USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 737 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 100 TYR OH : rot 108:sc= 0.777 USER MOD Set 1.2: A 114 ASN : amide:sc= -1.61! X(o=-0.83!,f=-1.2) USER MOD Set 2.1: A 61 ASN : amide:sc= -1.42 X(o=-3,f=-3.4) USER MOD Set 2.2: A 73 GLN : amide:sc= -1.6 K(o=-3,f=-7.3!) USER MOD Set 3.1: A 49 THR OG1 : rot -129:sc= -1.34! USER MOD Set 3.2: A 59 TYR OH : rot 165:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= -0.168 USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ -162:sc=-0.00737 (180deg=-0.155) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= -0.15 K(o=-0.15,f=-2.2!) USER MOD Single : A 30 HIS : no HD1:sc= -0.513 K(o=-0.51,f=-1.1) USER MOD Single : A 31 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 28:sc= 1.03 USER MOD Single : A 38 THR OG1 : rot -66:sc= 1.16 USER MOD Single : A 39 THR OG1 : rot -150:sc= -4.63! USER MOD Single : A 43 GLN : amide:sc= -0.0168 X(o=-0.017,f=0) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= -0.177 X(o=-0.18,f=0) USER MOD Single : A 48 THR OG1 : rot 180:sc= -0.737 USER MOD Single : A 52 ASN : amide:sc=-0.00786 X(o=-0.0079,f=-0.31) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 180:sc= -1.72! USER MOD Single : A 63 THR OG1 : rot 77:sc= 0.343 USER MOD Single : A 66 GLN : amide:sc= -7.34! C(o=-7.3!,f=-8.6!) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot -150:sc= -0.498 USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -12.3! C(o=-12!,f=-24!) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 ASN : amide:sc= -5.02! K(o=-5!,f=-1.8) USER MOD Single : A 95 THR OG1 : rot 180:sc= -0.406 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= -1.93 X(o=-1.9,f=-2.1!) USER MOD Single : A 106 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= -1.25 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 115 TYR OH : rot 30:sc= -2.69! USER MOD Single : A 116 SER OG : rot -43:sc= 0.00239 USER MOD Single : A 117 HIS : no HD1:sc= -0.24 X(o=-0.24,f=-0.01) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 GLN : amide:sc= -2.44! K(o=-2.4!,f=-0.72) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 HIS : no HD1:sc= -0.7 K(o=-0.7,f=-0.12) USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 15 37.140 15.919 9.671 1.00 0.00 N ATOM 2 CA GLY A 15 36.411 14.673 9.842 1.00 0.00 C ATOM 3 C GLY A 15 35.374 14.795 10.960 1.00 0.00 C ATOM 4 O GLY A 15 35.400 15.750 11.735 1.00 0.00 O ATOM 0 HA2 GLY A 15 35.915 14.406 8.909 1.00 0.00 H new ATOM 0 HA3 GLY A 15 37.108 13.868 10.074 1.00 0.00 H new ATOM 8 N SER A 16 34.485 13.815 11.008 1.00 0.00 N ATOM 9 CA SER A 16 33.440 13.799 12.018 1.00 0.00 C ATOM 10 C SER A 16 32.708 12.456 11.993 1.00 0.00 C ATOM 11 O SER A 16 32.909 11.652 11.084 1.00 0.00 O ATOM 12 CB SER A 16 32.451 14.947 11.804 1.00 0.00 C ATOM 13 OG SER A 16 31.499 15.035 12.861 1.00 0.00 O ATOM 0 H SER A 16 34.466 13.025 10.363 1.00 0.00 H new ATOM 0 HA SER A 16 33.906 13.933 12.994 1.00 0.00 H new ATOM 0 HB2 SER A 16 32.997 15.887 11.729 1.00 0.00 H new ATOM 0 HB3 SER A 16 31.930 14.805 10.857 1.00 0.00 H new ATOM 0 HG SER A 16 30.887 15.781 12.689 1.00 0.00 H new ATOM 18 N GLY A 17 31.872 12.255 13.002 1.00 0.00 N ATOM 19 CA GLY A 17 31.109 11.024 13.108 1.00 0.00 C ATOM 20 C GLY A 17 30.185 11.054 14.326 1.00 0.00 C ATOM 21 O GLY A 17 30.306 11.932 15.179 1.00 0.00 O ATOM 0 H GLY A 17 31.707 12.925 13.753 1.00 0.00 H new ATOM 0 HA2 GLY A 17 30.519 10.879 12.203 1.00 0.00 H new ATOM 0 HA3 GLY A 17 31.789 10.176 13.184 1.00 0.00 H new ATOM 25 N MET A 18 29.282 10.086 14.369 1.00 0.00 N ATOM 26 CA MET A 18 28.338 9.990 15.469 1.00 0.00 C ATOM 27 C MET A 18 28.089 8.530 15.854 1.00 0.00 C ATOM 28 O MET A 18 28.014 7.661 14.987 1.00 0.00 O ATOM 29 CB MET A 18 27.016 10.645 15.066 1.00 0.00 C ATOM 30 CG MET A 18 27.159 12.167 14.986 1.00 0.00 C ATOM 31 SD MET A 18 27.505 12.833 16.605 1.00 0.00 S ATOM 32 CE MET A 18 25.857 13.303 17.106 1.00 0.00 C ATOM 0 H MET A 18 29.184 9.360 13.659 1.00 0.00 H new ATOM 0 HA MET A 18 28.761 10.505 16.331 1.00 0.00 H new ATOM 0 HB2 MET A 18 26.693 10.255 14.101 1.00 0.00 H new ATOM 0 HB3 MET A 18 26.243 10.386 15.789 1.00 0.00 H new ATOM 0 HG2 MET A 18 27.961 12.429 14.297 1.00 0.00 H new ATOM 0 HG3 MET A 18 26.243 12.606 14.591 1.00 0.00 H new ATOM 0 HE1 MET A 18 25.891 13.740 18.104 1.00 0.00 H new ATOM 0 HE2 MET A 18 25.457 14.034 16.403 1.00 0.00 H new ATOM 0 HE3 MET A 18 25.215 12.422 17.118 1.00 0.00 H new ATOM 40 N LYS A 19 27.965 8.307 17.154 1.00 0.00 N ATOM 41 CA LYS A 19 27.726 6.967 17.663 1.00 0.00 C ATOM 42 C LYS A 19 26.321 6.898 18.265 1.00 0.00 C ATOM 43 O LYS A 19 25.705 7.929 18.532 1.00 0.00 O ATOM 44 CB LYS A 19 28.833 6.558 18.637 1.00 0.00 C ATOM 45 CG LYS A 19 30.093 6.125 17.885 1.00 0.00 C ATOM 46 CD LYS A 19 31.321 6.890 18.386 1.00 0.00 C ATOM 47 CE LYS A 19 31.558 8.151 17.552 1.00 0.00 C ATOM 48 NZ LYS A 19 32.101 7.798 16.221 1.00 0.00 N ATOM 0 H LYS A 19 28.025 9.031 17.870 1.00 0.00 H new ATOM 0 HA LYS A 19 27.762 6.240 16.852 1.00 0.00 H new ATOM 0 HB2 LYS A 19 29.068 7.393 19.297 1.00 0.00 H new ATOM 0 HB3 LYS A 19 28.483 5.741 19.268 1.00 0.00 H new ATOM 0 HG2 LYS A 19 30.249 5.054 18.016 1.00 0.00 H new ATOM 0 HG3 LYS A 19 29.962 6.300 16.817 1.00 0.00 H new ATOM 0 HD2 LYS A 19 31.183 7.162 19.432 1.00 0.00 H new ATOM 0 HD3 LYS A 19 32.200 6.247 18.337 1.00 0.00 H new ATOM 0 HE2 LYS A 19 30.623 8.699 17.436 1.00 0.00 H new ATOM 0 HE3 LYS A 19 32.252 8.812 18.071 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 32.536 8.638 15.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 32.818 7.052 16.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 31.331 7.456 15.612 1.00 0.00 H new ATOM 58 N GLU A 20 25.855 5.674 18.462 1.00 0.00 N ATOM 59 CA GLU A 20 24.534 5.457 19.027 1.00 0.00 C ATOM 60 C GLU A 20 24.549 4.246 19.962 1.00 0.00 C ATOM 61 O GLU A 20 25.506 3.473 19.966 1.00 0.00 O ATOM 62 CB GLU A 20 23.487 5.287 17.925 1.00 0.00 C ATOM 63 CG GLU A 20 23.725 3.997 17.137 1.00 0.00 C ATOM 64 CD GLU A 20 23.207 4.127 15.703 1.00 0.00 C ATOM 65 OE1 GLU A 20 23.389 5.222 15.131 1.00 0.00 O ATOM 66 OE2 GLU A 20 22.640 3.126 15.213 1.00 0.00 O ATOM 0 H GLU A 20 26.369 4.821 18.240 1.00 0.00 H new ATOM 0 HA GLU A 20 24.260 6.337 19.609 1.00 0.00 H new ATOM 0 HB2 GLU A 20 22.490 5.270 18.365 1.00 0.00 H new ATOM 0 HB3 GLU A 20 23.523 6.142 17.250 1.00 0.00 H new ATOM 0 HG2 GLU A 20 24.790 3.766 17.123 1.00 0.00 H new ATOM 0 HG3 GLU A 20 23.225 3.166 17.634 1.00 0.00 H new ATOM 71 N THR A 21 23.477 4.117 20.730 1.00 0.00 N ATOM 72 CA THR A 21 23.355 3.014 21.666 1.00 0.00 C ATOM 73 C THR A 21 21.963 2.385 21.571 1.00 0.00 C ATOM 74 O THR A 21 20.981 3.080 21.311 1.00 0.00 O ATOM 75 CB THR A 21 23.690 3.539 23.063 1.00 0.00 C ATOM 76 OG1 THR A 21 23.602 2.387 23.897 1.00 0.00 O ATOM 77 CG2 THR A 21 22.611 4.478 23.609 1.00 0.00 C ATOM 0 H THR A 21 22.685 4.759 20.723 1.00 0.00 H new ATOM 0 HA THR A 21 24.056 2.214 21.427 1.00 0.00 H new ATOM 0 HB THR A 21 24.646 4.061 23.035 1.00 0.00 H new ATOM 0 HG1 THR A 21 23.806 2.637 24.822 1.00 0.00 H new ATOM 0 HG21 THR A 21 22.897 4.822 24.603 1.00 0.00 H new ATOM 0 HG22 THR A 21 22.505 5.335 22.944 1.00 0.00 H new ATOM 0 HG23 THR A 21 21.662 3.946 23.669 1.00 0.00 H new ATOM 85 N ALA A 22 21.923 1.078 21.785 1.00 0.00 N ATOM 86 CA ALA A 22 20.667 0.349 21.727 1.00 0.00 C ATOM 87 C ALA A 22 20.197 0.036 23.149 1.00 0.00 C ATOM 88 O ALA A 22 21.010 -0.255 24.025 1.00 0.00 O ATOM 89 CB ALA A 22 20.850 -0.913 20.882 1.00 0.00 C ATOM 0 H ALA A 22 22.739 0.505 21.999 1.00 0.00 H new ATOM 0 HA ALA A 22 19.894 0.952 21.251 1.00 0.00 H new ATOM 0 HB1 ALA A 22 19.909 -1.461 20.838 1.00 0.00 H new ATOM 0 HB2 ALA A 22 21.156 -0.634 19.873 1.00 0.00 H new ATOM 0 HB3 ALA A 22 21.616 -1.544 21.332 1.00 0.00 H new ATOM 95 N ALA A 23 18.887 0.106 23.334 1.00 0.00 N ATOM 96 CA ALA A 23 18.300 -0.165 24.634 1.00 0.00 C ATOM 97 C ALA A 23 17.852 -1.627 24.691 1.00 0.00 C ATOM 98 O ALA A 23 18.351 -2.401 25.508 1.00 0.00 O ATOM 99 CB ALA A 23 17.146 0.807 24.887 1.00 0.00 C ATOM 0 H ALA A 23 18.216 0.347 22.605 1.00 0.00 H new ATOM 0 HA ALA A 23 19.034 -0.013 25.425 1.00 0.00 H new ATOM 0 HB1 ALA A 23 16.706 0.603 25.863 1.00 0.00 H new ATOM 0 HB2 ALA A 23 17.521 1.830 24.865 1.00 0.00 H new ATOM 0 HB3 ALA A 23 16.388 0.681 24.114 1.00 0.00 H new ATOM 105 N ALA A 24 16.919 -1.962 23.814 1.00 0.00 N ATOM 106 CA ALA A 24 16.398 -3.318 23.753 1.00 0.00 C ATOM 107 C ALA A 24 15.438 -3.439 22.570 1.00 0.00 C ATOM 108 O ALA A 24 15.168 -2.456 21.881 1.00 0.00 O ATOM 109 CB ALA A 24 15.730 -3.668 25.085 1.00 0.00 C ATOM 0 H ALA A 24 16.509 -1.317 23.138 1.00 0.00 H new ATOM 0 HA ALA A 24 17.206 -4.033 23.595 1.00 0.00 H new ATOM 0 HB1 ALA A 24 15.339 -4.685 25.040 1.00 0.00 H new ATOM 0 HB2 ALA A 24 16.462 -3.596 25.889 1.00 0.00 H new ATOM 0 HB3 ALA A 24 14.912 -2.973 25.276 1.00 0.00 H new ATOM 115 N LYS A 25 14.947 -4.653 22.369 1.00 0.00 N ATOM 116 CA LYS A 25 14.022 -4.915 21.280 1.00 0.00 C ATOM 117 C LYS A 25 12.684 -4.234 21.577 1.00 0.00 C ATOM 118 O LYS A 25 12.238 -4.207 22.722 1.00 0.00 O ATOM 119 CB LYS A 25 13.902 -6.420 21.029 1.00 0.00 C ATOM 120 CG LYS A 25 13.248 -7.125 22.219 1.00 0.00 C ATOM 121 CD LYS A 25 13.113 -8.627 21.961 1.00 0.00 C ATOM 122 CE LYS A 25 14.115 -9.420 22.803 1.00 0.00 C ATOM 123 NZ LYS A 25 14.410 -10.722 22.166 1.00 0.00 N ATOM 0 H LYS A 25 15.172 -5.466 22.942 1.00 0.00 H new ATOM 0 HA LYS A 25 14.399 -4.488 20.350 1.00 0.00 H new ATOM 0 HB2 LYS A 25 13.313 -6.596 20.129 1.00 0.00 H new ATOM 0 HB3 LYS A 25 14.891 -6.842 20.850 1.00 0.00 H new ATOM 0 HG2 LYS A 25 13.844 -6.959 23.117 1.00 0.00 H new ATOM 0 HG3 LYS A 25 12.264 -6.695 22.405 1.00 0.00 H new ATOM 0 HD2 LYS A 25 12.099 -8.950 22.196 1.00 0.00 H new ATOM 0 HD3 LYS A 25 13.277 -8.834 20.903 1.00 0.00 H new ATOM 0 HE2 LYS A 25 15.036 -8.848 22.918 1.00 0.00 H new ATOM 0 HE3 LYS A 25 13.712 -9.581 23.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 15.091 -11.248 22.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 13.532 -11.272 22.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 14.814 -10.563 21.221 1.00 0.00 H new ATOM 133 N PHE A 26 12.083 -3.699 20.524 1.00 0.00 N ATOM 134 CA PHE A 26 10.805 -3.019 20.658 1.00 0.00 C ATOM 135 C PHE A 26 9.651 -3.935 20.250 1.00 0.00 C ATOM 136 O PHE A 26 9.875 -5.039 19.755 1.00 0.00 O ATOM 137 CB PHE A 26 10.841 -1.813 19.718 1.00 0.00 C ATOM 138 CG PHE A 26 11.782 -0.696 20.174 1.00 0.00 C ATOM 139 CD1 PHE A 26 11.393 0.166 21.152 1.00 0.00 C ATOM 140 CD2 PHE A 26 13.009 -0.564 19.600 1.00 0.00 C ATOM 141 CE1 PHE A 26 12.266 1.201 21.574 1.00 0.00 C ATOM 142 CE2 PHE A 26 13.882 0.472 20.023 1.00 0.00 C ATOM 143 CZ PHE A 26 13.492 1.333 21.001 1.00 0.00 C ATOM 0 H PHE A 26 12.457 -3.722 19.575 1.00 0.00 H new ATOM 0 HA PHE A 26 10.648 -2.722 21.695 1.00 0.00 H new ATOM 0 HB2 PHE A 26 11.145 -2.148 18.726 1.00 0.00 H new ATOM 0 HB3 PHE A 26 9.833 -1.409 19.623 1.00 0.00 H new ATOM 0 HD1 PHE A 26 10.419 0.062 21.607 1.00 0.00 H new ATOM 0 HD2 PHE A 26 13.318 -1.247 18.823 1.00 0.00 H new ATOM 0 HE1 PHE A 26 11.957 1.885 22.351 1.00 0.00 H new ATOM 0 HE2 PHE A 26 14.856 0.577 19.568 1.00 0.00 H new ATOM 0 HZ PHE A 26 14.156 2.122 21.322 1.00 0.00 H new ATOM 152 N GLU A 27 8.441 -3.444 20.471 1.00 0.00 N ATOM 153 CA GLU A 27 7.250 -4.206 20.132 1.00 0.00 C ATOM 154 C GLU A 27 6.110 -3.262 19.742 1.00 0.00 C ATOM 155 O GLU A 27 6.198 -2.054 19.956 1.00 0.00 O ATOM 156 CB GLU A 27 6.835 -5.118 21.289 1.00 0.00 C ATOM 157 CG GLU A 27 6.365 -4.298 22.492 1.00 0.00 C ATOM 158 CD GLU A 27 5.022 -4.813 23.014 1.00 0.00 C ATOM 159 OE1 GLU A 27 4.952 -6.028 23.299 1.00 0.00 O ATOM 160 OE2 GLU A 27 4.097 -3.979 23.119 1.00 0.00 O ATOM 0 H GLU A 27 8.259 -2.528 20.881 1.00 0.00 H new ATOM 0 HA GLU A 27 7.479 -4.841 19.276 1.00 0.00 H new ATOM 0 HB2 GLU A 27 6.036 -5.784 20.963 1.00 0.00 H new ATOM 0 HB3 GLU A 27 7.676 -5.748 21.580 1.00 0.00 H new ATOM 0 HG2 GLU A 27 7.111 -4.348 23.285 1.00 0.00 H new ATOM 0 HG3 GLU A 27 6.271 -3.250 22.208 1.00 0.00 H new ATOM 165 N ARG A 28 5.067 -3.850 19.175 1.00 0.00 N ATOM 166 CA ARG A 28 3.911 -3.077 18.753 1.00 0.00 C ATOM 167 C ARG A 28 2.670 -3.503 19.541 1.00 0.00 C ATOM 168 O ARG A 28 2.622 -4.608 20.081 1.00 0.00 O ATOM 169 CB ARG A 28 3.644 -3.259 17.257 1.00 0.00 C ATOM 170 CG ARG A 28 3.324 -4.719 16.930 1.00 0.00 C ATOM 171 CD ARG A 28 1.961 -4.841 16.246 1.00 0.00 C ATOM 172 NE ARG A 28 1.313 -6.115 16.631 1.00 0.00 N ATOM 173 CZ ARG A 28 0.209 -6.602 16.050 1.00 0.00 C ATOM 174 NH1 ARG A 28 -0.380 -5.924 15.056 1.00 0.00 N ATOM 175 NH2 ARG A 28 -0.309 -7.766 16.465 1.00 0.00 N ATOM 0 H ARG A 28 4.998 -4.852 18.998 1.00 0.00 H new ATOM 0 HA ARG A 28 4.126 -2.026 18.948 1.00 0.00 H new ATOM 0 HB2 ARG A 28 2.812 -2.624 16.953 1.00 0.00 H new ATOM 0 HB3 ARG A 28 4.516 -2.938 16.687 1.00 0.00 H new ATOM 0 HG2 ARG A 28 4.098 -5.128 16.281 1.00 0.00 H new ATOM 0 HG3 ARG A 28 3.330 -5.310 17.846 1.00 0.00 H new ATOM 0 HD2 ARG A 28 1.327 -4.001 16.529 1.00 0.00 H new ATOM 0 HD3 ARG A 28 2.083 -4.798 15.164 1.00 0.00 H new ATOM 0 HE ARG A 28 1.734 -6.656 17.386 1.00 0.00 H new ATOM 0 HH11 ARG A 28 0.012 -5.037 14.741 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -1.221 -6.295 14.614 1.00 0.00 H new ATOM 0 HH21 ARG A 28 0.138 -8.281 17.224 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -1.150 -8.137 16.022 1.00 0.00 H new ATOM 186 N GLN A 29 1.697 -2.606 19.581 1.00 0.00 N ATOM 187 CA GLN A 29 0.459 -2.876 20.293 1.00 0.00 C ATOM 188 C GLN A 29 -0.731 -2.810 19.334 1.00 0.00 C ATOM 189 O GLN A 29 -1.467 -3.785 19.185 1.00 0.00 O ATOM 190 CB GLN A 29 0.276 -1.905 21.461 1.00 0.00 C ATOM 191 CG GLN A 29 -0.764 -2.429 22.453 1.00 0.00 C ATOM 192 CD GLN A 29 -0.109 -3.309 23.520 1.00 0.00 C ATOM 193 OE1 GLN A 29 1.103 -3.420 23.613 1.00 0.00 O ATOM 194 NE2 GLN A 29 -0.975 -3.926 24.319 1.00 0.00 N ATOM 0 H GLN A 29 1.740 -1.691 19.132 1.00 0.00 H new ATOM 0 HA GLN A 29 0.512 -3.884 20.705 1.00 0.00 H new ATOM 0 HB2 GLN A 29 1.229 -1.760 21.970 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -0.035 -0.931 21.083 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -1.272 -1.591 22.930 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -1.524 -3.001 21.921 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -1.977 -3.790 24.187 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -0.637 -4.535 25.064 1.00 0.00 H new ATOM 201 N HIS A 30 -0.883 -1.652 18.709 1.00 0.00 N ATOM 202 CA HIS A 30 -1.971 -1.446 17.768 1.00 0.00 C ATOM 203 C HIS A 30 -3.244 -2.102 18.306 1.00 0.00 C ATOM 204 O HIS A 30 -3.509 -3.272 18.030 1.00 0.00 O ATOM 205 CB HIS A 30 -1.587 -1.951 16.376 1.00 0.00 C ATOM 206 CG HIS A 30 -2.761 -2.413 15.546 1.00 0.00 C ATOM 207 ND1 HIS A 30 -2.864 -3.699 15.044 1.00 0.00 N ATOM 208 CD2 HIS A 30 -3.879 -1.750 15.135 1.00 0.00 C ATOM 209 CE1 HIS A 30 -3.996 -3.794 14.364 1.00 0.00 C ATOM 210 NE2 HIS A 30 -4.624 -2.584 14.420 1.00 0.00 N ATOM 0 H HIS A 30 -0.271 -0.846 18.836 1.00 0.00 H new ATOM 0 HA HIS A 30 -2.169 -0.379 17.662 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -1.068 -1.155 15.842 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -0.882 -2.776 16.481 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -4.118 -0.720 15.354 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -4.359 -4.675 13.855 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -5.518 -2.358 13.984 1.00 0.00 H new ATOM 217 N MET A 31 -3.999 -1.319 19.063 1.00 0.00 N ATOM 218 CA MET A 31 -5.240 -1.809 19.642 1.00 0.00 C ATOM 219 C MET A 31 -6.365 -0.786 19.473 1.00 0.00 C ATOM 220 O MET A 31 -7.407 -1.094 18.897 1.00 0.00 O ATOM 221 CB MET A 31 -5.030 -2.098 21.129 1.00 0.00 C ATOM 222 CG MET A 31 -5.987 -3.187 21.617 1.00 0.00 C ATOM 223 SD MET A 31 -5.091 -4.412 22.556 1.00 0.00 S ATOM 224 CE MET A 31 -5.630 -5.896 21.724 1.00 0.00 C ATOM 0 H MET A 31 -3.776 -0.350 19.289 1.00 0.00 H new ATOM 0 HA MET A 31 -5.526 -2.724 19.123 1.00 0.00 H new ATOM 0 HB2 MET A 31 -4.000 -2.411 21.300 1.00 0.00 H new ATOM 0 HB3 MET A 31 -5.186 -1.186 21.706 1.00 0.00 H new ATOM 0 HG2 MET A 31 -6.770 -2.745 22.234 1.00 0.00 H new ATOM 0 HG3 MET A 31 -6.479 -3.658 20.766 1.00 0.00 H new ATOM 0 HE1 MET A 31 -5.161 -6.764 22.188 1.00 0.00 H new ATOM 0 HE2 MET A 31 -6.714 -5.984 21.802 1.00 0.00 H new ATOM 0 HE3 MET A 31 -5.345 -5.848 20.673 1.00 0.00 H new ATOM 232 N ASP A 32 -6.115 0.410 19.986 1.00 0.00 N ATOM 233 CA ASP A 32 -7.094 1.480 19.899 1.00 0.00 C ATOM 234 C ASP A 32 -6.453 2.700 19.236 1.00 0.00 C ATOM 235 O ASP A 32 -5.234 2.759 19.084 1.00 0.00 O ATOM 236 CB ASP A 32 -7.578 1.897 21.290 1.00 0.00 C ATOM 237 CG ASP A 32 -6.512 1.851 22.386 1.00 0.00 C ATOM 238 OD1 ASP A 32 -5.469 2.511 22.192 1.00 0.00 O ATOM 239 OD2 ASP A 32 -6.764 1.156 23.394 1.00 0.00 O ATOM 0 H ASP A 32 -5.249 0.661 20.463 1.00 0.00 H new ATOM 0 HA ASP A 32 -7.940 1.116 19.316 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.974 2.911 21.232 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -8.404 1.248 21.580 1.00 0.00 H new ATOM 243 N SER A 33 -7.303 3.643 18.858 1.00 0.00 N ATOM 244 CA SER A 33 -6.835 4.858 18.213 1.00 0.00 C ATOM 245 C SER A 33 -7.922 5.933 18.270 1.00 0.00 C ATOM 246 O SER A 33 -9.111 5.618 18.270 1.00 0.00 O ATOM 247 CB SER A 33 -6.427 4.591 16.763 1.00 0.00 C ATOM 248 OG SER A 33 -5.104 4.068 16.668 1.00 0.00 O ATOM 0 H SER A 33 -8.314 3.590 18.986 1.00 0.00 H new ATOM 0 HA SER A 33 -5.955 5.212 18.749 1.00 0.00 H new ATOM 0 HB2 SER A 33 -7.128 3.888 16.313 1.00 0.00 H new ATOM 0 HB3 SER A 33 -6.493 5.517 16.192 1.00 0.00 H new ATOM 0 HG SER A 33 -4.888 3.573 17.486 1.00 0.00 H new ATOM 253 N PRO A 34 -7.464 7.212 18.317 1.00 0.00 N ATOM 254 CA PRO A 34 -8.383 8.336 18.373 1.00 0.00 C ATOM 255 C PRO A 34 -9.033 8.582 17.009 1.00 0.00 C ATOM 256 O PRO A 34 -9.018 7.708 16.145 1.00 0.00 O ATOM 257 CB PRO A 34 -7.544 9.509 18.852 1.00 0.00 C ATOM 258 CG PRO A 34 -6.097 9.116 18.601 1.00 0.00 C ATOM 259 CD PRO A 34 -6.062 7.622 18.318 1.00 0.00 C ATOM 0 HA PRO A 34 -9.220 8.161 19.049 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -7.801 10.420 18.311 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -7.717 9.707 19.910 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -5.691 9.674 17.757 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -5.481 9.355 19.468 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -5.587 7.411 17.360 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -5.494 7.088 19.079 1.00 0.00 H new ATOM 264 N ASP A 35 -9.587 9.776 16.860 1.00 0.00 N ATOM 265 CA ASP A 35 -10.239 10.148 15.617 1.00 0.00 C ATOM 266 C ASP A 35 -9.864 11.588 15.260 1.00 0.00 C ATOM 267 O ASP A 35 -10.099 12.507 16.044 1.00 0.00 O ATOM 268 CB ASP A 35 -11.761 10.075 15.750 1.00 0.00 C ATOM 269 CG ASP A 35 -12.273 9.074 16.788 1.00 0.00 C ATOM 270 OD1 ASP A 35 -12.056 9.342 17.990 1.00 0.00 O ATOM 271 OD2 ASP A 35 -12.867 8.063 16.357 1.00 0.00 O ATOM 0 H ASP A 35 -9.598 10.498 17.580 1.00 0.00 H new ATOM 0 HA ASP A 35 -9.911 9.454 14.844 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -12.136 11.066 16.007 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -12.183 9.816 14.779 1.00 0.00 H new ATOM 275 N LEU A 36 -9.288 11.740 14.077 1.00 0.00 N ATOM 276 CA LEU A 36 -8.878 13.053 13.608 1.00 0.00 C ATOM 277 C LEU A 36 -8.920 13.078 12.078 1.00 0.00 C ATOM 278 O LEU A 36 -7.889 12.933 11.423 1.00 0.00 O ATOM 279 CB LEU A 36 -7.515 13.430 14.192 1.00 0.00 C ATOM 280 CG LEU A 36 -7.524 14.525 15.260 1.00 0.00 C ATOM 281 CD1 LEU A 36 -6.517 14.217 16.370 1.00 0.00 C ATOM 282 CD2 LEU A 36 -7.286 15.901 14.636 1.00 0.00 C ATOM 0 H LEU A 36 -9.095 10.976 13.429 1.00 0.00 H new ATOM 0 HA LEU A 36 -9.571 13.817 13.960 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -7.065 12.535 14.621 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -6.868 13.751 13.376 1.00 0.00 H new ATOM 0 HG LEU A 36 -8.512 14.546 15.719 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -6.544 15.011 17.116 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -6.773 13.268 16.841 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -5.515 14.152 15.945 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -7.297 16.661 15.417 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -6.318 15.910 14.134 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -8.072 16.113 13.912 1.00 0.00 H new ATOM 293 N GLY A 37 -10.122 13.264 11.553 1.00 0.00 N ATOM 294 CA GLY A 37 -10.311 13.310 10.114 1.00 0.00 C ATOM 295 C GLY A 37 -11.798 13.275 9.755 1.00 0.00 C ATOM 296 O GLY A 37 -12.291 12.277 9.231 1.00 0.00 O ATOM 0 H GLY A 37 -10.975 13.385 12.099 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -9.858 14.216 9.713 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -9.801 12.466 9.649 1.00 0.00 H new ATOM 300 N THR A 38 -12.471 14.377 10.050 1.00 0.00 N ATOM 301 CA THR A 38 -13.892 14.485 9.766 1.00 0.00 C ATOM 302 C THR A 38 -14.113 15.032 8.354 1.00 0.00 C ATOM 303 O THR A 38 -15.058 15.783 8.116 1.00 0.00 O ATOM 304 CB THR A 38 -14.530 15.346 10.857 1.00 0.00 C ATOM 305 OG1 THR A 38 -15.902 15.426 10.481 1.00 0.00 O ATOM 306 CG2 THR A 38 -14.048 16.797 10.815 1.00 0.00 C ATOM 0 H THR A 38 -12.059 15.203 10.483 1.00 0.00 H new ATOM 0 HA THR A 38 -14.373 13.507 9.782 1.00 0.00 H new ATOM 0 HB THR A 38 -14.306 14.917 11.833 1.00 0.00 H new ATOM 0 HG1 THR A 38 -15.983 15.925 9.641 1.00 0.00 H new ATOM 0 HG21 THR A 38 -14.532 17.364 11.610 1.00 0.00 H new ATOM 0 HG22 THR A 38 -12.967 16.826 10.954 1.00 0.00 H new ATOM 0 HG23 THR A 38 -14.301 17.237 9.850 1.00 0.00 H new ATOM 314 N THR A 39 -13.226 14.634 7.454 1.00 0.00 N ATOM 315 CA THR A 39 -13.311 15.075 6.072 1.00 0.00 C ATOM 316 C THR A 39 -12.508 14.143 5.163 1.00 0.00 C ATOM 317 O THR A 39 -12.547 12.924 5.328 1.00 0.00 O ATOM 318 CB THR A 39 -12.847 16.532 6.011 1.00 0.00 C ATOM 319 OG1 THR A 39 -13.049 16.903 4.650 1.00 0.00 O ATOM 320 CG2 THR A 39 -11.338 16.674 6.217 1.00 0.00 C ATOM 0 H THR A 39 -12.444 14.010 7.655 1.00 0.00 H new ATOM 0 HA THR A 39 -14.337 15.030 5.705 1.00 0.00 H new ATOM 0 HB THR A 39 -13.373 17.113 6.769 1.00 0.00 H new ATOM 0 HG1 THR A 39 -12.390 17.582 4.395 1.00 0.00 H new ATOM 0 HG21 THR A 39 -11.061 17.727 6.164 1.00 0.00 H new ATOM 0 HG22 THR A 39 -11.065 16.275 7.194 1.00 0.00 H new ATOM 0 HG23 THR A 39 -10.811 16.121 5.439 1.00 0.00 H new ATOM 328 N LEU A 40 -11.799 14.751 4.224 1.00 0.00 N ATOM 329 CA LEU A 40 -10.988 13.990 3.289 1.00 0.00 C ATOM 330 C LEU A 40 -9.527 14.430 3.412 1.00 0.00 C ATOM 331 O LEU A 40 -9.167 15.525 2.985 1.00 0.00 O ATOM 332 CB LEU A 40 -11.549 14.111 1.871 1.00 0.00 C ATOM 333 CG LEU A 40 -11.661 15.532 1.313 1.00 0.00 C ATOM 334 CD1 LEU A 40 -11.807 15.512 -0.210 1.00 0.00 C ATOM 335 CD2 LEU A 40 -12.801 16.296 1.988 1.00 0.00 C ATOM 0 H LEU A 40 -11.769 15.762 4.090 1.00 0.00 H new ATOM 0 HA LEU A 40 -11.023 12.928 3.531 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -10.918 13.527 1.201 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -12.539 13.656 1.853 1.00 0.00 H new ATOM 0 HG LEU A 40 -10.737 16.064 1.541 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -11.885 16.534 -0.582 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -10.935 15.030 -0.653 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -12.705 14.958 -0.482 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -12.860 17.303 1.574 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -13.742 15.776 1.811 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -12.615 16.355 3.060 1.00 0.00 H new ATOM 346 N LEU A 41 -8.726 13.553 3.999 1.00 0.00 N ATOM 347 CA LEU A 41 -7.314 13.836 4.185 1.00 0.00 C ATOM 348 C LEU A 41 -6.524 13.263 3.006 1.00 0.00 C ATOM 349 O LEU A 41 -5.294 13.239 3.031 1.00 0.00 O ATOM 350 CB LEU A 41 -6.840 13.329 5.548 1.00 0.00 C ATOM 351 CG LEU A 41 -7.817 13.515 6.710 1.00 0.00 C ATOM 352 CD1 LEU A 41 -7.790 12.305 7.647 1.00 0.00 C ATOM 353 CD2 LEU A 41 -7.542 14.822 7.454 1.00 0.00 C ATOM 0 H LEU A 41 -9.029 12.645 4.352 1.00 0.00 H new ATOM 0 HA LEU A 41 -7.139 14.912 4.194 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.611 12.267 5.459 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -5.908 13.836 5.798 1.00 0.00 H new ATOM 0 HG LEU A 41 -8.825 13.584 6.301 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -8.493 12.462 8.465 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -8.072 11.410 7.093 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -6.785 12.180 8.051 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -8.251 14.929 8.275 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -6.527 14.808 7.850 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -7.652 15.662 6.768 1.00 0.00 H new ATOM 364 N GLU A 42 -7.263 12.815 2.002 1.00 0.00 N ATOM 365 CA GLU A 42 -6.647 12.244 0.816 1.00 0.00 C ATOM 366 C GLU A 42 -6.930 13.122 -0.405 1.00 0.00 C ATOM 367 O GLU A 42 -6.866 12.653 -1.540 1.00 0.00 O ATOM 368 CB GLU A 42 -7.129 10.811 0.585 1.00 0.00 C ATOM 369 CG GLU A 42 -6.637 9.880 1.694 1.00 0.00 C ATOM 370 CD GLU A 42 -7.615 9.862 2.870 1.00 0.00 C ATOM 371 OE1 GLU A 42 -8.832 9.935 2.597 1.00 0.00 O ATOM 372 OE2 GLU A 42 -7.123 9.776 4.016 1.00 0.00 O ATOM 0 H GLU A 42 -8.283 12.836 1.985 1.00 0.00 H new ATOM 0 HA GLU A 42 -5.569 12.209 0.971 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -8.218 10.792 0.546 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -6.769 10.454 -0.380 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -6.518 8.871 1.300 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -5.655 10.206 2.038 1.00 0.00 H new ATOM 377 N GLN A 43 -7.236 14.381 -0.130 1.00 0.00 N ATOM 378 CA GLN A 43 -7.528 15.329 -1.191 1.00 0.00 C ATOM 379 C GLN A 43 -6.265 15.626 -2.001 1.00 0.00 C ATOM 380 O GLN A 43 -5.800 16.763 -2.039 1.00 0.00 O ATOM 381 CB GLN A 43 -8.132 16.617 -0.626 1.00 0.00 C ATOM 382 CG GLN A 43 -8.439 17.615 -1.744 1.00 0.00 C ATOM 383 CD GLN A 43 -9.704 18.417 -1.430 1.00 0.00 C ATOM 384 OE1 GLN A 43 -10.635 18.492 -2.215 1.00 0.00 O ATOM 385 NE2 GLN A 43 -9.686 19.012 -0.241 1.00 0.00 N ATOM 0 H GLN A 43 -7.288 14.767 0.813 1.00 0.00 H new ATOM 0 HA GLN A 43 -8.266 14.882 -1.857 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -9.046 16.385 -0.080 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -7.440 17.065 0.087 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -7.596 18.294 -1.872 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -8.566 17.083 -2.687 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -8.875 18.909 0.369 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -10.483 19.572 0.061 1.00 0.00 H new ATOM 392 N TYR A 44 -5.746 14.582 -2.631 1.00 0.00 N ATOM 393 CA TYR A 44 -4.546 14.715 -3.438 1.00 0.00 C ATOM 394 C TYR A 44 -4.095 13.357 -3.980 1.00 0.00 C ATOM 395 O TYR A 44 -3.200 12.727 -3.419 1.00 0.00 O ATOM 396 CB TYR A 44 -3.466 15.260 -2.501 1.00 0.00 C ATOM 397 CG TYR A 44 -3.260 16.773 -2.603 1.00 0.00 C ATOM 398 CD1 TYR A 44 -2.904 17.342 -3.809 1.00 0.00 C ATOM 399 CD2 TYR A 44 -3.431 17.569 -1.490 1.00 0.00 C ATOM 400 CE1 TYR A 44 -2.709 18.765 -3.906 1.00 0.00 C ATOM 401 CE2 TYR A 44 -3.237 18.994 -1.585 1.00 0.00 C ATOM 402 CZ TYR A 44 -2.886 19.521 -2.789 1.00 0.00 C ATOM 403 OH TYR A 44 -2.703 20.865 -2.879 1.00 0.00 O ATOM 0 H TYR A 44 -6.135 13.640 -2.598 1.00 0.00 H new ATOM 0 HA TYR A 44 -4.729 15.368 -4.291 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -3.729 15.008 -1.474 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -2.523 14.760 -2.720 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -2.772 16.719 -4.681 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -3.711 17.124 -0.546 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -2.429 19.222 -4.844 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -3.367 19.628 -0.721 1.00 0.00 H new ATOM 0 HH TYR A 44 -2.864 21.276 -2.004 1.00 0.00 H new ATOM 412 N CYS A 45 -4.735 12.946 -5.065 1.00 0.00 N ATOM 413 CA CYS A 45 -4.412 11.675 -5.689 1.00 0.00 C ATOM 414 C CYS A 45 -5.414 11.425 -6.818 1.00 0.00 C ATOM 415 O CYS A 45 -6.039 10.368 -6.875 1.00 0.00 O ATOM 416 CB CYS A 45 -4.402 10.532 -4.671 1.00 0.00 C ATOM 417 SG CYS A 45 -2.815 9.628 -4.547 1.00 0.00 S ATOM 0 H CYS A 45 -5.476 13.472 -5.528 1.00 0.00 H new ATOM 0 HA CYS A 45 -3.404 11.715 -6.102 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -4.651 10.936 -3.690 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -5.188 9.824 -4.933 1.00 0.00 H new ATOM 421 N HIS A 46 -5.533 12.417 -7.689 1.00 0.00 N ATOM 422 CA HIS A 46 -6.449 12.318 -8.813 1.00 0.00 C ATOM 423 C HIS A 46 -6.035 11.148 -9.710 1.00 0.00 C ATOM 424 O HIS A 46 -4.856 10.989 -10.024 1.00 0.00 O ATOM 425 CB HIS A 46 -6.527 13.646 -9.569 1.00 0.00 C ATOM 426 CG HIS A 46 -7.735 13.772 -10.465 1.00 0.00 C ATOM 427 ND1 HIS A 46 -7.894 14.809 -11.368 1.00 0.00 N ATOM 428 CD2 HIS A 46 -8.840 12.981 -10.589 1.00 0.00 C ATOM 429 CE1 HIS A 46 -9.046 14.640 -12.000 1.00 0.00 C ATOM 430 NE2 HIS A 46 -9.631 13.508 -11.516 1.00 0.00 N ATOM 0 H HIS A 46 -5.011 13.292 -7.639 1.00 0.00 H new ATOM 0 HA HIS A 46 -7.456 12.114 -8.450 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -6.536 14.463 -8.848 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -5.626 13.763 -10.172 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -9.038 12.079 -10.028 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -9.451 15.286 -12.765 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -10.529 13.128 -11.817 1.00 0.00 H new ATOM 437 N ARG A 47 -7.027 10.361 -10.097 1.00 0.00 N ATOM 438 CA ARG A 47 -6.781 9.212 -10.952 1.00 0.00 C ATOM 439 C ARG A 47 -7.205 9.520 -12.390 1.00 0.00 C ATOM 440 O ARG A 47 -6.468 10.166 -13.132 1.00 0.00 O ATOM 441 CB ARG A 47 -7.546 7.983 -10.455 1.00 0.00 C ATOM 442 CG ARG A 47 -8.888 8.382 -9.841 1.00 0.00 C ATOM 443 CD ARG A 47 -8.736 8.712 -8.354 1.00 0.00 C ATOM 444 NE ARG A 47 -9.232 10.079 -8.085 1.00 0.00 N ATOM 445 CZ ARG A 47 -10.478 10.493 -8.352 1.00 0.00 C ATOM 446 NH1 ARG A 47 -11.363 9.647 -8.896 1.00 0.00 N ATOM 447 NH2 ARG A 47 -10.840 11.753 -8.074 1.00 0.00 N ATOM 0 H ARG A 47 -8.003 10.496 -9.834 1.00 0.00 H new ATOM 0 HA ARG A 47 -5.713 8.999 -10.922 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -7.712 7.294 -11.283 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -6.947 7.453 -9.715 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -9.291 9.246 -10.369 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -9.604 7.570 -9.965 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -9.291 7.991 -7.755 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -7.689 8.632 -8.061 1.00 0.00 H new ATOM 0 HE ARG A 47 -8.585 10.749 -7.670 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -11.088 8.688 -9.107 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -12.312 9.962 -9.099 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -10.167 12.397 -7.659 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -11.789 12.068 -8.277 1.00 0.00 H new ATOM 458 N THR A 48 -8.390 9.041 -12.739 1.00 0.00 N ATOM 459 CA THR A 48 -8.920 9.257 -14.074 1.00 0.00 C ATOM 460 C THR A 48 -10.166 8.398 -14.299 1.00 0.00 C ATOM 461 O THR A 48 -10.491 7.543 -13.477 1.00 0.00 O ATOM 462 CB THR A 48 -7.799 8.977 -15.078 1.00 0.00 C ATOM 463 OG1 THR A 48 -8.487 8.622 -16.275 1.00 0.00 O ATOM 464 CG2 THR A 48 -6.996 7.725 -14.724 1.00 0.00 C ATOM 0 H THR A 48 -8.998 8.504 -12.120 1.00 0.00 H new ATOM 0 HA THR A 48 -9.247 10.288 -14.208 1.00 0.00 H new ATOM 0 HB THR A 48 -7.130 9.836 -15.124 1.00 0.00 H new ATOM 0 HG1 THR A 48 -7.836 8.426 -16.981 1.00 0.00 H new ATOM 0 HG21 THR A 48 -6.214 7.572 -15.468 1.00 0.00 H new ATOM 0 HG22 THR A 48 -6.542 7.850 -13.741 1.00 0.00 H new ATOM 0 HG23 THR A 48 -7.658 6.860 -14.711 1.00 0.00 H new ATOM 472 N THR A 49 -10.828 8.655 -15.417 1.00 0.00 N ATOM 473 CA THR A 49 -12.030 7.915 -15.761 1.00 0.00 C ATOM 474 C THR A 49 -12.640 8.458 -17.055 1.00 0.00 C ATOM 475 O THR A 49 -13.286 9.506 -17.049 1.00 0.00 O ATOM 476 CB THR A 49 -12.984 7.980 -14.566 1.00 0.00 C ATOM 477 OG1 THR A 49 -14.267 7.728 -15.131 1.00 0.00 O ATOM 478 CG2 THR A 49 -13.102 9.392 -13.989 1.00 0.00 C ATOM 0 H THR A 49 -10.555 9.365 -16.096 1.00 0.00 H new ATOM 0 HA THR A 49 -11.805 6.867 -15.960 1.00 0.00 H new ATOM 0 HB THR A 49 -12.640 7.297 -13.789 1.00 0.00 H new ATOM 0 HG1 THR A 49 -14.892 8.427 -14.847 1.00 0.00 H new ATOM 0 HG21 THR A 49 -13.790 9.383 -13.144 1.00 0.00 H new ATOM 0 HG22 THR A 49 -12.122 9.732 -13.655 1.00 0.00 H new ATOM 0 HG23 THR A 49 -13.478 10.068 -14.756 1.00 0.00 H new ATOM 486 N ILE A 50 -12.413 7.723 -18.133 1.00 0.00 N ATOM 487 CA ILE A 50 -12.932 8.119 -19.432 1.00 0.00 C ATOM 488 C ILE A 50 -12.800 9.635 -19.588 1.00 0.00 C ATOM 489 O ILE A 50 -13.607 10.265 -20.271 1.00 0.00 O ATOM 490 CB ILE A 50 -14.360 7.603 -19.618 1.00 0.00 C ATOM 491 CG1 ILE A 50 -14.802 7.727 -21.077 1.00 0.00 C ATOM 492 CG2 ILE A 50 -15.326 8.308 -18.664 1.00 0.00 C ATOM 493 CD1 ILE A 50 -16.119 6.987 -21.316 1.00 0.00 C ATOM 0 H ILE A 50 -11.877 6.855 -18.134 1.00 0.00 H new ATOM 0 HA ILE A 50 -12.347 7.664 -20.231 1.00 0.00 H new ATOM 0 HB ILE A 50 -14.376 6.543 -19.366 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -14.920 8.779 -21.337 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -14.029 7.322 -21.730 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -16.334 7.923 -18.817 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -15.019 8.124 -17.634 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -15.314 9.380 -18.860 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -16.410 7.091 -22.361 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -15.991 5.931 -21.079 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -16.895 7.411 -20.679 1.00 0.00 H new ATOM 504 N GLY A 51 -11.777 10.178 -18.945 1.00 0.00 N ATOM 505 CA GLY A 51 -11.529 11.608 -19.003 1.00 0.00 C ATOM 506 C GLY A 51 -12.839 12.395 -18.922 1.00 0.00 C ATOM 507 O GLY A 51 -13.197 13.111 -19.855 1.00 0.00 O ATOM 0 H GLY A 51 -11.110 9.652 -18.381 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -10.873 11.901 -18.183 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -11.010 11.853 -19.929 1.00 0.00 H new ATOM 511 N ASN A 52 -13.518 12.235 -17.795 1.00 0.00 N ATOM 512 CA ASN A 52 -14.781 12.922 -17.579 1.00 0.00 C ATOM 513 C ASN A 52 -15.184 12.789 -16.109 1.00 0.00 C ATOM 514 O ASN A 52 -14.971 13.706 -15.317 1.00 0.00 O ATOM 515 CB ASN A 52 -15.893 12.310 -18.432 1.00 0.00 C ATOM 516 CG ASN A 52 -16.301 13.257 -19.564 1.00 0.00 C ATOM 517 OD1 ASN A 52 -15.842 13.153 -20.689 1.00 0.00 O ATOM 518 ND2 ASN A 52 -17.186 14.182 -19.203 1.00 0.00 N ATOM 0 H ASN A 52 -13.218 11.640 -17.022 1.00 0.00 H new ATOM 0 HA ASN A 52 -14.648 13.968 -17.856 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -15.555 11.362 -18.850 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -16.758 12.092 -17.806 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -17.521 14.861 -19.886 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -17.529 14.212 -18.243 1.00 0.00 H new ATOM 524 N PHE A 53 -15.759 11.639 -15.789 1.00 0.00 N ATOM 525 CA PHE A 53 -16.194 11.374 -14.428 1.00 0.00 C ATOM 526 C PHE A 53 -16.971 10.058 -14.348 1.00 0.00 C ATOM 527 O PHE A 53 -16.810 9.295 -13.396 1.00 0.00 O ATOM 528 CB PHE A 53 -17.118 12.524 -14.021 1.00 0.00 C ATOM 529 CG PHE A 53 -16.688 13.244 -12.741 1.00 0.00 C ATOM 530 CD1 PHE A 53 -15.370 13.471 -12.499 1.00 0.00 C ATOM 531 CD2 PHE A 53 -17.625 13.655 -11.845 1.00 0.00 C ATOM 532 CE1 PHE A 53 -14.971 14.139 -11.311 1.00 0.00 C ATOM 533 CE2 PHE A 53 -17.228 14.324 -10.658 1.00 0.00 C ATOM 534 CZ PHE A 53 -15.909 14.552 -10.415 1.00 0.00 C ATOM 0 H PHE A 53 -15.934 10.881 -16.448 1.00 0.00 H new ATOM 0 HA PHE A 53 -15.329 11.295 -13.769 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -17.162 13.247 -14.835 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -18.127 12.135 -13.886 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -14.626 13.143 -13.210 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -18.672 13.472 -12.037 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -13.924 14.319 -11.118 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -17.973 14.652 -9.948 1.00 0.00 H new ATOM 0 HZ PHE A 53 -15.606 15.060 -9.512 1.00 0.00 H new ATOM 543 N SER A 54 -17.797 9.833 -15.358 1.00 0.00 N ATOM 544 CA SER A 54 -18.600 8.623 -15.414 1.00 0.00 C ATOM 545 C SER A 54 -17.690 7.394 -15.464 1.00 0.00 C ATOM 546 O SER A 54 -16.531 7.491 -15.863 1.00 0.00 O ATOM 547 CB SER A 54 -19.538 8.639 -16.623 1.00 0.00 C ATOM 548 OG SER A 54 -20.904 8.755 -16.237 1.00 0.00 O ATOM 0 H SER A 54 -17.928 10.468 -16.145 1.00 0.00 H new ATOM 0 HA SER A 54 -19.213 8.577 -14.514 1.00 0.00 H new ATOM 0 HB2 SER A 54 -19.274 9.471 -17.276 1.00 0.00 H new ATOM 0 HB3 SER A 54 -19.401 7.725 -17.200 1.00 0.00 H new ATOM 0 HG SER A 54 -21.470 8.763 -17.037 1.00 0.00 H new ATOM 553 N GLY A 55 -18.251 6.266 -15.053 1.00 0.00 N ATOM 554 CA GLY A 55 -17.505 5.019 -15.046 1.00 0.00 C ATOM 555 C GLY A 55 -18.280 3.912 -15.762 1.00 0.00 C ATOM 556 O GLY A 55 -19.283 3.419 -15.248 1.00 0.00 O ATOM 0 H GLY A 55 -19.213 6.190 -14.723 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -16.541 5.165 -15.532 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -17.301 4.719 -14.018 1.00 0.00 H new ATOM 560 N PRO A 56 -17.773 3.543 -16.969 1.00 0.00 N ATOM 561 CA PRO A 56 -18.407 2.503 -17.761 1.00 0.00 C ATOM 562 C PRO A 56 -18.120 1.118 -17.178 1.00 0.00 C ATOM 563 O PRO A 56 -19.030 0.437 -16.707 1.00 0.00 O ATOM 564 CB PRO A 56 -17.852 2.683 -19.165 1.00 0.00 C ATOM 565 CG PRO A 56 -16.587 3.512 -19.009 1.00 0.00 C ATOM 566 CD PRO A 56 -16.587 4.104 -17.610 1.00 0.00 C ATOM 0 HA PRO A 56 -19.494 2.581 -17.764 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -17.633 1.719 -19.625 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -18.573 3.187 -19.808 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -15.703 2.892 -19.161 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -16.554 4.303 -19.758 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -15.680 3.837 -17.067 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -16.631 5.193 -17.641 1.00 0.00 H new ATOM 571 N TYR A 57 -16.851 0.741 -17.229 1.00 0.00 N ATOM 572 CA TYR A 57 -16.432 -0.551 -16.712 1.00 0.00 C ATOM 573 C TYR A 57 -15.956 -0.433 -15.263 1.00 0.00 C ATOM 574 O TYR A 57 -15.624 0.658 -14.801 1.00 0.00 O ATOM 575 CB TYR A 57 -15.258 -0.995 -17.587 1.00 0.00 C ATOM 576 CG TYR A 57 -14.192 0.084 -17.792 1.00 0.00 C ATOM 577 CD1 TYR A 57 -13.171 0.227 -16.875 1.00 0.00 C ATOM 578 CD2 TYR A 57 -14.251 0.912 -18.894 1.00 0.00 C ATOM 579 CE1 TYR A 57 -12.168 1.241 -17.068 1.00 0.00 C ATOM 580 CE2 TYR A 57 -13.248 1.926 -19.087 1.00 0.00 C ATOM 581 CZ TYR A 57 -12.255 2.041 -18.165 1.00 0.00 C ATOM 582 OH TYR A 57 -11.308 2.999 -18.348 1.00 0.00 O ATOM 0 H TYR A 57 -16.099 1.308 -17.621 1.00 0.00 H new ATOM 0 HA TYR A 57 -17.260 -1.259 -16.733 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -14.792 -1.871 -17.135 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -15.640 -1.304 -18.560 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -13.124 -0.422 -16.013 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -15.050 0.799 -19.612 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -11.364 1.364 -16.358 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -13.283 2.581 -19.945 1.00 0.00 H new ATOM 0 HH TYR A 57 -11.497 3.493 -19.173 1.00 0.00 H new ATOM 591 N THR A 58 -15.937 -1.571 -14.585 1.00 0.00 N ATOM 592 CA THR A 58 -15.507 -1.610 -13.197 1.00 0.00 C ATOM 593 C THR A 58 -13.980 -1.623 -13.113 1.00 0.00 C ATOM 594 O THR A 58 -13.351 -2.656 -13.339 1.00 0.00 O ATOM 595 CB THR A 58 -16.163 -2.822 -12.533 1.00 0.00 C ATOM 596 OG1 THR A 58 -17.558 -2.623 -12.749 1.00 0.00 O ATOM 597 CG2 THR A 58 -16.017 -2.805 -11.009 1.00 0.00 C ATOM 0 H THR A 58 -16.213 -2.474 -14.971 1.00 0.00 H new ATOM 0 HA THR A 58 -15.823 -0.716 -12.659 1.00 0.00 H new ATOM 0 HB THR A 58 -15.722 -3.736 -12.930 1.00 0.00 H new ATOM 0 HG1 THR A 58 -18.060 -3.365 -12.352 1.00 0.00 H new ATOM 0 HG21 THR A 58 -16.500 -3.687 -10.587 1.00 0.00 H new ATOM 0 HG22 THR A 58 -14.960 -2.809 -10.745 1.00 0.00 H new ATOM 0 HG23 THR A 58 -16.488 -1.907 -10.608 1.00 0.00 H new ATOM 605 N TYR A 59 -13.427 -0.464 -12.787 1.00 0.00 N ATOM 606 CA TYR A 59 -11.985 -0.329 -12.669 1.00 0.00 C ATOM 607 C TYR A 59 -11.562 -0.222 -11.203 1.00 0.00 C ATOM 608 O TYR A 59 -12.391 0.036 -10.331 1.00 0.00 O ATOM 609 CB TYR A 59 -11.622 0.972 -13.389 1.00 0.00 C ATOM 610 CG TYR A 59 -12.603 2.118 -13.132 1.00 0.00 C ATOM 611 CD1 TYR A 59 -12.813 2.570 -11.845 1.00 0.00 C ATOM 612 CD2 TYR A 59 -13.275 2.700 -14.187 1.00 0.00 C ATOM 613 CE1 TYR A 59 -13.735 3.649 -11.602 1.00 0.00 C ATOM 614 CE2 TYR A 59 -14.196 3.780 -13.944 1.00 0.00 C ATOM 615 CZ TYR A 59 -14.381 4.201 -12.665 1.00 0.00 C ATOM 616 OH TYR A 59 -15.252 5.220 -12.436 1.00 0.00 O ATOM 0 H TYR A 59 -13.952 0.391 -12.601 1.00 0.00 H new ATOM 0 HA TYR A 59 -11.483 -1.197 -13.096 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -10.625 1.283 -13.076 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -11.574 0.781 -14.461 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -12.286 2.114 -11.020 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -13.111 2.346 -15.194 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -13.910 4.012 -10.600 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -14.728 4.245 -14.760 1.00 0.00 H new ATOM 0 HH TYR A 59 -15.456 5.672 -13.281 1.00 0.00 H new ATOM 625 N CYS A 60 -10.272 -0.424 -10.976 1.00 0.00 N ATOM 626 CA CYS A 60 -9.730 -0.353 -9.630 1.00 0.00 C ATOM 627 C CYS A 60 -10.143 0.985 -9.016 1.00 0.00 C ATOM 628 O CYS A 60 -10.518 1.912 -9.731 1.00 0.00 O ATOM 629 CB CYS A 60 -8.211 -0.540 -9.622 1.00 0.00 C ATOM 630 SG CYS A 60 -7.596 -1.874 -10.713 1.00 0.00 S ATOM 0 H CYS A 60 -9.587 -0.637 -11.701 1.00 0.00 H new ATOM 0 HA CYS A 60 -10.134 -1.167 -9.029 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -7.742 0.398 -9.919 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -7.890 -0.748 -8.601 1.00 0.00 H new ATOM 634 N ASN A 61 -10.060 1.043 -7.694 1.00 0.00 N ATOM 635 CA ASN A 61 -10.421 2.253 -6.975 1.00 0.00 C ATOM 636 C ASN A 61 -9.153 2.921 -6.438 1.00 0.00 C ATOM 637 O ASN A 61 -8.070 2.340 -6.496 1.00 0.00 O ATOM 638 CB ASN A 61 -11.328 1.936 -5.784 1.00 0.00 C ATOM 639 CG ASN A 61 -12.008 3.203 -5.260 1.00 0.00 C ATOM 640 OD1 ASN A 61 -11.635 3.763 -4.241 1.00 0.00 O ATOM 641 ND2 ASN A 61 -13.022 3.622 -6.010 1.00 0.00 N ATOM 0 H ASN A 61 -9.748 0.272 -7.103 1.00 0.00 H new ATOM 0 HA ASN A 61 -10.949 2.910 -7.666 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -12.084 1.210 -6.081 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -10.742 1.478 -4.988 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -13.540 4.459 -5.745 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -13.282 3.106 -6.851 1.00 0.00 H new ATOM 647 N THR A 62 -9.330 4.131 -5.928 1.00 0.00 N ATOM 648 CA THR A 62 -8.212 4.883 -5.381 1.00 0.00 C ATOM 649 C THR A 62 -8.226 4.822 -3.853 1.00 0.00 C ATOM 650 O THR A 62 -9.278 4.968 -3.232 1.00 0.00 O ATOM 651 CB THR A 62 -8.286 6.307 -5.935 1.00 0.00 C ATOM 652 OG1 THR A 62 -7.000 6.855 -5.658 1.00 0.00 O ATOM 653 CG2 THR A 62 -9.248 7.194 -5.140 1.00 0.00 C ATOM 0 H THR A 62 -10.230 4.609 -5.882 1.00 0.00 H new ATOM 0 HA THR A 62 -7.258 4.451 -5.682 1.00 0.00 H new ATOM 0 HB THR A 62 -8.599 6.275 -6.979 1.00 0.00 H new ATOM 0 HG1 THR A 62 -6.960 7.778 -5.986 1.00 0.00 H new ATOM 0 HG21 THR A 62 -9.264 8.194 -5.574 1.00 0.00 H new ATOM 0 HG22 THR A 62 -10.250 6.767 -5.176 1.00 0.00 H new ATOM 0 HG23 THR A 62 -8.916 7.254 -4.104 1.00 0.00 H new ATOM 661 N THR A 63 -7.046 4.607 -3.291 1.00 0.00 N ATOM 662 CA THR A 63 -6.908 4.526 -1.846 1.00 0.00 C ATOM 663 C THR A 63 -5.526 3.988 -1.472 1.00 0.00 C ATOM 664 O THR A 63 -4.853 3.370 -2.295 1.00 0.00 O ATOM 665 CB THR A 63 -8.058 3.671 -1.310 1.00 0.00 C ATOM 666 OG1 THR A 63 -8.852 4.588 -0.562 1.00 0.00 O ATOM 667 CG2 THR A 63 -7.592 2.649 -0.271 1.00 0.00 C ATOM 0 H THR A 63 -6.176 4.486 -3.810 1.00 0.00 H new ATOM 0 HA THR A 63 -6.974 5.512 -1.386 1.00 0.00 H new ATOM 0 HB THR A 63 -8.542 3.153 -2.138 1.00 0.00 H new ATOM 0 HG1 THR A 63 -9.382 5.138 -1.176 1.00 0.00 H new ATOM 0 HG21 THR A 63 -8.446 2.069 0.077 1.00 0.00 H new ATOM 0 HG22 THR A 63 -6.858 1.981 -0.722 1.00 0.00 H new ATOM 0 HG23 THR A 63 -7.139 3.169 0.573 1.00 0.00 H new ATOM 675 N LEU A 64 -5.143 4.244 -0.230 1.00 0.00 N ATOM 676 CA LEU A 64 -3.854 3.794 0.264 1.00 0.00 C ATOM 677 C LEU A 64 -4.066 2.865 1.461 1.00 0.00 C ATOM 678 O LEU A 64 -4.947 3.101 2.286 1.00 0.00 O ATOM 679 CB LEU A 64 -2.948 4.991 0.568 1.00 0.00 C ATOM 680 CG LEU A 64 -3.244 5.742 1.868 1.00 0.00 C ATOM 681 CD1 LEU A 64 -4.678 6.275 1.880 1.00 0.00 C ATOM 682 CD2 LEU A 64 -2.947 4.866 3.086 1.00 0.00 C ATOM 0 H LEU A 64 -5.704 4.758 0.449 1.00 0.00 H new ATOM 0 HA LEU A 64 -3.335 3.216 -0.501 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -1.916 4.642 0.600 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -3.020 5.696 -0.260 1.00 0.00 H new ATOM 0 HG LEU A 64 -2.581 6.605 1.923 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -4.862 6.804 2.815 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -4.819 6.958 1.042 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -5.376 5.443 1.791 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -3.166 5.423 3.997 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -3.568 3.971 3.050 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -1.896 4.579 3.080 1.00 0.00 H new ATOM 693 N ASP A 65 -3.244 1.828 1.518 1.00 0.00 N ATOM 694 CA ASP A 65 -3.331 0.862 2.599 1.00 0.00 C ATOM 695 C ASP A 65 -2.199 -0.158 2.460 1.00 0.00 C ATOM 696 O ASP A 65 -2.380 -1.337 2.760 1.00 0.00 O ATOM 697 CB ASP A 65 -4.659 0.103 2.555 1.00 0.00 C ATOM 698 CG ASP A 65 -5.395 0.009 3.893 1.00 0.00 C ATOM 699 OD1 ASP A 65 -6.069 1.003 4.241 1.00 0.00 O ATOM 700 OD2 ASP A 65 -5.267 -1.054 4.538 1.00 0.00 O ATOM 0 H ASP A 65 -2.514 1.636 0.832 1.00 0.00 H new ATOM 0 HA ASP A 65 -3.257 1.405 3.541 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -5.314 0.588 1.831 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -4.471 -0.906 2.189 1.00 0.00 H new ATOM 704 N GLN A 66 -1.056 0.333 2.003 1.00 0.00 N ATOM 705 CA GLN A 66 0.105 -0.521 1.820 1.00 0.00 C ATOM 706 C GLN A 66 1.297 0.028 2.608 1.00 0.00 C ATOM 707 O GLN A 66 1.631 -0.487 3.674 1.00 0.00 O ATOM 708 CB GLN A 66 0.450 -0.666 0.337 1.00 0.00 C ATOM 709 CG GLN A 66 -0.260 -1.877 -0.273 1.00 0.00 C ATOM 710 CD GLN A 66 -1.780 -1.723 -0.190 1.00 0.00 C ATOM 711 OE1 GLN A 66 -2.453 -2.366 0.599 1.00 0.00 O ATOM 712 NE2 GLN A 66 -2.281 -0.836 -1.045 1.00 0.00 N ATOM 0 H GLN A 66 -0.909 1.311 1.754 1.00 0.00 H new ATOM 0 HA GLN A 66 -0.134 -1.513 2.203 1.00 0.00 H new ATOM 0 HB2 GLN A 66 0.160 0.238 -0.198 1.00 0.00 H new ATOM 0 HB3 GLN A 66 1.528 -0.774 0.219 1.00 0.00 H new ATOM 0 HG2 GLN A 66 0.041 -1.992 -1.314 1.00 0.00 H new ATOM 0 HG3 GLN A 66 0.046 -2.783 0.250 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -1.661 -0.332 -1.679 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -3.285 -0.660 -1.067 1.00 0.00 H new ATOM 719 N ILE A 67 1.905 1.066 2.053 1.00 0.00 N ATOM 720 CA ILE A 67 3.053 1.690 2.690 1.00 0.00 C ATOM 721 C ILE A 67 2.954 3.208 2.533 1.00 0.00 C ATOM 722 O ILE A 67 3.963 3.882 2.331 1.00 0.00 O ATOM 723 CB ILE A 67 4.354 1.099 2.146 1.00 0.00 C ATOM 724 CG1 ILE A 67 4.264 0.871 0.635 1.00 0.00 C ATOM 725 CG2 ILE A 67 4.734 -0.179 2.896 1.00 0.00 C ATOM 726 CD1 ILE A 67 5.519 1.385 -0.074 1.00 0.00 C ATOM 0 H ILE A 67 1.625 1.491 1.169 1.00 0.00 H new ATOM 0 HA ILE A 67 3.057 1.479 3.759 1.00 0.00 H new ATOM 0 HB ILE A 67 5.153 1.821 2.316 1.00 0.00 H new ATOM 0 HG12 ILE A 67 4.137 -0.192 0.431 1.00 0.00 H new ATOM 0 HG13 ILE A 67 3.385 1.379 0.239 1.00 0.00 H new ATOM 0 HG21 ILE A 67 5.663 -0.578 2.488 1.00 0.00 H new ATOM 0 HG22 ILE A 67 4.869 0.046 3.954 1.00 0.00 H new ATOM 0 HG23 ILE A 67 3.941 -0.918 2.781 1.00 0.00 H new ATOM 0 HD11 ILE A 67 5.428 1.210 -1.146 1.00 0.00 H new ATOM 0 HD12 ILE A 67 5.630 2.453 0.112 1.00 0.00 H new ATOM 0 HD13 ILE A 67 6.394 0.858 0.307 1.00 0.00 H new ATOM 737 N GLY A 68 1.728 3.704 2.634 1.00 0.00 N ATOM 738 CA GLY A 68 1.485 5.130 2.506 1.00 0.00 C ATOM 739 C GLY A 68 1.266 5.521 1.044 1.00 0.00 C ATOM 740 O GLY A 68 0.449 6.389 0.744 1.00 0.00 O ATOM 0 H GLY A 68 0.893 3.143 2.803 1.00 0.00 H new ATOM 0 HA2 GLY A 68 0.611 5.408 3.095 1.00 0.00 H new ATOM 0 HA3 GLY A 68 2.332 5.684 2.911 1.00 0.00 H new ATOM 744 N THR A 69 2.013 4.860 0.171 1.00 0.00 N ATOM 745 CA THR A 69 1.911 5.128 -1.254 1.00 0.00 C ATOM 746 C THR A 69 0.466 4.960 -1.727 1.00 0.00 C ATOM 747 O THR A 69 -0.068 3.852 -1.723 1.00 0.00 O ATOM 748 CB THR A 69 2.898 4.210 -1.979 1.00 0.00 C ATOM 749 OG1 THR A 69 4.169 4.806 -1.738 1.00 0.00 O ATOM 750 CG2 THR A 69 2.741 4.266 -3.500 1.00 0.00 C ATOM 0 H THR A 69 2.691 4.140 0.423 1.00 0.00 H new ATOM 0 HA THR A 69 2.176 6.160 -1.482 1.00 0.00 H new ATOM 0 HB THR A 69 2.757 3.184 -1.638 1.00 0.00 H new ATOM 0 HG1 THR A 69 4.868 4.273 -2.172 1.00 0.00 H new ATOM 0 HG21 THR A 69 3.465 3.597 -3.965 1.00 0.00 H new ATOM 0 HG22 THR A 69 1.732 3.956 -3.773 1.00 0.00 H new ATOM 0 HG23 THR A 69 2.914 5.285 -3.846 1.00 0.00 H new ATOM 758 N CYS A 70 -0.127 6.077 -2.121 1.00 0.00 N ATOM 759 CA CYS A 70 -1.500 6.068 -2.595 1.00 0.00 C ATOM 760 C CYS A 70 -1.505 5.580 -4.045 1.00 0.00 C ATOM 761 O CYS A 70 -0.631 5.945 -4.830 1.00 0.00 O ATOM 762 CB CYS A 70 -2.156 7.443 -2.454 1.00 0.00 C ATOM 763 SG CYS A 70 -3.455 7.805 -3.692 1.00 0.00 S ATOM 0 H CYS A 70 0.318 6.995 -2.122 1.00 0.00 H new ATOM 0 HA CYS A 70 -2.094 5.390 -1.982 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -2.591 7.522 -1.458 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -1.383 8.208 -2.525 1.00 0.00 H new ATOM 767 N TRP A 71 -2.499 4.760 -4.356 1.00 0.00 N ATOM 768 CA TRP A 71 -2.629 4.218 -5.698 1.00 0.00 C ATOM 769 C TRP A 71 -3.951 4.717 -6.284 1.00 0.00 C ATOM 770 O TRP A 71 -5.023 4.382 -5.782 1.00 0.00 O ATOM 771 CB TRP A 71 -2.519 2.693 -5.685 1.00 0.00 C ATOM 772 CG TRP A 71 -1.611 2.143 -4.584 1.00 0.00 C ATOM 773 CD1 TRP A 71 -1.869 2.046 -3.273 1.00 0.00 C ATOM 774 CD2 TRP A 71 -0.279 1.614 -4.753 1.00 0.00 C ATOM 775 NE1 TRP A 71 -0.806 1.496 -2.586 1.00 0.00 N ATOM 776 CE2 TRP A 71 0.192 1.225 -3.515 1.00 0.00 C ATOM 777 CE3 TRP A 71 0.503 1.469 -5.912 1.00 0.00 C ATOM 778 CZ2 TRP A 71 1.461 0.667 -3.318 1.00 0.00 C ATOM 779 CZ3 TRP A 71 1.768 0.909 -5.699 1.00 0.00 C ATOM 780 CH2 TRP A 71 2.257 0.512 -4.460 1.00 0.00 C ATOM 0 H TRP A 71 -3.221 4.458 -3.702 1.00 0.00 H new ATOM 0 HA TRP A 71 -1.814 4.564 -6.334 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -3.516 2.268 -5.565 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -2.144 2.358 -6.652 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -2.794 2.359 -2.811 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -0.761 1.321 -1.582 1.00 0.00 H new ATOM 0 HE3 TRP A 71 0.155 1.766 -6.890 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 1.807 0.372 -2.338 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 2.409 0.776 -6.558 1.00 0.00 H new ATOM 0 HH2 TRP A 71 3.246 0.086 -4.378 1.00 0.00 H new ATOM 790 N PRO A 72 -3.829 5.532 -7.366 1.00 0.00 N ATOM 791 CA PRO A 72 -5.001 6.082 -8.026 1.00 0.00 C ATOM 792 C PRO A 72 -5.708 5.015 -8.865 1.00 0.00 C ATOM 793 O PRO A 72 -5.073 4.082 -9.353 1.00 0.00 O ATOM 794 CB PRO A 72 -4.478 7.240 -8.858 1.00 0.00 C ATOM 795 CG PRO A 72 -2.982 7.011 -8.999 1.00 0.00 C ATOM 796 CD PRO A 72 -2.576 5.950 -7.988 1.00 0.00 C ATOM 0 HA PRO A 72 -5.758 6.426 -7.321 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -4.962 7.269 -9.834 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -4.683 8.194 -8.372 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -2.739 6.687 -10.011 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -2.435 7.937 -8.821 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -2.076 5.112 -8.473 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -1.882 6.352 -7.250 1.00 0.00 H new ATOM 801 N GLN A 73 -7.014 5.188 -9.008 1.00 0.00 N ATOM 802 CA GLN A 73 -7.814 4.252 -9.780 1.00 0.00 C ATOM 803 C GLN A 73 -7.025 3.756 -10.994 1.00 0.00 C ATOM 804 O GLN A 73 -6.153 4.459 -11.501 1.00 0.00 O ATOM 805 CB GLN A 73 -9.138 4.887 -10.208 1.00 0.00 C ATOM 806 CG GLN A 73 -10.045 5.132 -9.000 1.00 0.00 C ATOM 807 CD GLN A 73 -11.519 4.973 -9.380 1.00 0.00 C ATOM 808 OE1 GLN A 73 -12.284 4.281 -8.729 1.00 0.00 O ATOM 809 NE2 GLN A 73 -11.873 5.653 -10.468 1.00 0.00 N ATOM 0 H GLN A 73 -7.538 5.963 -8.602 1.00 0.00 H new ATOM 0 HA GLN A 73 -8.048 3.395 -9.148 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -8.945 5.830 -10.719 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -9.644 4.236 -10.921 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -9.793 4.431 -8.204 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -9.873 6.135 -8.609 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -11.182 6.214 -10.966 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -12.835 5.614 -10.803 1.00 0.00 H new ATOM 816 N SER A 74 -7.362 2.549 -11.425 1.00 0.00 N ATOM 817 CA SER A 74 -6.698 1.951 -12.569 1.00 0.00 C ATOM 818 C SER A 74 -7.603 0.896 -13.208 1.00 0.00 C ATOM 819 O SER A 74 -8.616 0.508 -12.627 1.00 0.00 O ATOM 820 CB SER A 74 -5.359 1.328 -12.166 1.00 0.00 C ATOM 821 OG SER A 74 -4.770 2.002 -11.057 1.00 0.00 O ATOM 0 H SER A 74 -8.087 1.969 -11.002 1.00 0.00 H new ATOM 0 HA SER A 74 -6.498 2.737 -13.297 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.509 0.278 -11.915 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.675 1.358 -13.014 1.00 0.00 H new ATOM 0 HG SER A 74 -3.794 1.937 -11.115 1.00 0.00 H new ATOM 826 N ALA A 75 -7.205 0.460 -14.394 1.00 0.00 N ATOM 827 CA ALA A 75 -7.968 -0.542 -15.118 1.00 0.00 C ATOM 828 C ALA A 75 -7.777 -1.905 -14.446 1.00 0.00 C ATOM 829 O ALA A 75 -6.764 -2.140 -13.789 1.00 0.00 O ATOM 830 CB ALA A 75 -7.537 -0.551 -16.586 1.00 0.00 C ATOM 0 H ALA A 75 -6.364 0.783 -14.872 1.00 0.00 H new ATOM 0 HA ALA A 75 -9.032 -0.307 -15.092 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -8.110 -1.303 -17.129 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -7.719 0.430 -17.025 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -6.475 -0.787 -16.652 1.00 0.00 H new ATOM 836 N PRO A 76 -8.793 -2.788 -14.640 1.00 0.00 N ATOM 837 CA PRO A 76 -8.747 -4.120 -14.061 1.00 0.00 C ATOM 838 C PRO A 76 -7.774 -5.017 -14.828 1.00 0.00 C ATOM 839 O PRO A 76 -7.575 -4.841 -16.029 1.00 0.00 O ATOM 840 CB PRO A 76 -10.182 -4.620 -14.111 1.00 0.00 C ATOM 841 CG PRO A 76 -10.892 -3.747 -15.132 1.00 0.00 C ATOM 842 CD PRO A 76 -10.008 -2.543 -15.413 1.00 0.00 C ATOM 0 HA PRO A 76 -8.374 -4.121 -13.037 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -10.220 -5.670 -14.401 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -10.657 -4.542 -13.133 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -11.077 -4.306 -16.049 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -11.862 -3.427 -14.752 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -9.789 -2.452 -16.477 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -10.492 -1.616 -15.107 1.00 0.00 H new ATOM 847 N GLY A 77 -7.192 -5.961 -14.103 1.00 0.00 N ATOM 848 CA GLY A 77 -6.245 -6.887 -14.699 1.00 0.00 C ATOM 849 C GLY A 77 -5.025 -6.145 -15.249 1.00 0.00 C ATOM 850 O GLY A 77 -4.735 -6.216 -16.442 1.00 0.00 O ATOM 0 H GLY A 77 -7.359 -6.104 -13.107 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -5.926 -7.616 -13.954 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -6.730 -7.442 -15.502 1.00 0.00 H new ATOM 854 N ALA A 78 -4.342 -5.448 -14.352 1.00 0.00 N ATOM 855 CA ALA A 78 -3.161 -4.693 -14.732 1.00 0.00 C ATOM 856 C ALA A 78 -2.072 -4.893 -13.676 1.00 0.00 C ATOM 857 O ALA A 78 -2.166 -5.796 -12.846 1.00 0.00 O ATOM 858 CB ALA A 78 -3.532 -3.220 -14.915 1.00 0.00 C ATOM 0 H ALA A 78 -4.585 -5.391 -13.363 1.00 0.00 H new ATOM 0 HA ALA A 78 -2.768 -5.050 -15.684 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -2.645 -2.654 -15.200 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -4.287 -3.129 -15.696 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -3.929 -2.826 -13.979 1.00 0.00 H new ATOM 864 N LEU A 79 -1.064 -4.035 -13.741 1.00 0.00 N ATOM 865 CA LEU A 79 0.041 -4.106 -12.802 1.00 0.00 C ATOM 866 C LEU A 79 0.383 -2.698 -12.313 1.00 0.00 C ATOM 867 O LEU A 79 0.995 -1.917 -13.040 1.00 0.00 O ATOM 868 CB LEU A 79 1.227 -4.845 -13.425 1.00 0.00 C ATOM 869 CG LEU A 79 1.759 -6.046 -12.639 1.00 0.00 C ATOM 870 CD1 LEU A 79 2.165 -5.637 -11.222 1.00 0.00 C ATOM 871 CD2 LEU A 79 0.744 -7.191 -12.637 1.00 0.00 C ATOM 0 H LEU A 79 -0.990 -3.287 -14.430 1.00 0.00 H new ATOM 0 HA LEU A 79 -0.243 -4.687 -11.925 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.935 -5.187 -14.418 1.00 0.00 H new ATOM 0 HB3 LEU A 79 2.042 -4.134 -13.559 1.00 0.00 H new ATOM 0 HG LEU A 79 2.657 -6.412 -13.138 1.00 0.00 H new ATOM 0 HD11 LEU A 79 2.539 -6.508 -10.685 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.946 -4.878 -11.272 1.00 0.00 H new ATOM 0 HD13 LEU A 79 1.299 -5.232 -10.698 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.146 -8.032 -12.072 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -0.184 -6.854 -12.175 1.00 0.00 H new ATOM 0 HD23 LEU A 79 0.546 -7.504 -13.662 1.00 0.00 H new ATOM 882 N VAL A 80 -0.031 -2.415 -11.086 1.00 0.00 N ATOM 883 CA VAL A 80 0.224 -1.113 -10.492 1.00 0.00 C ATOM 884 C VAL A 80 1.484 -1.188 -9.628 1.00 0.00 C ATOM 885 O VAL A 80 1.426 -0.965 -8.420 1.00 0.00 O ATOM 886 CB VAL A 80 -1.008 -0.643 -9.715 1.00 0.00 C ATOM 887 CG1 VAL A 80 -0.650 0.493 -8.756 1.00 0.00 C ATOM 888 CG2 VAL A 80 -2.130 -0.226 -10.666 1.00 0.00 C ATOM 0 H VAL A 80 -0.541 -3.065 -10.487 1.00 0.00 H new ATOM 0 HA VAL A 80 0.407 -0.369 -11.267 1.00 0.00 H new ATOM 0 HB VAL A 80 -1.369 -1.482 -9.120 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -1.543 0.809 -8.216 1.00 0.00 H new ATOM 0 HG12 VAL A 80 0.100 0.146 -8.045 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -0.252 1.335 -9.322 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -2.993 0.104 -10.088 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -1.785 0.591 -11.300 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -2.413 -1.074 -11.289 1.00 0.00 H new ATOM 898 N GLU A 81 2.593 -1.504 -10.281 1.00 0.00 N ATOM 899 CA GLU A 81 3.864 -1.612 -9.587 1.00 0.00 C ATOM 900 C GLU A 81 4.673 -0.324 -9.759 1.00 0.00 C ATOM 901 O GLU A 81 4.463 0.423 -10.713 1.00 0.00 O ATOM 902 CB GLU A 81 4.656 -2.826 -10.077 1.00 0.00 C ATOM 903 CG GLU A 81 5.098 -2.641 -11.531 1.00 0.00 C ATOM 904 CD GLU A 81 5.568 -3.967 -12.133 1.00 0.00 C ATOM 905 OE1 GLU A 81 6.391 -4.632 -11.468 1.00 0.00 O ATOM 906 OE2 GLU A 81 5.094 -4.285 -13.245 1.00 0.00 O ATOM 0 H GLU A 81 2.637 -1.689 -11.283 1.00 0.00 H new ATOM 0 HA GLU A 81 3.665 -1.755 -8.525 1.00 0.00 H new ATOM 0 HB2 GLU A 81 5.530 -2.974 -9.443 1.00 0.00 H new ATOM 0 HB3 GLU A 81 4.044 -3.724 -9.991 1.00 0.00 H new ATOM 0 HG2 GLU A 81 4.271 -2.243 -12.119 1.00 0.00 H new ATOM 0 HG3 GLU A 81 5.904 -1.909 -11.580 1.00 0.00 H new ATOM 911 N ARG A 82 5.582 -0.104 -8.820 1.00 0.00 N ATOM 912 CA ARG A 82 6.423 1.080 -8.855 1.00 0.00 C ATOM 913 C ARG A 82 7.637 0.895 -7.943 1.00 0.00 C ATOM 914 O ARG A 82 7.543 0.251 -6.900 1.00 0.00 O ATOM 915 CB ARG A 82 5.646 2.322 -8.413 1.00 0.00 C ATOM 916 CG ARG A 82 4.894 2.062 -7.107 1.00 0.00 C ATOM 917 CD ARG A 82 3.877 3.170 -6.830 1.00 0.00 C ATOM 918 NE ARG A 82 2.856 3.200 -7.901 1.00 0.00 N ATOM 919 CZ ARG A 82 2.958 3.938 -9.015 1.00 0.00 C ATOM 920 NH1 ARG A 82 4.036 4.710 -9.211 1.00 0.00 N ATOM 921 NH2 ARG A 82 1.983 3.903 -9.934 1.00 0.00 N ATOM 0 H ARG A 82 5.754 -0.726 -8.030 1.00 0.00 H new ATOM 0 HA ARG A 82 6.755 1.221 -9.884 1.00 0.00 H new ATOM 0 HB2 ARG A 82 6.333 3.157 -8.281 1.00 0.00 H new ATOM 0 HB3 ARG A 82 4.940 2.610 -9.192 1.00 0.00 H new ATOM 0 HG2 ARG A 82 4.384 1.101 -7.162 1.00 0.00 H new ATOM 0 HG3 ARG A 82 5.603 1.999 -6.281 1.00 0.00 H new ATOM 0 HD2 ARG A 82 3.399 3.003 -5.865 1.00 0.00 H new ATOM 0 HD3 ARG A 82 4.383 4.133 -6.772 1.00 0.00 H new ATOM 0 HE ARG A 82 2.023 2.623 -7.784 1.00 0.00 H new ATOM 0 HH11 ARG A 82 4.779 4.736 -8.512 1.00 0.00 H new ATOM 0 HH12 ARG A 82 4.114 5.272 -10.059 1.00 0.00 H new ATOM 0 HH21 ARG A 82 1.163 3.315 -9.786 1.00 0.00 H new ATOM 0 HH22 ARG A 82 2.061 4.465 -10.782 1.00 0.00 H new ATOM 932 N PRO A 83 8.780 1.489 -8.381 1.00 0.00 N ATOM 933 CA PRO A 83 10.012 1.397 -7.615 1.00 0.00 C ATOM 934 C PRO A 83 9.966 2.311 -6.390 1.00 0.00 C ATOM 935 O PRO A 83 9.720 3.510 -6.515 1.00 0.00 O ATOM 936 CB PRO A 83 11.113 1.771 -8.595 1.00 0.00 C ATOM 937 CG PRO A 83 10.425 2.505 -9.734 1.00 0.00 C ATOM 938 CD PRO A 83 8.930 2.260 -9.612 1.00 0.00 C ATOM 0 HA PRO A 83 10.181 0.400 -7.208 1.00 0.00 H new ATOM 0 HB2 PRO A 83 11.862 2.404 -8.118 1.00 0.00 H new ATOM 0 HB3 PRO A 83 11.631 0.883 -8.959 1.00 0.00 H new ATOM 0 HG2 PRO A 83 10.642 3.572 -9.686 1.00 0.00 H new ATOM 0 HG3 PRO A 83 10.793 2.148 -10.696 1.00 0.00 H new ATOM 0 HD2 PRO A 83 8.378 3.198 -9.561 1.00 0.00 H new ATOM 0 HD3 PRO A 83 8.547 1.711 -10.472 1.00 0.00 H new ATOM 943 N CYS A 84 10.207 1.710 -5.233 1.00 0.00 N ATOM 944 CA CYS A 84 10.195 2.456 -3.987 1.00 0.00 C ATOM 945 C CYS A 84 10.923 3.783 -4.214 1.00 0.00 C ATOM 946 O CYS A 84 12.151 3.821 -4.267 1.00 0.00 O ATOM 947 CB CYS A 84 10.816 1.654 -2.842 1.00 0.00 C ATOM 948 SG CYS A 84 10.062 0.010 -2.559 1.00 0.00 S ATOM 0 H CYS A 84 10.411 0.716 -5.133 1.00 0.00 H new ATOM 0 HA CYS A 84 9.165 2.654 -3.689 1.00 0.00 H new ATOM 0 HB2 CYS A 84 11.879 1.521 -3.045 1.00 0.00 H new ATOM 0 HB3 CYS A 84 10.737 2.237 -1.924 1.00 0.00 H new ATOM 952 N PRO A 85 10.113 4.867 -4.345 1.00 0.00 N ATOM 953 CA PRO A 85 10.666 6.193 -4.565 1.00 0.00 C ATOM 954 C PRO A 85 11.270 6.756 -3.276 1.00 0.00 C ATOM 955 O PRO A 85 11.194 6.124 -2.223 1.00 0.00 O ATOM 956 CB PRO A 85 9.505 7.022 -5.088 1.00 0.00 C ATOM 957 CG PRO A 85 8.245 6.264 -4.704 1.00 0.00 C ATOM 958 CD PRO A 85 8.654 4.861 -4.287 1.00 0.00 C ATOM 0 HA PRO A 85 11.490 6.192 -5.278 1.00 0.00 H new ATOM 0 HB2 PRO A 85 9.509 8.020 -4.650 1.00 0.00 H new ATOM 0 HB3 PRO A 85 9.571 7.148 -6.169 1.00 0.00 H new ATOM 0 HG2 PRO A 85 7.729 6.770 -3.888 1.00 0.00 H new ATOM 0 HG3 PRO A 85 7.552 6.226 -5.544 1.00 0.00 H new ATOM 0 HD2 PRO A 85 8.299 4.627 -3.284 1.00 0.00 H new ATOM 0 HD3 PRO A 85 8.234 4.111 -4.957 1.00 0.00 H new ATOM 963 N GLU A 86 11.855 7.938 -3.401 1.00 0.00 N ATOM 964 CA GLU A 86 12.472 8.592 -2.260 1.00 0.00 C ATOM 965 C GLU A 86 11.399 9.068 -1.278 1.00 0.00 C ATOM 966 O GLU A 86 10.218 9.119 -1.620 1.00 0.00 O ATOM 967 CB GLU A 86 13.359 9.756 -2.709 1.00 0.00 C ATOM 968 CG GLU A 86 12.541 10.816 -3.450 1.00 0.00 C ATOM 969 CD GLU A 86 12.073 11.915 -2.495 1.00 0.00 C ATOM 970 OE1 GLU A 86 12.891 12.303 -1.632 1.00 0.00 O ATOM 971 OE2 GLU A 86 10.910 12.345 -2.650 1.00 0.00 O ATOM 0 H GLU A 86 11.915 8.460 -4.275 1.00 0.00 H new ATOM 0 HA GLU A 86 13.108 7.868 -1.751 1.00 0.00 H new ATOM 0 HB2 GLU A 86 13.842 10.205 -1.841 1.00 0.00 H new ATOM 0 HB3 GLU A 86 14.152 9.384 -3.358 1.00 0.00 H new ATOM 0 HG2 GLU A 86 13.143 11.254 -4.246 1.00 0.00 H new ATOM 0 HG3 GLU A 86 11.677 10.349 -3.923 1.00 0.00 H new ATOM 976 N TYR A 87 11.847 9.404 -0.078 1.00 0.00 N ATOM 977 CA TYR A 87 10.942 9.873 0.956 1.00 0.00 C ATOM 978 C TYR A 87 9.748 8.927 1.109 1.00 0.00 C ATOM 979 O TYR A 87 8.597 9.360 1.056 1.00 0.00 O ATOM 980 CB TYR A 87 10.437 11.240 0.486 1.00 0.00 C ATOM 981 CG TYR A 87 9.337 11.834 1.369 1.00 0.00 C ATOM 982 CD1 TYR A 87 9.557 12.010 2.720 1.00 0.00 C ATOM 983 CD2 TYR A 87 8.127 12.195 0.814 1.00 0.00 C ATOM 984 CE1 TYR A 87 8.523 12.570 3.551 1.00 0.00 C ATOM 985 CE2 TYR A 87 7.092 12.754 1.644 1.00 0.00 C ATOM 986 CZ TYR A 87 7.341 12.914 2.972 1.00 0.00 C ATOM 987 OH TYR A 87 6.364 13.442 3.756 1.00 0.00 O ATOM 0 H TYR A 87 12.827 9.361 0.202 1.00 0.00 H new ATOM 0 HA TYR A 87 11.451 9.923 1.918 1.00 0.00 H new ATOM 0 HB2 TYR A 87 11.277 11.934 0.453 1.00 0.00 H new ATOM 0 HB3 TYR A 87 10.060 11.146 -0.533 1.00 0.00 H new ATOM 0 HD1 TYR A 87 10.505 11.728 3.154 1.00 0.00 H new ATOM 0 HD2 TYR A 87 7.956 12.058 -0.244 1.00 0.00 H new ATOM 0 HE1 TYR A 87 8.682 12.714 4.610 1.00 0.00 H new ATOM 0 HE2 TYR A 87 6.140 13.040 1.222 1.00 0.00 H new ATOM 0 HH TYR A 87 5.576 13.641 3.208 1.00 0.00 H new ATOM 996 N PHE A 88 10.062 7.654 1.297 1.00 0.00 N ATOM 997 CA PHE A 88 9.030 6.645 1.457 1.00 0.00 C ATOM 998 C PHE A 88 9.179 5.916 2.794 1.00 0.00 C ATOM 999 O PHE A 88 8.206 5.745 3.525 1.00 0.00 O ATOM 1000 CB PHE A 88 9.208 5.638 0.320 1.00 0.00 C ATOM 1001 CG PHE A 88 10.457 4.764 0.451 1.00 0.00 C ATOM 1002 CD1 PHE A 88 11.683 5.285 0.180 1.00 0.00 C ATOM 1003 CD2 PHE A 88 10.341 3.465 0.838 1.00 0.00 C ATOM 1004 CE1 PHE A 88 12.843 4.474 0.302 1.00 0.00 C ATOM 1005 CE2 PHE A 88 11.500 2.655 0.961 1.00 0.00 C ATOM 1006 CZ PHE A 88 12.726 3.176 0.690 1.00 0.00 C ATOM 0 H PHE A 88 11.017 7.298 1.342 1.00 0.00 H new ATOM 0 HA PHE A 88 8.046 7.113 1.436 1.00 0.00 H new ATOM 0 HB2 PHE A 88 8.330 4.994 0.278 1.00 0.00 H new ATOM 0 HB3 PHE A 88 9.253 6.178 -0.626 1.00 0.00 H new ATOM 0 HD1 PHE A 88 11.775 6.316 -0.128 1.00 0.00 H new ATOM 0 HD2 PHE A 88 9.367 3.050 1.052 1.00 0.00 H new ATOM 0 HE1 PHE A 88 13.817 4.888 0.087 1.00 0.00 H new ATOM 0 HE2 PHE A 88 11.408 1.624 1.270 1.00 0.00 H new ATOM 0 HZ PHE A 88 13.607 2.559 0.783 1.00 0.00 H new ATOM 1015 N ASN A 89 10.409 5.507 3.075 1.00 0.00 N ATOM 1016 CA ASN A 89 10.699 4.801 4.311 1.00 0.00 C ATOM 1017 C ASN A 89 11.598 5.671 5.192 1.00 0.00 C ATOM 1018 O ASN A 89 11.657 5.480 6.405 1.00 0.00 O ATOM 1019 CB ASN A 89 11.434 3.488 4.036 1.00 0.00 C ATOM 1020 CG ASN A 89 12.786 3.746 3.369 1.00 0.00 C ATOM 1021 OD1 ASN A 89 13.119 4.858 2.989 1.00 0.00 O ATOM 1022 ND2 ASN A 89 13.545 2.661 3.247 1.00 0.00 N ATOM 0 H ASN A 89 11.215 5.652 2.467 1.00 0.00 H new ATOM 0 HA ASN A 89 9.752 4.587 4.807 1.00 0.00 H new ATOM 0 HB2 ASN A 89 11.583 2.948 4.971 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.823 2.853 3.394 1.00 0.00 H new ATOM 0 HD21 ASN A 89 14.466 2.729 2.814 1.00 0.00 H new ATOM 0 HD22 ASN A 89 13.206 1.761 3.586 1.00 0.00 H new ATOM 1028 N GLY A 90 12.275 6.610 4.546 1.00 0.00 N ATOM 1029 CA GLY A 90 13.168 7.510 5.255 1.00 0.00 C ATOM 1030 C GLY A 90 14.274 8.024 4.332 1.00 0.00 C ATOM 1031 O GLY A 90 14.529 9.227 4.272 1.00 0.00 O ATOM 0 H GLY A 90 12.223 6.766 3.539 1.00 0.00 H new ATOM 0 HA2 GLY A 90 12.601 8.352 5.653 1.00 0.00 H new ATOM 0 HA3 GLY A 90 13.611 6.993 6.106 1.00 0.00 H new ATOM 1035 N ILE A 91 14.901 7.088 3.634 1.00 0.00 N ATOM 1036 CA ILE A 91 15.975 7.432 2.717 1.00 0.00 C ATOM 1037 C ILE A 91 15.397 7.626 1.313 1.00 0.00 C ATOM 1038 O ILE A 91 14.217 7.365 1.081 1.00 0.00 O ATOM 1039 CB ILE A 91 17.091 6.389 2.783 1.00 0.00 C ATOM 1040 CG1 ILE A 91 18.359 6.897 2.094 1.00 0.00 C ATOM 1041 CG2 ILE A 91 16.625 5.049 2.209 1.00 0.00 C ATOM 1042 CD1 ILE A 91 19.611 6.298 2.737 1.00 0.00 C ATOM 0 H ILE A 91 14.686 6.092 3.685 1.00 0.00 H new ATOM 0 HA ILE A 91 16.436 8.376 3.007 1.00 0.00 H new ATOM 0 HB ILE A 91 17.339 6.222 3.831 1.00 0.00 H new ATOM 0 HG12 ILE A 91 18.330 6.638 1.036 1.00 0.00 H new ATOM 0 HG13 ILE A 91 18.399 7.985 2.155 1.00 0.00 H new ATOM 0 HG21 ILE A 91 17.438 4.325 2.268 1.00 0.00 H new ATOM 0 HG22 ILE A 91 15.772 4.685 2.782 1.00 0.00 H new ATOM 0 HG23 ILE A 91 16.332 5.181 1.167 1.00 0.00 H new ATOM 0 HD11 ILE A 91 20.498 6.676 2.228 1.00 0.00 H new ATOM 0 HD12 ILE A 91 19.649 6.579 3.789 1.00 0.00 H new ATOM 0 HD13 ILE A 91 19.579 5.212 2.652 1.00 0.00 H new ATOM 1053 N LYS A 92 16.255 8.083 0.413 1.00 0.00 N ATOM 1054 CA LYS A 92 15.845 8.315 -0.962 1.00 0.00 C ATOM 1055 C LYS A 92 15.796 6.980 -1.707 1.00 0.00 C ATOM 1056 O LYS A 92 15.939 5.920 -1.099 1.00 0.00 O ATOM 1057 CB LYS A 92 16.751 9.356 -1.624 1.00 0.00 C ATOM 1058 CG LYS A 92 16.650 10.704 -0.907 1.00 0.00 C ATOM 1059 CD LYS A 92 17.074 11.848 -1.831 1.00 0.00 C ATOM 1060 CE LYS A 92 18.427 12.423 -1.407 1.00 0.00 C ATOM 1061 NZ LYS A 92 18.256 13.391 -0.301 1.00 0.00 N ATOM 0 H LYS A 92 17.232 8.299 0.609 1.00 0.00 H new ATOM 0 HA LYS A 92 14.840 8.736 -0.994 1.00 0.00 H new ATOM 0 HB2 LYS A 92 17.784 9.008 -1.608 1.00 0.00 H new ATOM 0 HB3 LYS A 92 16.471 9.475 -2.671 1.00 0.00 H new ATOM 0 HG2 LYS A 92 15.626 10.865 -0.569 1.00 0.00 H new ATOM 0 HG3 LYS A 92 17.281 10.696 -0.019 1.00 0.00 H new ATOM 0 HD2 LYS A 92 17.134 11.488 -2.858 1.00 0.00 H new ATOM 0 HD3 LYS A 92 16.319 12.634 -1.813 1.00 0.00 H new ATOM 0 HE2 LYS A 92 19.089 11.616 -1.093 1.00 0.00 H new ATOM 0 HE3 LYS A 92 18.903 12.913 -2.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 19.184 13.771 -0.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 17.641 14.170 -0.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 17.822 12.913 0.515 1.00 0.00 H new ATOM 1071 N TYR A 93 15.593 7.075 -3.013 1.00 0.00 N ATOM 1072 CA TYR A 93 15.523 5.887 -3.847 1.00 0.00 C ATOM 1073 C TYR A 93 16.923 5.349 -4.152 1.00 0.00 C ATOM 1074 O TYR A 93 17.818 6.109 -4.519 1.00 0.00 O ATOM 1075 CB TYR A 93 14.864 6.329 -5.155 1.00 0.00 C ATOM 1076 CG TYR A 93 15.842 6.901 -6.184 1.00 0.00 C ATOM 1077 CD1 TYR A 93 16.347 8.174 -6.021 1.00 0.00 C ATOM 1078 CD2 TYR A 93 16.219 6.142 -7.273 1.00 0.00 C ATOM 1079 CE1 TYR A 93 17.268 8.712 -6.989 1.00 0.00 C ATOM 1080 CE2 TYR A 93 17.140 6.679 -8.241 1.00 0.00 C ATOM 1081 CZ TYR A 93 17.619 7.939 -8.051 1.00 0.00 C ATOM 1082 OH TYR A 93 18.489 8.446 -8.966 1.00 0.00 O ATOM 0 H TYR A 93 15.475 7.956 -3.514 1.00 0.00 H new ATOM 0 HA TYR A 93 14.966 5.097 -3.344 1.00 0.00 H new ATOM 0 HB2 TYR A 93 14.347 5.476 -5.595 1.00 0.00 H new ATOM 0 HB3 TYR A 93 14.107 7.081 -4.932 1.00 0.00 H new ATOM 0 HD1 TYR A 93 16.052 8.767 -5.168 1.00 0.00 H new ATOM 0 HD2 TYR A 93 15.823 5.145 -7.399 1.00 0.00 H new ATOM 0 HE1 TYR A 93 17.671 9.707 -6.874 1.00 0.00 H new ATOM 0 HE2 TYR A 93 17.444 6.096 -9.098 1.00 0.00 H new ATOM 0 HH TYR A 93 18.649 7.782 -9.669 1.00 0.00 H new ATOM 1091 N ASN A 94 17.068 4.042 -3.989 1.00 0.00 N ATOM 1092 CA ASN A 94 18.343 3.393 -4.243 1.00 0.00 C ATOM 1093 C ASN A 94 18.161 2.327 -5.325 1.00 0.00 C ATOM 1094 O ASN A 94 19.122 1.665 -5.717 1.00 0.00 O ATOM 1095 CB ASN A 94 18.869 2.703 -2.983 1.00 0.00 C ATOM 1096 CG ASN A 94 18.966 3.689 -1.817 1.00 0.00 C ATOM 1097 OD1 ASN A 94 20.016 3.899 -1.234 1.00 0.00 O ATOM 1098 ND2 ASN A 94 17.814 4.279 -1.511 1.00 0.00 N ATOM 0 H ASN A 94 16.323 3.415 -3.684 1.00 0.00 H new ATOM 0 HA ASN A 94 19.054 4.156 -4.560 1.00 0.00 H new ATOM 0 HB2 ASN A 94 18.209 1.879 -2.713 1.00 0.00 H new ATOM 0 HB3 ASN A 94 19.850 2.273 -3.183 1.00 0.00 H new ATOM 0 HD21 ASN A 94 17.774 4.953 -0.747 1.00 0.00 H new ATOM 0 HD22 ASN A 94 16.971 4.057 -2.041 1.00 0.00 H new ATOM 1104 N THR A 95 16.924 2.194 -5.777 1.00 0.00 N ATOM 1105 CA THR A 95 16.604 1.218 -6.807 1.00 0.00 C ATOM 1106 C THR A 95 16.557 -0.190 -6.211 1.00 0.00 C ATOM 1107 O THR A 95 16.773 -0.369 -5.014 1.00 0.00 O ATOM 1108 CB THR A 95 17.628 1.368 -7.934 1.00 0.00 C ATOM 1109 OG1 THR A 95 17.834 2.775 -8.032 1.00 0.00 O ATOM 1110 CG2 THR A 95 17.058 0.979 -9.299 1.00 0.00 C ATOM 0 H THR A 95 16.130 2.745 -5.450 1.00 0.00 H new ATOM 0 HA THR A 95 15.612 1.393 -7.224 1.00 0.00 H new ATOM 0 HB THR A 95 18.500 0.751 -7.716 1.00 0.00 H new ATOM 0 HG1 THR A 95 18.486 2.962 -8.739 1.00 0.00 H new ATOM 0 HG21 THR A 95 17.826 1.104 -10.063 1.00 0.00 H new ATOM 0 HG22 THR A 95 16.736 -0.062 -9.275 1.00 0.00 H new ATOM 0 HG23 THR A 95 16.206 1.617 -9.533 1.00 0.00 H new ATOM 1118 N THR A 96 16.273 -1.154 -7.076 1.00 0.00 N ATOM 1119 CA THR A 96 16.195 -2.541 -6.650 1.00 0.00 C ATOM 1120 C THR A 96 14.922 -2.777 -5.835 1.00 0.00 C ATOM 1121 O THR A 96 14.133 -3.666 -6.153 1.00 0.00 O ATOM 1122 CB THR A 96 17.477 -2.874 -5.885 1.00 0.00 C ATOM 1123 OG1 THR A 96 18.521 -2.441 -6.753 1.00 0.00 O ATOM 1124 CG2 THR A 96 17.705 -4.381 -5.752 1.00 0.00 C ATOM 0 H THR A 96 16.094 -1.002 -8.069 1.00 0.00 H new ATOM 0 HA THR A 96 16.126 -3.214 -7.505 1.00 0.00 H new ATOM 0 HB THR A 96 17.435 -2.424 -4.893 1.00 0.00 H new ATOM 0 HG1 THR A 96 19.389 -2.618 -6.334 1.00 0.00 H new ATOM 0 HG21 THR A 96 18.628 -4.562 -5.201 1.00 0.00 H new ATOM 0 HG22 THR A 96 16.869 -4.830 -5.216 1.00 0.00 H new ATOM 0 HG23 THR A 96 17.781 -4.826 -6.744 1.00 0.00 H new ATOM 1132 N ARG A 97 14.763 -1.968 -4.798 1.00 0.00 N ATOM 1133 CA ARG A 97 13.599 -2.078 -3.935 1.00 0.00 C ATOM 1134 C ARG A 97 12.353 -1.560 -4.655 1.00 0.00 C ATOM 1135 O ARG A 97 12.045 -0.372 -4.594 1.00 0.00 O ATOM 1136 CB ARG A 97 13.797 -1.288 -2.640 1.00 0.00 C ATOM 1137 CG ARG A 97 14.278 0.135 -2.934 1.00 0.00 C ATOM 1138 CD ARG A 97 15.743 0.312 -2.534 1.00 0.00 C ATOM 1139 NE ARG A 97 15.831 0.990 -1.221 1.00 0.00 N ATOM 1140 CZ ARG A 97 16.937 1.023 -0.466 1.00 0.00 C ATOM 1141 NH1 ARG A 97 18.056 0.417 -0.886 1.00 0.00 N ATOM 1142 NH2 ARG A 97 16.925 1.662 0.713 1.00 0.00 N ATOM 0 H ARG A 97 15.421 -1.234 -4.536 1.00 0.00 H new ATOM 0 HA ARG A 97 13.468 -3.132 -3.688 1.00 0.00 H new ATOM 0 HB2 ARG A 97 12.860 -1.251 -2.085 1.00 0.00 H new ATOM 0 HB3 ARG A 97 14.523 -1.797 -2.006 1.00 0.00 H new ATOM 0 HG2 ARG A 97 14.159 0.351 -3.996 1.00 0.00 H new ATOM 0 HG3 ARG A 97 13.660 0.851 -2.392 1.00 0.00 H new ATOM 0 HD2 ARG A 97 16.235 -0.659 -2.485 1.00 0.00 H new ATOM 0 HD3 ARG A 97 16.267 0.897 -3.290 1.00 0.00 H new ATOM 0 HE ARG A 97 14.998 1.461 -0.869 1.00 0.00 H new ATOM 0 HH11 ARG A 97 18.067 -0.070 -1.782 1.00 0.00 H new ATOM 0 HH12 ARG A 97 18.897 0.443 -0.310 1.00 0.00 H new ATOM 0 HH21 ARG A 97 16.074 2.123 1.035 1.00 0.00 H new ATOM 0 HH22 ARG A 97 17.767 1.687 1.288 1.00 0.00 H new ATOM 1153 N ASN A 98 11.668 -2.479 -5.321 1.00 0.00 N ATOM 1154 CA ASN A 98 10.462 -2.131 -6.051 1.00 0.00 C ATOM 1155 C ASN A 98 9.341 -3.097 -5.668 1.00 0.00 C ATOM 1156 O ASN A 98 9.573 -4.296 -5.521 1.00 0.00 O ATOM 1157 CB ASN A 98 10.683 -2.238 -7.561 1.00 0.00 C ATOM 1158 CG ASN A 98 11.450 -3.515 -7.914 1.00 0.00 C ATOM 1159 OD1 ASN A 98 12.642 -3.501 -8.173 1.00 0.00 O ATOM 1160 ND2 ASN A 98 10.701 -4.614 -7.909 1.00 0.00 N ATOM 0 H ASN A 98 11.926 -3.465 -5.370 1.00 0.00 H new ATOM 0 HA ASN A 98 10.199 -1.104 -5.796 1.00 0.00 H new ATOM 0 HB2 ASN A 98 9.721 -2.234 -8.074 1.00 0.00 H new ATOM 0 HB3 ASN A 98 11.237 -1.368 -7.914 1.00 0.00 H new ATOM 0 HD21 ASN A 98 11.119 -5.517 -8.131 1.00 0.00 H new ATOM 0 HD22 ASN A 98 9.708 -4.554 -7.683 1.00 0.00 H new ATOM 1166 N ALA A 99 8.148 -2.540 -5.515 1.00 0.00 N ATOM 1167 CA ALA A 99 6.990 -3.338 -5.151 1.00 0.00 C ATOM 1168 C ALA A 99 6.026 -3.402 -6.337 1.00 0.00 C ATOM 1169 O ALA A 99 6.200 -2.686 -7.322 1.00 0.00 O ATOM 1170 CB ALA A 99 6.335 -2.748 -3.900 1.00 0.00 C ATOM 0 H ALA A 99 7.959 -1.545 -5.637 1.00 0.00 H new ATOM 0 HA ALA A 99 7.288 -4.359 -4.913 1.00 0.00 H new ATOM 0 HB1 ALA A 99 5.466 -3.347 -3.627 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.051 -2.752 -3.078 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.021 -1.724 -4.102 1.00 0.00 H new ATOM 1176 N TYR A 100 5.032 -4.268 -6.205 1.00 0.00 N ATOM 1177 CA TYR A 100 4.041 -4.435 -7.255 1.00 0.00 C ATOM 1178 C TYR A 100 2.640 -4.603 -6.664 1.00 0.00 C ATOM 1179 O TYR A 100 2.478 -5.201 -5.601 1.00 0.00 O ATOM 1180 CB TYR A 100 4.425 -5.716 -7.998 1.00 0.00 C ATOM 1181 CG TYR A 100 5.195 -6.724 -7.142 1.00 0.00 C ATOM 1182 CD1 TYR A 100 6.496 -6.459 -6.766 1.00 0.00 C ATOM 1183 CD2 TYR A 100 4.589 -7.900 -6.747 1.00 0.00 C ATOM 1184 CE1 TYR A 100 7.221 -7.407 -5.961 1.00 0.00 C ATOM 1185 CE2 TYR A 100 5.314 -8.848 -5.941 1.00 0.00 C ATOM 1186 CZ TYR A 100 6.594 -8.556 -5.588 1.00 0.00 C ATOM 1187 OH TYR A 100 7.278 -9.451 -4.828 1.00 0.00 O ATOM 0 H TYR A 100 4.891 -4.861 -5.387 1.00 0.00 H new ATOM 0 HA TYR A 100 4.023 -3.563 -7.908 1.00 0.00 H new ATOM 0 HB2 TYR A 100 3.519 -6.191 -8.374 1.00 0.00 H new ATOM 0 HB3 TYR A 100 5.031 -5.453 -8.865 1.00 0.00 H new ATOM 0 HD1 TYR A 100 6.971 -5.540 -7.076 1.00 0.00 H new ATOM 0 HD2 TYR A 100 3.571 -8.109 -7.042 1.00 0.00 H new ATOM 0 HE1 TYR A 100 8.239 -7.211 -5.660 1.00 0.00 H new ATOM 0 HE2 TYR A 100 4.851 -9.771 -5.624 1.00 0.00 H new ATOM 0 HH TYR A 100 6.920 -9.446 -3.916 1.00 0.00 H new ATOM 1196 N ARG A 101 1.662 -4.066 -7.378 1.00 0.00 N ATOM 1197 CA ARG A 101 0.280 -4.148 -6.939 1.00 0.00 C ATOM 1198 C ARG A 101 -0.631 -4.505 -8.114 1.00 0.00 C ATOM 1199 O ARG A 101 -1.273 -3.632 -8.694 1.00 0.00 O ATOM 1200 CB ARG A 101 -0.183 -2.825 -6.326 1.00 0.00 C ATOM 1201 CG ARG A 101 -0.071 -2.857 -4.801 1.00 0.00 C ATOM 1202 CD ARG A 101 -0.761 -1.643 -4.174 1.00 0.00 C ATOM 1203 NE ARG A 101 -2.124 -2.008 -3.730 1.00 0.00 N ATOM 1204 CZ ARG A 101 -2.389 -2.959 -2.824 1.00 0.00 C ATOM 1205 NH1 ARG A 101 -1.386 -3.644 -2.259 1.00 0.00 N ATOM 1206 NH2 ARG A 101 -3.658 -3.224 -2.481 1.00 0.00 N ATOM 0 H ARG A 101 1.800 -3.571 -8.259 1.00 0.00 H new ATOM 0 HA ARG A 101 0.220 -4.928 -6.180 1.00 0.00 H new ATOM 0 HB2 ARG A 101 0.419 -2.007 -6.721 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -1.216 -2.629 -6.614 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -0.521 -3.773 -4.419 1.00 0.00 H new ATOM 0 HG3 ARG A 101 0.979 -2.873 -4.510 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -0.179 -1.281 -3.327 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -0.811 -0.829 -4.897 1.00 0.00 H new ATOM 0 HE ARG A 101 -2.911 -1.504 -4.139 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -0.421 -3.442 -2.518 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -1.588 -4.368 -1.569 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -4.422 -2.702 -2.910 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -3.859 -3.948 -1.791 1.00 0.00 H new ATOM 1217 N GLU A 102 -0.658 -5.791 -8.431 1.00 0.00 N ATOM 1218 CA GLU A 102 -1.481 -6.275 -9.527 1.00 0.00 C ATOM 1219 C GLU A 102 -2.962 -6.053 -9.218 1.00 0.00 C ATOM 1220 O GLU A 102 -3.376 -6.121 -8.061 1.00 0.00 O ATOM 1221 CB GLU A 102 -1.196 -7.750 -9.817 1.00 0.00 C ATOM 1222 CG GLU A 102 -2.154 -8.295 -10.877 1.00 0.00 C ATOM 1223 CD GLU A 102 -3.315 -9.052 -10.229 1.00 0.00 C ATOM 1224 OE1 GLU A 102 -3.978 -8.440 -9.363 1.00 0.00 O ATOM 1225 OE2 GLU A 102 -3.515 -10.224 -10.614 1.00 0.00 O ATOM 0 H GLU A 102 -0.123 -6.513 -7.948 1.00 0.00 H new ATOM 0 HA GLU A 102 -1.229 -5.707 -10.423 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -0.167 -7.865 -10.158 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -1.295 -8.330 -8.900 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -2.542 -7.473 -11.479 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -1.615 -8.958 -11.553 1.00 0.00 H new ATOM 1230 N CYS A 103 -3.722 -5.794 -10.271 1.00 0.00 N ATOM 1231 CA CYS A 103 -5.149 -5.561 -10.126 1.00 0.00 C ATOM 1232 C CYS A 103 -5.894 -6.739 -10.758 1.00 0.00 C ATOM 1233 O CYS A 103 -5.537 -7.193 -11.845 1.00 0.00 O ATOM 1234 CB CYS A 103 -5.570 -4.225 -10.741 1.00 0.00 C ATOM 1235 SG CYS A 103 -6.423 -3.086 -9.590 1.00 0.00 S ATOM 0 H CYS A 103 -3.377 -5.740 -11.229 1.00 0.00 H new ATOM 0 HA CYS A 103 -5.403 -5.495 -9.068 1.00 0.00 H new ATOM 0 HB2 CYS A 103 -4.684 -3.726 -11.133 1.00 0.00 H new ATOM 0 HB3 CYS A 103 -6.227 -4.422 -11.588 1.00 0.00 H new ATOM 1239 N LEU A 104 -6.913 -7.202 -10.049 1.00 0.00 N ATOM 1240 CA LEU A 104 -7.711 -8.319 -10.526 1.00 0.00 C ATOM 1241 C LEU A 104 -8.617 -7.843 -11.665 1.00 0.00 C ATOM 1242 O LEU A 104 -8.904 -6.652 -11.778 1.00 0.00 O ATOM 1243 CB LEU A 104 -8.470 -8.968 -9.368 1.00 0.00 C ATOM 1244 CG LEU A 104 -7.856 -10.249 -8.798 1.00 0.00 C ATOM 1245 CD1 LEU A 104 -8.570 -10.675 -7.514 1.00 0.00 C ATOM 1246 CD2 LEU A 104 -7.843 -11.363 -9.845 1.00 0.00 C ATOM 0 H LEU A 104 -7.204 -6.824 -9.148 1.00 0.00 H new ATOM 0 HA LEU A 104 -7.069 -9.100 -10.933 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -8.555 -8.239 -8.562 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -9.483 -9.192 -9.703 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.818 -10.043 -8.535 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -8.114 -11.588 -7.130 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -8.482 -9.884 -6.769 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -9.623 -10.857 -7.727 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -7.402 -12.262 -9.414 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -8.864 -11.576 -10.162 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -7.254 -11.046 -10.706 1.00 0.00 H new ATOM 1257 N GLU A 105 -9.041 -8.798 -12.479 1.00 0.00 N ATOM 1258 CA GLU A 105 -9.907 -8.492 -13.604 1.00 0.00 C ATOM 1259 C GLU A 105 -11.341 -8.259 -13.123 1.00 0.00 C ATOM 1260 O GLU A 105 -12.236 -8.005 -13.927 1.00 0.00 O ATOM 1261 CB GLU A 105 -9.856 -9.603 -14.655 1.00 0.00 C ATOM 1262 CG GLU A 105 -10.316 -9.090 -16.020 1.00 0.00 C ATOM 1263 CD GLU A 105 -9.958 -10.081 -17.129 1.00 0.00 C ATOM 1264 OE1 GLU A 105 -8.757 -10.412 -17.228 1.00 0.00 O ATOM 1265 OE2 GLU A 105 -10.894 -10.488 -17.851 1.00 0.00 O ATOM 0 H GLU A 105 -8.801 -9.785 -12.382 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.548 -7.576 -14.073 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -8.840 -9.989 -14.732 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -10.490 -10.433 -14.342 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -11.394 -8.928 -16.007 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -9.851 -8.126 -16.225 1.00 0.00 H new ATOM 1270 N ASN A 106 -11.513 -8.353 -11.813 1.00 0.00 N ATOM 1271 CA ASN A 106 -12.823 -8.157 -11.213 1.00 0.00 C ATOM 1272 C ASN A 106 -12.964 -6.698 -10.775 1.00 0.00 C ATOM 1273 O ASN A 106 -14.010 -6.297 -10.266 1.00 0.00 O ATOM 1274 CB ASN A 106 -13.002 -9.041 -9.979 1.00 0.00 C ATOM 1275 CG ASN A 106 -14.288 -9.865 -10.076 1.00 0.00 C ATOM 1276 OD1 ASN A 106 -15.303 -9.553 -9.475 1.00 0.00 O ATOM 1277 ND2 ASN A 106 -14.189 -10.931 -10.865 1.00 0.00 N ATOM 0 H ASN A 106 -10.767 -8.562 -11.149 1.00 0.00 H new ATOM 0 HA ASN A 106 -13.577 -8.419 -11.955 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -12.146 -9.708 -9.878 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -13.030 -8.420 -9.084 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -14.993 -11.545 -10.996 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -13.309 -11.135 -11.339 1.00 0.00 H new ATOM 1283 N GLY A 107 -11.896 -5.943 -10.989 1.00 0.00 N ATOM 1284 CA GLY A 107 -11.888 -4.538 -10.622 1.00 0.00 C ATOM 1285 C GLY A 107 -11.574 -4.361 -9.134 1.00 0.00 C ATOM 1286 O GLY A 107 -12.216 -3.565 -8.451 1.00 0.00 O ATOM 0 H GLY A 107 -11.031 -6.278 -11.412 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -11.147 -4.007 -11.219 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -12.857 -4.094 -10.848 1.00 0.00 H new ATOM 1290 N THR A 108 -10.587 -5.116 -8.677 1.00 0.00 N ATOM 1291 CA THR A 108 -10.179 -5.053 -7.284 1.00 0.00 C ATOM 1292 C THR A 108 -8.663 -4.875 -7.178 1.00 0.00 C ATOM 1293 O THR A 108 -7.952 -4.980 -8.175 1.00 0.00 O ATOM 1294 CB THR A 108 -10.693 -6.313 -6.583 1.00 0.00 C ATOM 1295 OG1 THR A 108 -10.184 -7.382 -7.377 1.00 0.00 O ATOM 1296 CG2 THR A 108 -12.212 -6.462 -6.687 1.00 0.00 C ATOM 0 H THR A 108 -10.057 -5.775 -9.247 1.00 0.00 H new ATOM 0 HA THR A 108 -10.612 -4.186 -6.785 1.00 0.00 H new ATOM 0 HB THR A 108 -10.402 -6.290 -5.533 1.00 0.00 H new ATOM 0 HG1 THR A 108 -10.468 -8.238 -6.994 1.00 0.00 H new ATOM 0 HG21 THR A 108 -12.524 -7.371 -6.174 1.00 0.00 H new ATOM 0 HG22 THR A 108 -12.695 -5.601 -6.225 1.00 0.00 H new ATOM 0 HG23 THR A 108 -12.501 -6.520 -7.736 1.00 0.00 H new ATOM 1304 N TRP A 109 -8.214 -4.607 -5.960 1.00 0.00 N ATOM 1305 CA TRP A 109 -6.796 -4.413 -5.711 1.00 0.00 C ATOM 1306 C TRP A 109 -6.186 -5.774 -5.370 1.00 0.00 C ATOM 1307 O TRP A 109 -6.845 -6.805 -5.497 1.00 0.00 O ATOM 1308 CB TRP A 109 -6.570 -3.366 -4.620 1.00 0.00 C ATOM 1309 CG TRP A 109 -6.457 -1.933 -5.147 1.00 0.00 C ATOM 1310 CD1 TRP A 109 -7.129 -0.849 -4.738 1.00 0.00 C ATOM 1311 CD2 TRP A 109 -5.588 -1.472 -6.203 1.00 0.00 C ATOM 1312 NE1 TRP A 109 -6.758 0.274 -5.451 1.00 0.00 N ATOM 1313 CE2 TRP A 109 -5.792 -0.117 -6.370 1.00 0.00 C ATOM 1314 CE3 TRP A 109 -4.661 -2.176 -6.992 1.00 0.00 C ATOM 1315 CZ2 TRP A 109 -5.105 0.651 -7.318 1.00 0.00 C ATOM 1316 CZ3 TRP A 109 -3.983 -1.394 -7.935 1.00 0.00 C ATOM 1317 CH2 TRP A 109 -4.177 -0.030 -8.116 1.00 0.00 C ATOM 0 H TRP A 109 -8.808 -4.520 -5.135 1.00 0.00 H new ATOM 0 HA TRP A 109 -6.298 -4.021 -6.598 1.00 0.00 H new ATOM 0 HB2 TRP A 109 -7.392 -3.416 -3.906 1.00 0.00 H new ATOM 0 HB3 TRP A 109 -5.659 -3.615 -4.075 1.00 0.00 H new ATOM 0 HD1 TRP A 109 -7.868 -0.853 -3.950 1.00 0.00 H new ATOM 0 HE1 TRP A 109 -7.126 1.217 -5.326 1.00 0.00 H new ATOM 0 HE3 TRP A 109 -4.486 -3.236 -6.880 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 -5.281 1.711 -7.428 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 -3.258 -1.886 -8.566 1.00 0.00 H new ATOM 0 HH2 TRP A 109 -3.615 0.503 -8.869 1.00 0.00 H new ATOM 1327 N ALA A 110 -4.932 -5.734 -4.942 1.00 0.00 N ATOM 1328 CA ALA A 110 -4.226 -6.950 -4.581 1.00 0.00 C ATOM 1329 C ALA A 110 -4.399 -7.211 -3.083 1.00 0.00 C ATOM 1330 O ALA A 110 -5.470 -6.971 -2.529 1.00 0.00 O ATOM 1331 CB ALA A 110 -2.754 -6.826 -4.984 1.00 0.00 C ATOM 0 H ALA A 110 -4.388 -4.878 -4.838 1.00 0.00 H new ATOM 0 HA ALA A 110 -4.640 -7.805 -5.115 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -2.224 -7.739 -4.713 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -2.683 -6.672 -6.061 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -2.305 -5.979 -4.466 1.00 0.00 H new ATOM 1337 N SER A 111 -3.329 -7.699 -2.472 1.00 0.00 N ATOM 1338 CA SER A 111 -3.351 -7.995 -1.049 1.00 0.00 C ATOM 1339 C SER A 111 -2.816 -6.799 -0.259 1.00 0.00 C ATOM 1340 O SER A 111 -3.590 -6.013 0.285 1.00 0.00 O ATOM 1341 CB SER A 111 -2.532 -9.248 -0.736 1.00 0.00 C ATOM 1342 OG SER A 111 -3.297 -10.439 -0.897 1.00 0.00 O ATOM 0 H SER A 111 -2.442 -7.897 -2.936 1.00 0.00 H new ATOM 0 HA SER A 111 -4.383 -8.185 -0.753 1.00 0.00 H new ATOM 0 HB2 SER A 111 -1.661 -9.285 -1.391 1.00 0.00 H new ATOM 0 HB3 SER A 111 -2.160 -9.192 0.287 1.00 0.00 H new ATOM 0 HG SER A 111 -2.738 -11.217 -0.690 1.00 0.00 H new ATOM 1347 N ARG A 112 -1.495 -6.701 -0.218 1.00 0.00 N ATOM 1348 CA ARG A 112 -0.847 -5.614 0.497 1.00 0.00 C ATOM 1349 C ARG A 112 0.573 -5.403 -0.032 1.00 0.00 C ATOM 1350 O ARG A 112 1.518 -5.283 0.747 1.00 0.00 O ATOM 1351 CB ARG A 112 -0.788 -5.903 1.998 1.00 0.00 C ATOM 1352 CG ARG A 112 -0.112 -7.248 2.273 1.00 0.00 C ATOM 1353 CD ARG A 112 -0.706 -7.917 3.513 1.00 0.00 C ATOM 1354 NE ARG A 112 -0.379 -9.360 3.516 1.00 0.00 N ATOM 1355 CZ ARG A 112 -0.848 -10.235 4.416 1.00 0.00 C ATOM 1356 NH1 ARG A 112 -1.666 -9.819 5.391 1.00 0.00 N ATOM 1357 NH2 ARG A 112 -0.498 -11.527 4.340 1.00 0.00 N ATOM 0 H ARG A 112 -0.856 -7.356 -0.668 1.00 0.00 H new ATOM 0 HA ARG A 112 -1.436 -4.711 0.335 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -0.241 -5.107 2.504 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -1.797 -5.908 2.411 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -0.232 -7.903 1.410 1.00 0.00 H new ATOM 0 HG3 ARG A 112 0.959 -7.099 2.414 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -0.314 -7.445 4.414 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -1.787 -7.781 3.527 1.00 0.00 H new ATOM 0 HE ARG A 112 0.242 -9.711 2.787 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -1.932 -8.836 5.449 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -2.023 -10.485 6.076 1.00 0.00 H new ATOM 0 HH21 ARG A 112 0.125 -11.844 3.597 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -0.855 -12.193 5.025 1.00 0.00 H new ATOM 1368 N VAL A 113 0.679 -5.365 -1.352 1.00 0.00 N ATOM 1369 CA VAL A 113 1.969 -5.171 -1.993 1.00 0.00 C ATOM 1370 C VAL A 113 2.980 -6.155 -1.404 1.00 0.00 C ATOM 1371 O VAL A 113 2.649 -6.928 -0.507 1.00 0.00 O ATOM 1372 CB VAL A 113 2.406 -3.711 -1.858 1.00 0.00 C ATOM 1373 CG1 VAL A 113 2.864 -3.407 -0.429 1.00 0.00 C ATOM 1374 CG2 VAL A 113 3.501 -3.371 -2.869 1.00 0.00 C ATOM 0 H VAL A 113 -0.106 -5.465 -1.995 1.00 0.00 H new ATOM 0 HA VAL A 113 1.900 -5.378 -3.061 1.00 0.00 H new ATOM 0 HB VAL A 113 1.544 -3.081 -2.075 1.00 0.00 H new ATOM 0 HG11 VAL A 113 3.170 -2.363 -0.359 1.00 0.00 H new ATOM 0 HG12 VAL A 113 2.043 -3.592 0.263 1.00 0.00 H new ATOM 0 HG13 VAL A 113 3.706 -4.049 -0.172 1.00 0.00 H new ATOM 0 HG21 VAL A 113 3.793 -2.328 -2.752 1.00 0.00 H new ATOM 0 HG22 VAL A 113 4.366 -4.012 -2.698 1.00 0.00 H new ATOM 0 HG23 VAL A 113 3.125 -3.531 -3.880 1.00 0.00 H new ATOM 1384 N ASN A 114 4.194 -6.095 -1.933 1.00 0.00 N ATOM 1385 CA ASN A 114 5.256 -6.971 -1.470 1.00 0.00 C ATOM 1386 C ASN A 114 6.610 -6.375 -1.861 1.00 0.00 C ATOM 1387 O ASN A 114 6.706 -5.628 -2.833 1.00 0.00 O ATOM 1388 CB ASN A 114 5.146 -8.356 -2.112 1.00 0.00 C ATOM 1389 CG ASN A 114 6.311 -9.252 -1.686 1.00 0.00 C ATOM 1390 OD1 ASN A 114 6.938 -9.924 -2.488 1.00 0.00 O ATOM 1391 ND2 ASN A 114 6.565 -9.225 -0.380 1.00 0.00 N ATOM 0 H ASN A 114 4.465 -5.453 -2.678 1.00 0.00 H new ATOM 0 HA ASN A 114 5.167 -7.066 -0.388 1.00 0.00 H new ATOM 0 HB2 ASN A 114 4.202 -8.820 -1.825 1.00 0.00 H new ATOM 0 HB3 ASN A 114 5.136 -8.258 -3.198 1.00 0.00 H new ATOM 0 HD21 ASN A 114 7.323 -9.789 0.004 1.00 0.00 H new ATOM 0 HD22 ASN A 114 6.002 -8.640 0.237 1.00 0.00 H new ATOM 1397 N TYR A 115 7.622 -6.728 -1.082 1.00 0.00 N ATOM 1398 CA TYR A 115 8.966 -6.236 -1.334 1.00 0.00 C ATOM 1399 C TYR A 115 9.954 -6.788 -0.305 1.00 0.00 C ATOM 1400 O TYR A 115 9.789 -6.576 0.895 1.00 0.00 O ATOM 1401 CB TYR A 115 8.894 -4.714 -1.188 1.00 0.00 C ATOM 1402 CG TYR A 115 7.663 -4.221 -0.423 1.00 0.00 C ATOM 1403 CD1 TYR A 115 7.223 -4.907 0.690 1.00 0.00 C ATOM 1404 CD2 TYR A 115 6.996 -3.091 -0.847 1.00 0.00 C ATOM 1405 CE1 TYR A 115 6.065 -4.442 1.409 1.00 0.00 C ATOM 1406 CE2 TYR A 115 5.838 -2.626 -0.128 1.00 0.00 C ATOM 1407 CZ TYR A 115 5.430 -3.325 0.965 1.00 0.00 C ATOM 1408 OH TYR A 115 4.337 -2.886 1.645 1.00 0.00 O ATOM 0 H TYR A 115 7.538 -7.348 -0.277 1.00 0.00 H new ATOM 0 HA TYR A 115 9.308 -6.545 -2.322 1.00 0.00 H new ATOM 0 HB2 TYR A 115 9.791 -4.365 -0.676 1.00 0.00 H new ATOM 0 HB3 TYR A 115 8.897 -4.263 -2.180 1.00 0.00 H new ATOM 0 HD1 TYR A 115 7.746 -5.792 1.022 1.00 0.00 H new ATOM 0 HD2 TYR A 115 7.342 -2.555 -1.718 1.00 0.00 H new ATOM 0 HE1 TYR A 115 5.709 -4.969 2.282 1.00 0.00 H new ATOM 0 HE2 TYR A 115 5.306 -1.743 -0.449 1.00 0.00 H new ATOM 0 HH TYR A 115 4.421 -3.128 2.591 1.00 0.00 H new ATOM 1417 N SER A 116 10.960 -7.487 -0.812 1.00 0.00 N ATOM 1418 CA SER A 116 11.974 -8.072 0.048 1.00 0.00 C ATOM 1419 C SER A 116 13.141 -7.097 0.219 1.00 0.00 C ATOM 1420 O SER A 116 14.112 -7.400 0.910 1.00 0.00 O ATOM 1421 CB SER A 116 12.473 -9.404 -0.515 1.00 0.00 C ATOM 1422 OG SER A 116 13.021 -10.241 0.500 1.00 0.00 O ATOM 0 H SER A 116 11.094 -7.661 -1.808 1.00 0.00 H new ATOM 0 HA SER A 116 11.525 -8.266 1.022 1.00 0.00 H new ATOM 0 HB2 SER A 116 11.649 -9.922 -1.006 1.00 0.00 H new ATOM 0 HB3 SER A 116 13.230 -9.215 -1.277 1.00 0.00 H new ATOM 0 HG SER A 116 13.585 -9.705 1.097 1.00 0.00 H new ATOM 1427 N HIS A 117 13.007 -5.946 -0.423 1.00 0.00 N ATOM 1428 CA HIS A 117 14.039 -4.925 -0.351 1.00 0.00 C ATOM 1429 C HIS A 117 13.414 -3.594 0.074 1.00 0.00 C ATOM 1430 O HIS A 117 14.104 -2.580 0.158 1.00 0.00 O ATOM 1431 CB HIS A 117 14.799 -4.827 -1.675 1.00 0.00 C ATOM 1432 CG HIS A 117 14.557 -5.987 -2.610 1.00 0.00 C ATOM 1433 ND1 HIS A 117 15.503 -6.969 -2.849 1.00 0.00 N ATOM 1434 CD2 HIS A 117 13.466 -6.314 -3.363 1.00 0.00 C ATOM 1435 CE1 HIS A 117 14.995 -7.840 -3.707 1.00 0.00 C ATOM 1436 NE2 HIS A 117 13.734 -7.432 -4.025 1.00 0.00 N ATOM 0 H HIS A 117 12.200 -5.698 -0.995 1.00 0.00 H new ATOM 0 HA HIS A 117 14.776 -5.199 0.404 1.00 0.00 H new ATOM 0 HB2 HIS A 117 14.514 -3.903 -2.178 1.00 0.00 H new ATOM 0 HB3 HIS A 117 15.866 -4.760 -1.465 1.00 0.00 H new ATOM 0 HD2 HIS A 117 12.542 -5.757 -3.411 1.00 0.00 H new ATOM 0 HE1 HIS A 117 15.493 -8.720 -4.088 1.00 0.00 H new ATOM 0 HE2 HIS A 117 13.100 -7.908 -4.667 1.00 0.00 H new ATOM 1443 N CYS A 118 12.115 -3.643 0.332 1.00 0.00 N ATOM 1444 CA CYS A 118 11.391 -2.453 0.746 1.00 0.00 C ATOM 1445 C CYS A 118 10.838 -2.694 2.152 1.00 0.00 C ATOM 1446 O CYS A 118 10.297 -1.781 2.775 1.00 0.00 O ATOM 1447 CB CYS A 118 10.286 -2.089 -0.247 1.00 0.00 C ATOM 1448 SG CYS A 118 10.075 -0.295 -0.537 1.00 0.00 S ATOM 0 H CYS A 118 11.546 -4.487 0.262 1.00 0.00 H new ATOM 0 HA CYS A 118 12.068 -1.599 0.763 1.00 0.00 H new ATOM 0 HB2 CYS A 118 10.499 -2.574 -1.200 1.00 0.00 H new ATOM 0 HB3 CYS A 118 9.343 -2.498 0.115 1.00 0.00 H new ATOM 1452 N GLU A 119 10.991 -3.928 2.611 1.00 0.00 N ATOM 1453 CA GLU A 119 10.514 -4.300 3.932 1.00 0.00 C ATOM 1454 C GLU A 119 11.496 -3.825 5.005 1.00 0.00 C ATOM 1455 O GLU A 119 11.088 -3.250 6.013 1.00 0.00 O ATOM 1456 CB GLU A 119 10.286 -5.810 4.027 1.00 0.00 C ATOM 1457 CG GLU A 119 9.051 -6.126 4.872 1.00 0.00 C ATOM 1458 CD GLU A 119 9.437 -6.401 6.327 1.00 0.00 C ATOM 1459 OE1 GLU A 119 9.582 -5.408 7.072 1.00 0.00 O ATOM 1460 OE2 GLU A 119 9.577 -7.597 6.661 1.00 0.00 O ATOM 0 H GLU A 119 11.439 -4.683 2.091 1.00 0.00 H new ATOM 0 HA GLU A 119 9.556 -3.809 4.102 1.00 0.00 H new ATOM 0 HB2 GLU A 119 10.163 -6.226 3.027 1.00 0.00 H new ATOM 0 HB3 GLU A 119 11.163 -6.287 4.465 1.00 0.00 H new ATOM 0 HG2 GLU A 119 8.353 -5.290 4.829 1.00 0.00 H new ATOM 0 HG3 GLU A 119 8.535 -6.993 4.459 1.00 0.00 H new ATOM 1465 N PRO A 120 12.804 -4.088 4.744 1.00 0.00 N ATOM 1466 CA PRO A 120 13.848 -3.694 5.676 1.00 0.00 C ATOM 1467 C PRO A 120 14.102 -2.186 5.607 1.00 0.00 C ATOM 1468 O PRO A 120 14.629 -1.687 4.615 1.00 0.00 O ATOM 1469 CB PRO A 120 15.061 -4.519 5.280 1.00 0.00 C ATOM 1470 CG PRO A 120 14.794 -4.998 3.862 1.00 0.00 C ATOM 1471 CD PRO A 120 13.323 -4.767 3.560 1.00 0.00 C ATOM 0 HA PRO A 120 13.578 -3.882 6.715 1.00 0.00 H new ATOM 0 HB2 PRO A 120 15.972 -3.922 5.326 1.00 0.00 H new ATOM 0 HB3 PRO A 120 15.198 -5.362 5.958 1.00 0.00 H new ATOM 0 HG2 PRO A 120 15.419 -4.456 3.152 1.00 0.00 H new ATOM 0 HG3 PRO A 120 15.042 -6.055 3.763 1.00 0.00 H new ATOM 0 HD2 PRO A 120 13.193 -4.158 2.665 1.00 0.00 H new ATOM 0 HD3 PRO A 120 12.802 -5.708 3.383 1.00 0.00 H new ATOM 1476 N ILE A 121 13.715 -1.504 6.676 1.00 0.00 N ATOM 1477 CA ILE A 121 13.895 -0.065 6.750 1.00 0.00 C ATOM 1478 C ILE A 121 15.203 0.245 7.480 1.00 0.00 C ATOM 1479 O ILE A 121 15.914 -0.667 7.901 1.00 0.00 O ATOM 1480 CB ILE A 121 12.667 0.596 7.380 1.00 0.00 C ATOM 1481 CG1 ILE A 121 11.388 -0.157 7.012 1.00 0.00 C ATOM 1482 CG2 ILE A 121 12.588 2.077 7.005 1.00 0.00 C ATOM 1483 CD1 ILE A 121 11.076 -0.012 5.522 1.00 0.00 C ATOM 0 H ILE A 121 13.278 -1.922 7.497 1.00 0.00 H new ATOM 0 HA ILE A 121 13.980 0.360 5.750 1.00 0.00 H new ATOM 0 HB ILE A 121 12.770 0.543 8.464 1.00 0.00 H new ATOM 0 HG12 ILE A 121 11.498 -1.212 7.263 1.00 0.00 H new ATOM 0 HG13 ILE A 121 10.554 0.226 7.601 1.00 0.00 H new ATOM 0 HG21 ILE A 121 11.706 2.522 7.466 1.00 0.00 H new ATOM 0 HG22 ILE A 121 13.482 2.590 7.360 1.00 0.00 H new ATOM 0 HG23 ILE A 121 12.520 2.175 5.922 1.00 0.00 H new ATOM 0 HD11 ILE A 121 10.162 -0.557 5.287 1.00 0.00 H new ATOM 0 HD12 ILE A 121 10.943 1.042 5.279 1.00 0.00 H new ATOM 0 HD13 ILE A 121 11.901 -0.418 4.936 1.00 0.00 H new ATOM 1494 N LEU A 122 15.482 1.534 7.605 1.00 0.00 N ATOM 1495 CA LEU A 122 16.694 1.976 8.277 1.00 0.00 C ATOM 1496 C LEU A 122 17.908 1.331 7.605 1.00 0.00 C ATOM 1497 O LEU A 122 18.277 0.204 7.931 1.00 0.00 O ATOM 1498 CB LEU A 122 16.604 1.699 9.779 1.00 0.00 C ATOM 1499 CG LEU A 122 15.193 1.553 10.352 1.00 0.00 C ATOM 1500 CD1 LEU A 122 15.215 0.792 11.679 1.00 0.00 C ATOM 1501 CD2 LEU A 122 14.512 2.917 10.484 1.00 0.00 C ATOM 0 H LEU A 122 14.891 2.287 7.253 1.00 0.00 H new ATOM 0 HA LEU A 122 16.811 3.055 8.181 1.00 0.00 H new ATOM 0 HB2 LEU A 122 17.158 0.785 9.993 1.00 0.00 H new ATOM 0 HB3 LEU A 122 17.107 2.508 10.308 1.00 0.00 H new ATOM 0 HG LEU A 122 14.600 0.963 9.653 1.00 0.00 H new ATOM 0 HD11 LEU A 122 14.199 0.703 12.064 1.00 0.00 H new ATOM 0 HD12 LEU A 122 15.632 -0.203 11.521 1.00 0.00 H new ATOM 0 HD13 LEU A 122 15.829 1.333 12.399 1.00 0.00 H new ATOM 0 HD21 LEU A 122 13.510 2.786 10.894 1.00 0.00 H new ATOM 0 HD22 LEU A 122 15.096 3.552 11.150 1.00 0.00 H new ATOM 0 HD23 LEU A 122 14.444 3.386 9.503 1.00 0.00 H new ATOM 1512 N ASP A 123 18.494 2.076 6.678 1.00 0.00 N ATOM 1513 CA ASP A 123 19.659 1.590 5.957 1.00 0.00 C ATOM 1514 C ASP A 123 20.165 2.689 5.019 1.00 0.00 C ATOM 1515 O ASP A 123 19.756 2.758 3.861 1.00 0.00 O ATOM 1516 CB ASP A 123 19.311 0.366 5.108 1.00 0.00 C ATOM 1517 CG ASP A 123 20.468 -0.606 4.871 1.00 0.00 C ATOM 1518 OD1 ASP A 123 20.791 -1.347 5.826 1.00 0.00 O ATOM 1519 OD2 ASP A 123 21.004 -0.588 3.742 1.00 0.00 O ATOM 0 H ASP A 123 18.185 3.010 6.410 1.00 0.00 H new ATOM 0 HA ASP A 123 20.419 1.316 6.688 1.00 0.00 H new ATOM 0 HB2 ASP A 123 18.496 -0.173 5.592 1.00 0.00 H new ATOM 0 HB3 ASP A 123 18.939 0.707 4.142 1.00 0.00 H new ATOM 1523 N ASP A 124 21.048 3.519 5.554 1.00 0.00 N ATOM 1524 CA ASP A 124 21.615 4.610 4.779 1.00 0.00 C ATOM 1525 C ASP A 124 23.140 4.574 4.895 1.00 0.00 C ATOM 1526 O ASP A 124 23.690 3.764 5.640 1.00 0.00 O ATOM 1527 CB ASP A 124 21.133 5.964 5.302 1.00 0.00 C ATOM 1528 CG ASP A 124 21.374 6.205 6.794 1.00 0.00 C ATOM 1529 OD1 ASP A 124 21.505 5.195 7.518 1.00 0.00 O ATOM 1530 OD2 ASP A 124 21.422 7.394 7.177 1.00 0.00 O ATOM 0 H ASP A 124 21.385 3.458 6.515 1.00 0.00 H new ATOM 0 HA ASP A 124 21.297 4.489 3.743 1.00 0.00 H new ATOM 0 HB2 ASP A 124 21.630 6.752 4.737 1.00 0.00 H new ATOM 0 HB3 ASP A 124 20.065 6.054 5.103 1.00 0.00 H new ATOM 1534 N LYS A 125 23.780 5.460 4.146 1.00 0.00 N ATOM 1535 CA LYS A 125 25.230 5.539 4.155 1.00 0.00 C ATOM 1536 C LYS A 125 25.814 4.158 3.850 1.00 0.00 C ATOM 1537 O LYS A 125 26.544 3.595 4.664 1.00 0.00 O ATOM 1538 CB LYS A 125 25.726 6.139 5.472 1.00 0.00 C ATOM 1539 CG LYS A 125 25.712 7.668 5.419 1.00 0.00 C ATOM 1540 CD LYS A 125 26.990 8.204 4.769 1.00 0.00 C ATOM 1541 CE LYS A 125 26.666 9.267 3.718 1.00 0.00 C ATOM 1542 NZ LYS A 125 27.409 10.516 3.997 1.00 0.00 N ATOM 0 H LYS A 125 23.320 6.129 3.529 1.00 0.00 H new ATOM 0 HA LYS A 125 25.579 6.213 3.373 1.00 0.00 H new ATOM 0 HB2 LYS A 125 25.096 5.794 6.292 1.00 0.00 H new ATOM 0 HB3 LYS A 125 26.737 5.788 5.677 1.00 0.00 H new ATOM 0 HG2 LYS A 125 24.843 8.008 4.856 1.00 0.00 H new ATOM 0 HG3 LYS A 125 25.616 8.070 6.428 1.00 0.00 H new ATOM 0 HD2 LYS A 125 27.640 8.630 5.533 1.00 0.00 H new ATOM 0 HD3 LYS A 125 27.538 7.384 4.305 1.00 0.00 H new ATOM 0 HE2 LYS A 125 26.925 8.897 2.726 1.00 0.00 H new ATOM 0 HE3 LYS A 125 25.595 9.468 3.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 27.177 11.227 3.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 27.142 10.877 4.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 28.431 10.324 3.978 1.00 0.00 H new ATOM 1552 N GLN A 126 25.471 3.653 2.674 1.00 0.00 N ATOM 1553 CA GLN A 126 25.953 2.349 2.251 1.00 0.00 C ATOM 1554 C GLN A 126 27.480 2.300 2.314 1.00 0.00 C ATOM 1555 O GLN A 126 28.158 2.992 1.556 1.00 0.00 O ATOM 1556 CB GLN A 126 25.450 2.008 0.847 1.00 0.00 C ATOM 1557 CG GLN A 126 24.690 0.680 0.844 1.00 0.00 C ATOM 1558 CD GLN A 126 25.324 -0.311 -0.135 1.00 0.00 C ATOM 1559 OE1 GLN A 126 25.124 -0.251 -1.336 1.00 0.00 O ATOM 1560 NE2 GLN A 126 26.096 -1.226 0.446 1.00 0.00 N ATOM 0 H GLN A 126 24.865 4.123 2.001 1.00 0.00 H new ATOM 0 HA GLN A 126 25.558 1.598 2.935 1.00 0.00 H new ATOM 0 HB2 GLN A 126 24.799 2.804 0.487 1.00 0.00 H new ATOM 0 HB3 GLN A 126 26.293 1.950 0.159 1.00 0.00 H new ATOM 0 HG2 GLN A 126 24.689 0.255 1.848 1.00 0.00 H new ATOM 0 HG3 GLN A 126 23.649 0.853 0.570 1.00 0.00 H new ATOM 0 HE21 GLN A 126 26.221 -1.219 1.458 1.00 0.00 H new ATOM 0 HE22 GLN A 126 26.563 -1.934 -0.121 1.00 0.00 H new ATOM 1567 N ARG A 127 27.978 1.477 3.224 1.00 0.00 N ATOM 1568 CA ARG A 127 29.413 1.330 3.395 1.00 0.00 C ATOM 1569 C ARG A 127 30.016 0.580 2.206 1.00 0.00 C ATOM 1570 O ARG A 127 30.159 -0.640 2.244 1.00 0.00 O ATOM 1571 CB ARG A 127 29.740 0.572 4.685 1.00 0.00 C ATOM 1572 CG ARG A 127 30.223 1.529 5.776 1.00 0.00 C ATOM 1573 CD ARG A 127 31.682 1.928 5.548 1.00 0.00 C ATOM 1574 NE ARG A 127 31.749 3.169 4.745 1.00 0.00 N ATOM 1575 CZ ARG A 127 32.823 3.552 4.041 1.00 0.00 C ATOM 1576 NH1 ARG A 127 33.927 2.792 4.037 1.00 0.00 N ATOM 1577 NH2 ARG A 127 32.793 4.695 3.342 1.00 0.00 N ATOM 0 H ARG A 127 27.413 0.905 3.851 1.00 0.00 H new ATOM 0 HA ARG A 127 29.843 2.330 3.455 1.00 0.00 H new ATOM 0 HB2 ARG A 127 28.855 0.037 5.031 1.00 0.00 H new ATOM 0 HB3 ARG A 127 30.507 -0.176 4.487 1.00 0.00 H new ATOM 0 HG2 ARG A 127 29.596 2.420 5.787 1.00 0.00 H new ATOM 0 HG3 ARG A 127 30.120 1.055 6.752 1.00 0.00 H new ATOM 0 HD2 ARG A 127 32.180 2.078 6.506 1.00 0.00 H new ATOM 0 HD3 ARG A 127 32.211 1.125 5.035 1.00 0.00 H new ATOM 0 HE ARG A 127 30.926 3.771 4.726 1.00 0.00 H new ATOM 0 HH11 ARG A 127 33.949 1.922 4.570 1.00 0.00 H new ATOM 0 HH12 ARG A 127 34.745 3.083 3.501 1.00 0.00 H new ATOM 0 HH21 ARG A 127 31.953 5.273 3.346 1.00 0.00 H new ATOM 0 HH22 ARG A 127 33.610 4.987 2.806 1.00 0.00 H new ATOM 1588 N LYS A 128 30.352 1.343 1.175 1.00 0.00 N ATOM 1589 CA LYS A 128 30.936 0.766 -0.024 1.00 0.00 C ATOM 1590 C LYS A 128 32.277 1.443 -0.308 1.00 0.00 C ATOM 1591 O LYS A 128 32.598 2.471 0.288 1.00 0.00 O ATOM 1592 CB LYS A 128 29.949 0.843 -1.190 1.00 0.00 C ATOM 1593 CG LYS A 128 29.765 -0.527 -1.845 1.00 0.00 C ATOM 1594 CD LYS A 128 28.568 -1.266 -1.244 1.00 0.00 C ATOM 1595 CE LYS A 128 28.978 -2.648 -0.730 1.00 0.00 C ATOM 1596 NZ LYS A 128 28.551 -3.701 -1.677 1.00 0.00 N ATOM 0 H LYS A 128 30.231 2.355 1.146 1.00 0.00 H new ATOM 0 HA LYS A 128 31.139 -0.295 0.123 1.00 0.00 H new ATOM 0 HB2 LYS A 128 28.987 1.211 -0.833 1.00 0.00 H new ATOM 0 HB3 LYS A 128 30.310 1.558 -1.930 1.00 0.00 H new ATOM 0 HG2 LYS A 128 29.620 -0.404 -2.918 1.00 0.00 H new ATOM 0 HG3 LYS A 128 30.668 -1.122 -1.712 1.00 0.00 H new ATOM 0 HD2 LYS A 128 28.148 -0.680 -0.427 1.00 0.00 H new ATOM 0 HD3 LYS A 128 27.786 -1.371 -1.996 1.00 0.00 H new ATOM 0 HE2 LYS A 128 30.059 -2.687 -0.597 1.00 0.00 H new ATOM 0 HE3 LYS A 128 28.530 -2.826 0.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 28.837 -4.632 -1.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 27.517 -3.674 -1.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 28.998 -3.539 -2.602 1.00 0.00 H new ATOM 1606 N TYR A 129 33.028 0.839 -1.218 1.00 0.00 N ATOM 1607 CA TYR A 129 34.328 1.371 -1.589 1.00 0.00 C ATOM 1608 C TYR A 129 35.228 1.525 -0.362 1.00 0.00 C ATOM 1609 O TYR A 129 34.772 1.367 0.770 1.00 0.00 O ATOM 1610 CB TYR A 129 34.063 2.752 -2.190 1.00 0.00 C ATOM 1611 CG TYR A 129 34.119 2.788 -3.718 1.00 0.00 C ATOM 1612 CD1 TYR A 129 33.132 2.170 -4.460 1.00 0.00 C ATOM 1613 CD2 TYR A 129 35.155 3.438 -4.356 1.00 0.00 C ATOM 1614 CE1 TYR A 129 33.184 2.203 -5.897 1.00 0.00 C ATOM 1615 CE2 TYR A 129 35.207 3.472 -5.795 1.00 0.00 C ATOM 1616 CZ TYR A 129 34.219 2.853 -6.495 1.00 0.00 C ATOM 1617 OH TYR A 129 34.268 2.884 -7.854 1.00 0.00 O ATOM 0 H TYR A 129 32.760 -0.014 -1.709 1.00 0.00 H new ATOM 0 HA TYR A 129 34.831 0.702 -2.287 1.00 0.00 H new ATOM 0 HB2 TYR A 129 33.081 3.096 -1.865 1.00 0.00 H new ATOM 0 HB3 TYR A 129 34.795 3.456 -1.793 1.00 0.00 H new ATOM 0 HD1 TYR A 129 32.320 1.661 -3.961 1.00 0.00 H new ATOM 0 HD2 TYR A 129 35.927 3.922 -3.776 1.00 0.00 H new ATOM 0 HE1 TYR A 129 32.419 1.723 -6.488 1.00 0.00 H new ATOM 0 HE2 TYR A 129 36.013 3.978 -6.307 1.00 0.00 H new ATOM 0 HH TYR A 129 35.061 3.383 -8.141 1.00 0.00 H new ATOM 1626 N ASP A 130 36.489 1.832 -0.627 1.00 0.00 N ATOM 1627 CA ASP A 130 37.457 2.009 0.442 1.00 0.00 C ATOM 1628 C ASP A 130 38.598 2.900 -0.051 1.00 0.00 C ATOM 1629 O ASP A 130 39.007 2.807 -1.208 1.00 0.00 O ATOM 1630 CB ASP A 130 38.055 0.668 0.873 1.00 0.00 C ATOM 1631 CG ASP A 130 38.796 -0.091 -0.229 1.00 0.00 C ATOM 1632 OD1 ASP A 130 38.132 -0.423 -1.235 1.00 0.00 O ATOM 1633 OD2 ASP A 130 40.010 -0.325 -0.040 1.00 0.00 O ATOM 0 H ASP A 130 36.863 1.963 -1.567 1.00 0.00 H new ATOM 0 HA ASP A 130 36.943 2.463 1.290 1.00 0.00 H new ATOM 0 HB2 ASP A 130 38.744 0.843 1.700 1.00 0.00 H new ATOM 0 HB3 ASP A 130 37.254 0.035 1.254 1.00 0.00 H new ATOM 1637 N LEU A 131 39.081 3.743 0.850 1.00 0.00 N ATOM 1638 CA LEU A 131 40.168 4.650 0.520 1.00 0.00 C ATOM 1639 C LEU A 131 41.343 3.846 -0.040 1.00 0.00 C ATOM 1640 O LEU A 131 41.502 2.668 0.276 1.00 0.00 O ATOM 1641 CB LEU A 131 40.533 5.510 1.731 1.00 0.00 C ATOM 1642 CG LEU A 131 41.121 6.888 1.421 1.00 0.00 C ATOM 1643 CD1 LEU A 131 40.245 8.002 1.999 1.00 0.00 C ATOM 1644 CD2 LEU A 131 42.569 6.989 1.905 1.00 0.00 C ATOM 0 H LEU A 131 38.740 3.817 1.808 1.00 0.00 H new ATOM 0 HA LEU A 131 39.860 5.349 -0.257 1.00 0.00 H new ATOM 0 HB2 LEU A 131 39.638 5.647 2.338 1.00 0.00 H new ATOM 0 HB3 LEU A 131 41.250 4.959 2.340 1.00 0.00 H new ATOM 0 HG LEU A 131 41.133 7.017 0.339 1.00 0.00 H new ATOM 0 HD11 LEU A 131 40.686 8.971 1.764 1.00 0.00 H new ATOM 0 HD12 LEU A 131 39.247 7.943 1.564 1.00 0.00 H new ATOM 0 HD13 LEU A 131 40.177 7.887 3.081 1.00 0.00 H new ATOM 0 HD21 LEU A 131 42.962 7.978 1.672 1.00 0.00 H new ATOM 0 HD22 LEU A 131 42.604 6.829 2.983 1.00 0.00 H new ATOM 0 HD23 LEU A 131 43.173 6.232 1.406 1.00 0.00 H new ATOM 1655 N HIS A 132 42.138 4.517 -0.862 1.00 0.00 N ATOM 1656 CA HIS A 132 43.295 3.880 -1.469 1.00 0.00 C ATOM 1657 C HIS A 132 44.573 4.567 -0.983 1.00 0.00 C ATOM 1658 O HIS A 132 44.549 5.742 -0.619 1.00 0.00 O ATOM 1659 CB HIS A 132 43.171 3.868 -2.993 1.00 0.00 C ATOM 1660 CG HIS A 132 43.766 5.082 -3.667 1.00 0.00 C ATOM 1661 ND1 HIS A 132 43.132 6.311 -3.693 1.00 0.00 N ATOM 1662 CD2 HIS A 132 44.943 5.241 -4.339 1.00 0.00 C ATOM 1663 CE1 HIS A 132 43.901 7.165 -4.353 1.00 0.00 C ATOM 1664 NE2 HIS A 132 45.022 6.499 -4.753 1.00 0.00 N ATOM 0 H HIS A 132 42.004 5.494 -1.121 1.00 0.00 H new ATOM 0 HA HIS A 132 43.345 2.836 -1.159 1.00 0.00 H new ATOM 0 HB2 HIS A 132 43.660 2.974 -3.380 1.00 0.00 H new ATOM 0 HB3 HIS A 132 42.117 3.796 -3.261 1.00 0.00 H new ATOM 0 HD2 HIS A 132 45.684 4.473 -4.506 1.00 0.00 H new ATOM 0 HE1 HIS A 132 43.679 8.205 -4.541 1.00 0.00 H new ATOM 0 HE2 HIS A 132 45.794 6.902 -5.283 1.00 0.00 H new ATOM 1672 N TYR A 133 45.656 3.805 -0.993 1.00 0.00 N ATOM 1673 CA TYR A 133 46.942 4.327 -0.558 1.00 0.00 C ATOM 1674 C TYR A 133 47.427 5.437 -1.492 1.00 0.00 C ATOM 1675 O TYR A 133 47.273 5.343 -2.708 1.00 0.00 O ATOM 1676 CB TYR A 133 47.919 3.152 -0.632 1.00 0.00 C ATOM 1677 CG TYR A 133 49.392 3.564 -0.578 1.00 0.00 C ATOM 1678 CD1 TYR A 133 49.861 4.310 0.483 1.00 0.00 C ATOM 1679 CD2 TYR A 133 50.250 3.188 -1.591 1.00 0.00 C ATOM 1680 CE1 TYR A 133 51.247 4.699 0.533 1.00 0.00 C ATOM 1681 CE2 TYR A 133 51.636 3.576 -1.541 1.00 0.00 C ATOM 1682 CZ TYR A 133 52.067 4.312 -0.481 1.00 0.00 C ATOM 1683 OH TYR A 133 53.375 4.678 -0.434 1.00 0.00 O ATOM 0 H TYR A 133 45.671 2.831 -1.295 1.00 0.00 H new ATOM 0 HA TYR A 133 46.867 4.747 0.445 1.00 0.00 H new ATOM 0 HB2 TYR A 133 47.713 2.469 0.192 1.00 0.00 H new ATOM 0 HB3 TYR A 133 47.740 2.601 -1.555 1.00 0.00 H new ATOM 0 HD1 TYR A 133 49.189 4.602 1.276 1.00 0.00 H new ATOM 0 HD2 TYR A 133 49.882 2.603 -2.421 1.00 0.00 H new ATOM 0 HE1 TYR A 133 51.627 5.285 1.357 1.00 0.00 H new ATOM 0 HE2 TYR A 133 52.318 3.289 -2.328 1.00 0.00 H new ATOM 0 HH TYR A 133 53.840 4.331 -1.223 1.00 0.00 H new TER 1692 TYR A 133