -7.337 1.391 13.406 1.00 0.00 C ATOM 418 C LEU A 92 -6.107 0.917 14.172 1.00 0.00 C ATOM 419 O LEU A 92 -5.180 1.690 14.415 1.00 0.00 O ATOM 420 CB LEU A 92 -7.170 1.093 11.915 1.00 0.00 C ATOM 421 CG LEU A 92 -6.351 -0.150 11.566 1.00 0.00 C ATOM 422 CD1 LEU A 92 -6.831 -0.755 10.256 1.00 0.00 C ATOM 423 CD2 LEU A 92 -4.870 0.192 11.487 1.00 0.00 C ATOM 0 H LEU A 92 -7.424 3.393 12.783 1.00 0.00 H new ATOM 0 HA LEU A 92 -8.206 0.852 13.783 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -8.161 0.986 11.473 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -6.702 1.956 11.443 1.00 0.00 H new ATOM 0 HG LEU A 92 -6.491 -0.888 12.356 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -6.236 -1.639 10.024 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -7.880 -1.037 10.348 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -6.721 -0.023 9.456 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -4.302 -0.705 11.238 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -4.712 0.948 10.717 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -4.534 0.578 12.449 1.00 0.00 H new ATOM 435 N GLN A 93 -6.104 -0.358 14.547 1.00 0.00 N ATOM 436 CA GLN A 93 -4.986 -0.935 15.283 1.00 0.00 C ATOM 437 C GLN A 93 -3.948 -1.517 14.330 1.00 0.00 C ATOM 438 O GLN A 93 -4.294 -2.125 13.317 1.00 0.00 O ATOM 439 CB GLN A 93 -5.484 -2.021 16.239 1.00 0.00 C ATOM 440 CG GLN A 93 -6.162 -1.471 17.484 1.00 0.00 C ATOM 441 CD GLN A 93 -6.854 -2.549 18.296 1.00 0.00 C ATOM 442 OE1 GLN A 93 -7.984 -2.937 17.998 1.00 0.00 O ATOM 443 NE2 GLN A 93 -6.177 -3.039 19.328 1.00 0.00 N ATOM 0 H GLN A 93 -6.863 -1.011 14.353 1.00 0.00 H new ATOM 0 HA GLN A 93 -4.515 -0.140 15.861 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -6.184 -2.667 15.709 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -4.641 -2.644 16.539 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -5.420 -0.972 18.107 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -6.892 -0.716 17.192 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -5.243 -2.688 19.538 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -6.591 -3.767 19.910 1.00 0.00 H new ATOM 452 N TRP A 94 -2.676 -1.327 14.661 1.00 0.00 N ATOM 453 CA TRP A 94 -1.587 -1.834 13.833 1.00 0.00 C ATOM 454 C TRP A 94 -1.759 -3.324 13.560 1.00 0.00 C ATOM 455 O TRP A 94 -1.700 -3.764 12.412 1.00 0.00 O ATOM 456 CB TRP A 94 -0.241 -1.579 14.512 1.00 0.00 C ATOM 457 CG TRP A 94 0.931 -1.764 13.597 1.00 0.00 C ATOM 458 CD1 TRP A 94 1.588 -2.932 13.333 1.00 0.00 C ATOM 459 CD2 TRP A 94 1.585 -0.750 12.827 1.00 0.00 C ATOM 460 NE1 TRP A 94 2.612 -2.705 12.445 1.00 0.00 N ATOM 461 CE2 TRP A 94 2.631 -1.374 12.118 1.00 0.00 C ATOM 462 CE3 TRP A 94 1.389 0.624 12.665 1.00 0.00 C ATOM 463 CZ2 TRP A 94 3.475 -0.670 11.264 1.00 0.00 C ATOM 464 CZ3 TRP A 94 2.228 1.321 11.816 1.00 0.00 C ATOM 465 CH2 TRP A 94 3.260 0.674 11.124 1.00 0.00 C ATOM 0 H TRP A 94 -2.373 -0.826 15.496 1.00 0.00 H new ATOM 0 HA TRP A 94 -1.611 -1.304 12.881 1.00 0.00 H new ATOM 0 HB2 TRP A 94 -0.228 -0.563 14.906 1.00 0.00 H new ATOM 0 HB3 TRP A 94 -0.138 -2.252 15.363 1.00 0.00 H new ATOM 0 HD1 TRP A 94 1.339 -3.893 13.759 1.00 0.00 H new ATOM 0 HE1 TRP A 94 3.254 -3.412 12.087 1.00 0.00 H new ATOM 0 HE3 TRP A 94 0.596 1.132 13.194 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 4.272 -1.167 10.731 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 2.085 2.383 11.684 1.00 0.00 H new ATOM 0 HH2 TRP A 94 3.898 1.247 10.467 1.00 0.00 H new ATOM 476 N GLU A 95 -1.971 -4.095 14.621 1.00 0.00 N ATOM 477 CA GLU A 95 -2.151 -5.537 14.494 1.00 0.00 C ATOM 478 C GLU A 95 -3.021 -5.872 13.286 1.00 0.00 C ATOM 479 O GLU A 95 -2.707 -6.778 12.513 1.00 0.00 O ATOM 480 CB GLU A 95 -2.782 -6.109 15.765 1.00 0.00 C ATOM 481 CG GLU A 95 -4.187 -5.595 16.032 1.00 0.00 C ATOM 482 CD GLU A 95 -4.550 -5.627 17.503 1.00 0.00 C ATOM 483 OE1 GLU A 95 -3.640 -5.473 18.344 1.00 0.00 O ATOM 484 OE2 GLU A 95 -5.746 -5.808 17.815 1.00 0.00 O ATOM 0 H GLU A 95 -2.022 -3.746 15.578 1.00 0.00 H new ATOM 0 HA GLU A 95 -1.169 -5.988 14.350 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -2.810 -7.196 15.689 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -2.147 -5.865 16.617 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -4.272 -4.573 15.663 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -4.903 -6.197 15.472 1.00 0.00 H new ATOM 491 N VAL A 96 -4.115 -5.135 13.129 1.00 0.00 N ATOM 492 CA VAL A 96 -5.031 -5.352 12.015 1.00 0.00 C ATOM 493 C VAL A 96 -4.362 -5.031 10.683 1.00 0.00 C ATOM 494 O VAL A 96 -4.550 -5.742 9.695 1.00 0.00 O ATOM 495 CB VAL A 96 -6.303 -4.495 12.159 1.00 0.00 C ATOM 496 CG1 VAL A 96 -7.237 -4.725 10.981 1.00 0.00 C ATOM 497 CG2 VAL A 96 -7.004 -4.799 13.473 1.00 0.00 C ATOM 0 H VAL A 96 -4.389 -4.382 13.759 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.309 -6.406 12.034 1.00 0.00 H new ATOM 0 HB VAL A 96 -6.014 -3.444 12.163 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -8.130 -4.112 11.100 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -6.730 -4.452 10.056 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -7.522 -5.776 10.942 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -7.900 -4.185 13.558 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -7.282 -5.853 13.502 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -6.333 -4.578 14.303 1.00 0.00 H new ATOM 507 N LEU A 97 -3.581 -3.957 10.664 1.00 0.00 N ATOM 508 CA LEU A 97 -2.882 -3.541 9.453 1.00 0.00 C ATOM 509 C LEU A 97 -2.004 -4.668 8.917 1.00 0.00 C ATOM 510 O LEU A 97 -2.198 -5.140 7.797 1.00 0.00 O ATOM 511 CB LEU A 97 -2.029 -2.303 9.732 1.00 0.00 C ATOM 512 CG LEU A 97 -1.496 -1.564 8.504 1.00 0.00 C ATOM 513 CD1 LEU A 97 -2.644 -1.068 7.639 1.00 0.00 C ATOM 514 CD2 LEU A 97 -0.603 -0.405 8.925 1.00 0.00 C ATOM 0 H LEU A 97 -3.416 -3.358 11.473 1.00 0.00 H new ATOM 0 HA LEU A 97 -3.629 -3.296 8.698 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -2.621 -1.604 10.323 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -1.181 -2.602 10.348 1.00 0.00 H new ATOM 0 HG LEU A 97 -0.900 -2.261 7.915 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -2.245 -0.545 6.770 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -3.243 -1.916 7.308 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -3.268 -0.387 8.218 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -0.233 0.110 8.038 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -1.176 0.292 9.536 1.00 0.00 H new ATOM 0 HD23 LEU A 97 0.240 -0.786 9.502 1.00 0.00 H new ATOM 526 N ASP A 98 -1.039 -5.094 9.724 1.00 0.00 N ATOM 527 CA ASP A 98 -0.133 -6.167 9.333 1.00 0.00 C ATOM 528 C ASP A 98 -0.852 -7.197 8.468 1.00 0.00 C ATOM 529 O ASP A 98 -0.431 -7.484 7.347 1.00 0.00 O ATOM 530 CB ASP A 98 0.455 -6.844 10.572 1.00 0.00 C ATOM 531 CG ASP A 98 1.549 -7.835 10.226 1.00 0.00 C ATOM 532 OD1 ASP A 98 2.280 -7.592 9.243 1.00 0.00 O ATOM 533 OD2 ASP A 98 1.673 -8.855 10.937 1.00 0.00 O ATOM 0 H ASP A 98 -0.864 -4.712 10.654 1.00 0.00 H new ATOM 0 HA ASP A 98 0.677 -5.730 8.749 1.00 0.00 H new ATOM 0 HB2 ASP A 98 0.856 -6.084 11.242 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -0.339 -7.358 11.113 1.00 0.00 H new ATOM 538 N SER A 99 -1.938 -7.752 8.997 1.00 0.00 N ATOM 539 CA SER A 99 -2.714 -8.754 8.275 1.00 0.00 C ATOM 540 C SER A 99 -3.200 -8.205 6.937 1.00 0.00 C ATOM 541 O SER A 99 -2.994 -8.819 5.889 1.00 0.00 O ATOM 542 CB SER A 99 -3.908 -9.209 9.116 1.00 0.00 C ATOM 543 OG SER A 99 -4.290 -10.533 8.785 1.00 0.00 O ATOM 0 H SER A 99 -2.300 -7.525 9.923 1.00 0.00 H new ATOM 0 HA SER A 99 -2.067 -9.610 8.083 1.00 0.00 H new ATOM 0 HB2 SER A 99 -3.653 -9.155 10.174 1.00 0.00 H new ATOM 0 HB3 SER A 99 -4.748 -8.534 8.955 1.00 0.00 H new ATOM 0 HG SER A 99 -5.054 -10.801 9.337 1.00 0.00 H new ATOM 549 N LEU A 100 -3.846 -7.045 6.980 1.00 0.00 N ATOM 550 CA LEU A 100 -4.362 -6.411 5.772 1.00 0.00 C ATOM 551 C LEU A 100 -3.327 -6.449 4.652 1.00 0.00 C ATOM 552 O LEU A 100 -3.672 -6.575 3.477 1.00 0.00 O ATOM 553 CB LEU A 100 -4.763 -4.964 6.063 1.00 0.00 C ATOM 554 CG LEU A 100 -6.116 -4.767 6.746 1.00 0.00 C ATOM 555 CD1 LEU A 100 -6.207 -3.379 7.361 1.00 0.00 C ATOM 556 CD2 LEU A 100 -7.251 -4.989 5.757 1.00 0.00 C ATOM 0 H LEU A 100 -4.025 -6.524 7.839 1.00 0.00 H new ATOM 0 HA LEU A 100 -5.242 -6.967 5.447 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -3.993 -4.514 6.690 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -4.770 -4.414 5.122 1.00 0.00 H new ATOM 0 HG LEU A 100 -6.208 -5.503 7.545 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -7.177 -3.257 7.843 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -5.416 -3.257 8.101 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -6.093 -2.627 6.580 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -8.206 -4.844 6.261 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -7.163 -4.277 4.936 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -7.198 -6.004 5.364 1.00 0.00 H new ATOM 568 N LEU A 101 -2.056 -6.342 5.025 1.00 0.00 N ATOM 569 CA LEU A 101 -0.969 -6.366 4.052 1.00 0.00 C ATOM 570 C LEU A 101 -0.562 -7.799 3.726 1.00 0.00 C ATOM 571 O LEU A 101 -0.191 -8.108 2.593 1.00 0.00 O ATOM 572 CB LEU A 101 0.236 -5.590 4.586 1.00 0.00 C ATOM 573 CG LEU A 101 -0.080 -4.349 5.420 1.00 0.00 C ATOM 574 CD1 LEU A 101 1.192 -3.767 6.016 1.00 0.00 C ATOM 575 CD2 LEU A 101 -0.800 -3.307 4.576 1.00 0.00 C ATOM 0 H LEU A 101 -1.753 -6.238 5.993 1.00 0.00 H new ATOM 0 HA LEU A 101 -1.322 -5.891 3.137 1.00 0.00 H new ATOM 0 HB2 LEU A 101 0.839 -6.266 5.192 1.00 0.00 H new ATOM 0 HB3 LEU A 101 0.852 -5.287 3.739 1.00 0.00 H new ATOM 0 HG LEU A 101 -0.738 -4.644 6.237 1.00 0.00 H new ATOM 0 HD11 LEU A 101 0.946 -2.884 6.606 1.00 0.00 H new ATOM 0 HD12 LEU A 101 1.667 -4.511 6.656 1.00 0.00 H new ATOM 0 HD13 LEU A 101 1.875 -3.488 5.214 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -1.017 -2.431 5.187 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -0.167 -3.017 3.737 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -1.733 -3.726 4.199 1.00 0.00 H new ATOM 587 N VAL A 102 -0.637 -8.672 4.725 1.00 0.00 N ATOM 588 CA VAL A 102 -0.280 -10.074 4.544 1.00 0.00 C ATOM 589 C VAL A 102 -1.404 -10.844 3.859 1.00 0.00 C ATOM 590 O VAL A 102 -1.240 -12.008 3.496 1.00 0.00 O ATOM 591 CB VAL A 102 0.043 -10.749 5.890 1.00 0.00 C ATOM 592 CG1 VAL A 102 -1.213 -11.352 6.501 1.00 0.00 C ATOM 593 CG2 VAL A 102 1.119 -11.810 5.709 1.00 0.00 C ATOM 0 H VAL A 102 -0.942 -8.433 5.669 1.00 0.00 H new ATOM 0 HA VAL A 102 0.608 -10.095 3.913 1.00 0.00 H new ATOM 0 HB VAL A 102 0.423 -9.991 6.574 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -0.965 -11.824 7.451 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -1.950 -10.566 6.668 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -1.626 -12.098 5.822 1.00 0.00 H new ATOM 0 HG21 VAL A 102 1.335 -12.277 6.670 1.00 0.00 H new ATOM 0 HG22 VAL A 102 0.769 -12.568 5.008 1.00 0.00 H new ATOM 0 HG23 VAL A 102 2.025 -11.346 5.319 1.00 0.00 H new ATOM 603 N GLN A 103 -2.545 -10.184 3.686 1.00 0.00 N ATOM 604 CA GLN A 103 -3.696 -10.807 3.044 1.00 0.00 C ATOM 605 C GLN A 103 -3.560 -10.769 1.525 1.00 0.00 C ATOM 606 O GLN A 103 -3.844 -11.753 0.842 1.00 0.00 O ATOM 607 CB GLN A 103 -4.986 -10.104 3.470 1.00 0.00 C ATOM 608 CG GLN A 103 -5.602 -10.677 4.736 1.00 0.00 C ATOM 609 CD GLN A 103 -6.520 -11.851 4.458 1.00 0.00 C ATOM 610 OE1 GLN A 103 -6.954 -12.061 3.325 1.00 0.00 O ATOM 611 NE2 GLN A 103 -6.821 -12.626 5.494 1.00 0.00 N ATOM 0 H GLN A 103 -2.697 -9.219 3.981 1.00 0.00 H new ATOM 0 HA GLN A 103 -3.736 -11.849 3.360 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -4.779 -9.045 3.624 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -5.712 -10.172 2.660 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -4.807 -10.994 5.411 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -6.163 -9.895 5.249 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -6.439 -12.416 6.416 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -7.434 -13.431 5.367 1.00 0.00 H new ATOM 620 N TYR A 104 -3.124 -9.628 1.004 1.00 0.00 N ATOM 621 CA TYR A 104 -2.952 -9.461 -0.434 1.00 0.00 C ATOM 622 C TYR A 104 -1.928 -10.451 -0.980 1.00 0.00 C ATOM 623 O TYR A 104 -2.215 -11.213 -1.902 1.00 0.00 O ATOM 624 CB TYR A 104 -2.515 -8.030 -0.754 1.00 0.00 C ATOM 625 CG TYR A 104 -3.587 -6.996 -0.491 1.00 0.00 C ATOM 626 CD1 TYR A 104 -4.607 -6.775 -1.408 1.00 0.00 C ATOM 627 CD2 TYR A 104 -3.580 -6.242 0.676 1.00 0.00 C ATOM 628 CE1 TYR A 104 -5.587 -5.831 -1.172 1.00 0.00 C ATOM 629 CE2 TYR A 104 -4.557 -5.297 0.921 1.00 0.00 C ATOM 630 CZ TYR A 104 -5.558 -5.094 -0.006 1.00 0.00 C ATOM 631 OH TYR A 104 -6.534 -4.154 0.234 1.00 0.00 O ATOM 0 H TYR A 104 -2.883 -8.805 1.556 1.00 0.00 H new ATOM 0 HA TYR A 104 -3.911 -9.657 -0.913 1.00 0.00 H new ATOM 0 HB2 TYR A 104 -1.634 -7.787 -0.160 1.00 0.00 H new ATOM 0 HB3 TYR A 104 -2.218 -7.975 -1.801 1.00 0.00 H new ATOM 0 HD1 TYR A 104 -4.634 -7.351 -2.321 1.00 0.00 H new ATOM 0 HD2 TYR A 104 -2.797 -6.397 1.404 1.00 0.00 H new ATOM 0 HE1 TYR A 104 -6.372 -5.671 -1.896 1.00 0.00 H new ATOM 0 HE2 TYR A 104 -4.537 -4.720 1.834 1.00 0.00 H new ATOM 0 HH TYR A 104 -6.369 -3.724 1.099 1.00 0.00 H new ATOM 641 N GLY A 105 -0.732 -10.435 -0.400 1.00 0.00 N ATOM 642 CA GLY A 105 0.318 -11.336 -0.840 1.00 0.00 C ATOM 643 C GLY A 105 1.301 -11.663 0.266 1.00 0.00 C ATOM 644 O GLY A 105 0.974 -11.562 1.449 1.00 0.00 O ATOM 0 H GLY A 105 -0.471 -9.815 0.366 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -0.130 -12.259 -1.209 1.00 0.00 H new ATOM 0 HA3 GLY A 105 0.853 -10.885 -1.676 1.00 0.00 H new ATOM 648 N VAL A 106 2.511 -12.060 -0.118 1.00 0.00 N ATOM 649 CA VAL A 106 3.545 -12.405 0.850 1.00 0.00 C ATOM 650 C VAL A 106 4.377 -11.183 1.224 1.00 0.00 C ATOM 651 O VAL A 106 5.366 -10.866 0.563 1.00 0.00 O ATOM 652 CB VAL A 106 4.479 -13.502 0.307 1.00 0.00 C ATOM 653 CG1 VAL A 106 5.672 -13.694 1.231 1.00 0.00 C ATOM 654 CG2 VAL A 106 3.719 -14.807 0.125 1.00 0.00 C ATOM 0 H VAL A 106 2.798 -12.150 -1.092 1.00 0.00 H new ATOM 0 HA VAL A 106 3.035 -12.780 1.738 1.00 0.00 H new ATOM 0 HB VAL A 106 4.852 -13.187 -0.667 1.00 0.00 H new ATOM 0 HG11 VAL A 106 6.321 -14.473 0.831 1.00 0.00 H new ATOM 0 HG12 VAL A 106 6.229 -12.760 1.304 1.00 0.00 H new ATOM 0 HG13 VAL A 106 5.322 -13.986 2.221 1.00 0.00 H new ATOM 0 HG21 VAL A 106 4.395 -15.571 -0.259 1.00 0.00 H new ATOM 0 HG22 VAL A 106 3.315 -15.130 1.085 1.00 0.00 H new ATOM 0 HG23 VAL A 106 2.902 -14.657 -0.581 1.00 0.00 H new ATOM 664 N VAL A 107 3.970 -10.500 2.289 1.00 0.00 N ATOM 665 CA VAL A 107 4.679 -9.313 2.752 1.00 0.00 C ATOM 666 C VAL A 107 6.024 -9.682 3.369 1.00 0.00 C ATOM 667 O VAL A 107 6.093 -10.491 4.293 1.00 0.00 O ATOM 668 CB VAL A 107 3.849 -8.532 3.788 1.00 0.00 C ATOM 669 CG1 VAL A 107 3.498 -9.421 4.972 1.00 0.00 C ATOM 670 CG2 VAL A 107 4.601 -7.292 4.248 1.00 0.00 C ATOM 0 H VAL A 107 3.153 -10.748 2.847 1.00 0.00 H new ATOM 0 HA VAL A 107 4.844 -8.682 1.879 1.00 0.00 H new ATOM 0 HB VAL A 107 2.920 -8.212 3.316 1.00 0.00 H new ATOM 0 HG11 VAL A 107 2.912 -8.852 5.693 1.00 0.00 H new ATOM 0 HG12 VAL A 107 2.917 -10.276 4.626 1.00 0.00 H new ATOM 0 HG13 VAL A 107 4.414 -9.773 5.446 1.00 0.00 H new ATOM 0 HG21 VAL A 107 4.000 -6.752 4.980 1.00 0.00 H new ATOM 0 HG22 VAL A 107 5.547 -7.588 4.702 1.00 0.00 H new ATOM 0 HG23 VAL A 107 4.796 -6.646 3.392 1.00 0.00 H new ATOM 680 N GLU A 108 7.091 -9.082 2.850 1.00 0.00 N ATOM 681 CA GLU A 108 8.435 -9.348 3.350 1.00 0.00 C ATOM 682 C GLU A 108 8.698 -8.577 4.640 1.00 0.00 C ATOM 683 O GLU A 108 9.180 -9.138 5.624 1.00 0.00 O ATOM 684 CB GLU A 108 9.479 -8.972 2.296 1.00 0.00 C ATOM 685 CG GLU A 108 10.746 -9.806 2.371 1.00 0.00 C ATOM 686 CD GLU A 108 11.281 -9.930 3.785 1.00 0.00 C ATOM 687 OE1 GLU A 108 11.759 -8.913 4.330 1.00 0.00 O ATOM 688 OE2 GLU A 108 11.221 -11.044 4.346 1.00 0.00 O ATOM 0 H GLU A 108 7.051 -8.409 2.084 1.00 0.00 H new ATOM 0 HA GLU A 108 8.512 -10.414 3.562 1.00 0.00 H new ATOM 0 HB2 GLU A 108 9.039 -9.083 1.305 1.00 0.00 H new ATOM 0 HB3 GLU A 108 9.739 -7.920 2.413 1.00 0.00 H new ATOM 0 HG2 GLU A 108 10.545 -10.801 1.974 1.00 0.00 H new ATOM 0 HG3 GLU A 108 11.510 -9.357 1.736 1.00 0.00 H new ATOM 695 N SER A 109 8.378 -7.287 4.628 1.00 0.00 N ATOM 696 CA SER A 109 8.583 -6.437 5.794 1.00 0.00 C ATOM 697 C SER A 109 7.737 -5.170 5.700 1.00 0.00 C ATOM 698 O SER A 109 7.585 -4.591 4.623 1.00 0.00 O ATOM 699 CB SER A 109 10.062 -6.067 5.928 1.00 0.00 C ATOM 700 OG SER A 109 10.347 -5.566 7.223 1.00 0.00 O ATOM 0 H SER A 109 7.975 -6.808 3.823 1.00 0.00 H new ATOM 0 HA SER A 109 8.273 -6.995 6.678 1.00 0.00 H new ATOM 0 HB2 SER A 109 10.679 -6.944 5.730 1.00 0.00 H new ATOM 0 HB3 SER A 109 10.322 -5.318 5.180 1.00 0.00 H new ATOM 0 HG SER A 109 11.298 -5.339 7.284 1.00 0.00 H new ATOM 706 N CYS A 110 7.189 -4.747 6.833 1.00 0.00 N ATOM 707 CA CYS A 110 6.358 -3.550 6.880 1.00 0.00 C ATOM 708 C CYS A 110 7.020 -2.460 7.716 1.00 0.00 C ATOM 709 O CYS A 110 6.947 -2.476 8.944 1.00 0.00 O ATOM 710 CB CYS A 110 4.980 -3.883 7.453 1.00 0.00 C ATOM 711 SG CYS A 110 3.939 -2.437 7.761 1.00 0.00 S ATOM 0 H CYS A 110 7.305 -5.215 7.732 1.00 0.00 H new ATOM 0 HA CYS A 110 6.240 -3.180 5.862 1.00 0.00 H new ATOM 0 HB2 CYS A 110 4.463 -4.549 6.763 1.00 0.00 H new ATOM 0 HB3 CYS A 110 5.109 -4.430 8.387 1.00 0.00 H new ATOM 0 HG CYS A 110 2.794 -2.821 8.243 1.00 0.00 H new ATOM 717 N GLU A 111 7.667 -1.514 7.041 1.00 0.00 N ATOM 718 CA GLU A 111 8.344 -0.418 7.723 1.00 0.00 C ATOM 719 C GLU A 111 7.388 0.747 7.963 1.00 0.00 C ATOM 720 O GLU A 111 6.395 0.904 7.253 1.00 0.00 O ATOM 721 CB GLU A 111 9.547 0.056 6.904 1.00 0.00 C ATOM 722 CG GLU A 111 10.480 0.978 7.671 1.00 0.00 C ATOM 723 CD GLU A 111 11.917 0.880 7.197 1.00 0.00 C ATOM 724 OE1 GLU A 111 12.261 1.555 6.204 1.00 0.00 O ATOM 725 OE2 GLU A 111 12.697 0.128 7.817 1.00 0.00 O ATOM 0 H GLU A 111 7.736 -1.485 6.024 1.00 0.00 H new ATOM 0 HA GLU A 111 8.692 -0.785 8.689 1.00 0.00 H new ATOM 0 HB2 GLU A 111 10.109 -0.813 6.563 1.00 0.00 H new ATOM 0 HB3 GLU A 111 9.189 0.574 6.014 1.00 0.00 H new ATOM 0 HG2 GLU A 111 10.136 2.007 7.565 1.00 0.00 H new ATOM 0 HG3 GLU A 111 10.434 0.734 8.732 1.00 0.00 H new ATOM 732 N GLN A 112 7.695 1.559 8.969 1.00 0.00 N ATOM 733 CA GLN A 112 6.863 2.709 9.304 1.00 0.00 C ATOM 734 C GLN A 112 7.414 3.983 8.672 1.00 0.00 C ATOM 735 O GLN A 112 8.595 4.060 8.335 1.00 0.00 O ATOM 736 CB GLN A 112 6.775 2.876 10.822 1.00 0.00 C ATOM 737 CG GLN A 112 5.509 3.580 11.284 1.00 0.00 C ATOM 738 CD GLN A 112 5.651 5.089 11.294 1.00 0.00 C ATOM 739 OE1 GLN A 112 6.762 5.620 11.279 1.00 0.00 O ATOM 740 NE2 GLN A 112 4.523 5.790 11.320 1.00 0.00 N ATOM 0 H GLN A 112 8.513 1.442 9.566 1.00 0.00 H new ATOM 0 HA GLN A 112 5.864 2.531 8.906 1.00 0.00 H new ATOM 0 HB2 GLN A 112 6.826 1.893 11.291 1.00 0.00 H new ATOM 0 HB3 GLN A 112 7.641 3.440 11.168 1.00 0.00 H new ATOM 0 HG2 GLN A 112 4.683 3.301 10.630 1.00 0.00 H new ATOM 0 HG3 GLN A 112 5.252 3.236 12.286 1.00 0.00 H new ATOM 0 HE21 GLN A 112 3.624 5.309 11.332 1.00 0.00 H new ATOM 0 HE22 GLN A 112 4.556 6.809 11.328 1.00 0.00 H new ATOM 749 N VAL A 113 6.549 4.980 8.512 1.00 0.00 N ATOM 750 CA VAL A 113 6.949 6.251 7.920 1.00 0.00 C ATOM 751 C VAL A 113 6.040 7.383 8.384 1.00 0.00 C ATOM 752 O VAL A 113 4.924 7.148 8.845 1.00 0.00 O ATOM 753 CB VAL A 113 6.925 6.186 6.382 1.00 0.00 C ATOM 754 CG1 VAL A 113 7.757 7.311 5.786 1.00 0.00 C ATOM 755 CG2 VAL A 113 7.422 4.831 5.898 1.00 0.00 C ATOM 0 H VAL A 113 5.567 4.932 8.784 1.00 0.00 H new ATOM 0 HA VAL A 113 7.968 6.448 8.252 1.00 0.00 H new ATOM 0 HB VAL A 113 5.895 6.311 6.047 1.00 0.00 H new ATOM 0 HG11 VAL A 113 7.728 7.248 4.698 1.00 0.00 H new ATOM 0 HG12 VAL A 113 7.352 8.271 6.105 1.00 0.00 H new ATOM 0 HG13 VAL A 113 8.788 7.221 6.127 1.00 0.00 H new ATOM 0 HG21 VAL A 113 7.398 4.803 4.809 1.00 0.00 H new ATOM 0 HG22 VAL A 113 8.444 4.674 6.243 1.00 0.00 H new ATOM 0 HG23 VAL A 113 6.780 4.045 6.295 1.00 0.00 H new ATOM 765 N ASN A 114 6.526 8.614 8.259 1.00 0.00 N ATOM 766 CA ASN A 114 5.757 9.784 8.666 1.00 0.00 C ATOM 767 C ASN A 114 5.700 10.815 7.543 1.00 0.00 C ATOM 768 O ASN A 114 6.731 11.293 7.069 1.00 0.00 O ATOM 769 CB ASN A 114 6.370 10.413 9.919 1.00 0.00 C ATOM 770 CG ASN A 114 7.423 11.453 9.588 1.00 0.00 C ATOM 771 OD1 ASN A 114 7.180 12.655 9.698 1.00 0.00 O ATOM 772 ND2 ASN A 114 8.600 10.994 9.180 1.00 0.00 N ATOM 0 H ASN A 114 7.448 8.827 7.879 1.00 0.00 H new ATOM 0 HA ASN A 114 4.741 9.459 8.890 1.00 0.00 H new ATOM 0 HB2 ASN A 114 5.582 10.875 10.513 1.00 0.00 H new ATOM 0 HB3 ASN A 114 6.816 9.631 10.534 1.00 0.00 H new ATOM 0 HD21 ASN A 114 9.347 11.646 8.943 1.00 0.00 H new ATOM 0 HD22 ASN A 114 8.757 9.989 9.104 1.00 0.00 H new ATOM 779 N THR A 115 4.486 11.154 7.120 1.00 0.00 N ATOM 780 CA THR A 115 4.293 12.127 6.052 1.00 0.00 C ATOM 781 C THR A 115 3.989 13.510 6.617 1.00 0.00 C ATOM 782 O THR A 115 3.574 14.412 5.888 1.00 0.00 O ATOM 783 CB THR A 115 3.149 11.707 5.110 1.00 0.00 C ATOM 784 OG1 THR A 115 3.083 12.600 3.992 1.00 0.00 O ATOM 785 CG2 THR A 115 1.816 11.705 5.843 1.00 0.00 C ATOM 0 H THR A 115 3.622 10.769 7.501 1.00 0.00 H new ATOM 0 HA THR A 115 5.224 12.165 5.487 1.00 0.00 H new ATOM 0 HB THR A 115 3.352 10.696 4.756 1.00 0.00 H new ATOM 0 HG1 THR A 115 3.169 13.524 4.306 1.00 0.00 H new ATOM 0 HG21 THR A 115 1.024 11.405 5.157 1.00 0.00 H new ATOM 0 HG22 THR A 115 1.860 11.003 6.676 1.00 0.00 H new ATOM 0 HG23 THR A 115 1.608 12.705 6.222 1.00 0.00 H new ATOM 793 N ASP A 116 4.198 13.672 7.919 1.00 0.00 N ATOM 794 CA ASP A 116 3.948 14.946 8.581 1.00 0.00 C ATOM 795 C ASP A 116 2.467 15.309 8.520 1.00 0.00 C ATOM 796 O ASP A 116 2.108 16.438 8.186 1.00 0.00 O ATOM 797 CB ASP A 116 4.784 16.053 7.937 1.00 0.00 C ATOM 798 CG ASP A 116 4.761 17.338 8.740 1.00 0.00 C ATOM 799 OD1 ASP A 116 4.856 17.263 9.983 1.00 0.00 O ATOM 800 OD2 ASP A 116 4.647 18.420 8.127 1.00 0.00 O ATOM 0 H ASP A 116 4.540 12.936 8.537 1.00 0.00 H new ATOM 0 HA ASP A 116 4.236 14.846 9.627 1.00 0.00 H new ATOM 0 HB2 ASP A 116 5.814 15.712 7.832 1.00 0.00 H new ATOM 0 HB3 ASP A 116 4.409 16.249 6.932 1.00 0.00 H new ATOM 805 N SER A 117 1.613 14.344 8.843 1.00 0.00 N ATOM 806 CA SER A 117 0.171 14.561 8.820 1.00 0.00 C ATOM 807 C SER A 117 -0.522 13.717 9.886 1.00 0.00 C ATOM 808 O SER A 117 0.075 12.804 10.455 1.00 0.00 O ATOM 809 CB SER A 117 -0.395 14.223 7.439 1.00 0.00 C ATOM 810 OG SER A 117 0.307 14.912 6.419 1.00 0.00 O ATOM 0 H SER A 117 1.894 13.404 9.124 1.00 0.00 H new ATOM 0 HA SER A 117 -0.017 15.613 9.035 1.00 0.00 H new ATOM 0 HB2 SER A 117 -0.329 13.148 7.268 1.00 0.00 H new ATOM 0 HB3 SER A 117 -1.452 14.488 7.401 1.00 0.00 H new ATOM 0 HG SER A 117 -0.072 14.679 5.546 1.00 0.00 H new ATOM 816 N GLU A 118 -1.787 14.030 10.150 1.00 0.00 N ATOM 817 CA GLU A 118 -2.562 13.302 11.147 1.00 0.00 C ATOM 818 C GLU A 118 -2.613 11.813 10.816 1.00 0.00 C ATOM 819 O GLU A 118 -2.298 10.967 11.654 1.00 0.00 O ATOM 820 CB GLU A 118 -3.982 13.865 11.234 1.00 0.00 C ATOM 821 CG GLU A 118 -4.627 13.682 12.597 1.00 0.00 C ATOM 822 CD GLU A 118 -6.025 14.266 12.664 1.00 0.00 C ATOM 823 OE1 GLU A 118 -6.969 13.604 12.183 1.00 0.00 O ATOM 824 OE2 GLU A 118 -6.175 15.385 13.198 1.00 0.00 O ATOM 0 H GLU A 118 -2.296 14.783 9.687 1.00 0.00 H new ATOM 0 HA GLU A 118 -2.071 13.426 12.112 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -3.958 14.928 10.993 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -4.603 13.381 10.480 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -4.670 12.619 12.835 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -4.003 14.154 13.356 1.00 0.00 H new ATOM 831 N THR A 119 -3.012 11.499 9.588 1.00 0.00 N ATOM 832 CA THR A 119 -3.106 10.114 9.145 1.00 0.00 C ATOM 833 C THR A 119 -1.781 9.385 9.334 1.00 0.00 C ATOM 834 O THR A 119 -0.733 10.012 9.485 1.00 0.00 O ATOM 835 CB THR A 119 -3.522 10.024 7.664 1.00 0.00 C ATOM 836 OG1 THR A 119 -2.671 10.854 6.866 1.00 0.00 O ATOM 837 CG2 THR A 119 -4.971 10.451 7.482 1.00 0.00 C ATOM 0 H THR A 119 -3.276 12.186 8.882 1.00 0.00 H new ATOM 0 HA THR A 119 -3.870 9.638 9.759 1.00 0.00 H new ATOM 0 HB THR A 119 -3.423 8.987 7.343 1.00 0.00 H new ATOM 0 HG1 THR A 119 -2.940 10.790 5.926 1.00 0.00 H new ATOM 0 HG21 THR A 119 -5.242 10.379 6.429 1.00 0.00 H new ATOM 0 HG22 THR A 119 -5.619 9.799 8.069 1.00 0.00 H new ATOM 0 HG23 THR A 119 -5.092 11.481 7.818 1.00 0.00 H new ATOM 845 N ALA A 120 -1.835 8.057 9.324 1.00 0.00 N ATOM 846 CA ALA A 120 -0.638 7.243 9.492 1.00 0.00 C ATOM 847 C ALA A 120 -0.037 6.866 8.142 1.00 0.00 C ATOM 848 O ALA A 120 -0.746 6.766 7.141 1.00 0.00 O ATOM 849 CB ALA A 120 -0.959 5.992 10.297 1.00 0.00 C ATOM 0 H ALA A 120 -2.695 7.522 9.201 1.00 0.00 H new ATOM 0 HA ALA A 120 0.099 7.833 10.037 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -0.056 5.393 10.415 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -1.335 6.278 11.279 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -1.716 5.407 9.774 1.00 0.00 H new ATOM 855 N VAL A 121 1.276 6.658 8.121 1.00 0.00 N ATOM 856 CA VAL A 121 1.973 6.291 6.894 1.00 0.00 C ATOM 857 C VAL A 121 2.922 5.121 7.129 1.00 0.00 C ATOM 858 O VAL A 121 3.551 5.020 8.183 1.00 0.00 O ATOM 859 CB VAL A 121 2.771 7.479 6.326 1.00 0.00 C ATOM 860 CG1 VAL A 121 3.384 7.117 4.982 1.00 0.00 C ATOM 861 CG2 VAL A 121 1.883 8.708 6.203 1.00 0.00 C ATOM 0 H VAL A 121 1.878 6.737 8.940 1.00 0.00 H new ATOM 0 HA VAL A 121 1.211 5.997 6.173 1.00 0.00 H new ATOM 0 HB VAL A 121 3.581 7.713 7.017 1.00 0.00 H new ATOM 0 HG11 VAL A 121 3.944 7.969 4.596 1.00 0.00 H new ATOM 0 HG12 VAL A 121 4.055 6.267 5.105 1.00 0.00 H new ATOM 0 HG13 VAL A 121 2.593 6.855 4.280 1.00 0.00 H new ATOM 0 HG21 VAL A 121 2.464 9.538 5.800 1.00 0.00 H new ATOM 0 HG22 VAL A 121 1.050 8.490 5.535 1.00 0.00 H new ATOM 0 HG23 VAL A 121 1.498 8.979 7.186 1.00 0.00 H new ATOM 871 N VAL A 122 3.020 4.238 6.140 1.00 0.00 N ATOM 872 CA VAL A 122 3.894 3.075 6.238 1.00 0.00 C ATOM 873 C VAL A 122 4.325 2.594 4.858 1.00 0.00 C ATOM 874 O VAL A 122 3.740 2.976 3.845 1.00 0.00 O ATOM 875 CB VAL A 122 3.203 1.916 6.981 1.00 0.00 C ATOM 876 CG1 VAL A 122 2.813 2.340 8.389 1.00 0.00 C ATOM 877 CG2 VAL A 122 1.987 1.435 6.204 1.00 0.00 C ATOM 0 H VAL A 122 2.505 4.306 5.262 1.00 0.00 H new ATOM 0 HA VAL A 122 4.773 3.386 6.802 1.00 0.00 H new ATOM 0 HB VAL A 122 3.907 1.087 7.059 1.00 0.00 H new ATOM 0 HG11 VAL A 122 2.326 1.508 8.898 1.00 0.00 H new ATOM 0 HG12 VAL A 122 3.706 2.631 8.942 1.00 0.00 H new ATOM 0 HG13 VAL A 122 2.127 3.185 8.337 1.00 0.00 H new ATOM 0 HG21 VAL A 122 1.511 0.616 6.743 1.00 0.00 H new ATOM 0 HG22 VAL A 122 1.279 2.256 6.092 1.00 0.00 H new ATOM 0 HG23 VAL A 122 2.299 1.088 5.219 1.00 0.00 H new ATOM 887 N ASN A 123 5.354 1.754 4.825 1.00 0.00 N ATOM 888 CA ASN A 123 5.865 1.220 3.567 1.00 0.00 C ATOM 889 C ASN A 123 5.786 -0.304 3.551 1.00 0.00 C ATOM 890 O ASN A 123 6.330 -0.974 4.428 1.00 0.00 O ATOM 891 CB ASN A 123 7.312 1.669 3.349 1.00 0.00 C ATOM 892 CG ASN A 123 7.416 3.148 3.033 1.00 0.00 C ATOM 893 OD1 ASN A 123 6.414 3.809 2.763 1.00 0.00 O ATOM 894 ND2 ASN A 123 8.635 3.675 3.066 1.00 0.00 N ATOM 0 H ASN A 123 5.851 1.428 5.654 1.00 0.00 H new ATOM 0 HA ASN A 123 5.245 1.607 2.758 1.00 0.00 H new ATOM 0 HB2 ASN A 123 7.896 1.449 4.242 1.00 0.00 H new ATOM 0 HB3 ASN A 123 7.749 1.094 2.533 1.00 0.00 H new ATOM 0 HD21 ASN A 123 8.768 4.666 2.863 1.00 0.00 H new ATOM 0 HD22 ASN A 123 9.438 3.089 3.295 1.00 0.00 H new ATOM 901 N VAL A 124 5.104 -0.844 2.546 1.00 0.00 N ATOM 902 CA VAL A 124 4.955 -2.289 2.413 1.00 0.00 C ATOM 903 C VAL A 124 5.958 -2.856 1.416 1.00 0.00 C ATOM 904 O VAL A 124 6.079 -2.366 0.292 1.00 0.00 O ATOM 905 CB VAL A 124 3.531 -2.667 1.964 1.00 0.00 C ATOM 906 CG1 VAL A 124 3.391 -4.177 1.845 1.00 0.00 C ATOM 907 CG2 VAL A 124 2.500 -2.102 2.930 1.00 0.00 C ATOM 0 H VAL A 124 4.646 -0.303 1.812 1.00 0.00 H new ATOM 0 HA VAL A 124 5.144 -2.718 3.397 1.00 0.00 H new ATOM 0 HB VAL A 124 3.351 -2.231 0.981 1.00 0.00 H new ATOM 0 HG11 VAL A 124 2.378 -4.425 1.527 1.00 0.00 H new ATOM 0 HG12 VAL A 124 4.104 -4.552 1.111 1.00 0.00 H new ATOM 0 HG13 VAL A 124 3.590 -4.638 2.812 1.00 0.00 H new ATOM 0 HG21 VAL A 124 1.500 -2.379 2.597 1.00 0.00 H new ATOM 0 HG22 VAL A 124 2.676 -2.506 3.927 1.00 0.00 H new ATOM 0 HG23 VAL A 124 2.585 -1.016 2.959 1.00 0.00 H new ATOM 917 N THR A 125 6.678 -3.893 1.833 1.00 0.00 N ATOM 918 CA THR A 125 7.672 -4.527 0.976 1.00 0.00 C ATOM 919 C THR A 125 7.371 -6.010 0.789 1.00 0.00 C ATOM 920 O THR A 125 7.726 -6.836 1.630 1.00 0.00 O ATOM 921 CB THR A 125 9.091 -4.372 1.554 1.00 0.00 C ATOM 922 OG1 THR A 125 9.284 -3.036 2.029 1.00 0.00 O ATOM 923 CG2 THR A 125 10.142 -4.698 0.502 1.00 0.00 C ATOM 0 H THR A 125 6.591 -4.311 2.759 1.00 0.00 H new ATOM 0 HA THR A 125 7.624 -4.025 0.010 1.00 0.00 H new ATOM 0 HB THR A 125 9.200 -5.071 2.383 1.00 0.00 H new ATOM 0 HG1 THR A 125 10.188 -2.947 2.396 1.00 0.00 H new ATOM 0 HG21 THR A 125 11.136 -4.582 0.933 1.00 0.00 H new ATOM 0 HG22 THR A 125 10.011 -5.726 0.163 1.00 0.00 H new ATOM 0 HG23 THR A 125 10.032 -4.020 -0.345 1.00 0.00 H new ATOM 931 N TYR A 126 6.715 -6.341 -0.317 1.00 0.00 N ATOM 932 CA TYR A 126 6.364 -7.724 -0.614 1.00 0.00 C ATOM 933 C TYR A 126 7.543 -8.463 -1.240 1.00 0.00 C ATOM 934 O TYR A 126 8.574 -7.863 -1.546 1.00 0.00 O ATOM 935 CB TYR A 126 5.158 -7.777 -1.553 1.00 0.00 C ATOM 936 CG TYR A 126 3.859 -7.371 -0.893 1.00 0.00 C ATOM 937 CD1 TYR A 126 3.230 -8.206 0.020 1.00 0.00 C ATOM 938 CD2 TYR A 126 3.263 -6.150 -1.184 1.00 0.00 C ATOM 939 CE1 TYR A 126 2.043 -7.839 0.624 1.00 0.00 C ATOM 940 CE2 TYR A 126 2.077 -5.773 -0.584 1.00 0.00 C ATOM 941 CZ TYR A 126 1.470 -6.621 0.319 1.00 0.00 C ATOM 942 OH TYR A 126 0.289 -6.251 0.920 1.00 0.00 O ATOM 0 H TYR A 126 6.415 -5.669 -1.024 1.00 0.00 H new ATOM 0 HA TYR A 126 6.107 -8.216 0.324 1.00 0.00 H new ATOM 0 HB2 TYR A 126 5.343 -7.123 -2.405 1.00 0.00 H new ATOM 0 HB3 TYR A 126 5.056 -8.789 -1.944 1.00 0.00 H new ATOM 0 HD1 TYR A 126 3.676 -9.159 0.262 1.00 0.00 H new ATOM 0 HD2 TYR A 126 3.735 -5.484 -1.891 1.00 0.00 H new ATOM 0 HE1 TYR A 126 1.566 -8.502 1.331 1.00 0.00 H new ATOM 0 HE2 TYR A 126 1.628 -4.820 -0.821 1.00 0.00 H new ATOM 0 HH TYR A 126 0.060 -6.900 1.618 1.00 0.00 H new ATOM 952 N SER A 127 7.382 -9.769 -1.429 1.00 0.00 N ATOM 953 CA SER A 127 8.433 -10.591 -2.017 1.00 0.00 C ATOM 954 C SER A 127 8.271 -10.680 -3.531 1.00 0.00 C ATOM 955 O SER A 127 9.232 -10.510 -4.281 1.00 0.00 O ATOM 956 CB SER A 127 8.413 -11.994 -1.407 1.00 0.00 C ATOM 957 OG SER A 127 9.387 -12.827 -2.012 1.00 0.00 O ATOM 0 H SER A 127 6.534 -10.280 -1.184 1.00 0.00 H new ATOM 0 HA SER A 127 9.392 -10.121 -1.799 1.00 0.00 H new ATOM 0 HB2 SER A 127 8.599 -11.931 -0.335 1.00 0.00 H new ATOM 0 HB3 SER A 127 7.424 -12.435 -1.533 1.00 0.00 H new ATOM 0 HG SER A 127 9.355 -13.717 -1.604 1.00 0.00 H new ATOM 963 N SER A 128 7.047 -10.949 -3.974 1.00 0.00 N ATOM 964 CA SER A 128 6.758 -11.066 -5.398 1.00 0.00 C ATOM 965 C SER A 128 6.215 -9.751 -5.952 1.00 0.00 C ATOM 966 O SER A 128 5.834 -8.856 -5.197 1.00 0.00 O ATOM 967 CB SER A 128 5.751 -12.190 -5.646 1.00 0.00 C ATOM 968 OG SER A 128 6.398 -13.450 -5.705 1.00 0.00 O ATOM 0 H SER A 128 6.240 -11.090 -3.367 1.00 0.00 H new ATOM 0 HA SER A 128 7.689 -11.302 -5.914 1.00 0.00 H new ATOM 0 HB2 SER A 128 5.006 -12.197 -4.851 1.00 0.00 H new ATOM 0 HB3 SER A 128 5.219 -12.007 -6.580 1.00 0.00 H new ATOM 0 HG SER A 128 5.733 -14.152 -5.863 1.00 0.00 H new ATOM 974 N LYS A 129 6.184 -9.642 -7.275 1.00 0.00 N ATOM 975 CA LYS A 129 5.688 -8.439 -7.933 1.00 0.00 C ATOM 976 C LYS A 129 4.163 -8.440 -7.990 1.00 0.00 C ATOM 977 O LYS A 129 3.513 -7.525 -7.485 1.00 0.00 O ATOM 978 CB LYS A 129 6.262 -8.332 -9.347 1.00 0.00 C ATOM 979 CG LYS A 129 7.597 -7.610 -9.408 1.00 0.00 C ATOM 980 CD LYS A 129 8.742 -8.519 -8.993 1.00 0.00 C ATOM 981 CE LYS A 129 10.079 -7.798 -9.061 1.00 0.00 C ATOM 982 NZ LYS A 129 10.418 -7.388 -10.452 1.00 0.00 N ATOM 0 H LYS A 129 6.497 -10.373 -7.914 1.00 0.00 H new ATOM 0 HA LYS A 129 6.012 -7.577 -7.351 1.00 0.00 H new ATOM 0 HB2 LYS A 129 6.381 -9.334 -9.759 1.00 0.00 H new ATOM 0 HB3 LYS A 129 5.546 -7.810 -9.982 1.00 0.00 H new ATOM 0 HG2 LYS A 129 7.769 -7.246 -10.421 1.00 0.00 H new ATOM 0 HG3 LYS A 129 7.570 -6.737 -8.756 1.00 0.00 H new ATOM 0 HD2 LYS A 129 8.573 -8.879 -7.978 1.00 0.00 H new ATOM 0 HD3 LYS A 129 8.766 -9.395 -9.642 1.00 0.00 H new ATOM 0 HE2 LYS A 129 10.050 -6.917 -8.420 1.00 0.00 H new ATOM 0 HE3 LYS A 129 10.863 -8.449 -8.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 11.413 -7.087 -10.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 10.273 -8.192 -11.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 9.805 -6.599 -10.740 1.00 0.00 H new ATOM 996 N ASP A 130 3.600 -9.472 -8.608 1.00 0.00 N ATOM 997 CA ASP A 130 2.152 -9.593 -8.729 1.00 0.00 C ATOM 998 C ASP A 130 1.472 -9.358 -7.383 1.00 0.00 C ATOM 999 O ASP A 130 0.516 -8.590 -7.287 1.00 0.00 O ATOM 1000 CB ASP A 130 1.778 -10.975 -9.269 1.00 0.00 C ATOM 1001 CG ASP A 130 0.277 -11.176 -9.355 1.00 0.00 C ATOM 1002 OD1 ASP A 130 -0.419 -10.253 -9.828 1.00 0.00 O ATOM 1003 OD2 ASP A 130 -0.200 -12.256 -8.949 1.00 0.00 O ATOM 0 H ASP A 130 4.124 -10.237 -9.033 1.00 0.00 H new ATOM 0 HA ASP A 130 1.806 -8.832 -9.428 1.00 0.00 H new ATOM 0 HB2 ASP A 130 2.217 -11.106 -10.258 1.00 0.00 H new ATOM 0 HB3 ASP A 130 2.208 -11.742 -8.625 1.00 0.00 H new ATOM 1008 N GLN A 131 1.973 -10.026 -6.349 1.00 0.00 N ATOM 1009 CA GLN A 131 1.412 -9.891 -5.010 1.00 0.00 C ATOM 1010 C GLN A 131 1.304 -8.423 -4.611 1.00 0.00 C ATOM 1011 O GLN A 131 0.372 -8.026 -3.912 1.00 0.00 O ATOM 1012 CB GLN A 131 2.273 -10.645 -3.995 1.00 0.00 C ATOM 1013 CG GLN A 131 1.928 -12.121 -3.882 1.00 0.00 C ATOM 1014 CD GLN A 131 3.120 -12.971 -3.489 1.00 0.00 C ATOM 1015 OE1 GLN A 131 4.082 -12.362 -2.805 1.00 0.00 O flip ATOM 1016 NE2 GLN A 131 3.176 -14.162 -3.797 1.00 0.00 N flip ATOM 0 H GLN A 131 2.765 -10.665 -6.413 1.00 0.00 H new ATOM 0 HA GLN A 131 0.411 -10.322 -5.018 1.00 0.00 H new ATOM 0 HB2 GLN A 131 3.322 -10.546 -4.276 1.00 0.00 H new ATOM 0 HB3 GLN A 131 2.160 -10.178 -3.017 1.00 0.00 H new ATOM 0 HG2 GLN A 131 1.136 -12.250 -3.144 1.00 0.00 H new ATOM 0 HG3 GLN A 131 1.535 -12.472 -4.836 1.00 0.00 H new ATOM 0 HE21 GLN A 131 2.414 -14.589 -4.323 1.00 0.00 H new ATOM 0 HE22 GLN A 131 3.985 -14.721 -3.526 1.00 0.00 H new ATOM 1025 N ALA A 132 2.264 -7.620 -5.060 1.00 0.00 N ATOM 1026 CA ALA A 132 2.275 -6.196 -4.751 1.00 0.00 C ATOM 1027 C ALA A 132 1.271 -5.439 -5.614 1.00 0.00 C ATOM 1028 O ALA A 132 0.589 -4.531 -5.138 1.00 0.00 O ATOM 1029 CB ALA A 132 3.673 -5.626 -4.941 1.00 0.00 C ATOM 0 H ALA A 132 3.044 -7.932 -5.639 1.00 0.00 H new ATOM 0 HA ALA A 132 1.983 -6.073 -3.708 1.00 0.00 H new ATOM 0 HB1 ALA A 132 3.667 -4.561 -4.707 1.00 0.00 H new ATOM 0 HB2 ALA A 132 4.369 -6.140 -4.277 1.00 0.00 H new ATOM 0 HB3 ALA A 132 3.986 -5.768 -5.975 1.00 0.00 H new ATOM 1035 N ARG A 133 1.187 -5.818 -6.885 1.00 0.00 N ATOM 1036 CA ARG A 133 0.267 -5.173 -7.815 1.00 0.00 C ATOM 1037 C ARG A 133 -1.136 -5.089 -7.221 1.00 0.00 C ATOM 1038 O ARG A 133 -1.775 -4.038 -7.264 1.00 0.00 O ATOM 1039 CB ARG A 133 0.227 -5.938 -9.139 1.00 0.00 C ATOM 1040 CG ARG A 133 -0.650 -5.285 -10.194 1.00 0.00 C ATOM 1041 CD ARG A 133 -0.161 -5.600 -11.599 1.00 0.00 C ATOM 1042 NE ARG A 133 -1.007 -4.991 -12.622 1.00 0.00 N ATOM 1043 CZ ARG A 133 -1.099 -5.448 -13.866 1.00 0.00 C ATOM 1044 NH1 ARG A 133 -0.403 -6.513 -14.238 1.00 0.00 N ATOM 1045 NH2 ARG A 133 -1.891 -4.840 -14.740 1.00 0.00 N ATOM 0 H ARG A 133 1.744 -6.568 -7.294 1.00 0.00 H new ATOM 0 HA ARG A 133 0.626 -4.161 -7.999 1.00 0.00 H new ATOM 0 HB2 ARG A 133 1.241 -6.028 -9.527 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -0.135 -6.949 -8.954 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -1.677 -5.631 -10.079 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -0.658 -4.205 -10.044 1.00 0.00 H new ATOM 0 HD2 ARG A 133 0.862 -5.243 -11.715 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -0.140 -6.680 -11.742 1.00 0.00 H new ATOM 0 HE ARG A 133 -1.557 -4.170 -12.368 1.00 0.00 H new ATOM 0 HH11 ARG A 133 0.205 -6.984 -13.568 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -0.476 -6.861 -15.194 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -2.430 -4.021 -14.457 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -1.961 -5.191 -15.695 1.00 0.00 H new ATOM 1059 N GLN A 134 -1.608 -6.202 -6.670 1.00 0.00 N ATOM 1060 CA GLN A 134 -2.935 -6.253 -6.069 1.00 0.00 C ATOM 1061 C GLN A 134 -3.015 -5.345 -4.846 1.00 0.00 C ATOM 1062 O GLN A 134 -3.813 -4.410 -4.807 1.00 0.00 O ATOM 1063 CB GLN A 134 -3.285 -7.690 -5.676 1.00 0.00 C ATOM 1064 CG GLN A 134 -4.781 -7.953 -5.601 1.00 0.00 C ATOM 1065 CD GLN A 134 -5.109 -9.430 -5.512 1.00 0.00 C ATOM 1066 OE1 GLN A 134 -4.437 -10.265 -6.117 1.00 0.00 O ATOM 1067 NE2 GLN A 134 -6.148 -9.761 -4.753 1.00 0.00 N ATOM 0 H GLN A 134 -1.091 -7.080 -6.627 1.00 0.00 H new ATOM 0 HA GLN A 134 -3.654 -5.900 -6.808 1.00 0.00 H new ATOM 0 HB2 GLN A 134 -2.840 -8.374 -6.399 1.00 0.00 H new ATOM 0 HB3 GLN A 134 -2.836 -7.913 -4.708 1.00 0.00 H new ATOM 0 HG2 GLN A 134 -5.193 -7.440 -4.732 1.00 0.00 H new ATOM 0 HG3 GLN A 134 -5.265 -7.529 -6.481 1.00 0.00 H new ATOM 0 HE21 GLN A 134 -6.678 -9.036 -4.269 1.00 0.00 H new ATOM 0 HE22 GLN A 134 -6.416 -10.740 -4.654 1.00 0.00 H new ATOM 1076 N ALA A 135 -2.183 -5.629 -3.850 1.00 0.00 N ATOM 1077 CA ALA A 135 -2.158 -4.837 -2.626 1.00 0.00 C ATOM 1078 C ALA A 135 -2.441 -3.367 -2.918 1.00 0.00 C ATOM 1079 O ALA A 135 -3.350 -2.772 -2.337 1.00 0.00 O ATOM 1080 CB ALA A 135 -0.816 -4.989 -1.926 1.00 0.00 C ATOM 0 H ALA A 135 -1.517 -6.402 -3.866 1.00 0.00 H new ATOM 0 HA ALA A 135 -2.943 -5.207 -1.967 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -0.812 -4.392 -1.014 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -0.653 -6.037 -1.675 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -0.020 -4.647 -2.587 1.00 0.00 H new ATOM 1086 N LEU A 136 -1.657 -2.786 -3.820 1.00 0.00 N ATOM 1087 CA LEU A 136 -1.823 -1.385 -4.188 1.00 0.00 C ATOM 1088 C LEU A 136 -3.087 -1.186 -5.018 1.00 0.00 C ATOM 1089 O LEU A 136 -3.932 -0.353 -4.691 1.00 0.00 O ATOM 1090 CB LEU A 136 -0.603 -0.895 -4.970 1.00 0.00 C ATOM 1091 CG LEU A 136 -0.757 0.451 -5.681 1.00 0.00 C ATOM 1092 CD1 LEU A 136 0.605 1.042 -6.007 1.00 0.00 C ATOM 1093 CD2 LEU A 136 -1.589 0.294 -6.945 1.00 0.00 C ATOM 0 H LEU A 136 -0.900 -3.264 -4.310 1.00 0.00 H new ATOM 0 HA LEU A 136 -1.917 -0.803 -3.271 1.00 0.00 H new ATOM 0 HB2 LEU A 136 0.240 -0.826 -4.283 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -0.347 -1.649 -5.714 1.00 0.00 H new ATOM 0 HG LEU A 136 -1.276 1.137 -5.011 1.00 0.00 H new ATOM 0 HD11 LEU A 136 0.475 1.999 -6.512 1.00 0.00 H new ATOM 0 HD12 LEU A 136 1.167 1.192 -5.085 1.00 0.00 H new ATOM 0 HD13 LEU A 136 1.151 0.359 -6.658 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -1.688 1.261 -7.438 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -1.098 -0.408 -7.619 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -2.578 -0.084 -6.685 1.00 0.00 H new ATOM 1105 N ASP A 137 -3.211 -1.958 -6.093 1.00 0.00 N ATOM 1106 CA ASP A 137 -4.373 -1.869 -6.968 1.00 0.00 C ATOM 1107 C ASP A 137 -5.659 -1.758 -6.155 1.00 0.00 C ATOM 1108 O ASP A 137 -6.649 -1.186 -6.612 1.00 0.00 O ATOM 1109 CB ASP A 137 -4.441 -3.090 -7.887 1.00 0.00 C ATOM 1110 CG ASP A 137 -3.666 -2.889 -9.175 1.00 0.00 C ATOM 1111 OD1 ASP A 137 -3.575 -1.733 -9.638 1.00 0.00 O ATOM 1112 OD2 ASP A 137 -3.149 -3.888 -9.718 1.00 0.00 O ATOM 0 H ASP A 137 -2.520 -2.652 -6.379 1.00 0.00 H new ATOM 0 HA ASP A 137 -4.270 -0.971 -7.576 1.00 0.00 H new ATOM 0 HB2 ASP A 137 -4.047 -3.959 -7.361 1.00 0.00 H new ATOM 0 HB3 ASP A 137 -5.483 -3.306 -8.123 1.00 0.00 H new ATOM 1117 N LYS A 138 -5.638 -2.309 -4.946 1.00 0.00 N ATOM 1118 CA LYS A 138 -6.801 -2.272 -4.067 1.00 0.00 C ATOM 1119 C LYS A 138 -6.653 -1.179 -3.014 1.00 0.00 C ATOM 1120 O LYS A 138 -7.468 -0.258 -2.941 1.00 0.00 O ATOM 1121 CB LYS A 138 -6.994 -3.629 -3.386 1.00 0.00 C ATOM 1122 CG LYS A 138 -7.204 -4.775 -4.360 1.00 0.00 C ATOM 1123 CD LYS A 138 -8.597 -4.744 -4.965 1.00 0.00 C ATOM 1124 CE LYS A 138 -9.070 -6.139 -5.347 1.00 0.00 C ATOM 1125 NZ LYS A 138 -10.552 -6.261 -5.274 1.00 0.00 N ATOM 0 H LYS A 138 -4.827 -2.787 -4.552 1.00 0.00 H new ATOM 0 HA LYS A 138 -7.678 -2.049 -4.675 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -6.122 -3.843 -2.769 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -7.852 -3.571 -2.716 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -6.460 -4.719 -5.155 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -7.051 -5.724 -3.846 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -9.295 -4.305 -4.252 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -8.597 -4.104 -5.847 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -8.736 -6.372 -6.358 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -8.612 -6.872 -4.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -10.835 -7.226 -5.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -10.869 -6.064 -4.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -10.989 -5.579 -5.926 1.00 0.00 H new ATOM 1139 N LEU A 139 -5.608 -1.285 -2.201 1.00 0.00 N ATOM 1140 CA LEU A 139 -5.352 -0.304 -1.152 1.00 0.00 C ATOM 1141 C LEU A 139 -5.462 1.117 -1.697 1.00 0.00 C ATOM 1142 O LEU A 139 -6.135 1.965 -1.112 1.00 0.00 O ATOM 1143 CB LEU A 139 -3.964 -0.524 -0.548 1.00 0.00 C ATOM 1144 CG LEU A 139 -3.769 -1.826 0.230 1.00 0.00 C ATOM 1145 CD1 LEU A 139 -2.289 -2.136 0.390 1.00 0.00 C ATOM 1146 CD2 LEU A 139 -4.448 -1.741 1.589 1.00 0.00 C ATOM 0 H LEU A 139 -4.924 -2.040 -2.248 1.00 0.00 H new ATOM 0 HA LEU A 139 -6.105 -0.435 -0.375 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -3.230 -0.492 -1.353 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -3.743 0.310 0.118 1.00 0.00 H new ATOM 0 HG LEU A 139 -4.230 -2.637 -0.334 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -2.170 -3.066 0.946 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -1.831 -2.240 -0.593 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -1.804 -1.324 0.932 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -4.299 -2.676 2.129 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -4.017 -0.919 2.160 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -5.515 -1.567 1.452 1.00 0.00 H new ATOM 1158 N ASN A 140 -4.799 1.368 -2.821 1.00 0.00 N ATOM 1159 CA ASN A 140 -4.824 2.685 -3.445 1.00 0.00 C ATOM 1160 C ASN A 140 -6.226 3.284 -3.395 1.00 0.00 C ATOM 1161 O ASN A 140 -6.395 4.502 -3.442 1.00 0.00 O ATOM 1162 CB ASN A 140 -4.348 2.594 -4.897 1.00 0.00 C ATOM 1163 CG ASN A 140 -4.772 3.794 -5.721 1.00 0.00 C ATOM 1164 OD1 ASN A 140 -5.920 3.889 -6.154 1.00 0.00 O ATOM 1165 ND2 ASN A 140 -3.844 4.718 -5.941 1.00 0.00 N ATOM 0 H ASN A 140 -4.238 0.676 -3.318 1.00 0.00 H new ATOM 0 HA ASN A 140 -4.150 3.336 -2.888 1.00 0.00 H new ATOM 0 HB2 ASN A 140 -3.261 2.510 -4.916 1.00 0.00 H new ATOM 0 HB3 ASN A 140 -4.746 1.686 -5.351 1.00 0.00 H new ATOM 0 HD21 ASN A 140 -4.071 5.548 -6.489 1.00 0.00 H new ATOM 0 HD22 ASN A 140 -2.905 4.598 -5.562 1.00 0.00 H new ATOM 1172 N GLY A 141 -7.231 2.419 -3.298 1.00 0.00 N ATOM 1173 CA GLY A 141 -8.606 2.881 -3.242 1.00 0.00 C ATOM 1174 C GLY A 141 -9.382 2.254 -2.101 1.00 0.00 C ATOM 1175 O GLY A 141 -10.558 2.558 -1.900 1.00 0.00 O ATOM 0 H GLY A 141 -7.118 1.406 -3.257 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -8.618 3.965 -3.132 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -9.102 2.651 -4.185 1.00 0.00 H new ATOM 1179 N PHE A 142 -8.724 1.375 -1.352 1.00 0.00 N ATOM 1180 CA PHE A 142 -9.361 0.701 -0.227 1.00 0.00 C ATOM 1181 C PHE A 142 -9.832 1.711 0.816 1.00 0.00 C ATOM 1182 O PHE A 142 -9.024 2.298 1.535 1.00 0.00 O ATOM 1183 CB PHE A 142 -8.392 -0.295 0.413 1.00 0.00 C ATOM 1184 CG PHE A 142 -9.015 -1.123 1.501 1.00 0.00 C ATOM 1185 CD1 PHE A 142 -9.359 -0.550 2.715 1.00 0.00 C ATOM 1186 CD2 PHE A 142 -9.258 -2.473 1.309 1.00 0.00 C ATOM 1187 CE1 PHE A 142 -9.931 -1.310 3.717 1.00 0.00 C ATOM 1188 CE2 PHE A 142 -9.830 -3.238 2.308 1.00 0.00 C ATOM 1189 CZ PHE A 142 -10.169 -2.655 3.513 1.00 0.00 C ATOM 0 H PHE A 142 -7.750 1.113 -1.504 1.00 0.00 H new ATOM 0 HA PHE A 142 -10.230 0.161 -0.604 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -8.002 -0.958 -0.359 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -7.542 0.250 0.824 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -9.178 0.502 2.880 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -8.997 -2.933 0.367 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -10.192 -0.852 4.660 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -10.012 -4.290 2.146 1.00 0.00 H new ATOM 0 HZ PHE A 142 -10.619 -3.250 4.294 1.00 0.00 H new ATOM 1199 N GLN A 143 -11.144 1.908 0.889 1.00 0.00 N ATOM 1200 CA GLN A 143 -11.723 2.848 1.842 1.00 0.00 C ATOM 1201 C GLN A 143 -11.777 2.242 3.240 1.00 0.00 C ATOM 1202 O GLN A 143 -12.510 1.282 3.485 1.00 0.00 O ATOM 1203 CB GLN A 143 -13.127 3.259 1.397 1.00 0.00 C ATOM 1204 CG GLN A 143 -13.523 4.657 1.844 1.00 0.00 C ATOM 1205 CD GLN A 143 -14.878 5.078 1.312 1.00 0.00 C ATOM 1206 OE1 GLN A 143 -15.240 4.760 0.178 1.00 0.00 O ATOM 1207 NE2 GLN A 143 -15.638 5.798 2.129 1.00 0.00 N ATOM 0 H GLN A 143 -11.826 1.430 0.300 1.00 0.00 H new ATOM 0 HA GLN A 143 -11.086 3.732 1.873 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -13.185 3.204 0.310 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -13.848 2.543 1.791 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -13.537 4.696 2.933 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -12.768 5.369 1.509 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -15.299 6.039 3.060 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -16.560 6.110 1.825 1.00 0.00 H new ATOM 1216 N LEU A 144 -10.996 2.806 4.155 1.00 0.00 N ATOM 1217 CA LEU A 144 -10.955 2.321 5.530 1.00 0.00 C ATOM 1218 C LEU A 144 -11.231 3.452 6.516 1.00 0.00 C ATOM 1219 O LEU A 144 -10.494 4.436 6.567 1.00 0.00 O ATOM 1220 CB LEU A 144 -9.593 1.690 5.828 1.00 0.00 C ATOM 1221 CG LEU A 144 -9.546 0.722 7.011 1.00 0.00 C ATOM 1222 CD1 LEU A 144 -8.341 -0.199 6.900 1.00 0.00 C ATOM 1223 CD2 LEU A 144 -9.515 1.487 8.326 1.00 0.00 C ATOM 0 H LEU A 144 -10.383 3.600 3.969 1.00 0.00 H new ATOM 0 HA LEU A 144 -11.732 1.566 5.646 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -9.258 1.159 4.937 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -8.876 2.491 6.011 1.00 0.00 H new ATOM 0 HG LEU A 144 -10.448 0.111 6.991 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -8.324 -0.881 7.751 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -8.406 -0.773 5.976 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -7.428 0.396 6.894 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -9.482 0.782 9.156 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -8.631 2.124 8.355 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -10.410 2.104 8.409 1.00 0.00 H new ATOM 1235 N GLU A 145 -12.296 3.302 7.297 1.00 0.00 N ATOM 1236 CA GLU A 145 -12.667 4.311 8.282 1.00 0.00 C ATOM 1237 C GLU A 145 -12.835 5.678 7.624 1.00 0.00 C ATOM 1238 O GLU A 145 -12.393 6.694 8.159 1.00 0.00 O ATOM 1239 CB GLU A 145 -11.612 4.391 9.387 1.00 0.00 C ATOM 1240 CG GLU A 145 -11.669 3.232 10.368 1.00 0.00 C ATOM 1241 CD GLU A 145 -11.145 3.604 11.741 1.00 0.00 C ATOM 1242 OE1 GLU A 145 -11.716 4.523 12.365 1.00 0.00 O ATOM 1243 OE2 GLU A 145 -10.164 2.977 12.192 1.00 0.00 O ATOM 0 H GLU A 145 -12.916 2.493 7.267 1.00 0.00 H new ATOM 0 HA GLU A 145 -13.621 4.018 8.721 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -10.622 4.422 8.931 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -11.741 5.325 9.934 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -12.699 2.887 10.458 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -11.087 2.399 9.974 1.00 0.00 H new ATOM 1250 N ASN A 146 -13.476 5.693 6.460 1.00 0.00 N ATOM 1251 CA ASN A 146 -13.701 6.934 5.728 1.00 0.00 C ATOM 1252 C ASN A 146 -12.379 7.553 5.286 1.00 0.00 C ATOM 1253 O ASN A 146 -12.261 8.772 5.167 1.00 0.00 O ATOM 1254 CB ASN A 146 -14.478 7.927 6.593 1.00 0.00 C ATOM 1255 CG ASN A 146 -15.632 7.274 7.330 1.00 0.00 C ATOM 1256 OD1 ASN A 146 -16.481 6.622 6.722 1.00 0.00 O ATOM 1257 ND2 ASN A 146 -15.667 7.446 8.646 1.00 0.00 N ATOM 0 H ASN A 146 -13.849 4.860 6.004 1.00 0.00 H new ATOM 0 HA ASN A 146 -14.287 6.701 4.839 1.00 0.00 H new ATOM 0 HB2 ASN A 146 -13.801 8.383 7.315 1.00 0.00 H new ATOM 0 HB3 ASN A 146 -14.861 8.731 5.964 1.00 0.00 H new ATOM 0 HD21 ASN A 146 -16.419 7.030 9.195 1.00 0.00 H new ATOM 0 HD22 ASN A 146 -14.942 7.994 9.108 1.00 0.00 H new ATOM 1264 N PHE A 147 -11.386 6.703 5.044 1.00 0.00 N ATOM 1265 CA PHE A 147 -10.071 7.166 4.616 1.00 0.00 C ATOM 1266 C PHE A 147 -9.536 6.305 3.475 1.00 0.00 C ATOM 1267 O PHE A 147 -9.102 5.172 3.687 1.00 0.00 O ATOM 1268 CB PHE A 147 -9.091 7.141 5.791 1.00 0.00 C ATOM 1269 CG PHE A 147 -9.194 8.345 6.683 1.00 0.00 C ATOM 1270 CD1 PHE A 147 -8.717 9.577 6.266 1.00 0.00 C ATOM 1271 CD2 PHE A 147 -9.769 8.245 7.940 1.00 0.00 C ATOM 1272 CE1 PHE A 147 -8.811 10.687 7.084 1.00 0.00 C ATOM 1273 CE2 PHE A 147 -9.866 9.351 8.763 1.00 0.00 C ATOM 1274 CZ PHE A 147 -9.386 10.573 8.335 1.00 0.00 C ATOM 0 H PHE A 147 -11.467 5.690 5.137 1.00 0.00 H new ATOM 0 HA PHE A 147 -10.173 8.190 4.258 1.00 0.00 H new ATOM 0 HB2 PHE A 147 -9.269 6.244 6.383 1.00 0.00 H new ATOM 0 HB3 PHE A 147 -8.074 7.071 5.404 1.00 0.00 H new ATOM 0 HD1 PHE A 147 -8.266 9.671 5.289 1.00 0.00 H new ATOM 0 HD2 PHE A 147 -10.146 7.292 8.280 1.00 0.00 H new ATOM 0 HE1 PHE A 147 -8.436 11.642 6.746 1.00 0.00 H new ATOM 0 HE2 PHE A 147 -10.317 9.260 9.740 1.00 0.00 H new ATOM 0 HZ PHE A 147 -9.460 11.438 8.977 1.00 0.00 H new ATOM 1284 N THR A 148 -9.571 6.851 2.263 1.00 0.00 N ATOM 1285 CA THR A 148 -9.093 6.135 1.088 1.00 0.00 C ATOM 1286 C THR A 148 -7.580 5.951 1.134 1.00 0.00 C ATOM 1287 O THR A 148 -6.822 6.882 0.856 1.00 0.00 O ATOM 1288 CB THR A 148 -9.469 6.871 -0.211 1.00 0.00 C ATOM 1289 OG1 THR A 148 -10.835 7.298 -0.154 1.00 0.00 O ATOM 1290 CG2 THR A 148 -9.264 5.973 -1.422 1.00 0.00 C ATOM 0 H THR A 148 -9.926 7.788 2.070 1.00 0.00 H new ATOM 0 HA THR A 148 -9.576 5.158 1.096 1.00 0.00 H new ATOM 0 HB THR A 148 -8.820 7.741 -0.310 1.00 0.00 H new ATOM 0 HG1 THR A 148 -11.066 7.767 -0.983 1.00 0.00 H new ATOM 0 HG21 THR A 148 -9.536 6.515 -2.327 1.00 0.00 H new ATOM 0 HG22 THR A 148 -8.218 5.673 -1.480 1.00 0.00 H new ATOM 0 HG23 THR A 148 -9.891 5.086 -1.328 1.00 0.00 H new ATOM 1298 N LEU A 149 -7.146 4.746 1.486 1.00 0.00 N ATOM 1299 CA LEU A 149 -5.722 4.439 1.568 1.00 0.00 C ATOM 1300 C LEU A 149 -5.013 4.793 0.264 1.00 0.00 C ATOM 1301 O LEU A 149 -5.237 4.161 -0.768 1.00 0.00 O ATOM 1302 CB LEU A 149 -5.516 2.958 1.888 1.00 0.00 C ATOM 1303 CG LEU A 149 -6.245 2.431 3.124 1.00 0.00 C ATOM 1304 CD1 LEU A 149 -6.065 0.926 3.249 1.00 0.00 C ATOM 1305 CD2 LEU A 149 -5.747 3.135 4.378 1.00 0.00 C ATOM 0 H LEU A 149 -7.760 3.965 1.719 1.00 0.00 H new ATOM 0 HA LEU A 149 -5.292 5.040 2.369 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -5.835 2.373 1.026 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -4.448 2.780 2.017 1.00 0.00 H new ATOM 0 HG LEU A 149 -7.309 2.641 3.011 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -6.591 0.569 4.135 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -6.471 0.436 2.364 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -5.004 0.693 3.338 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -6.277 2.747 5.248 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -4.678 2.957 4.495 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -5.929 4.206 4.290 1.00 0.00 H new ATOM 1317 N LYS A 150 -4.155 5.805 0.319 1.00 0.00 N ATOM 1318 CA LYS A 150 -3.409 6.242 -0.855 1.00 0.00 C ATOM 1319 C LYS A 150 -2.101 5.468 -0.988 1.00 0.00 C ATOM 1320 O LYS A 150 -1.201 5.605 -0.160 1.00 0.00 O ATOM 1321 CB LYS A 150 -3.120 7.743 -0.773 1.00 0.00 C ATOM 1322 CG LYS A 150 -4.361 8.590 -0.551 1.00 0.00 C ATOM 1323 CD LYS A 150 -4.209 9.972 -1.163 1.00 0.00 C ATOM 1324 CE LYS A 150 -4.705 10.002 -2.601 1.00 0.00 C ATOM 1325 NZ LYS A 150 -4.542 11.349 -3.216 1.00 0.00 N ATOM 0 H LYS A 150 -3.958 6.339 1.165 1.00 0.00 H new ATOM 0 HA LYS A 150 -4.019 6.044 -1.736 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -2.416 7.925 0.039 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -2.633 8.062 -1.695 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -5.226 8.091 -0.987 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -4.553 8.683 0.518 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -4.766 10.697 -0.570 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -3.161 10.272 -1.132 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -4.158 9.265 -3.189 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -5.756 9.715 -2.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -4.891 11.328 -4.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -5.085 12.048 -2.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -3.536 11.613 -3.213 1.00 0.00 H new ATOM 1339 N VAL A 151 -2.003 4.657 -2.036 1.00 0.00 N ATOM 1340 CA VAL A 151 -0.804 3.863 -2.279 1.00 0.00 C ATOM 1341 C VAL A 151 -0.123 4.280 -3.578 1.00 0.00 C ATOM 1342 O VAL A 151 -0.785 4.548 -4.580 1.00 0.00 O ATOM 1343 CB VAL A 151 -1.130 2.359 -2.343 1.00 0.00 C ATOM 1344 CG1 VAL A 151 0.149 1.536 -2.365 1.00 0.00 C ATOM 1345 CG2 VAL A 151 -2.013 1.956 -1.171 1.00 0.00 C ATOM 0 H VAL A 151 -2.739 4.532 -2.731 1.00 0.00 H new ATOM 0 HA VAL A 151 -0.129 4.045 -1.443 1.00 0.00 H new ATOM 0 HB VAL A 151 -1.676 2.162 -3.265 1.00 0.00 H new ATOM 0 HG11 VAL A 151 -0.101 0.476 -2.410 1.00 0.00 H new ATOM 0 HG12 VAL A 151 0.741 1.807 -3.239 1.00 0.00 H new ATOM 0 HG13 VAL A 151 0.725 1.735 -1.461 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -2.234 0.890 -1.231 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -1.495 2.167 -0.236 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -2.944 2.522 -1.205 1.00 0.00 H new ATOM 1355 N ALA A 152 1.205 4.332 -3.553 1.00 0.00 N ATOM 1356 CA ALA A 152 1.977 4.713 -4.729 1.00 0.00 C ATOM 1357 C ALA A 152 3.323 3.997 -4.758 1.00 0.00 C ATOM 1358 O ALA A 152 3.974 3.836 -3.726 1.00 0.00 O ATOM 1359 CB ALA A 152 2.178 6.221 -4.762 1.00 0.00 C ATOM 0 H ALA A 152 1.768 4.115 -2.731 1.00 0.00 H new ATOM 0 HA ALA A 152 1.417 4.413 -5.614 1.00 0.00 H new ATOM 0 HB1 ALA A 152 2.756 6.492 -5.645 1.00 0.00 H new ATOM 0 HB2 ALA A 152 1.208 6.717 -4.797 1.00 0.00 H new ATOM 0 HB3 ALA A 152 2.714 6.536 -3.867 1.00 0.00 H new ATOM 1365 N TYR A 153 3.734 3.569 -5.946 1.00 0.00 N ATOM 1366 CA TYR A 153 5.001 2.867 -6.109 1.00 0.00 C ATOM 1367 C TYR A 153 6.176 3.777 -5.764 1.00 0.00 C ATOM 1368 O TYR A 153 6.513 4.688 -6.521 1.00 0.00 O ATOM 1369 CB TYR A 153 5.143 2.354 -7.543 1.00 0.00 C ATOM 1370 CG TYR A 153 4.393 1.067 -7.803 1.00 0.00 C ATOM 1371 CD1 TYR A 153 4.845 -0.141 -7.285 1.00 0.00 C ATOM 1372 CD2 TYR A 153 3.231 1.059 -8.565 1.00 0.00 C ATOM 1373 CE1 TYR A 153 4.164 -1.319 -7.521 1.00 0.00 C ATOM 1374 CE2 TYR A 153 2.542 -0.115 -8.804 1.00 0.00 C ATOM 1375 CZ TYR A 153 3.012 -1.301 -8.280 1.00 0.00 C ATOM 1376 OH TYR A 153 2.330 -2.472 -8.516 1.00 0.00 O ATOM 0 H TYR A 153 3.208 3.696 -6.811 1.00 0.00 H new ATOM 0 HA TYR A 153 5.008 2.019 -5.424 1.00 0.00 H new ATOM 0 HB2 TYR A 153 4.784 3.119 -8.231 1.00 0.00 H new ATOM 0 HB3 TYR A 153 6.200 2.199 -7.762 1.00 0.00 H new ATOM 0 HD1 TYR A 153 5.744 -0.159 -6.688 1.00 0.00 H new ATOM 0 HD2 TYR A 153 2.860 1.986 -8.977 1.00 0.00 H new ATOM 0 HE1 TYR A 153 4.531 -2.249 -7.114 1.00 0.00 H new ATOM 0 HE2 TYR A 153 1.640 -0.104 -9.398 1.00 0.00 H new ATOM 0 HH TYR A 153 1.541 -2.286 -9.066 1.00 0.00 H new ATOM 1386 N ILE A 154 6.796 3.522 -4.617 1.00 0.00 N ATOM 1387 CA ILE A 154 7.934 4.316 -4.171 1.00 0.00 C ATOM 1388 C ILE A 154 9.043 4.324 -5.219 1.00 0.00 C ATOM 1389 O ILE A 154 9.400 3.293 -5.788 1.00 0.00 O ATOM 1390 CB ILE A 154 8.504 3.787 -2.842 1.00 0.00 C ATOM 1391 CG1 ILE A 154 7.433 3.829 -1.750 1.00 0.00 C ATOM 1392 CG2 ILE A 154 9.723 4.598 -2.428 1.00 0.00 C ATOM 1393 CD1 ILE A 154 7.883 3.225 -0.438 1.00 0.00 C ATOM 0 H ILE A 154 6.529 2.772 -3.980 1.00 0.00 H new ATOM 0 HA ILE A 154 7.570 5.333 -4.022 1.00 0.00 H new ATOM 0 HB ILE A 154 8.812 2.751 -2.983 1.00 0.00 H new ATOM 0 HG12 ILE A 154 7.138 4.865 -1.582 1.00 0.00 H new ATOM 0 HG13 ILE A 154 6.548 3.298 -2.100 1.00 0.00 H new ATOM 0 HG21 ILE A 154 10.114 4.212 -1.487 1.00 0.00 H new ATOM 0 HG22 ILE A 154 10.490 4.521 -3.199 1.00 0.00 H new ATOM 0 HG23 ILE A 154 9.439 5.643 -2.302 1.00 0.00 H new ATOM 0 HD11 ILE A 154 7.073 3.289 0.289 1.00 0.00 H new ATOM 0 HD12 ILE A 154 8.151 2.180 -0.592 1.00 0.00 H new ATOM 0 HD13 ILE A 154 8.750 3.770 -0.065 1.00 0.00 H new ATOM 1405 N PRO A 155 9.601 5.516 -5.480 1.00 0.00 N ATOM 1406 CA PRO A 155 10.679 5.687 -6.458 1.00 0.00 C ATOM 1407 C PRO A 155 11.990 5.064 -5.992 1.00 0.00 C ATOM 1408 O PRO A 155 12.583 5.506 -5.007 1.00 0.00 O ATOM 1409 CB PRO A 155 10.819 7.207 -6.569 1.00 0.00 C ATOM 1410 CG PRO A 155 10.313 7.730 -5.269 1.00 0.00 C ATOM 1411 CD PRO A 155 9.225 6.787 -4.839 1.00 0.00 C ATOM 0 HA PRO A 155 10.452 5.195 -7.404 1.00 0.00 H new ATOM 0 HB2 PRO A 155 11.856 7.498 -6.736 1.00 0.00 H new ATOM 0 HB3 PRO A 155 10.240 7.598 -7.405 1.00 0.00 H new ATOM 0 HG2 PRO A 155 11.111 7.770 -4.527 1.00 0.00 H new ATOM 0 HG3 PRO A 155 9.929 8.744 -5.379 1.00 0.00 H new ATOM 0 HD2 PRO A 155 9.181 6.692 -3.754 1.00 0.00 H new ATOM 0 HD3 PRO A 155 8.244 7.128 -5.169 1.00 0.00 H new ATOM 1419 N ASP A 156 12.438 4.037 -6.705 1.00 0.00 N ATOM 1420 CA ASP A 156 13.681 3.354 -6.365 1.00 0.00 C ATOM 1421 C ASP A 156 14.872 4.023 -7.043 1.00 0.00 C ATOM 1422 O ASP A 156 14.712 4.989 -7.788 1.00 0.00 O ATOM 1423 CB ASP A 156 13.607 1.881 -6.773 1.00 0.00 C ATOM 1424 CG ASP A 156 14.463 0.993 -5.891 1.00 0.00 C ATOM 1425 OD1 ASP A 156 14.356 1.106 -4.652 1.00 0.00 O ATOM 1426 OD2 ASP A 156 15.239 0.184 -6.441 1.00 0.00 O ATOM 0 H ASP A 156 11.959 3.659 -7.522 1.00 0.00 H new ATOM 0 HA ASP A 156 13.818 3.418 -5.285 1.00 0.00 H new ATOM 0 HB2 ASP A 156 12.571 1.545 -6.725 1.00 0.00 H new ATOM 0 HB3 ASP A 156 13.928 1.777 -7.809 1.00 0.00 H new ATOM 1431 N GLU A 157 16.067 3.503 -6.777 1.00 0.00 N ATOM 1432 CA GLU A 157 17.285 4.053 -7.361 1.00 0.00 C ATOM 1433 C GLU A 157 18.330 2.960 -7.569 1.00 0.00 C ATOM 1434 O GLU A 157 18.205 1.858 -7.035 1.00 0.00 O ATOM 1435 CB GLU A 157 17.855 5.154 -6.465 1.00 0.00 C ATOM 1436 CG GLU A 157 18.090 4.711 -5.031 1.00 0.00 C ATOM 1437 CD GLU A 157 18.321 5.878 -4.090 1.00 0.00 C ATOM 1438 OE1 GLU A 157 18.788 6.936 -4.562 1.00 0.00 O ATOM 1439 OE2 GLU A 157 18.036 5.733 -2.883 1.00 0.00 O ATOM 0 H GLU A 157 16.217 2.703 -6.162 1.00 0.00 H new ATOM 0 HA GLU A 157 17.031 4.479 -8.332 1.00 0.00 H new ATOM 0 HB2 GLU A 157 18.797 5.503 -6.888 1.00 0.00 H new ATOM 0 HB3 GLU A 157 17.171 6.003 -6.467 1.00 0.00 H new ATOM 0 HG2 GLU A 157 17.230 4.136 -4.687 1.00 0.00 H new ATOM 0 HG3 GLU A 157 18.953 4.045 -4.997 1.00 0.00 H new ATOM 1446 N MET A 158 19.359 3.274 -8.349 1.00 0.00 N ATOM 1447 CA MET A 158 20.426 2.320 -8.627 1.00 0.00 C ATOM 1448 C MET A 158 21.310 2.120 -7.401 1.00 0.00 C ATOM 1449 O MET A 158 21.258 2.903 -6.453 1.00 0.00 O ATOM 1450 CB MET A 158 21.272 2.798 -9.808 1.00 0.00 C ATOM 1451 CG MET A 158 20.585 2.633 -11.155 1.00 0.00 C ATOM 1452 SD MET A 158 19.605 4.075 -11.616 1.00 0.00 S ATOM 1453 CE MET A 158 20.836 5.064 -12.461 1.00 0.00 C ATOM 0 H MET A 158 19.477 4.181 -8.800 1.00 0.00 H new ATOM 0 HA MET A 158 19.967 1.365 -8.881 1.00 0.00 H new ATOM 0 HB2 MET A 158 21.522 3.849 -9.663 1.00 0.00 H new ATOM 0 HB3 MET A 158 22.211 2.245 -9.818 1.00 0.00 H new ATOM 0 HG2 MET A 158 21.337 2.449 -11.922 1.00 0.00 H new ATOM 0 HG3 MET A 158 19.940 1.755 -11.124 1.00 0.00 H new ATOM 0 HE1 MET A 158 20.382 5.993 -12.807 1.00 0.00 H new ATOM 0 HE2 MET A 158 21.652 5.293 -11.776 1.00 0.00 H new ATOM 0 HE3 MET A 158 21.224 4.510 -13.315 1.00 0.00 H new ATOM 1463 N ALA A 159 22.121 1.067 -7.426 1.00 0.00 N ATOM 1464 CA ALA A 159 23.017 0.767 -6.317 1.00 0.00 C ATOM 1465 C ALA A 159 24.345 1.501 -6.469 1.00 0.00 C ATOM 1466 O ALA A 159 25.408 0.947 -6.192 1.00 0.00 O ATOM 1467 CB ALA A 159 23.251 -0.734 -6.219 1.00 0.00 C ATOM 0 H ALA A 159 22.175 0.408 -8.202 1.00 0.00 H new ATOM 0 HA ALA A 159 22.544 1.112 -5.397 1.00 0.00 H new ATOM 0 HB1 ALA A 159 23.922 -0.944 -5.386 1.00 0.00 H new ATOM 0 HB2 ALA A 159 22.300 -1.241 -6.055 1.00 0.00 H new ATOM 0 HB3 ALA A 159 23.699 -1.094 -7.145 1.00 0.00 H new ATOM 1473 N ALA A 160 24.276 2.752 -6.913 1.00 0.00 N ATOM 1474 CA ALA A 160 25.472 3.563 -7.101 1.00 0.00 C ATOM 1475 C ALA A 160 26.420 3.426 -5.914 1.00 0.00 C ATOM 1476 O ALA A 160 27.560 2.987 -6.067 1.00 0.00 O ATOM 1477 CB ALA A 160 25.094 5.022 -7.311 1.00 0.00 C ATOM 0 H ALA A 160 23.404 3.226 -7.149 1.00 0.00 H new ATOM 0 HA ALA A 160 25.989 3.202 -7.990 1.00 0.00 H new ATOM 0 HB1 ALA A 160 25.998 5.616 -7.450 1.00 0.00 H new ATOM 0 HB2 ALA A 160 24.462 5.111 -8.195 1.00 0.00 H new ATOM 0 HB3 ALA A 160 24.551 5.386 -6.439 1.00 0.00 H new ATOM 1483 N GLN A 161 25.942 3.806 -4.734 1.00 0.00 N ATOM 1484 CA GLN A 161 26.748 3.726 -3.522 1.00 0.00 C ATOM 1485 C GLN A 161 26.271 2.590 -2.623 1.00 0.00 C ATOM 1486 O GLN A 161 27.072 1.926 -1.966 1.00 0.00 O ATOM 1487 CB GLN A 161 26.695 5.052 -2.760 1.00 0.00 C ATOM 1488 CG GLN A 161 25.329 5.359 -2.169 1.00 0.00 C ATOM 1489 CD GLN A 161 25.043 4.560 -0.913 1.00 0.00 C ATOM 1490 OE1 GLN A 161 24.159 3.703 -0.897 1.00 0.00 O ATOM 1491 NE2 GLN A 161 25.791 4.837 0.148 1.00 0.00 N ATOM 0 H GLN A 161 25.001 4.172 -4.591 1.00 0.00 H new ATOM 0 HA GLN A 161 27.778 3.524 -3.815 1.00 0.00 H new ATOM 0 HB2 GLN A 161 27.432 5.030 -1.958 1.00 0.00 H new ATOM 0 HB3 GLN A 161 26.980 5.860 -3.433 1.00 0.00 H new ATOM 0 HG2 GLN A 161 25.267 6.423 -1.940 1.00 0.00 H new ATOM 0 HG3 GLN A 161 24.560 5.148 -2.912 1.00 0.00 H new ATOM 0 HE21 GLN A 161 26.513 5.555 0.090 1.00 0.00 H new ATOM 0 HE22 GLN A 161 25.644 4.331 1.022 1.00 0.00 H new TER 1500 GLN A 161