USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 916 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 91 THR OG1 : rot 169:sc= 1.23 USER MOD Set 1.2: A 112 TYR OH : rot -142:sc= 0.887 USER MOD Set 2.1: A 56 TYR OH : rot 152:sc= 1.04 USER MOD Set 2.2: A 82 LYS NZ :NH3+ -137:sc= 1.33 (180deg=0.106) USER MOD Single : A 22 ASN :FLIP amide:sc= 0 F(o=-2,f=0) USER MOD Single : A 29 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 30 THR OG1 : rot 113:sc= 1.39 USER MOD Single : A 34 THR OG1 : rot -83:sc= 0.759 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= -0.004 USER MOD Single : A 40 GLN : amide:sc= 0.998 K(o=1,f=-6.4!) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot -150:sc= -0.707 USER MOD Single : A 47 GLN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 50 TYR OH : rot 44:sc= 0.156 USER MOD Single : A 51 LYS NZ :NH3+ -173:sc= 1.21 (180deg=1.16) USER MOD Single : A 58 SER OG : rot -102:sc= 1.4 USER MOD Single : A 61 ASN : amide:sc= 0.0088 X(o=0.0088,f=0) USER MOD Single : A 64 MET CE :methyl -124:sc= -1.08 (180deg=-1.54) USER MOD Single : A 68 LYS NZ :NH3+ 167:sc= -0.0245 (180deg=-0.203) USER MOD Single : A 75 ASN : amide:sc= -1.94 K(o=-1.9,f=-8.8!) USER MOD Single : A 79 LYS NZ :NH3+ 159:sc= -1.4 (180deg=-2.07!) USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 87 HIS :FLIP no HE2:sc= 0.102 F(o=-0.42,f=0.1) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot -42:sc= -1.09 USER MOD Single : A 99 THR OG1 : rot -43:sc= 0.0569 USER MOD Single : A 102 ASN :FLIP amide:sc= -0.0245 F(o=-1.1,f=-0.025) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= -0.264 USER MOD Single : A 115 ASN : amide:sc= 0.0729 K(o=0.073,f=-0.58) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 GLN : amide:sc= -0.671 X(o=-0.67,f=-0.19) USER MOD Single : A 125 ASN : amide:sc= -0.553 K(o=-0.55,f=-5.8!) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 THR OG1 : rot -86:sc= 1.21 USER MOD Single : A 135 THR OG1 : rot 150:sc= 0.361 USER MOD Single : A 136 ASN : amide:sc= -1.89! C(o=-1.9!,f=-4!) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 20 30.598 -0.821 0.436 1.00 0.00 N ATOM 2 CA ASP A 20 29.973 -1.999 -0.095 1.00 0.00 C ATOM 3 C ASP A 20 29.323 -2.758 1.038 1.00 0.00 C ATOM 4 O ASP A 20 29.973 -3.071 2.046 1.00 0.00 O ATOM 5 CB ASP A 20 30.987 -2.896 -0.813 1.00 0.00 C ATOM 6 CG ASP A 20 31.773 -2.193 -1.906 1.00 0.00 C ATOM 7 OD1 ASP A 20 31.173 -1.531 -2.788 1.00 0.00 O ATOM 8 OD2 ASP A 20 33.024 -2.259 -1.889 1.00 0.00 O ATOM 0 HA ASP A 20 29.223 -1.699 -0.827 1.00 0.00 H new ATOM 0 HB2 ASP A 20 31.686 -3.297 -0.078 1.00 0.00 H new ATOM 0 HB3 ASP A 20 30.460 -3.745 -1.248 1.00 0.00 H new ATOM 13 N CYS A 21 28.060 -3.018 0.884 1.00 0.00 N ATOM 14 CA CYS A 21 27.255 -3.681 1.879 1.00 0.00 C ATOM 15 C CYS A 21 27.661 -5.122 2.024 1.00 0.00 C ATOM 16 O CYS A 21 28.018 -5.776 1.053 1.00 0.00 O ATOM 17 CB CYS A 21 25.788 -3.591 1.496 1.00 0.00 C ATOM 18 SG CYS A 21 25.171 -1.894 1.368 1.00 0.00 S ATOM 0 H CYS A 21 27.542 -2.770 0.041 1.00 0.00 H new ATOM 0 HA CYS A 21 27.411 -3.184 2.837 1.00 0.00 H new ATOM 0 HB2 CYS A 21 25.640 -4.095 0.541 1.00 0.00 H new ATOM 0 HB3 CYS A 21 25.195 -4.129 2.236 1.00 0.00 H new ATOM 23 N ASN A 22 27.648 -5.600 3.241 1.00 0.00 N ATOM 24 CA ASN A 22 27.998 -6.987 3.543 1.00 0.00 C ATOM 25 C ASN A 22 26.750 -7.724 4.028 1.00 0.00 C ATOM 26 O ASN A 22 26.835 -8.787 4.633 1.00 0.00 O ATOM 27 CB ASN A 22 29.091 -7.042 4.638 1.00 0.00 C ATOM 28 CG ASN A 22 30.507 -6.710 4.178 1.00 0.00 C ATOM 29 OD1 ASN A 22 30.650 -5.906 3.165 1.00 0.00 O flip ATOM 30 ND2 ASN A 22 31.478 -7.191 4.758 1.00 0.00 N flip ATOM 0 H ASN A 22 27.396 -5.048 4.061 1.00 0.00 H new ATOM 0 HA ASN A 22 28.384 -7.462 2.641 1.00 0.00 H new ATOM 0 HB2 ASN A 22 28.816 -6.350 5.434 1.00 0.00 H new ATOM 0 HB3 ASN A 22 29.095 -8.042 5.071 1.00 0.00 H new ATOM 0 HD21 ASN A 22 31.340 -7.819 5.550 1.00 0.00 H new ATOM 0 HD22 ASN A 22 32.422 -6.962 4.448 1.00 0.00 H new ATOM 37 N GLU A 23 25.605 -7.159 3.710 1.00 0.00 N ATOM 38 CA GLU A 23 24.300 -7.669 4.111 1.00 0.00 C ATOM 39 C GLU A 23 23.309 -7.204 3.118 1.00 0.00 C ATOM 40 O GLU A 23 23.564 -6.266 2.356 1.00 0.00 O ATOM 41 CB GLU A 23 23.924 -7.153 5.498 1.00 0.00 C ATOM 42 CG GLU A 23 23.838 -5.627 5.563 1.00 0.00 C ATOM 43 CD GLU A 23 23.492 -5.105 6.924 1.00 0.00 C ATOM 44 OE1 GLU A 23 24.410 -4.962 7.759 1.00 0.00 O ATOM 45 OE2 GLU A 23 22.304 -4.801 7.177 1.00 0.00 O ATOM 0 H GLU A 23 25.549 -6.308 3.150 1.00 0.00 H new ATOM 0 HA GLU A 23 24.323 -8.758 4.153 1.00 0.00 H new ATOM 0 HB2 GLU A 23 22.964 -7.579 5.790 1.00 0.00 H new ATOM 0 HB3 GLU A 23 24.661 -7.501 6.222 1.00 0.00 H new ATOM 0 HG2 GLU A 23 24.793 -5.204 5.252 1.00 0.00 H new ATOM 0 HG3 GLU A 23 23.090 -5.283 4.849 1.00 0.00 H new ATOM 52 N LEU A 24 22.253 -7.927 3.067 1.00 0.00 N ATOM 53 CA LEU A 24 21.191 -7.724 2.220 1.00 0.00 C ATOM 54 C LEU A 24 20.200 -6.742 2.785 1.00 0.00 C ATOM 55 O LEU A 24 20.151 -6.549 4.010 1.00 0.00 O ATOM 56 CB LEU A 24 20.608 -9.097 1.999 1.00 0.00 C ATOM 57 CG LEU A 24 21.409 -9.972 1.053 1.00 0.00 C ATOM 58 CD1 LEU A 24 21.377 -9.437 -0.312 1.00 0.00 C ATOM 59 CD2 LEU A 24 22.812 -10.115 1.441 1.00 0.00 C ATOM 0 H LEU A 24 22.121 -8.735 3.675 1.00 0.00 H new ATOM 0 HA LEU A 24 21.494 -7.271 1.276 1.00 0.00 H new ATOM 0 HB2 LEU A 24 20.526 -9.603 2.961 1.00 0.00 H new ATOM 0 HB3 LEU A 24 19.596 -8.990 1.607 1.00 0.00 H new ATOM 0 HG LEU A 24 20.934 -10.952 1.102 1.00 0.00 H new ATOM 0 HD11 LEU A 24 21.959 -10.083 -0.970 1.00 0.00 H new ATOM 0 HD12 LEU A 24 20.346 -9.396 -0.663 1.00 0.00 H new ATOM 0 HD13 LEU A 24 21.803 -8.434 -0.320 1.00 0.00 H new ATOM 0 HD21 LEU A 24 23.325 -10.753 0.721 1.00 0.00 H new ATOM 0 HD22 LEU A 24 23.286 -9.134 1.459 1.00 0.00 H new ATOM 0 HD23 LEU A 24 22.871 -10.565 2.432 1.00 0.00 H new ATOM 71 N PRO A 25 19.449 -6.064 1.900 1.00 0.00 N ATOM 72 CA PRO A 25 18.453 -5.073 2.288 1.00 0.00 C ATOM 73 C PRO A 25 17.448 -5.625 3.300 1.00 0.00 C ATOM 74 O PRO A 25 16.792 -6.650 3.048 1.00 0.00 O ATOM 75 CB PRO A 25 17.750 -4.718 0.964 1.00 0.00 C ATOM 76 CG PRO A 25 18.168 -5.771 0.002 1.00 0.00 C ATOM 77 CD PRO A 25 19.514 -6.209 0.438 1.00 0.00 C ATOM 0 HA PRO A 25 18.909 -4.214 2.780 1.00 0.00 H new ATOM 0 HB2 PRO A 25 16.667 -4.704 1.085 1.00 0.00 H new ATOM 0 HB3 PRO A 25 18.044 -3.728 0.616 1.00 0.00 H new ATOM 0 HG2 PRO A 25 17.466 -6.605 0.006 1.00 0.00 H new ATOM 0 HG3 PRO A 25 18.195 -5.382 -1.016 1.00 0.00 H new ATOM 0 HD2 PRO A 25 19.719 -7.238 0.143 1.00 0.00 H new ATOM 0 HD3 PRO A 25 20.300 -5.590 0.005 1.00 0.00 H new ATOM 85 N PRO A 26 17.343 -4.981 4.473 1.00 0.00 N ATOM 86 CA PRO A 26 16.414 -5.399 5.506 1.00 0.00 C ATOM 87 C PRO A 26 14.985 -5.244 5.027 1.00 0.00 C ATOM 88 O PRO A 26 14.619 -4.182 4.495 1.00 0.00 O ATOM 89 CB PRO A 26 16.679 -4.424 6.663 1.00 0.00 C ATOM 90 CG PRO A 26 17.997 -3.810 6.361 1.00 0.00 C ATOM 91 CD PRO A 26 18.112 -3.795 4.875 1.00 0.00 C ATOM 0 HA PRO A 26 16.547 -6.444 5.786 1.00 0.00 H new ATOM 0 HB2 PRO A 26 15.897 -3.667 6.727 1.00 0.00 H new ATOM 0 HB3 PRO A 26 16.697 -4.945 7.620 1.00 0.00 H new ATOM 0 HG2 PRO A 26 18.060 -2.801 6.767 1.00 0.00 H new ATOM 0 HG3 PRO A 26 18.807 -4.385 6.809 1.00 0.00 H new ATOM 0 HD2 PRO A 26 17.699 -2.882 4.447 1.00 0.00 H new ATOM 0 HD3 PRO A 26 19.150 -3.858 4.550 1.00 0.00 H new ATOM 99 N ARG A 27 14.178 -6.282 5.218 1.00 0.00 N ATOM 100 CA ARG A 27 12.809 -6.246 4.774 1.00 0.00 C ATOM 101 C ARG A 27 12.051 -5.155 5.491 1.00 0.00 C ATOM 102 O ARG A 27 12.298 -4.869 6.675 1.00 0.00 O ATOM 103 CB ARG A 27 12.098 -7.585 4.930 1.00 0.00 C ATOM 104 CG ARG A 27 11.958 -8.085 6.342 1.00 0.00 C ATOM 105 CD ARG A 27 11.129 -9.341 6.368 1.00 0.00 C ATOM 106 NE ARG A 27 9.746 -9.100 5.919 1.00 0.00 N ATOM 107 CZ ARG A 27 8.630 -9.332 6.632 1.00 0.00 C ATOM 108 NH1 ARG A 27 8.690 -9.822 7.866 1.00 0.00 N ATOM 109 NH2 ARG A 27 7.451 -9.067 6.097 1.00 0.00 N ATOM 0 H ARG A 27 14.456 -7.150 5.676 1.00 0.00 H new ATOM 0 HA ARG A 27 12.830 -6.028 3.706 1.00 0.00 H new ATOM 0 HB2 ARG A 27 11.103 -7.501 4.493 1.00 0.00 H new ATOM 0 HB3 ARG A 27 12.639 -8.333 4.350 1.00 0.00 H new ATOM 0 HG2 ARG A 27 12.943 -8.282 6.765 1.00 0.00 H new ATOM 0 HG3 ARG A 27 11.492 -7.320 6.962 1.00 0.00 H new ATOM 0 HD2 ARG A 27 11.591 -10.094 5.729 1.00 0.00 H new ATOM 0 HD3 ARG A 27 11.116 -9.746 7.380 1.00 0.00 H new ATOM 0 HE ARG A 27 9.624 -8.722 4.980 1.00 0.00 H new ATOM 0 HH11 ARG A 27 9.595 -10.029 8.289 1.00 0.00 H new ATOM 0 HH12 ARG A 27 7.831 -9.991 8.390 1.00 0.00 H new ATOM 0 HH21 ARG A 27 7.393 -8.690 5.151 1.00 0.00 H new ATOM 0 HH22 ARG A 27 6.599 -9.240 6.630 1.00 0.00 H new ATOM 123 N ARG A 28 11.151 -4.556 4.795 1.00 0.00 N ATOM 124 CA ARG A 28 10.409 -3.444 5.302 1.00 0.00 C ATOM 125 C ARG A 28 9.084 -3.970 5.798 1.00 0.00 C ATOM 126 O ARG A 28 8.724 -5.108 5.494 1.00 0.00 O ATOM 127 CB ARG A 28 10.178 -2.475 4.164 1.00 0.00 C ATOM 128 CG ARG A 28 11.445 -1.984 3.464 1.00 0.00 C ATOM 129 CD ARG A 28 12.163 -0.940 4.265 1.00 0.00 C ATOM 130 NE ARG A 28 11.331 0.256 4.434 1.00 0.00 N ATOM 131 CZ ARG A 28 11.747 1.427 4.911 1.00 0.00 C ATOM 132 NH1 ARG A 28 13.027 1.599 5.282 1.00 0.00 N ATOM 133 NH2 ARG A 28 10.880 2.421 5.017 1.00 0.00 N ATOM 0 H ARG A 28 10.902 -4.824 3.843 1.00 0.00 H new ATOM 0 HA ARG A 28 10.940 -2.940 6.110 1.00 0.00 H new ATOM 0 HB2 ARG A 28 9.535 -2.953 3.425 1.00 0.00 H new ATOM 0 HB3 ARG A 28 9.635 -1.611 4.547 1.00 0.00 H new ATOM 0 HG2 ARG A 28 12.112 -2.828 3.289 1.00 0.00 H new ATOM 0 HG3 ARG A 28 11.184 -1.576 2.488 1.00 0.00 H new ATOM 0 HD2 ARG A 28 12.428 -1.344 5.242 1.00 0.00 H new ATOM 0 HD3 ARG A 28 13.095 -0.672 3.768 1.00 0.00 H new ATOM 0 HE ARG A 28 10.350 0.184 4.163 1.00 0.00 H new ATOM 0 HH11 ARG A 28 13.690 0.828 5.199 1.00 0.00 H new ATOM 0 HH12 ARG A 28 13.336 2.500 5.646 1.00 0.00 H new ATOM 0 HH21 ARG A 28 9.909 2.283 4.735 1.00 0.00 H new ATOM 0 HH22 ARG A 28 11.182 3.325 5.381 1.00 0.00 H new ATOM 147 N ASN A 29 8.358 -3.191 6.547 1.00 0.00 N ATOM 148 CA ASN A 29 7.058 -3.651 7.002 1.00 0.00 C ATOM 149 C ASN A 29 6.029 -3.440 5.910 1.00 0.00 C ATOM 150 O ASN A 29 5.310 -4.366 5.518 1.00 0.00 O ATOM 151 CB ASN A 29 6.609 -2.959 8.295 1.00 0.00 C ATOM 152 CG ASN A 29 5.231 -3.440 8.761 1.00 0.00 C ATOM 153 OD1 ASN A 29 4.833 -4.581 8.513 1.00 0.00 O ATOM 154 ND2 ASN A 29 4.506 -2.587 9.429 1.00 0.00 N ATOM 0 H ASN A 29 8.626 -2.256 6.855 1.00 0.00 H new ATOM 0 HA ASN A 29 7.148 -4.714 7.226 1.00 0.00 H new ATOM 0 HB2 ASN A 29 7.342 -3.148 9.079 1.00 0.00 H new ATOM 0 HB3 ASN A 29 6.581 -1.881 8.137 1.00 0.00 H new ATOM 0 HD21 ASN A 29 3.581 -2.856 9.763 1.00 0.00 H new ATOM 0 HD22 ASN A 29 4.864 -1.651 9.618 1.00 0.00 H new ATOM 161 N THR A 30 5.985 -2.244 5.403 1.00 0.00 N ATOM 162 CA THR A 30 5.058 -1.884 4.378 1.00 0.00 C ATOM 163 C THR A 30 5.638 -2.095 2.974 1.00 0.00 C ATOM 164 O THR A 30 4.947 -1.908 1.979 1.00 0.00 O ATOM 165 CB THR A 30 4.613 -0.430 4.590 1.00 0.00 C ATOM 166 OG1 THR A 30 5.741 0.332 5.081 1.00 0.00 O ATOM 167 CG2 THR A 30 3.472 -0.354 5.596 1.00 0.00 C ATOM 0 H THR A 30 6.600 -1.484 5.694 1.00 0.00 H new ATOM 0 HA THR A 30 4.190 -2.540 4.448 1.00 0.00 H new ATOM 0 HB THR A 30 4.261 -0.022 3.642 1.00 0.00 H new ATOM 0 HG1 THR A 30 6.016 0.983 4.402 1.00 0.00 H new ATOM 0 HG21 THR A 30 3.174 0.686 5.730 1.00 0.00 H new ATOM 0 HG22 THR A 30 2.623 -0.930 5.228 1.00 0.00 H new ATOM 0 HG23 THR A 30 3.801 -0.763 6.551 1.00 0.00 H new ATOM 175 N GLU A 31 6.892 -2.532 2.905 1.00 0.00 N ATOM 176 CA GLU A 31 7.548 -2.724 1.629 1.00 0.00 C ATOM 177 C GLU A 31 8.267 -4.092 1.547 1.00 0.00 C ATOM 178 O GLU A 31 8.589 -4.702 2.569 1.00 0.00 O ATOM 179 CB GLU A 31 8.523 -1.583 1.296 1.00 0.00 C ATOM 180 CG GLU A 31 7.955 -0.160 1.297 1.00 0.00 C ATOM 181 CD GLU A 31 7.849 0.488 2.682 1.00 0.00 C ATOM 182 OE1 GLU A 31 8.763 0.286 3.522 1.00 0.00 O ATOM 183 OE2 GLU A 31 6.876 1.247 2.930 1.00 0.00 O ATOM 0 H GLU A 31 7.467 -2.757 3.717 1.00 0.00 H new ATOM 0 HA GLU A 31 6.757 -2.713 0.879 1.00 0.00 H new ATOM 0 HB2 GLU A 31 9.345 -1.620 2.011 1.00 0.00 H new ATOM 0 HB3 GLU A 31 8.948 -1.777 0.311 1.00 0.00 H new ATOM 0 HG2 GLU A 31 8.583 0.467 0.665 1.00 0.00 H new ATOM 0 HG3 GLU A 31 6.964 -0.179 0.843 1.00 0.00 H new ATOM 190 N ILE A 32 8.506 -4.546 0.324 1.00 0.00 N ATOM 191 CA ILE A 32 9.117 -5.859 0.000 1.00 0.00 C ATOM 192 C ILE A 32 10.002 -5.630 -1.176 1.00 0.00 C ATOM 193 O ILE A 32 9.744 -4.755 -1.974 1.00 0.00 O ATOM 194 CB ILE A 32 8.009 -6.884 -0.442 1.00 0.00 C ATOM 195 CG1 ILE A 32 6.861 -6.957 0.565 1.00 0.00 C ATOM 196 CG2 ILE A 32 8.574 -8.280 -0.687 1.00 0.00 C ATOM 197 CD1 ILE A 32 5.709 -7.819 0.091 1.00 0.00 C ATOM 0 H ILE A 32 8.278 -4.003 -0.509 1.00 0.00 H new ATOM 0 HA ILE A 32 9.648 -6.252 0.867 1.00 0.00 H new ATOM 0 HB ILE A 32 7.616 -6.507 -1.386 1.00 0.00 H new ATOM 0 HG12 ILE A 32 7.238 -7.351 1.509 1.00 0.00 H new ATOM 0 HG13 ILE A 32 6.495 -5.950 0.764 1.00 0.00 H new ATOM 0 HG21 ILE A 32 7.769 -8.950 -0.990 1.00 0.00 H new ATOM 0 HG22 ILE A 32 9.325 -8.235 -1.476 1.00 0.00 H new ATOM 0 HG23 ILE A 32 9.032 -8.653 0.229 1.00 0.00 H new ATOM 0 HD11 ILE A 32 4.927 -7.830 0.850 1.00 0.00 H new ATOM 0 HD12 ILE A 32 5.308 -7.412 -0.837 1.00 0.00 H new ATOM 0 HD13 ILE A 32 6.062 -8.836 -0.081 1.00 0.00 H new ATOM 209 N LEU A 33 11.029 -6.393 -1.267 1.00 0.00 N ATOM 210 CA LEU A 33 11.944 -6.326 -2.363 1.00 0.00 C ATOM 211 C LEU A 33 11.247 -6.691 -3.671 1.00 0.00 C ATOM 212 O LEU A 33 10.221 -7.395 -3.683 1.00 0.00 O ATOM 213 CB LEU A 33 13.090 -7.288 -2.129 1.00 0.00 C ATOM 214 CG LEU A 33 14.163 -6.919 -1.118 1.00 0.00 C ATOM 215 CD1 LEU A 33 14.888 -5.644 -1.473 1.00 0.00 C ATOM 216 CD2 LEU A 33 13.684 -6.892 0.297 1.00 0.00 C ATOM 0 H LEU A 33 11.268 -7.099 -0.571 1.00 0.00 H new ATOM 0 HA LEU A 33 12.321 -5.306 -2.434 1.00 0.00 H new ATOM 0 HB2 LEU A 33 12.662 -8.242 -1.822 1.00 0.00 H new ATOM 0 HB3 LEU A 33 13.583 -7.453 -3.087 1.00 0.00 H new ATOM 0 HG LEU A 33 14.882 -7.736 -1.179 1.00 0.00 H new ATOM 0 HD11 LEU A 33 15.642 -5.431 -0.715 1.00 0.00 H new ATOM 0 HD12 LEU A 33 15.371 -5.758 -2.444 1.00 0.00 H new ATOM 0 HD13 LEU A 33 14.175 -4.820 -1.517 1.00 0.00 H new ATOM 0 HD21 LEU A 33 14.509 -6.620 0.955 1.00 0.00 H new ATOM 0 HD22 LEU A 33 12.884 -6.158 0.396 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.309 -7.877 0.573 1.00 0.00 H new ATOM 228 N THR A 34 11.761 -6.204 -4.746 1.00 0.00 N ATOM 229 CA THR A 34 11.217 -6.519 -6.042 1.00 0.00 C ATOM 230 C THR A 34 11.899 -7.747 -6.642 1.00 0.00 C ATOM 231 O THR A 34 11.328 -8.463 -7.479 1.00 0.00 O ATOM 232 CB THR A 34 11.334 -5.325 -6.985 1.00 0.00 C ATOM 233 OG1 THR A 34 12.668 -4.792 -6.925 1.00 0.00 O ATOM 234 CG2 THR A 34 10.323 -4.251 -6.614 1.00 0.00 C ATOM 0 H THR A 34 12.566 -5.578 -4.764 1.00 0.00 H new ATOM 0 HA THR A 34 10.160 -6.750 -5.912 1.00 0.00 H new ATOM 0 HB THR A 34 11.124 -5.656 -8.002 1.00 0.00 H new ATOM 0 HG1 THR A 34 12.744 -4.186 -6.159 1.00 0.00 H new ATOM 0 HG21 THR A 34 10.421 -3.407 -7.297 1.00 0.00 H new ATOM 0 HG22 THR A 34 9.315 -4.660 -6.685 1.00 0.00 H new ATOM 0 HG23 THR A 34 10.507 -3.915 -5.594 1.00 0.00 H new ATOM 242 N GLY A 35 13.081 -8.000 -6.193 1.00 0.00 N ATOM 243 CA GLY A 35 13.841 -9.115 -6.655 1.00 0.00 C ATOM 244 C GLY A 35 14.252 -9.997 -5.516 1.00 0.00 C ATOM 245 O GLY A 35 13.886 -9.742 -4.356 1.00 0.00 O ATOM 0 H GLY A 35 13.553 -7.434 -5.488 1.00 0.00 H new ATOM 0 HA2 GLY A 35 13.252 -9.690 -7.370 1.00 0.00 H new ATOM 0 HA3 GLY A 35 14.727 -8.762 -7.183 1.00 0.00 H new ATOM 249 N SER A 36 14.979 -11.024 -5.824 1.00 0.00 N ATOM 250 CA SER A 36 15.507 -11.902 -4.836 1.00 0.00 C ATOM 251 C SER A 36 16.980 -11.565 -4.671 1.00 0.00 C ATOM 252 O SER A 36 17.622 -11.066 -5.611 1.00 0.00 O ATOM 253 CB SER A 36 15.316 -13.368 -5.255 1.00 0.00 C ATOM 254 OG SER A 36 15.747 -14.260 -4.234 1.00 0.00 O ATOM 0 H SER A 36 15.224 -11.277 -6.781 1.00 0.00 H new ATOM 0 HA SER A 36 14.984 -11.775 -3.888 1.00 0.00 H new ATOM 0 HB2 SER A 36 14.265 -13.550 -5.479 1.00 0.00 H new ATOM 0 HB3 SER A 36 15.875 -13.562 -6.170 1.00 0.00 H new ATOM 0 HG SER A 36 15.612 -15.185 -4.529 1.00 0.00 H new ATOM 260 N TRP A 37 17.499 -11.768 -3.492 1.00 0.00 N ATOM 261 CA TRP A 37 18.874 -11.465 -3.199 1.00 0.00 C ATOM 262 C TRP A 37 19.386 -12.600 -2.375 1.00 0.00 C ATOM 263 O TRP A 37 18.659 -13.112 -1.516 1.00 0.00 O ATOM 264 CB TRP A 37 19.016 -10.186 -2.355 1.00 0.00 C ATOM 265 CG TRP A 37 18.233 -8.974 -2.811 1.00 0.00 C ATOM 266 CD1 TRP A 37 16.878 -8.832 -2.834 1.00 0.00 C ATOM 267 CD2 TRP A 37 18.767 -7.716 -3.245 1.00 0.00 C ATOM 268 NE1 TRP A 37 16.542 -7.603 -3.309 1.00 0.00 N ATOM 269 CE2 TRP A 37 17.681 -6.887 -3.553 1.00 0.00 C ATOM 270 CE3 TRP A 37 20.055 -7.218 -3.416 1.00 0.00 C ATOM 271 CZ2 TRP A 37 17.845 -5.583 -4.020 1.00 0.00 C ATOM 272 CZ3 TRP A 37 20.218 -5.927 -3.874 1.00 0.00 C ATOM 273 CH2 TRP A 37 19.118 -5.124 -4.171 1.00 0.00 C ATOM 0 H TRP A 37 16.978 -12.150 -2.703 1.00 0.00 H new ATOM 0 HA TRP A 37 19.417 -11.319 -4.133 1.00 0.00 H new ATOM 0 HB2 TRP A 37 18.716 -10.419 -1.333 1.00 0.00 H new ATOM 0 HB3 TRP A 37 20.072 -9.916 -2.324 1.00 0.00 H new ATOM 0 HD1 TRP A 37 16.172 -9.587 -2.520 1.00 0.00 H new ATOM 0 HE1 TRP A 37 15.590 -7.268 -3.460 1.00 0.00 H new ATOM 0 HE3 TRP A 37 20.914 -7.833 -3.193 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 16.994 -4.960 -4.253 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 21.215 -5.532 -4.005 1.00 0.00 H new ATOM 0 HH2 TRP A 37 19.279 -4.117 -4.528 1.00 0.00 H new ATOM 284 N SER A 38 20.569 -13.035 -2.623 1.00 0.00 N ATOM 285 CA SER A 38 21.127 -14.107 -1.847 1.00 0.00 C ATOM 286 C SER A 38 22.605 -13.891 -1.597 1.00 0.00 C ATOM 287 O SER A 38 23.307 -14.807 -1.172 1.00 0.00 O ATOM 288 CB SER A 38 20.891 -15.434 -2.570 1.00 0.00 C ATOM 289 OG SER A 38 19.496 -15.653 -2.784 1.00 0.00 O ATOM 0 H SER A 38 21.178 -12.671 -3.356 1.00 0.00 H new ATOM 0 HA SER A 38 20.631 -14.132 -0.877 1.00 0.00 H new ATOM 0 HB2 SER A 38 21.414 -15.431 -3.526 1.00 0.00 H new ATOM 0 HB3 SER A 38 21.306 -16.253 -1.982 1.00 0.00 H new ATOM 0 HG SER A 38 19.366 -16.506 -3.249 1.00 0.00 H new ATOM 295 N ASP A 39 23.088 -12.672 -1.797 1.00 0.00 N ATOM 296 CA ASP A 39 24.520 -12.461 -1.651 1.00 0.00 C ATOM 297 C ASP A 39 24.828 -11.335 -0.766 1.00 0.00 C ATOM 298 O ASP A 39 24.409 -10.234 -1.027 1.00 0.00 O ATOM 299 CB ASP A 39 25.241 -12.254 -2.957 1.00 0.00 C ATOM 300 CG ASP A 39 25.166 -13.397 -3.928 1.00 0.00 C ATOM 301 OD1 ASP A 39 25.981 -14.340 -3.832 1.00 0.00 O ATOM 302 OD2 ASP A 39 24.306 -13.353 -4.839 1.00 0.00 O ATOM 0 H ASP A 39 22.539 -11.850 -2.049 1.00 0.00 H new ATOM 0 HA ASP A 39 24.880 -13.389 -1.208 1.00 0.00 H new ATOM 0 HB2 ASP A 39 24.835 -11.364 -3.439 1.00 0.00 H new ATOM 0 HB3 ASP A 39 26.290 -12.050 -2.744 1.00 0.00 H new ATOM 307 N GLN A 40 25.628 -11.617 0.251 1.00 0.00 N ATOM 308 CA GLN A 40 25.978 -10.665 1.294 1.00 0.00 C ATOM 309 C GLN A 40 26.544 -9.383 0.749 1.00 0.00 C ATOM 310 O GLN A 40 26.092 -8.305 1.100 1.00 0.00 O ATOM 311 CB GLN A 40 26.962 -11.246 2.339 1.00 0.00 C ATOM 312 CG GLN A 40 26.495 -12.504 3.067 1.00 0.00 C ATOM 313 CD GLN A 40 26.812 -13.794 2.327 1.00 0.00 C ATOM 314 OE1 GLN A 40 26.899 -13.835 1.098 1.00 0.00 O ATOM 315 NE2 GLN A 40 26.981 -14.846 3.062 1.00 0.00 N ATOM 0 H GLN A 40 26.061 -12.532 0.377 1.00 0.00 H new ATOM 0 HA GLN A 40 25.032 -10.448 1.790 1.00 0.00 H new ATOM 0 HB2 GLN A 40 27.904 -11.468 1.838 1.00 0.00 H new ATOM 0 HB3 GLN A 40 27.170 -10.476 3.082 1.00 0.00 H new ATOM 0 HG2 GLN A 40 26.961 -12.537 4.052 1.00 0.00 H new ATOM 0 HG3 GLN A 40 25.418 -12.442 3.226 1.00 0.00 H new ATOM 0 HE21 GLN A 40 26.902 -14.777 4.077 1.00 0.00 H new ATOM 0 HE22 GLN A 40 27.193 -15.744 2.627 1.00 0.00 H new ATOM 324 N THR A 41 27.493 -9.489 -0.110 1.00 0.00 N ATOM 325 CA THR A 41 28.170 -8.327 -0.534 1.00 0.00 C ATOM 326 C THR A 41 27.633 -7.746 -1.848 1.00 0.00 C ATOM 327 O THR A 41 27.458 -8.455 -2.849 1.00 0.00 O ATOM 328 CB THR A 41 29.686 -8.547 -0.573 1.00 0.00 C ATOM 329 OG1 THR A 41 30.012 -9.641 -1.454 1.00 0.00 O ATOM 330 CG2 THR A 41 30.221 -8.862 0.820 1.00 0.00 C ATOM 0 H THR A 41 27.813 -10.363 -0.528 1.00 0.00 H new ATOM 0 HA THR A 41 27.964 -7.565 0.218 1.00 0.00 H new ATOM 0 HB THR A 41 30.147 -7.629 -0.939 1.00 0.00 H new ATOM 0 HG1 THR A 41 30.983 -9.769 -1.471 1.00 0.00 H new ATOM 0 HG21 THR A 41 31.299 -9.015 0.770 1.00 0.00 H new ATOM 0 HG22 THR A 41 30.003 -8.030 1.490 1.00 0.00 H new ATOM 0 HG23 THR A 41 29.744 -9.766 1.197 1.00 0.00 H new ATOM 338 N TYR A 42 27.346 -6.466 -1.803 1.00 0.00 N ATOM 339 CA TYR A 42 26.895 -5.685 -2.938 1.00 0.00 C ATOM 340 C TYR A 42 27.656 -4.380 -2.956 1.00 0.00 C ATOM 341 O TYR A 42 28.057 -3.898 -1.898 1.00 0.00 O ATOM 342 CB TYR A 42 25.379 -5.413 -2.891 1.00 0.00 C ATOM 343 CG TYR A 42 24.526 -6.515 -3.480 1.00 0.00 C ATOM 344 CD1 TYR A 42 24.196 -6.503 -4.832 1.00 0.00 C ATOM 345 CD2 TYR A 42 24.044 -7.549 -2.705 1.00 0.00 C ATOM 346 CE1 TYR A 42 23.409 -7.489 -5.387 1.00 0.00 C ATOM 347 CE2 TYR A 42 23.259 -8.542 -3.258 1.00 0.00 C ATOM 348 CZ TYR A 42 22.944 -8.506 -4.594 1.00 0.00 C ATOM 349 OH TYR A 42 22.138 -9.488 -5.137 1.00 0.00 O ATOM 0 H TYR A 42 27.422 -5.918 -0.946 1.00 0.00 H new ATOM 0 HA TYR A 42 27.087 -6.254 -3.848 1.00 0.00 H new ATOM 0 HB2 TYR A 42 25.083 -5.256 -1.854 1.00 0.00 H new ATOM 0 HB3 TYR A 42 25.172 -4.486 -3.425 1.00 0.00 H new ATOM 0 HD1 TYR A 42 24.564 -5.705 -5.459 1.00 0.00 H new ATOM 0 HD2 TYR A 42 24.283 -7.583 -1.652 1.00 0.00 H new ATOM 0 HE1 TYR A 42 23.161 -7.461 -6.438 1.00 0.00 H new ATOM 0 HE2 TYR A 42 22.893 -9.348 -2.639 1.00 0.00 H new ATOM 0 HH TYR A 42 21.896 -10.134 -4.441 1.00 0.00 H new ATOM 359 N PRO A 43 27.908 -3.806 -4.138 1.00 0.00 N ATOM 360 CA PRO A 43 28.653 -2.552 -4.259 1.00 0.00 C ATOM 361 C PRO A 43 27.878 -1.350 -3.716 1.00 0.00 C ATOM 362 O PRO A 43 26.630 -1.323 -3.744 1.00 0.00 O ATOM 363 CB PRO A 43 28.880 -2.400 -5.769 1.00 0.00 C ATOM 364 CG PRO A 43 27.814 -3.220 -6.413 1.00 0.00 C ATOM 365 CD PRO A 43 27.482 -4.330 -5.451 1.00 0.00 C ATOM 0 HA PRO A 43 29.575 -2.582 -3.678 1.00 0.00 H new ATOM 0 HB2 PRO A 43 28.811 -1.356 -6.074 1.00 0.00 H new ATOM 0 HB3 PRO A 43 29.872 -2.750 -6.055 1.00 0.00 H new ATOM 0 HG2 PRO A 43 26.933 -2.614 -6.623 1.00 0.00 H new ATOM 0 HG3 PRO A 43 28.158 -3.623 -7.365 1.00 0.00 H new ATOM 0 HD2 PRO A 43 26.417 -4.562 -5.462 1.00 0.00 H new ATOM 0 HD3 PRO A 43 28.011 -5.249 -5.704 1.00 0.00 H new ATOM 373 N GLU A 44 28.603 -0.370 -3.200 1.00 0.00 N ATOM 374 CA GLU A 44 27.977 0.837 -2.713 1.00 0.00 C ATOM 375 C GLU A 44 27.372 1.560 -3.901 1.00 0.00 C ATOM 376 O GLU A 44 27.999 1.647 -4.959 1.00 0.00 O ATOM 377 CB GLU A 44 28.968 1.769 -2.019 1.00 0.00 C ATOM 378 CG GLU A 44 28.269 2.825 -1.181 1.00 0.00 C ATOM 379 CD GLU A 44 29.158 3.917 -0.669 1.00 0.00 C ATOM 380 OE1 GLU A 44 29.515 4.810 -1.448 1.00 0.00 O ATOM 381 OE2 GLU A 44 29.450 3.944 0.535 1.00 0.00 O ATOM 0 H GLU A 44 29.619 -0.391 -3.110 1.00 0.00 H new ATOM 0 HA GLU A 44 27.222 0.559 -1.977 1.00 0.00 H new ATOM 0 HB2 GLU A 44 29.632 1.183 -1.383 1.00 0.00 H new ATOM 0 HB3 GLU A 44 29.592 2.256 -2.768 1.00 0.00 H new ATOM 0 HG2 GLU A 44 27.474 3.273 -1.777 1.00 0.00 H new ATOM 0 HG3 GLU A 44 27.793 2.336 -0.331 1.00 0.00 H new ATOM 388 N GLY A 45 26.174 2.047 -3.742 1.00 0.00 N ATOM 389 CA GLY A 45 25.509 2.708 -4.827 1.00 0.00 C ATOM 390 C GLY A 45 24.408 1.857 -5.397 1.00 0.00 C ATOM 391 O GLY A 45 23.669 2.291 -6.284 1.00 0.00 O ATOM 0 H GLY A 45 25.640 1.999 -2.874 1.00 0.00 H new ATOM 0 HA2 GLY A 45 25.096 3.655 -4.480 1.00 0.00 H new ATOM 0 HA3 GLY A 45 26.231 2.943 -5.609 1.00 0.00 H new ATOM 395 N THR A 46 24.281 0.652 -4.890 1.00 0.00 N ATOM 396 CA THR A 46 23.249 -0.242 -5.355 1.00 0.00 C ATOM 397 C THR A 46 21.915 0.012 -4.694 1.00 0.00 C ATOM 398 O THR A 46 21.790 -0.082 -3.482 1.00 0.00 O ATOM 399 CB THR A 46 23.660 -1.730 -5.272 1.00 0.00 C ATOM 400 OG1 THR A 46 24.800 -1.968 -6.105 1.00 0.00 O ATOM 401 CG2 THR A 46 22.514 -2.667 -5.669 1.00 0.00 C ATOM 0 H THR A 46 24.879 0.270 -4.157 1.00 0.00 H new ATOM 0 HA THR A 46 23.121 -0.015 -6.413 1.00 0.00 H new ATOM 0 HB THR A 46 23.912 -1.945 -4.234 1.00 0.00 H new ATOM 0 HG1 THR A 46 24.777 -2.891 -6.434 1.00 0.00 H new ATOM 0 HG21 THR A 46 22.848 -3.702 -5.596 1.00 0.00 H new ATOM 0 HG22 THR A 46 21.668 -2.511 -5.000 1.00 0.00 H new ATOM 0 HG23 THR A 46 22.210 -2.456 -6.694 1.00 0.00 H new ATOM 409 N GLN A 47 20.933 0.357 -5.502 1.00 0.00 N ATOM 410 CA GLN A 47 19.629 0.631 -5.005 1.00 0.00 C ATOM 411 C GLN A 47 18.777 -0.617 -4.932 1.00 0.00 C ATOM 412 O GLN A 47 18.875 -1.522 -5.779 1.00 0.00 O ATOM 413 CB GLN A 47 18.930 1.731 -5.806 1.00 0.00 C ATOM 414 CG GLN A 47 18.672 1.414 -7.272 1.00 0.00 C ATOM 415 CD GLN A 47 17.921 2.534 -7.976 1.00 0.00 C ATOM 416 OE1 GLN A 47 18.071 3.740 -7.490 1.00 0.00 O flip ATOM 417 NE2 GLN A 47 17.178 2.310 -8.929 1.00 0.00 N flip ATOM 0 H GLN A 47 21.030 0.451 -6.513 1.00 0.00 H new ATOM 0 HA GLN A 47 19.756 0.999 -3.987 1.00 0.00 H new ATOM 0 HB2 GLN A 47 17.976 1.954 -5.328 1.00 0.00 H new ATOM 0 HB3 GLN A 47 19.534 2.637 -5.749 1.00 0.00 H new ATOM 0 HG2 GLN A 47 19.622 1.241 -7.778 1.00 0.00 H new ATOM 0 HG3 GLN A 47 18.098 0.490 -7.347 1.00 0.00 H new ATOM 0 HE21 GLN A 47 17.080 1.360 -9.287 1.00 0.00 H new ATOM 0 HE22 GLN A 47 16.659 3.074 -9.362 1.00 0.00 H new ATOM 426 N ALA A 48 17.980 -0.656 -3.921 1.00 0.00 N ATOM 427 CA ALA A 48 17.055 -1.701 -3.688 1.00 0.00 C ATOM 428 C ALA A 48 15.688 -1.134 -3.909 1.00 0.00 C ATOM 429 O ALA A 48 15.268 -0.193 -3.208 1.00 0.00 O ATOM 430 CB ALA A 48 17.191 -2.227 -2.276 1.00 0.00 C ATOM 0 H ALA A 48 17.957 0.072 -3.207 1.00 0.00 H new ATOM 0 HA ALA A 48 17.240 -2.537 -4.362 1.00 0.00 H new ATOM 0 HB1 ALA A 48 16.471 -3.030 -2.116 1.00 0.00 H new ATOM 0 HB2 ALA A 48 18.201 -2.609 -2.126 1.00 0.00 H new ATOM 0 HB3 ALA A 48 16.999 -1.421 -1.567 1.00 0.00 H new ATOM 436 N ILE A 49 15.044 -1.625 -4.904 1.00 0.00 N ATOM 437 CA ILE A 49 13.745 -1.175 -5.260 1.00 0.00 C ATOM 438 C ILE A 49 12.734 -2.001 -4.506 1.00 0.00 C ATOM 439 O ILE A 49 12.803 -3.232 -4.496 1.00 0.00 O ATOM 440 CB ILE A 49 13.528 -1.309 -6.786 1.00 0.00 C ATOM 441 CG1 ILE A 49 14.629 -0.533 -7.525 1.00 0.00 C ATOM 442 CG2 ILE A 49 12.146 -0.789 -7.182 1.00 0.00 C ATOM 443 CD1 ILE A 49 14.590 -0.655 -9.036 1.00 0.00 C ATOM 0 H ILE A 49 15.409 -2.363 -5.505 1.00 0.00 H new ATOM 0 HA ILE A 49 13.630 -0.123 -5.000 1.00 0.00 H new ATOM 0 HB ILE A 49 13.581 -2.362 -7.064 1.00 0.00 H new ATOM 0 HG12 ILE A 49 14.553 0.521 -7.258 1.00 0.00 H new ATOM 0 HG13 ILE A 49 15.599 -0.882 -7.172 1.00 0.00 H new ATOM 0 HG21 ILE A 49 12.013 -0.892 -8.259 1.00 0.00 H new ATOM 0 HG22 ILE A 49 11.379 -1.365 -6.665 1.00 0.00 H new ATOM 0 HG23 ILE A 49 12.059 0.262 -6.905 1.00 0.00 H new ATOM 0 HD11 ILE A 49 15.404 -0.074 -9.469 1.00 0.00 H new ATOM 0 HD12 ILE A 49 14.700 -1.702 -9.319 1.00 0.00 H new ATOM 0 HD13 ILE A 49 13.637 -0.277 -9.407 1.00 0.00 H new ATOM 455 N TYR A 50 11.851 -1.346 -3.831 1.00 0.00 N ATOM 456 CA TYR A 50 10.854 -2.031 -3.097 1.00 0.00 C ATOM 457 C TYR A 50 9.498 -1.882 -3.718 1.00 0.00 C ATOM 458 O TYR A 50 9.143 -0.822 -4.261 1.00 0.00 O ATOM 459 CB TYR A 50 10.794 -1.555 -1.649 1.00 0.00 C ATOM 460 CG TYR A 50 11.982 -1.926 -0.802 1.00 0.00 C ATOM 461 CD1 TYR A 50 13.087 -1.112 -0.733 1.00 0.00 C ATOM 462 CD2 TYR A 50 11.988 -3.094 -0.058 1.00 0.00 C ATOM 463 CE1 TYR A 50 14.157 -1.445 0.042 1.00 0.00 C ATOM 464 CE2 TYR A 50 13.061 -3.435 0.721 1.00 0.00 C ATOM 465 CZ TYR A 50 14.147 -2.603 0.766 1.00 0.00 C ATOM 466 OH TYR A 50 15.221 -2.918 1.549 1.00 0.00 O ATOM 0 H TYR A 50 11.804 -0.329 -3.775 1.00 0.00 H new ATOM 0 HA TYR A 50 11.135 -3.084 -3.116 1.00 0.00 H new ATOM 0 HB2 TYR A 50 10.689 -0.470 -1.644 1.00 0.00 H new ATOM 0 HB3 TYR A 50 9.896 -1.964 -1.186 1.00 0.00 H new ATOM 0 HD1 TYR A 50 13.108 -0.194 -1.302 1.00 0.00 H new ATOM 0 HD2 TYR A 50 11.130 -3.749 -0.093 1.00 0.00 H new ATOM 0 HE1 TYR A 50 15.016 -0.791 0.084 1.00 0.00 H new ATOM 0 HE2 TYR A 50 13.051 -4.351 1.294 1.00 0.00 H new ATOM 0 HH TYR A 50 15.515 -2.121 2.037 1.00 0.00 H new ATOM 476 N LYS A 51 8.763 -2.953 -3.664 1.00 0.00 N ATOM 477 CA LYS A 51 7.384 -2.938 -3.978 1.00 0.00 C ATOM 478 C LYS A 51 6.735 -2.641 -2.666 1.00 0.00 C ATOM 479 O LYS A 51 7.246 -3.050 -1.617 1.00 0.00 O ATOM 480 CB LYS A 51 6.871 -4.291 -4.525 1.00 0.00 C ATOM 481 CG LYS A 51 6.960 -5.461 -3.560 1.00 0.00 C ATOM 482 CD LYS A 51 6.153 -6.647 -4.055 1.00 0.00 C ATOM 483 CE LYS A 51 6.738 -7.301 -5.300 1.00 0.00 C ATOM 484 NZ LYS A 51 7.939 -8.115 -5.010 1.00 0.00 N ATOM 0 H LYS A 51 9.120 -3.870 -3.395 1.00 0.00 H new ATOM 0 HA LYS A 51 7.164 -2.216 -4.764 1.00 0.00 H new ATOM 0 HB2 LYS A 51 5.831 -4.170 -4.828 1.00 0.00 H new ATOM 0 HB3 LYS A 51 7.437 -4.539 -5.423 1.00 0.00 H new ATOM 0 HG2 LYS A 51 8.002 -5.754 -3.436 1.00 0.00 H new ATOM 0 HG3 LYS A 51 6.596 -5.155 -2.579 1.00 0.00 H new ATOM 0 HD2 LYS A 51 6.088 -7.390 -3.260 1.00 0.00 H new ATOM 0 HD3 LYS A 51 5.135 -6.320 -4.270 1.00 0.00 H new ATOM 0 HE2 LYS A 51 5.980 -7.933 -5.763 1.00 0.00 H new ATOM 0 HE3 LYS A 51 6.995 -6.528 -6.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 8.363 -8.438 -5.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 8.630 -7.540 -4.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 7.669 -8.940 -4.436 1.00 0.00 H new ATOM 498 N CYS A 52 5.675 -1.981 -2.675 1.00 0.00 N ATOM 499 CA CYS A 52 5.095 -1.569 -1.443 1.00 0.00 C ATOM 500 C CYS A 52 3.934 -2.409 -1.049 1.00 0.00 C ATOM 501 O CYS A 52 2.994 -1.923 -0.488 1.00 0.00 O ATOM 502 CB CYS A 52 4.723 -0.139 -1.535 1.00 0.00 C ATOM 503 SG CYS A 52 6.164 0.947 -1.680 1.00 0.00 S ATOM 0 H CYS A 52 5.168 -1.699 -3.514 1.00 0.00 H new ATOM 0 HA CYS A 52 5.837 -1.701 -0.656 1.00 0.00 H new ATOM 0 HB2 CYS A 52 4.073 0.009 -2.397 1.00 0.00 H new ATOM 0 HB3 CYS A 52 4.149 0.141 -0.652 1.00 0.00 H new ATOM 508 N ARG A 53 4.034 -3.698 -1.318 1.00 0.00 N ATOM 509 CA ARG A 53 2.990 -4.673 -0.963 1.00 0.00 C ATOM 510 C ARG A 53 1.701 -4.423 -1.743 1.00 0.00 C ATOM 511 O ARG A 53 1.484 -3.343 -2.307 1.00 0.00 O ATOM 512 CB ARG A 53 2.687 -4.636 0.558 1.00 0.00 C ATOM 513 CG ARG A 53 3.790 -5.152 1.441 1.00 0.00 C ATOM 514 CD ARG A 53 3.498 -4.871 2.899 1.00 0.00 C ATOM 515 NE ARG A 53 2.198 -5.386 3.345 1.00 0.00 N ATOM 516 CZ ARG A 53 1.825 -5.508 4.623 1.00 0.00 C ATOM 517 NH1 ARG A 53 2.687 -5.241 5.603 1.00 0.00 N ATOM 518 NH2 ARG A 53 0.586 -5.906 4.914 1.00 0.00 N ATOM 0 H ARG A 53 4.839 -4.110 -1.790 1.00 0.00 H new ATOM 0 HA ARG A 53 3.373 -5.659 -1.228 1.00 0.00 H new ATOM 0 HB2 ARG A 53 2.465 -3.608 0.844 1.00 0.00 H new ATOM 0 HB3 ARG A 53 1.787 -5.221 0.748 1.00 0.00 H new ATOM 0 HG2 ARG A 53 3.908 -6.225 1.291 1.00 0.00 H new ATOM 0 HG3 ARG A 53 4.734 -4.685 1.159 1.00 0.00 H new ATOM 0 HD2 ARG A 53 4.284 -5.313 3.511 1.00 0.00 H new ATOM 0 HD3 ARG A 53 3.531 -3.795 3.067 1.00 0.00 H new ATOM 0 HE ARG A 53 1.531 -5.671 2.628 1.00 0.00 H new ATOM 0 HH11 ARG A 53 3.636 -4.942 5.380 1.00 0.00 H new ATOM 0 HH12 ARG A 53 2.398 -5.336 6.577 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -0.072 -6.116 4.163 1.00 0.00 H new ATOM 0 HH22 ARG A 53 0.296 -6.001 5.887 1.00 0.00 H new ATOM 532 N PRO A 54 0.849 -5.414 -1.847 1.00 0.00 N ATOM 533 CA PRO A 54 -0.437 -5.205 -2.432 1.00 0.00 C ATOM 534 C PRO A 54 -1.307 -4.353 -1.485 1.00 0.00 C ATOM 535 O PRO A 54 -1.605 -4.763 -0.350 1.00 0.00 O ATOM 536 CB PRO A 54 -0.993 -6.627 -2.614 1.00 0.00 C ATOM 537 CG PRO A 54 -0.276 -7.455 -1.609 1.00 0.00 C ATOM 538 CD PRO A 54 1.075 -6.826 -1.452 1.00 0.00 C ATOM 0 HA PRO A 54 -0.411 -4.663 -3.377 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -2.070 -6.653 -2.450 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -0.816 -6.993 -3.625 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -0.813 -7.471 -0.660 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -0.190 -8.489 -1.944 1.00 0.00 H new ATOM 0 HD2 PRO A 54 1.436 -6.903 -0.427 1.00 0.00 H new ATOM 0 HD3 PRO A 54 1.818 -7.307 -2.089 1.00 0.00 H new ATOM 546 N GLY A 55 -1.635 -3.149 -1.913 1.00 0.00 N ATOM 547 CA GLY A 55 -2.485 -2.281 -1.114 1.00 0.00 C ATOM 548 C GLY A 55 -1.813 -0.994 -0.697 1.00 0.00 C ATOM 549 O GLY A 55 -2.484 -0.015 -0.341 1.00 0.00 O ATOM 0 H GLY A 55 -1.330 -2.750 -2.801 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -3.384 -2.044 -1.682 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -2.804 -2.820 -0.222 1.00 0.00 H new ATOM 553 N TYR A 56 -0.516 -0.976 -0.718 1.00 0.00 N ATOM 554 CA TYR A 56 0.200 0.237 -0.369 1.00 0.00 C ATOM 555 C TYR A 56 0.797 0.874 -1.601 1.00 0.00 C ATOM 556 O TYR A 56 0.929 0.226 -2.647 1.00 0.00 O ATOM 557 CB TYR A 56 1.263 0.013 0.706 1.00 0.00 C ATOM 558 CG TYR A 56 0.719 -0.448 2.023 1.00 0.00 C ATOM 559 CD1 TYR A 56 0.534 -1.798 2.293 1.00 0.00 C ATOM 560 CD2 TYR A 56 0.380 0.466 2.994 1.00 0.00 C ATOM 561 CE1 TYR A 56 0.016 -2.210 3.497 1.00 0.00 C ATOM 562 CE2 TYR A 56 -0.124 0.067 4.190 1.00 0.00 C ATOM 563 CZ TYR A 56 -0.309 -1.269 4.446 1.00 0.00 C ATOM 564 OH TYR A 56 -0.863 -1.656 5.644 1.00 0.00 O ATOM 0 H TYR A 56 0.073 -1.770 -0.968 1.00 0.00 H new ATOM 0 HA TYR A 56 -0.530 0.922 0.062 1.00 0.00 H new ATOM 0 HB2 TYR A 56 1.980 -0.724 0.344 1.00 0.00 H new ATOM 0 HB3 TYR A 56 1.811 0.943 0.858 1.00 0.00 H new ATOM 0 HD1 TYR A 56 0.801 -2.533 1.548 1.00 0.00 H new ATOM 0 HD2 TYR A 56 0.517 1.520 2.801 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -0.134 -3.261 3.696 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -0.379 0.801 4.940 1.00 0.00 H new ATOM 0 HH TYR A 56 -0.630 -1.004 6.338 1.00 0.00 H new ATOM 574 N ARG A 57 1.129 2.135 -1.486 1.00 0.00 N ATOM 575 CA ARG A 57 1.636 2.914 -2.589 1.00 0.00 C ATOM 576 C ARG A 57 2.355 4.140 -2.057 1.00 0.00 C ATOM 577 O ARG A 57 2.443 4.358 -0.851 1.00 0.00 O ATOM 578 CB ARG A 57 0.467 3.466 -3.407 1.00 0.00 C ATOM 579 CG ARG A 57 -0.388 4.397 -2.565 1.00 0.00 C ATOM 580 CD ARG A 57 -1.161 5.403 -3.363 1.00 0.00 C ATOM 581 NE ARG A 57 -1.810 6.356 -2.449 1.00 0.00 N ATOM 582 CZ ARG A 57 -2.250 7.580 -2.769 1.00 0.00 C ATOM 583 NH1 ARG A 57 -2.226 8.004 -4.036 1.00 0.00 N ATOM 584 NH2 ARG A 57 -2.741 8.363 -1.819 1.00 0.00 N ATOM 0 H ARG A 57 1.054 2.657 -0.613 1.00 0.00 H new ATOM 0 HA ARG A 57 2.290 2.273 -3.181 1.00 0.00 H new ATOM 0 HB2 ARG A 57 0.847 4.001 -4.277 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -0.143 2.643 -3.780 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -1.086 3.801 -1.977 1.00 0.00 H new ATOM 0 HG3 ARG A 57 0.254 4.924 -1.859 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -0.495 5.932 -4.045 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -1.910 4.901 -3.975 1.00 0.00 H new ATOM 0 HE ARG A 57 -1.937 6.057 -1.482 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -1.870 7.393 -4.771 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -2.564 8.938 -4.268 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -2.781 8.032 -0.855 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -3.079 9.297 -2.052 1.00 0.00 H new ATOM 598 N SER A 58 2.782 4.943 -2.976 1.00 0.00 N ATOM 599 CA SER A 58 3.314 6.236 -2.752 1.00 0.00 C ATOM 600 C SER A 58 3.407 6.857 -4.122 1.00 0.00 C ATOM 601 O SER A 58 3.072 6.191 -5.111 1.00 0.00 O ATOM 602 CB SER A 58 4.680 6.153 -2.059 1.00 0.00 C ATOM 603 OG SER A 58 5.582 5.346 -2.791 1.00 0.00 O ATOM 0 H SER A 58 2.765 4.692 -3.964 1.00 0.00 H new ATOM 0 HA SER A 58 2.692 6.835 -2.088 1.00 0.00 H new ATOM 0 HB2 SER A 58 5.094 7.155 -1.947 1.00 0.00 H new ATOM 0 HB3 SER A 58 4.557 5.745 -1.056 1.00 0.00 H new ATOM 0 HG SER A 58 5.649 4.464 -2.368 1.00 0.00 H new ATOM 609 N LEU A 59 3.833 8.083 -4.214 1.00 0.00 N ATOM 610 CA LEU A 59 4.001 8.734 -5.506 1.00 0.00 C ATOM 611 C LEU A 59 5.395 8.435 -6.073 1.00 0.00 C ATOM 612 O LEU A 59 5.986 9.234 -6.801 1.00 0.00 O ATOM 613 CB LEU A 59 3.732 10.251 -5.404 1.00 0.00 C ATOM 614 CG LEU A 59 2.250 10.723 -5.425 1.00 0.00 C ATOM 615 CD1 LEU A 59 1.556 10.303 -6.712 1.00 0.00 C ATOM 616 CD2 LEU A 59 1.465 10.235 -4.212 1.00 0.00 C ATOM 0 H LEU A 59 4.075 8.665 -3.412 1.00 0.00 H new ATOM 0 HA LEU A 59 3.265 8.329 -6.200 1.00 0.00 H new ATOM 0 HB2 LEU A 59 4.186 10.611 -4.481 1.00 0.00 H new ATOM 0 HB3 LEU A 59 4.252 10.740 -6.227 1.00 0.00 H new ATOM 0 HG LEU A 59 2.272 11.812 -5.380 1.00 0.00 H new ATOM 0 HD11 LEU A 59 0.522 10.647 -6.697 1.00 0.00 H new ATOM 0 HD12 LEU A 59 2.073 10.744 -7.565 1.00 0.00 H new ATOM 0 HD13 LEU A 59 1.575 9.217 -6.798 1.00 0.00 H new ATOM 0 HD21 LEU A 59 0.437 10.592 -4.276 1.00 0.00 H new ATOM 0 HD22 LEU A 59 1.470 9.145 -4.190 1.00 0.00 H new ATOM 0 HD23 LEU A 59 1.926 10.618 -3.302 1.00 0.00 H new ATOM 628 N GLY A 60 5.876 7.268 -5.743 1.00 0.00 N ATOM 629 CA GLY A 60 7.122 6.758 -6.183 1.00 0.00 C ATOM 630 C GLY A 60 7.231 5.343 -5.703 1.00 0.00 C ATOM 631 O GLY A 60 6.236 4.611 -5.715 1.00 0.00 O ATOM 0 H GLY A 60 5.376 6.624 -5.130 1.00 0.00 H new ATOM 0 HA2 GLY A 60 7.190 6.799 -7.270 1.00 0.00 H new ATOM 0 HA3 GLY A 60 7.942 7.359 -5.790 1.00 0.00 H new ATOM 635 N ASN A 61 8.386 4.966 -5.277 1.00 0.00 N ATOM 636 CA ASN A 61 8.623 3.672 -4.681 1.00 0.00 C ATOM 637 C ASN A 61 9.602 3.870 -3.582 1.00 0.00 C ATOM 638 O ASN A 61 10.322 4.878 -3.570 1.00 0.00 O ATOM 639 CB ASN A 61 9.203 2.644 -5.681 1.00 0.00 C ATOM 640 CG ASN A 61 8.210 2.139 -6.711 1.00 0.00 C ATOM 641 OD1 ASN A 61 8.059 2.723 -7.792 1.00 0.00 O ATOM 642 ND2 ASN A 61 7.575 1.026 -6.421 1.00 0.00 N ATOM 0 H ASN A 61 9.219 5.553 -5.329 1.00 0.00 H new ATOM 0 HA ASN A 61 7.671 3.273 -4.332 1.00 0.00 H new ATOM 0 HB2 ASN A 61 10.047 3.098 -6.201 1.00 0.00 H new ATOM 0 HB3 ASN A 61 9.593 1.793 -5.123 1.00 0.00 H new ATOM 0 HD21 ASN A 61 6.932 0.615 -7.097 1.00 0.00 H new ATOM 0 HD22 ASN A 61 7.725 0.573 -5.519 1.00 0.00 H new ATOM 649 N VAL A 62 9.630 2.975 -2.648 1.00 0.00 N ATOM 650 CA VAL A 62 10.612 3.045 -1.619 1.00 0.00 C ATOM 651 C VAL A 62 11.910 2.512 -2.168 1.00 0.00 C ATOM 652 O VAL A 62 12.057 1.322 -2.435 1.00 0.00 O ATOM 653 CB VAL A 62 10.177 2.304 -0.336 1.00 0.00 C ATOM 654 CG1 VAL A 62 11.306 2.252 0.695 1.00 0.00 C ATOM 655 CG2 VAL A 62 8.971 3.006 0.259 1.00 0.00 C ATOM 0 H VAL A 62 8.984 2.188 -2.578 1.00 0.00 H new ATOM 0 HA VAL A 62 10.741 4.084 -1.318 1.00 0.00 H new ATOM 0 HB VAL A 62 9.923 1.278 -0.602 1.00 0.00 H new ATOM 0 HG11 VAL A 62 10.963 1.723 1.584 1.00 0.00 H new ATOM 0 HG12 VAL A 62 12.163 1.729 0.270 1.00 0.00 H new ATOM 0 HG13 VAL A 62 11.598 3.267 0.966 1.00 0.00 H new ATOM 0 HG21 VAL A 62 8.659 2.487 1.166 1.00 0.00 H new ATOM 0 HG22 VAL A 62 9.233 4.036 0.502 1.00 0.00 H new ATOM 0 HG23 VAL A 62 8.154 3.000 -0.462 1.00 0.00 H new ATOM 665 N ILE A 63 12.794 3.413 -2.445 1.00 0.00 N ATOM 666 CA ILE A 63 14.066 3.072 -2.973 1.00 0.00 C ATOM 667 C ILE A 63 15.100 3.218 -1.890 1.00 0.00 C ATOM 668 O ILE A 63 15.246 4.294 -1.278 1.00 0.00 O ATOM 669 CB ILE A 63 14.455 3.980 -4.180 1.00 0.00 C ATOM 670 CG1 ILE A 63 13.387 3.922 -5.282 1.00 0.00 C ATOM 671 CG2 ILE A 63 15.814 3.568 -4.752 1.00 0.00 C ATOM 672 CD1 ILE A 63 13.219 2.558 -5.905 1.00 0.00 C ATOM 0 H ILE A 63 12.649 4.413 -2.309 1.00 0.00 H new ATOM 0 HA ILE A 63 14.021 2.043 -3.329 1.00 0.00 H new ATOM 0 HB ILE A 63 14.521 5.005 -3.814 1.00 0.00 H new ATOM 0 HG12 ILE A 63 12.431 4.239 -4.864 1.00 0.00 H new ATOM 0 HG13 ILE A 63 13.647 4.637 -6.063 1.00 0.00 H new ATOM 0 HG21 ILE A 63 16.066 4.214 -5.593 1.00 0.00 H new ATOM 0 HG22 ILE A 63 16.578 3.663 -3.980 1.00 0.00 H new ATOM 0 HG23 ILE A 63 15.767 2.533 -5.091 1.00 0.00 H new ATOM 0 HD11 ILE A 63 12.447 2.601 -6.673 1.00 0.00 H new ATOM 0 HD12 ILE A 63 14.161 2.245 -6.355 1.00 0.00 H new ATOM 0 HD13 ILE A 63 12.927 1.841 -5.138 1.00 0.00 H new ATOM 684 N MET A 64 15.780 2.162 -1.620 1.00 0.00 N ATOM 685 CA MET A 64 16.878 2.198 -0.699 1.00 0.00 C ATOM 686 C MET A 64 18.129 2.029 -1.480 1.00 0.00 C ATOM 687 O MET A 64 18.067 1.726 -2.656 1.00 0.00 O ATOM 688 CB MET A 64 16.773 1.142 0.398 1.00 0.00 C ATOM 689 CG MET A 64 15.669 1.421 1.402 1.00 0.00 C ATOM 690 SD MET A 64 15.553 0.175 2.709 1.00 0.00 S ATOM 691 CE MET A 64 17.137 0.385 3.526 1.00 0.00 C ATOM 0 H MET A 64 15.598 1.245 -2.027 1.00 0.00 H new ATOM 0 HA MET A 64 16.869 3.156 -0.180 1.00 0.00 H new ATOM 0 HB2 MET A 64 16.599 0.169 -0.061 1.00 0.00 H new ATOM 0 HB3 MET A 64 17.725 1.080 0.925 1.00 0.00 H new ATOM 0 HG2 MET A 64 15.839 2.397 1.855 1.00 0.00 H new ATOM 0 HG3 MET A 64 14.716 1.475 0.877 1.00 0.00 H new ATOM 0 HE1 MET A 64 17.667 -0.567 3.542 1.00 0.00 H new ATOM 0 HE2 MET A 64 17.731 1.122 2.985 1.00 0.00 H new ATOM 0 HE3 MET A 64 16.977 0.728 4.548 1.00 0.00 H new ATOM 701 N VAL A 65 19.240 2.231 -0.874 1.00 0.00 N ATOM 702 CA VAL A 65 20.482 2.094 -1.580 1.00 0.00 C ATOM 703 C VAL A 65 21.614 1.778 -0.617 1.00 0.00 C ATOM 704 O VAL A 65 21.607 2.210 0.547 1.00 0.00 O ATOM 705 CB VAL A 65 20.801 3.353 -2.476 1.00 0.00 C ATOM 706 CG1 VAL A 65 21.156 4.536 -1.675 1.00 0.00 C ATOM 707 CG2 VAL A 65 21.888 3.107 -3.480 1.00 0.00 C ATOM 0 H VAL A 65 19.327 2.492 0.108 1.00 0.00 H new ATOM 0 HA VAL A 65 20.382 1.252 -2.265 1.00 0.00 H new ATOM 0 HB VAL A 65 19.873 3.545 -3.014 1.00 0.00 H new ATOM 0 HG11 VAL A 65 21.366 5.375 -2.338 1.00 0.00 H new ATOM 0 HG12 VAL A 65 20.325 4.793 -1.017 1.00 0.00 H new ATOM 0 HG13 VAL A 65 22.039 4.317 -1.075 1.00 0.00 H new ATOM 0 HG21 VAL A 65 22.057 4.013 -4.063 1.00 0.00 H new ATOM 0 HG22 VAL A 65 22.807 2.832 -2.962 1.00 0.00 H new ATOM 0 HG23 VAL A 65 21.591 2.297 -4.146 1.00 0.00 H new ATOM 717 N CYS A 66 22.504 0.968 -1.089 1.00 0.00 N ATOM 718 CA CYS A 66 23.684 0.559 -0.388 1.00 0.00 C ATOM 719 C CYS A 66 24.612 1.756 -0.255 1.00 0.00 C ATOM 720 O CYS A 66 24.964 2.397 -1.270 1.00 0.00 O ATOM 721 CB CYS A 66 24.355 -0.550 -1.202 1.00 0.00 C ATOM 722 SG CYS A 66 25.824 -1.278 -0.449 1.00 0.00 S ATOM 0 H CYS A 66 22.428 0.552 -2.017 1.00 0.00 H new ATOM 0 HA CYS A 66 23.444 0.187 0.608 1.00 0.00 H new ATOM 0 HB2 CYS A 66 23.626 -1.342 -1.377 1.00 0.00 H new ATOM 0 HB3 CYS A 66 24.628 -0.147 -2.177 1.00 0.00 H new ATOM 727 N ARG A 67 24.970 2.089 0.957 1.00 0.00 N ATOM 728 CA ARG A 67 25.807 3.220 1.219 1.00 0.00 C ATOM 729 C ARG A 67 26.497 3.048 2.556 1.00 0.00 C ATOM 730 O ARG A 67 25.850 2.704 3.535 1.00 0.00 O ATOM 731 CB ARG A 67 24.955 4.483 1.208 1.00 0.00 C ATOM 732 CG ARG A 67 25.731 5.769 1.347 1.00 0.00 C ATOM 733 CD ARG A 67 24.825 6.958 1.168 1.00 0.00 C ATOM 734 NE ARG A 67 24.221 6.987 -0.165 1.00 0.00 N ATOM 735 CZ ARG A 67 23.143 7.692 -0.496 1.00 0.00 C ATOM 736 NH1 ARG A 67 22.429 8.306 0.451 1.00 0.00 N ATOM 737 NH2 ARG A 67 22.748 7.748 -1.768 1.00 0.00 N ATOM 0 H ARG A 67 24.685 1.577 1.792 1.00 0.00 H new ATOM 0 HA ARG A 67 26.573 3.303 0.448 1.00 0.00 H new ATOM 0 HB2 ARG A 67 24.389 4.515 0.277 1.00 0.00 H new ATOM 0 HB3 ARG A 67 24.230 4.423 2.020 1.00 0.00 H new ATOM 0 HG2 ARG A 67 26.204 5.810 2.328 1.00 0.00 H new ATOM 0 HG3 ARG A 67 26.530 5.799 0.606 1.00 0.00 H new ATOM 0 HD2 ARG A 67 24.039 6.932 1.923 1.00 0.00 H new ATOM 0 HD3 ARG A 67 25.392 7.875 1.330 1.00 0.00 H new ATOM 0 HE ARG A 67 24.660 6.425 -0.894 1.00 0.00 H new ATOM 0 HH11 ARG A 67 22.710 8.234 1.429 1.00 0.00 H new ATOM 0 HH12 ARG A 67 21.602 8.847 0.196 1.00 0.00 H new ATOM 0 HH21 ARG A 67 23.273 7.250 -2.487 1.00 0.00 H new ATOM 0 HH22 ARG A 67 21.921 8.289 -2.022 1.00 0.00 H new ATOM 751 N LYS A 68 27.823 3.231 2.581 1.00 0.00 N ATOM 752 CA LYS A 68 28.643 3.159 3.811 1.00 0.00 C ATOM 753 C LYS A 68 28.683 1.756 4.402 1.00 0.00 C ATOM 754 O LYS A 68 29.078 1.569 5.547 1.00 0.00 O ATOM 755 CB LYS A 68 28.144 4.161 4.857 1.00 0.00 C ATOM 756 CG LYS A 68 28.242 5.616 4.418 1.00 0.00 C ATOM 757 CD LYS A 68 29.686 6.054 4.241 1.00 0.00 C ATOM 758 CE LYS A 68 29.789 7.526 3.862 1.00 0.00 C ATOM 759 NZ LYS A 68 29.260 8.413 4.921 1.00 0.00 N ATOM 0 H LYS A 68 28.368 3.435 1.743 1.00 0.00 H new ATOM 0 HA LYS A 68 29.662 3.420 3.525 1.00 0.00 H new ATOM 0 HB2 LYS A 68 27.105 3.934 5.096 1.00 0.00 H new ATOM 0 HB3 LYS A 68 28.718 4.029 5.774 1.00 0.00 H new ATOM 0 HG2 LYS A 68 27.704 5.750 3.480 1.00 0.00 H new ATOM 0 HG3 LYS A 68 27.757 6.253 5.158 1.00 0.00 H new ATOM 0 HD2 LYS A 68 30.235 5.878 5.166 1.00 0.00 H new ATOM 0 HD3 LYS A 68 30.158 5.446 3.469 1.00 0.00 H new ATOM 0 HE2 LYS A 68 30.832 7.777 3.667 1.00 0.00 H new ATOM 0 HE3 LYS A 68 29.240 7.701 2.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 29.545 9.394 4.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 28.222 8.351 4.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 29.641 8.118 5.843 1.00 0.00 H new ATOM 773 N GLY A 69 28.294 0.784 3.618 1.00 0.00 N ATOM 774 CA GLY A 69 28.296 -0.583 4.068 1.00 0.00 C ATOM 775 C GLY A 69 26.949 -1.007 4.584 1.00 0.00 C ATOM 776 O GLY A 69 26.750 -2.176 4.949 1.00 0.00 O ATOM 0 H GLY A 69 27.970 0.915 2.660 1.00 0.00 H new ATOM 0 HA2 GLY A 69 28.591 -1.235 3.246 1.00 0.00 H new ATOM 0 HA3 GLY A 69 29.041 -0.705 4.855 1.00 0.00 H new ATOM 780 N GLU A 70 26.021 -0.081 4.618 1.00 0.00 N ATOM 781 CA GLU A 70 24.703 -0.365 5.105 1.00 0.00 C ATOM 782 C GLU A 70 23.663 -0.001 4.063 1.00 0.00 C ATOM 783 O GLU A 70 23.977 0.611 3.043 1.00 0.00 O ATOM 784 CB GLU A 70 24.452 0.381 6.420 1.00 0.00 C ATOM 785 CG GLU A 70 24.595 1.893 6.332 1.00 0.00 C ATOM 786 CD GLU A 70 24.448 2.551 7.668 1.00 0.00 C ATOM 787 OE1 GLU A 70 25.464 2.718 8.366 1.00 0.00 O ATOM 788 OE2 GLU A 70 23.317 2.889 8.062 1.00 0.00 O ATOM 0 H GLU A 70 26.161 0.881 4.310 1.00 0.00 H new ATOM 0 HA GLU A 70 24.622 -1.434 5.300 1.00 0.00 H new ATOM 0 HB2 GLU A 70 23.447 0.145 6.769 1.00 0.00 H new ATOM 0 HB3 GLU A 70 25.147 0.007 7.172 1.00 0.00 H new ATOM 0 HG2 GLU A 70 25.570 2.141 5.912 1.00 0.00 H new ATOM 0 HG3 GLU A 70 23.843 2.289 5.649 1.00 0.00 H new ATOM 795 N TRP A 71 22.446 -0.351 4.320 1.00 0.00 N ATOM 796 CA TRP A 71 21.381 -0.058 3.420 1.00 0.00 C ATOM 797 C TRP A 71 20.629 1.069 3.969 1.00 0.00 C ATOM 798 O TRP A 71 20.120 1.010 5.097 1.00 0.00 O ATOM 799 CB TRP A 71 20.484 -1.266 3.155 1.00 0.00 C ATOM 800 CG TRP A 71 21.128 -2.299 2.295 1.00 0.00 C ATOM 801 CD1 TRP A 71 21.897 -3.337 2.697 1.00 0.00 C ATOM 802 CD2 TRP A 71 21.059 -2.377 0.867 1.00 0.00 C ATOM 803 NE1 TRP A 71 22.311 -4.059 1.611 1.00 0.00 N ATOM 804 CE2 TRP A 71 21.814 -3.492 0.474 1.00 0.00 C ATOM 805 CE3 TRP A 71 20.432 -1.613 -0.112 1.00 0.00 C ATOM 806 CZ2 TRP A 71 21.961 -3.864 -0.867 1.00 0.00 C ATOM 807 CZ3 TRP A 71 20.574 -1.982 -1.430 1.00 0.00 C ATOM 808 CH2 TRP A 71 21.333 -3.094 -1.798 1.00 0.00 C ATOM 0 H TRP A 71 22.162 -0.850 5.163 1.00 0.00 H new ATOM 0 HA TRP A 71 21.794 0.205 2.446 1.00 0.00 H new ATOM 0 HB2 TRP A 71 20.204 -1.718 4.107 1.00 0.00 H new ATOM 0 HB3 TRP A 71 19.563 -0.929 2.679 1.00 0.00 H new ATOM 0 HD1 TRP A 71 22.147 -3.562 3.723 1.00 0.00 H new ATOM 0 HE1 TRP A 71 22.899 -4.891 1.646 1.00 0.00 H new ATOM 0 HE3 TRP A 71 19.845 -0.747 0.157 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 22.548 -4.725 -1.151 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 20.087 -1.398 -2.197 1.00 0.00 H new ATOM 0 HH2 TRP A 71 21.424 -3.349 -2.843 1.00 0.00 H new ATOM 819 N VAL A 72 20.593 2.099 3.231 1.00 0.00 N ATOM 820 CA VAL A 72 19.988 3.271 3.665 1.00 0.00 C ATOM 821 C VAL A 72 18.997 3.691 2.671 1.00 0.00 C ATOM 822 O VAL A 72 18.722 2.996 1.709 1.00 0.00 O ATOM 823 CB VAL A 72 21.047 4.329 3.868 1.00 0.00 C ATOM 824 CG1 VAL A 72 21.553 5.179 2.713 1.00 0.00 C ATOM 825 CG2 VAL A 72 21.343 4.749 5.278 1.00 0.00 C ATOM 0 H VAL A 72 20.991 2.147 2.293 1.00 0.00 H new ATOM 0 HA VAL A 72 19.478 3.112 4.615 1.00 0.00 H new ATOM 0 HB VAL A 72 21.877 3.658 3.647 1.00 0.00 H new ATOM 0 HG11 VAL A 72 22.309 5.874 3.077 1.00 0.00 H new ATOM 0 HG12 VAL A 72 21.990 4.534 1.951 1.00 0.00 H new ATOM 0 HG13 VAL A 72 20.723 5.739 2.282 1.00 0.00 H new ATOM 0 HG21 VAL A 72 22.121 5.512 5.275 1.00 0.00 H new ATOM 0 HG22 VAL A 72 20.440 5.154 5.734 1.00 0.00 H new ATOM 0 HG23 VAL A 72 21.684 3.886 5.851 1.00 0.00 H new ATOM 835 N ALA A 73 18.536 4.803 2.872 1.00 0.00 N ATOM 836 CA ALA A 73 17.468 5.337 2.141 1.00 0.00 C ATOM 837 C ALA A 73 17.938 6.251 1.021 1.00 0.00 C ATOM 838 O ALA A 73 18.654 7.235 1.257 1.00 0.00 O ATOM 839 CB ALA A 73 16.627 6.070 3.107 1.00 0.00 C ATOM 0 H ALA A 73 18.894 5.432 3.591 1.00 0.00 H new ATOM 0 HA ALA A 73 16.909 4.539 1.651 1.00 0.00 H new ATOM 0 HB1 ALA A 73 15.775 6.509 2.588 1.00 0.00 H new ATOM 0 HB2 ALA A 73 16.270 5.382 3.874 1.00 0.00 H new ATOM 0 HB3 ALA A 73 17.214 6.861 3.574 1.00 0.00 H new ATOM 845 N LEU A 74 17.564 5.897 -0.201 1.00 0.00 N ATOM 846 CA LEU A 74 17.804 6.735 -1.353 1.00 0.00 C ATOM 847 C LEU A 74 16.869 7.897 -1.223 1.00 0.00 C ATOM 848 O LEU A 74 17.279 9.054 -1.232 1.00 0.00 O ATOM 849 CB LEU A 74 17.478 5.959 -2.645 1.00 0.00 C ATOM 850 CG LEU A 74 17.802 6.602 -4.034 1.00 0.00 C ATOM 851 CD1 LEU A 74 17.094 7.924 -4.321 1.00 0.00 C ATOM 852 CD2 LEU A 74 19.292 6.680 -4.294 1.00 0.00 C ATOM 0 H LEU A 74 17.087 5.021 -0.415 1.00 0.00 H new ATOM 0 HA LEU A 74 18.845 7.054 -1.401 1.00 0.00 H new ATOM 0 HB2 LEU A 74 18.005 5.006 -2.595 1.00 0.00 H new ATOM 0 HB3 LEU A 74 16.412 5.734 -2.630 1.00 0.00 H new ATOM 0 HG LEU A 74 17.373 5.908 -4.757 1.00 0.00 H new ATOM 0 HD11 LEU A 74 17.385 8.286 -5.307 1.00 0.00 H new ATOM 0 HD12 LEU A 74 16.015 7.772 -4.295 1.00 0.00 H new ATOM 0 HD13 LEU A 74 17.376 8.659 -3.567 1.00 0.00 H new ATOM 0 HD21 LEU A 74 19.468 7.133 -5.270 1.00 0.00 H new ATOM 0 HD22 LEU A 74 19.765 7.287 -3.522 1.00 0.00 H new ATOM 0 HD23 LEU A 74 19.717 5.676 -4.278 1.00 0.00 H new ATOM 864 N ASN A 75 15.609 7.588 -1.078 1.00 0.00 N ATOM 865 CA ASN A 75 14.645 8.610 -0.970 1.00 0.00 C ATOM 866 C ASN A 75 13.931 8.486 0.368 1.00 0.00 C ATOM 867 O ASN A 75 13.070 7.631 0.536 1.00 0.00 O ATOM 868 CB ASN A 75 13.631 8.555 -2.101 1.00 0.00 C ATOM 869 CG ASN A 75 12.934 9.877 -2.257 1.00 0.00 C ATOM 870 OD1 ASN A 75 11.962 10.164 -1.580 1.00 0.00 O ATOM 871 ND2 ASN A 75 13.422 10.674 -3.165 1.00 0.00 N ATOM 0 H ASN A 75 15.243 6.637 -1.034 1.00 0.00 H new ATOM 0 HA ASN A 75 15.159 9.569 -1.037 1.00 0.00 H new ATOM 0 HB2 ASN A 75 14.132 8.291 -3.032 1.00 0.00 H new ATOM 0 HB3 ASN A 75 12.898 7.774 -1.901 1.00 0.00 H new ATOM 0 HD21 ASN A 75 12.988 11.582 -3.333 1.00 0.00 H new ATOM 0 HD22 ASN A 75 14.238 10.390 -3.707 1.00 0.00 H new ATOM 878 N PRO A 76 14.313 9.301 1.353 1.00 0.00 N ATOM 879 CA PRO A 76 13.712 9.269 2.707 1.00 0.00 C ATOM 880 C PRO A 76 12.373 9.997 2.765 1.00 0.00 C ATOM 881 O PRO A 76 11.681 10.019 3.793 1.00 0.00 O ATOM 882 CB PRO A 76 14.748 10.015 3.537 1.00 0.00 C ATOM 883 CG PRO A 76 15.307 11.019 2.577 1.00 0.00 C ATOM 884 CD PRO A 76 15.397 10.304 1.262 1.00 0.00 C ATOM 0 HA PRO A 76 13.499 8.255 3.046 1.00 0.00 H new ATOM 0 HB2 PRO A 76 14.296 10.497 4.404 1.00 0.00 H new ATOM 0 HB3 PRO A 76 15.521 9.344 3.912 1.00 0.00 H new ATOM 0 HG2 PRO A 76 14.662 11.895 2.505 1.00 0.00 H new ATOM 0 HG3 PRO A 76 16.287 11.370 2.901 1.00 0.00 H new ATOM 0 HD2 PRO A 76 15.249 10.983 0.422 1.00 0.00 H new ATOM 0 HD3 PRO A 76 16.371 9.834 1.124 1.00 0.00 H new ATOM 892 N LEU A 77 12.024 10.592 1.674 1.00 0.00 N ATOM 893 CA LEU A 77 10.815 11.334 1.572 1.00 0.00 C ATOM 894 C LEU A 77 9.690 10.415 1.232 1.00 0.00 C ATOM 895 O LEU A 77 8.557 10.587 1.681 1.00 0.00 O ATOM 896 CB LEU A 77 10.988 12.373 0.522 1.00 0.00 C ATOM 897 CG LEU A 77 12.160 13.293 0.782 1.00 0.00 C ATOM 898 CD1 LEU A 77 12.207 14.309 -0.260 1.00 0.00 C ATOM 899 CD2 LEU A 77 12.065 13.935 2.154 1.00 0.00 C ATOM 0 H LEU A 77 12.578 10.576 0.818 1.00 0.00 H new ATOM 0 HA LEU A 77 10.581 11.817 2.521 1.00 0.00 H new ATOM 0 HB2 LEU A 77 11.124 11.886 -0.443 1.00 0.00 H new ATOM 0 HB3 LEU A 77 10.076 12.967 0.454 1.00 0.00 H new ATOM 0 HG LEU A 77 13.079 12.708 0.763 1.00 0.00 H new ATOM 0 HD11 LEU A 77 13.050 14.977 -0.080 1.00 0.00 H new ATOM 0 HD12 LEU A 77 12.326 13.829 -1.231 1.00 0.00 H new ATOM 0 HD13 LEU A 77 11.281 14.883 -0.250 1.00 0.00 H new ATOM 0 HD21 LEU A 77 12.922 14.590 2.309 1.00 0.00 H new ATOM 0 HD22 LEU A 77 11.146 14.518 2.220 1.00 0.00 H new ATOM 0 HD23 LEU A 77 12.058 13.159 2.919 1.00 0.00 H new ATOM 911 N ARG A 78 10.031 9.396 0.492 1.00 0.00 N ATOM 912 CA ARG A 78 9.074 8.401 0.065 1.00 0.00 C ATOM 913 C ARG A 78 8.963 7.284 1.064 1.00 0.00 C ATOM 914 O ARG A 78 9.965 6.790 1.587 1.00 0.00 O ATOM 915 CB ARG A 78 9.397 7.806 -1.318 1.00 0.00 C ATOM 916 CG ARG A 78 9.251 8.760 -2.493 1.00 0.00 C ATOM 917 CD ARG A 78 7.854 9.347 -2.566 1.00 0.00 C ATOM 918 NE ARG A 78 7.677 10.206 -3.744 1.00 0.00 N ATOM 919 CZ ARG A 78 6.882 11.281 -3.789 1.00 0.00 C ATOM 920 NH1 ARG A 78 6.258 11.695 -2.697 1.00 0.00 N ATOM 921 NH2 ARG A 78 6.727 11.947 -4.930 1.00 0.00 N ATOM 0 H ARG A 78 10.982 9.228 0.165 1.00 0.00 H new ATOM 0 HA ARG A 78 8.122 8.927 -0.009 1.00 0.00 H new ATOM 0 HB2 ARG A 78 10.420 7.431 -1.302 1.00 0.00 H new ATOM 0 HB3 ARG A 78 8.746 6.948 -1.486 1.00 0.00 H new ATOM 0 HG2 ARG A 78 9.980 9.565 -2.401 1.00 0.00 H new ATOM 0 HG3 ARG A 78 9.473 8.232 -3.421 1.00 0.00 H new ATOM 0 HD2 ARG A 78 7.123 8.539 -2.594 1.00 0.00 H new ATOM 0 HD3 ARG A 78 7.656 9.925 -1.663 1.00 0.00 H new ATOM 0 HE ARG A 78 8.197 9.966 -4.588 1.00 0.00 H new ATOM 0 HH11 ARG A 78 6.383 11.194 -1.817 1.00 0.00 H new ATOM 0 HH12 ARG A 78 5.653 12.515 -2.735 1.00 0.00 H new ATOM 0 HH21 ARG A 78 7.214 11.638 -5.771 1.00 0.00 H new ATOM 0 HH22 ARG A 78 6.121 12.767 -4.964 1.00 0.00 H new ATOM 935 N LYS A 79 7.757 6.917 1.333 1.00 0.00 N ATOM 936 CA LYS A 79 7.425 5.795 2.157 1.00 0.00 C ATOM 937 C LYS A 79 6.128 5.299 1.640 1.00 0.00 C ATOM 938 O LYS A 79 5.407 6.052 0.994 1.00 0.00 O ATOM 939 CB LYS A 79 7.257 6.173 3.635 1.00 0.00 C ATOM 940 CG LYS A 79 6.146 7.189 3.897 1.00 0.00 C ATOM 941 CD LYS A 79 5.854 7.375 5.387 1.00 0.00 C ATOM 942 CE LYS A 79 4.926 6.283 5.968 1.00 0.00 C ATOM 943 NZ LYS A 79 5.446 4.894 5.857 1.00 0.00 N ATOM 0 H LYS A 79 6.939 7.408 0.972 1.00 0.00 H new ATOM 0 HA LYS A 79 8.225 5.056 2.116 1.00 0.00 H new ATOM 0 HB2 LYS A 79 7.051 5.269 4.209 1.00 0.00 H new ATOM 0 HB3 LYS A 79 8.199 6.578 4.005 1.00 0.00 H new ATOM 0 HG2 LYS A 79 6.428 8.149 3.464 1.00 0.00 H new ATOM 0 HG3 LYS A 79 5.237 6.865 3.391 1.00 0.00 H new ATOM 0 HD2 LYS A 79 6.795 7.374 5.938 1.00 0.00 H new ATOM 0 HD3 LYS A 79 5.396 8.352 5.541 1.00 0.00 H new ATOM 0 HE2 LYS A 79 4.744 6.504 7.020 1.00 0.00 H new ATOM 0 HE3 LYS A 79 3.963 6.337 5.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 4.969 4.288 6.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 5.263 4.530 4.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 6.470 4.891 6.038 1.00 0.00 H new ATOM 957 N CYS A 80 5.799 4.097 1.894 1.00 0.00 N ATOM 958 CA CYS A 80 4.569 3.637 1.397 1.00 0.00 C ATOM 959 C CYS A 80 3.428 3.720 2.366 1.00 0.00 C ATOM 960 O CYS A 80 3.533 3.352 3.544 1.00 0.00 O ATOM 961 CB CYS A 80 4.685 2.369 0.585 1.00 0.00 C ATOM 962 SG CYS A 80 5.473 2.737 -1.042 1.00 0.00 S ATOM 0 H CYS A 80 6.349 3.426 2.431 1.00 0.00 H new ATOM 0 HA CYS A 80 4.261 4.371 0.653 1.00 0.00 H new ATOM 0 HB2 CYS A 80 5.277 1.632 1.128 1.00 0.00 H new ATOM 0 HB3 CYS A 80 3.698 1.934 0.431 1.00 0.00 H new ATOM 967 N GLN A 81 2.389 4.342 1.872 1.00 0.00 N ATOM 968 CA GLN A 81 1.158 4.599 2.567 1.00 0.00 C ATOM 969 C GLN A 81 0.061 3.836 1.873 1.00 0.00 C ATOM 970 O GLN A 81 0.327 3.093 0.935 1.00 0.00 O ATOM 971 CB GLN A 81 0.870 6.105 2.539 1.00 0.00 C ATOM 972 CG GLN A 81 1.885 6.925 3.317 1.00 0.00 C ATOM 973 CD GLN A 81 1.670 8.421 3.206 1.00 0.00 C ATOM 974 OE1 GLN A 81 1.207 8.936 2.186 1.00 0.00 O ATOM 975 NE2 GLN A 81 1.968 9.125 4.264 1.00 0.00 N ATOM 0 H GLN A 81 2.381 4.703 0.918 1.00 0.00 H new ATOM 0 HA GLN A 81 1.222 4.279 3.607 1.00 0.00 H new ATOM 0 HB2 GLN A 81 0.855 6.446 1.504 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -0.124 6.286 2.949 1.00 0.00 H new ATOM 0 HG2 GLN A 81 1.843 6.637 4.368 1.00 0.00 H new ATOM 0 HG3 GLN A 81 2.886 6.683 2.960 1.00 0.00 H new ATOM 0 HE21 GLN A 81 2.350 8.666 5.091 1.00 0.00 H new ATOM 0 HE22 GLN A 81 1.819 10.134 4.264 1.00 0.00 H new ATOM 984 N LYS A 82 -1.147 4.017 2.314 1.00 0.00 N ATOM 985 CA LYS A 82 -2.280 3.306 1.754 1.00 0.00 C ATOM 986 C LYS A 82 -2.621 3.824 0.362 1.00 0.00 C ATOM 987 O LYS A 82 -2.331 4.983 0.020 1.00 0.00 O ATOM 988 CB LYS A 82 -3.484 3.496 2.647 1.00 0.00 C ATOM 989 CG LYS A 82 -3.348 2.948 4.050 1.00 0.00 C ATOM 990 CD LYS A 82 -3.287 1.432 4.107 1.00 0.00 C ATOM 991 CE LYS A 82 -3.300 0.961 5.556 1.00 0.00 C ATOM 992 NZ LYS A 82 -3.386 -0.519 5.696 1.00 0.00 N ATOM 0 H LYS A 82 -1.386 4.658 3.070 1.00 0.00 H new ATOM 0 HA LYS A 82 -2.016 2.251 1.684 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -3.702 4.562 2.712 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -4.344 3.023 2.173 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -2.446 3.357 4.505 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -4.191 3.292 4.649 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -4.135 1.006 3.570 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -2.384 1.078 3.609 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -2.396 1.314 6.053 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -4.146 1.417 6.071 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -4.062 -0.758 6.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -3.707 -0.935 4.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -2.449 -0.900 5.939 1.00 0.00 H new ATOM 1006 N ARG A 83 -3.202 2.974 -0.440 1.00 0.00 N ATOM 1007 CA ARG A 83 -3.663 3.388 -1.747 1.00 0.00 C ATOM 1008 C ARG A 83 -5.095 3.865 -1.613 1.00 0.00 C ATOM 1009 O ARG A 83 -5.787 3.446 -0.692 1.00 0.00 O ATOM 1010 CB ARG A 83 -3.574 2.252 -2.785 1.00 0.00 C ATOM 1011 CG ARG A 83 -4.580 1.128 -2.600 1.00 0.00 C ATOM 1012 CD ARG A 83 -4.436 0.092 -3.689 1.00 0.00 C ATOM 1013 NE ARG A 83 -4.634 0.649 -5.051 1.00 0.00 N ATOM 1014 CZ ARG A 83 -4.039 0.180 -6.171 1.00 0.00 C ATOM 1015 NH1 ARG A 83 -3.271 -0.895 -6.113 1.00 0.00 N ATOM 1016 NH2 ARG A 83 -4.261 0.763 -7.346 1.00 0.00 N ATOM 0 H ARG A 83 -3.369 1.993 -0.217 1.00 0.00 H new ATOM 0 HA ARG A 83 -3.019 4.190 -2.108 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -3.708 2.678 -3.779 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -2.570 1.829 -2.752 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -4.434 0.661 -1.626 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -5.591 1.534 -2.610 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -3.445 -0.357 -3.627 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -5.159 -0.707 -3.521 1.00 0.00 H new ATOM 0 HE ARG A 83 -5.265 1.444 -5.149 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -3.127 -1.371 -5.223 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -2.823 -1.248 -6.959 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -4.883 1.569 -7.406 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -3.809 0.404 -8.187 1.00 0.00 H new ATOM 1030 N PRO A 84 -5.554 4.759 -2.473 1.00 0.00 N ATOM 1031 CA PRO A 84 -6.907 5.222 -2.418 1.00 0.00 C ATOM 1032 C PRO A 84 -7.852 4.385 -3.265 1.00 0.00 C ATOM 1033 O PRO A 84 -7.455 3.772 -4.263 1.00 0.00 O ATOM 1034 CB PRO A 84 -6.830 6.619 -3.018 1.00 0.00 C ATOM 1035 CG PRO A 84 -5.667 6.582 -3.958 1.00 0.00 C ATOM 1036 CD PRO A 84 -4.796 5.417 -3.543 1.00 0.00 C ATOM 0 HA PRO A 84 -7.292 5.177 -1.399 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -7.751 6.873 -3.542 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -6.686 7.372 -2.243 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -6.007 6.461 -4.987 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -5.107 7.516 -3.915 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -4.615 4.739 -4.377 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -3.822 5.755 -3.190 1.00 0.00 H new ATOM 1044 N CYS A 85 -9.070 4.366 -2.867 1.00 0.00 N ATOM 1045 CA CYS A 85 -10.114 3.792 -3.653 1.00 0.00 C ATOM 1046 C CYS A 85 -11.157 4.857 -3.818 1.00 0.00 C ATOM 1047 O CYS A 85 -12.132 4.914 -3.080 1.00 0.00 O ATOM 1048 CB CYS A 85 -10.708 2.566 -3.002 1.00 0.00 C ATOM 1049 SG CYS A 85 -9.565 1.177 -2.765 1.00 0.00 S ATOM 0 H CYS A 85 -9.381 4.752 -1.976 1.00 0.00 H new ATOM 0 HA CYS A 85 -9.720 3.461 -4.614 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -11.112 2.851 -2.031 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -11.547 2.224 -3.608 1.00 0.00 H new ATOM 1054 N GLY A 86 -10.852 5.770 -4.692 1.00 0.00 N ATOM 1055 CA GLY A 86 -11.674 6.936 -4.957 1.00 0.00 C ATOM 1056 C GLY A 86 -13.134 6.643 -5.271 1.00 0.00 C ATOM 1057 O GLY A 86 -13.478 6.366 -6.419 1.00 0.00 O ATOM 0 H GLY A 86 -10.005 5.733 -5.260 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -11.631 7.595 -4.090 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -11.242 7.482 -5.795 1.00 0.00 H new ATOM 1061 N HIS A 87 -13.965 6.684 -4.216 1.00 0.00 N ATOM 1062 CA HIS A 87 -15.436 6.570 -4.266 1.00 0.00 C ATOM 1063 C HIS A 87 -15.881 5.126 -4.623 1.00 0.00 C ATOM 1064 O HIS A 87 -15.470 4.578 -5.641 1.00 0.00 O ATOM 1065 CB HIS A 87 -16.015 7.605 -5.249 1.00 0.00 C ATOM 1066 CG HIS A 87 -17.393 8.094 -4.927 1.00 0.00 C ATOM 1067 ND1 HIS A 87 -18.601 7.529 -5.090 1.00 0.00 N flip ATOM 1068 CD2 HIS A 87 -17.631 9.333 -4.379 1.00 0.00 C flip ATOM 1069 CE1 HIS A 87 -19.528 8.422 -4.643 1.00 0.00 C flip ATOM 1070 NE2 HIS A 87 -18.923 9.500 -4.222 1.00 0.00 N flip ATOM 0 H HIS A 87 -13.618 6.802 -3.264 1.00 0.00 H new ATOM 0 HA HIS A 87 -15.833 6.785 -3.274 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -15.343 8.462 -5.286 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -16.027 7.166 -6.247 1.00 0.00 H new ATOM 0 HD1 HIS A 87 -18.789 6.604 -5.476 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -16.872 10.056 -4.118 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -20.596 8.263 -4.638 1.00 0.00 H new ATOM 1079 N PRO A 88 -16.749 4.500 -3.781 1.00 0.00 N ATOM 1080 CA PRO A 88 -17.216 3.080 -3.957 1.00 0.00 C ATOM 1081 C PRO A 88 -18.200 2.877 -5.106 1.00 0.00 C ATOM 1082 O PRO A 88 -19.097 2.028 -5.027 1.00 0.00 O ATOM 1083 CB PRO A 88 -17.895 2.779 -2.615 1.00 0.00 C ATOM 1084 CG PRO A 88 -18.371 4.099 -2.128 1.00 0.00 C ATOM 1085 CD PRO A 88 -17.344 5.105 -2.567 1.00 0.00 C ATOM 0 HA PRO A 88 -16.385 2.423 -4.213 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -18.723 2.080 -2.738 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -17.197 2.326 -1.911 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -19.350 4.337 -2.543 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -18.476 4.099 -1.043 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -17.799 6.071 -2.784 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -16.593 5.272 -1.795 1.00 0.00 H new ATOM 1093 N GLY A 89 -17.974 3.559 -6.185 1.00 0.00 N ATOM 1094 CA GLY A 89 -18.828 3.441 -7.314 1.00 0.00 C ATOM 1095 C GLY A 89 -19.646 4.668 -7.496 1.00 0.00 C ATOM 1096 O GLY A 89 -19.105 5.774 -7.518 1.00 0.00 O ATOM 0 H GLY A 89 -17.196 4.208 -6.303 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -18.231 3.262 -8.208 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -19.483 2.579 -7.190 1.00 0.00 H new ATOM 1100 N ASP A 90 -20.923 4.483 -7.603 1.00 0.00 N ATOM 1101 CA ASP A 90 -21.886 5.543 -7.769 1.00 0.00 C ATOM 1102 C ASP A 90 -23.226 4.971 -7.430 1.00 0.00 C ATOM 1103 O ASP A 90 -23.387 3.747 -7.449 1.00 0.00 O ATOM 1104 CB ASP A 90 -21.893 6.099 -9.212 1.00 0.00 C ATOM 1105 CG ASP A 90 -22.225 5.062 -10.266 1.00 0.00 C ATOM 1106 OD1 ASP A 90 -23.411 4.830 -10.559 1.00 0.00 O ATOM 1107 OD2 ASP A 90 -21.285 4.447 -10.823 1.00 0.00 O ATOM 0 H ASP A 90 -21.348 3.556 -7.577 1.00 0.00 H new ATOM 0 HA ASP A 90 -21.630 6.378 -7.117 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -22.617 6.912 -9.275 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -20.914 6.526 -9.432 1.00 0.00 H new ATOM 1112 N THR A 91 -24.161 5.799 -7.103 1.00 0.00 N ATOM 1113 CA THR A 91 -25.466 5.348 -6.747 1.00 0.00 C ATOM 1114 C THR A 91 -26.415 6.539 -6.611 1.00 0.00 C ATOM 1115 O THR A 91 -26.086 7.534 -5.958 1.00 0.00 O ATOM 1116 CB THR A 91 -25.465 4.508 -5.421 1.00 0.00 C ATOM 1117 OG1 THR A 91 -26.791 4.059 -5.130 1.00 0.00 O ATOM 1118 CG2 THR A 91 -24.916 5.301 -4.227 1.00 0.00 C ATOM 0 H THR A 91 -24.042 6.812 -7.075 1.00 0.00 H new ATOM 0 HA THR A 91 -25.811 4.693 -7.547 1.00 0.00 H new ATOM 0 HB THR A 91 -24.805 3.655 -5.579 1.00 0.00 H new ATOM 0 HG1 THR A 91 -26.761 3.393 -4.411 1.00 0.00 H new ATOM 0 HG21 THR A 91 -24.937 4.676 -3.334 1.00 0.00 H new ATOM 0 HG22 THR A 91 -23.890 5.605 -4.433 1.00 0.00 H new ATOM 0 HG23 THR A 91 -25.531 6.186 -4.064 1.00 0.00 H new ATOM 1126 N PRO A 92 -27.579 6.491 -7.259 1.00 0.00 N ATOM 1127 CA PRO A 92 -28.575 7.526 -7.095 1.00 0.00 C ATOM 1128 C PRO A 92 -29.381 7.315 -5.806 1.00 0.00 C ATOM 1129 O PRO A 92 -30.067 8.221 -5.322 1.00 0.00 O ATOM 1130 CB PRO A 92 -29.473 7.395 -8.332 1.00 0.00 C ATOM 1131 CG PRO A 92 -29.166 6.060 -8.953 1.00 0.00 C ATOM 1132 CD PRO A 92 -27.984 5.459 -8.230 1.00 0.00 C ATOM 0 HA PRO A 92 -28.130 8.517 -7.011 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -30.525 7.459 -8.054 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -29.279 8.203 -9.037 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -30.031 5.400 -8.881 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -28.942 6.177 -10.013 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -28.256 4.529 -7.730 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -27.174 5.225 -8.921 1.00 0.00 H new ATOM 1140 N PHE A 93 -29.263 6.131 -5.233 1.00 0.00 N ATOM 1141 CA PHE A 93 -29.991 5.796 -4.045 1.00 0.00 C ATOM 1142 C PHE A 93 -29.114 5.025 -3.061 1.00 0.00 C ATOM 1143 O PHE A 93 -29.016 3.805 -3.115 1.00 0.00 O ATOM 1144 CB PHE A 93 -31.334 5.054 -4.370 1.00 0.00 C ATOM 1145 CG PHE A 93 -31.231 3.754 -5.159 1.00 0.00 C ATOM 1146 CD1 PHE A 93 -31.007 3.768 -6.525 1.00 0.00 C ATOM 1147 CD2 PHE A 93 -31.373 2.522 -4.523 1.00 0.00 C ATOM 1148 CE1 PHE A 93 -30.917 2.588 -7.243 1.00 0.00 C ATOM 1149 CE2 PHE A 93 -31.284 1.341 -5.235 1.00 0.00 C ATOM 1150 CZ PHE A 93 -31.058 1.374 -6.597 1.00 0.00 C ATOM 0 H PHE A 93 -28.661 5.386 -5.583 1.00 0.00 H new ATOM 0 HA PHE A 93 -30.274 6.727 -3.555 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -31.840 4.840 -3.428 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -31.974 5.739 -4.927 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -30.901 4.713 -7.038 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -31.555 2.490 -3.459 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -30.737 2.616 -8.307 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -31.391 0.394 -4.727 1.00 0.00 H new ATOM 0 HZ PHE A 93 -30.992 0.453 -7.157 1.00 0.00 H new ATOM 1160 N GLY A 94 -28.427 5.733 -2.198 1.00 0.00 N ATOM 1161 CA GLY A 94 -27.614 5.049 -1.242 1.00 0.00 C ATOM 1162 C GLY A 94 -26.621 5.922 -0.561 1.00 0.00 C ATOM 1163 O GLY A 94 -26.373 7.047 -0.987 1.00 0.00 O ATOM 0 H GLY A 94 -28.417 6.751 -2.142 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -28.259 4.594 -0.490 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -27.086 4.237 -1.743 1.00 0.00 H new ATOM 1167 N THR A 95 -26.072 5.408 0.502 1.00 0.00 N ATOM 1168 CA THR A 95 -25.075 6.076 1.278 1.00 0.00 C ATOM 1169 C THR A 95 -24.040 5.010 1.661 1.00 0.00 C ATOM 1170 O THR A 95 -24.307 3.804 1.533 1.00 0.00 O ATOM 1171 CB THR A 95 -25.710 6.656 2.569 1.00 0.00 C ATOM 1172 OG1 THR A 95 -26.936 7.339 2.245 1.00 0.00 O ATOM 1173 CG2 THR A 95 -24.775 7.648 3.252 1.00 0.00 C ATOM 0 H THR A 95 -26.315 4.485 0.861 1.00 0.00 H new ATOM 0 HA THR A 95 -24.625 6.896 0.718 1.00 0.00 H new ATOM 0 HB THR A 95 -25.900 5.823 3.245 1.00 0.00 H new ATOM 0 HG1 THR A 95 -27.334 7.702 3.063 1.00 0.00 H new ATOM 0 HG21 THR A 95 -25.251 8.035 4.153 1.00 0.00 H new ATOM 0 HG22 THR A 95 -23.845 7.146 3.520 1.00 0.00 H new ATOM 0 HG23 THR A 95 -24.560 8.473 2.572 1.00 0.00 H new ATOM 1181 N PHE A 96 -22.904 5.426 2.116 1.00 0.00 N ATOM 1182 CA PHE A 96 -21.874 4.522 2.514 1.00 0.00 C ATOM 1183 C PHE A 96 -21.244 5.049 3.779 1.00 0.00 C ATOM 1184 O PHE A 96 -21.304 6.252 4.059 1.00 0.00 O ATOM 1185 CB PHE A 96 -20.811 4.371 1.407 1.00 0.00 C ATOM 1186 CG PHE A 96 -20.086 5.651 1.078 1.00 0.00 C ATOM 1187 CD1 PHE A 96 -20.579 6.512 0.113 1.00 0.00 C ATOM 1188 CD2 PHE A 96 -18.915 5.988 1.741 1.00 0.00 C ATOM 1189 CE1 PHE A 96 -19.921 7.687 -0.185 1.00 0.00 C ATOM 1190 CE2 PHE A 96 -18.255 7.157 1.450 1.00 0.00 C ATOM 1191 CZ PHE A 96 -18.757 8.011 0.484 1.00 0.00 C ATOM 0 H PHE A 96 -22.662 6.411 2.223 1.00 0.00 H new ATOM 0 HA PHE A 96 -22.303 3.536 2.690 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -20.083 3.621 1.716 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -21.292 3.995 0.504 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -21.489 6.261 -0.412 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -18.518 5.324 2.494 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -20.315 8.352 -0.939 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -17.345 7.409 1.975 1.00 0.00 H new ATOM 0 HZ PHE A 96 -18.239 8.930 0.253 1.00 0.00 H new ATOM 1201 N THR A 97 -20.666 4.186 4.526 1.00 0.00 N ATOM 1202 CA THR A 97 -20.002 4.555 5.728 1.00 0.00 C ATOM 1203 C THR A 97 -18.621 3.932 5.750 1.00 0.00 C ATOM 1204 O THR A 97 -18.452 2.805 5.313 1.00 0.00 O ATOM 1205 CB THR A 97 -20.811 4.103 6.947 1.00 0.00 C ATOM 1206 OG1 THR A 97 -21.223 2.730 6.774 1.00 0.00 O ATOM 1207 CG2 THR A 97 -22.041 4.977 7.170 1.00 0.00 C ATOM 0 H THR A 97 -20.637 3.187 4.321 1.00 0.00 H new ATOM 0 HA THR A 97 -19.908 5.640 5.767 1.00 0.00 H new ATOM 0 HB THR A 97 -20.170 4.197 7.823 1.00 0.00 H new ATOM 0 HG1 THR A 97 -21.527 2.593 5.852 1.00 0.00 H new ATOM 0 HG21 THR A 97 -22.586 4.622 8.044 1.00 0.00 H new ATOM 0 HG22 THR A 97 -21.730 6.009 7.331 1.00 0.00 H new ATOM 0 HG23 THR A 97 -22.687 4.926 6.294 1.00 0.00 H new ATOM 1215 N LEU A 98 -17.653 4.657 6.217 1.00 0.00 N ATOM 1216 CA LEU A 98 -16.293 4.169 6.259 1.00 0.00 C ATOM 1217 C LEU A 98 -15.955 3.771 7.676 1.00 0.00 C ATOM 1218 O LEU A 98 -16.373 4.430 8.620 1.00 0.00 O ATOM 1219 CB LEU A 98 -15.328 5.233 5.739 1.00 0.00 C ATOM 1220 CG LEU A 98 -15.538 5.672 4.287 1.00 0.00 C ATOM 1221 CD1 LEU A 98 -14.599 6.793 3.928 1.00 0.00 C ATOM 1222 CD2 LEU A 98 -15.336 4.507 3.346 1.00 0.00 C ATOM 0 H LEU A 98 -17.773 5.602 6.581 1.00 0.00 H new ATOM 0 HA LEU A 98 -16.196 3.296 5.614 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -15.407 6.112 6.379 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -14.311 4.855 5.841 1.00 0.00 H new ATOM 0 HG LEU A 98 -16.562 6.031 4.187 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -14.765 7.089 2.892 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -14.782 7.645 4.583 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -13.569 6.457 4.048 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -15.489 4.838 2.319 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -14.322 4.122 3.456 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -16.051 3.719 3.584 1.00 0.00 H new ATOM 1234 N THR A 99 -15.239 2.684 7.840 1.00 0.00 N ATOM 1235 CA THR A 99 -14.948 2.204 9.184 1.00 0.00 C ATOM 1236 C THR A 99 -13.441 1.823 9.353 1.00 0.00 C ATOM 1237 O THR A 99 -13.049 1.115 10.293 1.00 0.00 O ATOM 1238 CB THR A 99 -15.899 1.008 9.520 1.00 0.00 C ATOM 1239 OG1 THR A 99 -15.956 0.750 10.929 1.00 0.00 O ATOM 1240 CG2 THR A 99 -15.460 -0.248 8.800 1.00 0.00 C ATOM 0 H THR A 99 -14.851 2.121 7.083 1.00 0.00 H new ATOM 0 HA THR A 99 -15.133 3.009 9.895 1.00 0.00 H new ATOM 0 HB THR A 99 -16.895 1.293 9.181 1.00 0.00 H new ATOM 0 HG1 THR A 99 -15.052 0.792 11.306 1.00 0.00 H new ATOM 0 HG21 THR A 99 -16.136 -1.066 9.049 1.00 0.00 H new ATOM 0 HG22 THR A 99 -15.480 -0.076 7.724 1.00 0.00 H new ATOM 0 HG23 THR A 99 -14.447 -0.508 9.107 1.00 0.00 H new ATOM 1248 N GLY A 100 -12.607 2.334 8.475 1.00 0.00 N ATOM 1249 CA GLY A 100 -11.172 2.047 8.550 1.00 0.00 C ATOM 1250 C GLY A 100 -10.397 3.271 8.192 1.00 0.00 C ATOM 1251 O GLY A 100 -9.250 3.212 7.721 1.00 0.00 O ATOM 0 H GLY A 100 -12.882 2.944 7.706 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -10.909 1.719 9.555 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -10.918 1.232 7.872 1.00 0.00 H new ATOM 1255 N GLY A 101 -11.039 4.373 8.406 1.00 0.00 N ATOM 1256 CA GLY A 101 -10.552 5.646 8.025 1.00 0.00 C ATOM 1257 C GLY A 101 -11.733 6.460 7.610 1.00 0.00 C ATOM 1258 O GLY A 101 -12.848 5.925 7.561 1.00 0.00 O ATOM 0 H GLY A 101 -11.948 4.406 8.867 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -10.028 6.122 8.854 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -9.839 5.556 7.206 1.00 0.00 H new ATOM 1262 N ASN A 102 -11.537 7.704 7.314 1.00 0.00 N ATOM 1263 CA ASN A 102 -12.632 8.574 6.898 1.00 0.00 C ATOM 1264 C ASN A 102 -12.370 9.093 5.509 1.00 0.00 C ATOM 1265 O ASN A 102 -12.979 10.061 5.059 1.00 0.00 O ATOM 1266 CB ASN A 102 -12.837 9.738 7.884 1.00 0.00 C ATOM 1267 CG ASN A 102 -13.390 9.309 9.244 1.00 0.00 C ATOM 1268 OD1 ASN A 102 -14.207 8.280 9.272 1.00 0.00 O flip ATOM 1269 ND2 ASN A 102 -13.091 9.927 10.271 1.00 0.00 N flip ATOM 0 H ASN A 102 -10.626 8.161 7.348 1.00 0.00 H new ATOM 0 HA ASN A 102 -13.551 7.988 6.894 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -11.884 10.246 8.034 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -13.518 10.463 7.438 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -12.454 10.722 10.221 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -13.481 9.642 11.169 1.00 0.00 H new ATOM 1276 N VAL A 103 -11.519 8.392 4.810 1.00 0.00 N ATOM 1277 CA VAL A 103 -11.114 8.745 3.478 1.00 0.00 C ATOM 1278 C VAL A 103 -11.075 7.485 2.688 1.00 0.00 C ATOM 1279 O VAL A 103 -11.276 6.406 3.244 1.00 0.00 O ATOM 1280 CB VAL A 103 -9.712 9.441 3.413 1.00 0.00 C ATOM 1281 CG1 VAL A 103 -9.735 10.800 4.075 1.00 0.00 C ATOM 1282 CG2 VAL A 103 -8.635 8.573 4.036 1.00 0.00 C ATOM 0 H VAL A 103 -11.079 7.541 5.159 1.00 0.00 H new ATOM 0 HA VAL A 103 -11.827 9.468 3.082 1.00 0.00 H new ATOM 0 HB VAL A 103 -9.475 9.580 2.358 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -8.746 11.253 4.011 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -10.460 11.438 3.570 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -10.016 10.690 5.122 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -7.675 9.085 3.975 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -8.879 8.384 5.081 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -8.576 7.626 3.500 1.00 0.00 H new ATOM 1292 N PHE A 104 -10.828 7.583 1.438 1.00 0.00 N ATOM 1293 CA PHE A 104 -10.765 6.420 0.636 1.00 0.00 C ATOM 1294 C PHE A 104 -9.366 5.906 0.592 1.00 0.00 C ATOM 1295 O PHE A 104 -8.522 6.412 -0.152 1.00 0.00 O ATOM 1296 CB PHE A 104 -11.318 6.692 -0.739 1.00 0.00 C ATOM 1297 CG PHE A 104 -12.752 7.096 -0.689 1.00 0.00 C ATOM 1298 CD1 PHE A 104 -13.694 6.235 -0.167 1.00 0.00 C ATOM 1299 CD2 PHE A 104 -13.157 8.332 -1.132 1.00 0.00 C ATOM 1300 CE1 PHE A 104 -15.008 6.591 -0.091 1.00 0.00 C ATOM 1301 CE2 PHE A 104 -14.478 8.704 -1.061 1.00 0.00 C ATOM 1302 CZ PHE A 104 -15.408 7.830 -0.540 1.00 0.00 C ATOM 0 H PHE A 104 -10.665 8.460 0.944 1.00 0.00 H new ATOM 0 HA PHE A 104 -11.387 5.642 1.079 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -10.735 7.480 -1.216 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -11.213 5.800 -1.356 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -13.386 5.262 0.188 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -12.430 9.018 -1.540 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -15.733 5.904 0.320 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -14.786 9.678 -1.412 1.00 0.00 H new ATOM 0 HZ PHE A 104 -16.448 8.116 -0.484 1.00 0.00 H new ATOM 1312 N GLU A 105 -9.103 4.938 1.419 1.00 0.00 N ATOM 1313 CA GLU A 105 -7.799 4.366 1.530 1.00 0.00 C ATOM 1314 C GLU A 105 -7.922 2.884 1.836 1.00 0.00 C ATOM 1315 O GLU A 105 -8.964 2.434 2.370 1.00 0.00 O ATOM 1316 CB GLU A 105 -7.001 5.060 2.634 1.00 0.00 C ATOM 1317 CG GLU A 105 -7.525 4.780 4.049 1.00 0.00 C ATOM 1318 CD GLU A 105 -6.718 5.443 5.133 1.00 0.00 C ATOM 1319 OE1 GLU A 105 -5.514 5.152 5.258 1.00 0.00 O ATOM 1320 OE2 GLU A 105 -7.268 6.267 5.879 1.00 0.00 O ATOM 0 H GLU A 105 -9.796 4.521 2.040 1.00 0.00 H new ATOM 0 HA GLU A 105 -7.272 4.502 0.586 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -5.961 4.741 2.572 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -7.015 6.136 2.458 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -8.559 5.119 4.118 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -7.531 3.703 4.219 1.00 0.00 H new ATOM 1327 N TYR A 106 -6.899 2.140 1.457 1.00 0.00 N ATOM 1328 CA TYR A 106 -6.803 0.711 1.695 1.00 0.00 C ATOM 1329 C TYR A 106 -7.058 0.382 3.156 1.00 0.00 C ATOM 1330 O TYR A 106 -6.347 0.840 4.067 1.00 0.00 O ATOM 1331 CB TYR A 106 -5.440 0.170 1.184 1.00 0.00 C ATOM 1332 CG TYR A 106 -5.104 -1.268 1.550 1.00 0.00 C ATOM 1333 CD1 TYR A 106 -5.918 -2.311 1.171 1.00 0.00 C ATOM 1334 CD2 TYR A 106 -3.958 -1.569 2.280 1.00 0.00 C ATOM 1335 CE1 TYR A 106 -5.616 -3.614 1.498 1.00 0.00 C ATOM 1336 CE2 TYR A 106 -3.645 -2.871 2.612 1.00 0.00 C ATOM 1337 CZ TYR A 106 -4.478 -3.890 2.218 1.00 0.00 C ATOM 1338 OH TYR A 106 -4.180 -5.192 2.557 1.00 0.00 O ATOM 0 H TYR A 106 -6.092 2.522 0.963 1.00 0.00 H new ATOM 0 HA TYR A 106 -7.583 0.203 1.127 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -5.422 0.259 0.098 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -4.650 0.814 1.570 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -6.814 -2.103 0.604 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -3.302 -0.770 2.592 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -6.271 -4.416 1.190 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -2.751 -3.088 3.178 1.00 0.00 H new ATOM 0 HH TYR A 106 -3.342 -5.214 3.064 1.00 0.00 H new ATOM 1348 N GLY A 107 -8.105 -0.357 3.374 1.00 0.00 N ATOM 1349 CA GLY A 107 -8.463 -0.721 4.695 1.00 0.00 C ATOM 1350 C GLY A 107 -9.837 -0.255 5.059 1.00 0.00 C ATOM 1351 O GLY A 107 -10.477 -0.849 5.935 1.00 0.00 O ATOM 0 H GLY A 107 -8.722 -0.716 2.646 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -8.410 -1.805 4.798 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.741 -0.299 5.394 1.00 0.00 H new ATOM 1355 N VAL A 108 -10.327 0.801 4.413 1.00 0.00 N ATOM 1356 CA VAL A 108 -11.662 1.259 4.729 1.00 0.00 C ATOM 1357 C VAL A 108 -12.687 0.331 4.137 1.00 0.00 C ATOM 1358 O VAL A 108 -12.536 -0.176 3.015 1.00 0.00 O ATOM 1359 CB VAL A 108 -12.001 2.743 4.324 1.00 0.00 C ATOM 1360 CG1 VAL A 108 -11.012 3.730 4.847 1.00 0.00 C ATOM 1361 CG2 VAL A 108 -12.247 2.933 2.837 1.00 0.00 C ATOM 0 H VAL A 108 -9.835 1.333 3.695 1.00 0.00 H new ATOM 0 HA VAL A 108 -11.695 1.248 5.818 1.00 0.00 H new ATOM 0 HB VAL A 108 -12.951 2.949 4.816 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -11.300 4.734 4.535 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -10.990 3.681 5.936 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -10.023 3.497 4.453 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -12.474 3.980 2.637 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -11.356 2.642 2.281 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -13.088 2.313 2.525 1.00 0.00 H new ATOM 1371 N LYS A 109 -13.668 0.063 4.903 1.00 0.00 N ATOM 1372 CA LYS A 109 -14.768 -0.693 4.462 1.00 0.00 C ATOM 1373 C LYS A 109 -15.883 0.276 4.287 1.00 0.00 C ATOM 1374 O LYS A 109 -16.206 1.003 5.233 1.00 0.00 O ATOM 1375 CB LYS A 109 -15.156 -1.735 5.502 1.00 0.00 C ATOM 1376 CG LYS A 109 -16.326 -2.601 5.095 1.00 0.00 C ATOM 1377 CD LYS A 109 -16.716 -3.576 6.199 1.00 0.00 C ATOM 1378 CE LYS A 109 -15.714 -4.718 6.315 1.00 0.00 C ATOM 1379 NZ LYS A 109 -16.020 -5.630 7.434 1.00 0.00 N ATOM 0 H LYS A 109 -13.731 0.369 5.874 1.00 0.00 H new ATOM 0 HA LYS A 109 -14.535 -1.223 3.539 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -14.295 -2.374 5.700 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -15.399 -1.229 6.436 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -17.179 -1.968 4.850 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -16.071 -3.156 4.192 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -16.777 -3.046 7.149 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -17.708 -3.980 5.996 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -15.703 -5.283 5.383 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -14.714 -4.306 6.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -15.309 -6.388 7.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -16.004 -5.100 8.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -16.963 -6.046 7.295 1.00 0.00 H new ATOM 1393 N ALA A 110 -16.408 0.348 3.105 1.00 0.00 N ATOM 1394 CA ALA A 110 -17.515 1.188 2.830 1.00 0.00 C ATOM 1395 C ALA A 110 -18.771 0.373 3.033 1.00 0.00 C ATOM 1396 O ALA A 110 -19.162 -0.399 2.152 1.00 0.00 O ATOM 1397 CB ALA A 110 -17.463 1.727 1.406 1.00 0.00 C ATOM 0 H ALA A 110 -16.073 -0.182 2.301 1.00 0.00 H new ATOM 0 HA ALA A 110 -17.498 2.048 3.500 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -18.327 2.368 1.228 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -16.549 2.304 1.269 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -17.477 0.895 0.701 1.00 0.00 H new ATOM 1403 N VAL A 111 -19.334 0.460 4.207 1.00 0.00 N ATOM 1404 CA VAL A 111 -20.549 -0.249 4.524 1.00 0.00 C ATOM 1405 C VAL A 111 -21.696 0.512 3.896 1.00 0.00 C ATOM 1406 O VAL A 111 -21.877 1.712 4.156 1.00 0.00 O ATOM 1407 CB VAL A 111 -20.757 -0.401 6.058 1.00 0.00 C ATOM 1408 CG1 VAL A 111 -22.040 -1.166 6.375 1.00 0.00 C ATOM 1409 CG2 VAL A 111 -19.563 -1.097 6.692 1.00 0.00 C ATOM 0 H VAL A 111 -18.965 1.024 4.973 1.00 0.00 H new ATOM 0 HA VAL A 111 -20.493 -1.263 4.127 1.00 0.00 H new ATOM 0 HB VAL A 111 -20.849 0.600 6.479 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -22.154 -1.254 7.455 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -22.895 -0.630 5.962 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -21.989 -2.161 5.934 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -19.726 -1.194 7.765 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -19.443 -2.087 6.252 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -18.663 -0.509 6.514 1.00 0.00 H new ATOM 1419 N TYR A 112 -22.429 -0.155 3.065 1.00 0.00 N ATOM 1420 CA TYR A 112 -23.460 0.462 2.283 1.00 0.00 C ATOM 1421 C TYR A 112 -24.762 0.332 2.992 1.00 0.00 C ATOM 1422 O TYR A 112 -25.092 -0.725 3.519 1.00 0.00 O ATOM 1423 CB TYR A 112 -23.504 -0.195 0.905 1.00 0.00 C ATOM 1424 CG TYR A 112 -24.333 0.521 -0.135 1.00 0.00 C ATOM 1425 CD1 TYR A 112 -23.809 1.589 -0.849 1.00 0.00 C ATOM 1426 CD2 TYR A 112 -25.623 0.120 -0.419 1.00 0.00 C ATOM 1427 CE1 TYR A 112 -24.556 2.234 -1.812 1.00 0.00 C ATOM 1428 CE2 TYR A 112 -26.368 0.757 -1.381 1.00 0.00 C ATOM 1429 CZ TYR A 112 -25.840 1.808 -2.072 1.00 0.00 C ATOM 1430 OH TYR A 112 -26.595 2.440 -3.032 1.00 0.00 O ATOM 0 H TYR A 112 -22.330 -1.158 2.905 1.00 0.00 H new ATOM 0 HA TYR A 112 -23.253 1.524 2.149 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -22.484 -0.283 0.532 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -23.891 -1.208 1.018 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -22.801 1.920 -0.648 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -26.053 -0.708 0.124 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -24.138 3.067 -2.358 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -27.374 0.425 -1.591 1.00 0.00 H new ATOM 0 HH TYR A 112 -27.526 2.495 -2.732 1.00 0.00 H new ATOM 1440 N THR A 113 -25.465 1.415 3.079 1.00 0.00 N ATOM 1441 CA THR A 113 -26.730 1.436 3.730 1.00 0.00 C ATOM 1442 C THR A 113 -27.538 2.573 3.122 1.00 0.00 C ATOM 1443 O THR A 113 -26.966 3.520 2.567 1.00 0.00 O ATOM 1444 CB THR A 113 -26.569 1.686 5.248 1.00 0.00 C ATOM 1445 OG1 THR A 113 -25.433 0.963 5.756 1.00 0.00 O ATOM 1446 CG2 THR A 113 -27.781 1.176 5.972 1.00 0.00 C ATOM 0 H THR A 113 -25.173 2.315 2.697 1.00 0.00 H new ATOM 0 HA THR A 113 -27.227 0.475 3.596 1.00 0.00 H new ATOM 0 HB THR A 113 -26.439 2.757 5.404 1.00 0.00 H new ATOM 0 HG1 THR A 113 -25.341 1.131 6.717 1.00 0.00 H new ATOM 0 HG21 THR A 113 -27.667 1.352 7.042 1.00 0.00 H new ATOM 0 HG22 THR A 113 -28.667 1.698 5.611 1.00 0.00 H new ATOM 0 HG23 THR A 113 -27.890 0.107 5.790 1.00 0.00 H new ATOM 1454 N CYS A 114 -28.822 2.490 3.210 1.00 0.00 N ATOM 1455 CA CYS A 114 -29.679 3.496 2.648 1.00 0.00 C ATOM 1456 C CYS A 114 -30.745 3.917 3.641 1.00 0.00 C ATOM 1457 O CYS A 114 -30.657 4.984 4.250 1.00 0.00 O ATOM 1458 CB CYS A 114 -30.322 2.990 1.354 1.00 0.00 C ATOM 1459 SG CYS A 114 -29.135 2.537 0.051 1.00 0.00 S ATOM 0 H CYS A 114 -29.314 1.725 3.672 1.00 0.00 H new ATOM 0 HA CYS A 114 -29.069 4.369 2.415 1.00 0.00 H new ATOM 0 HB2 CYS A 114 -30.939 2.121 1.585 1.00 0.00 H new ATOM 0 HB3 CYS A 114 -30.989 3.761 0.969 1.00 0.00 H new ATOM 1464 N ASN A 115 -31.706 3.051 3.864 1.00 0.00 N ATOM 1465 CA ASN A 115 -32.844 3.375 4.708 1.00 0.00 C ATOM 1466 C ASN A 115 -33.048 2.283 5.728 1.00 0.00 C ATOM 1467 O ASN A 115 -32.225 1.376 5.829 1.00 0.00 O ATOM 1468 CB ASN A 115 -34.131 3.586 3.874 1.00 0.00 C ATOM 1469 CG ASN A 115 -34.087 4.805 2.955 1.00 0.00 C ATOM 1470 OD1 ASN A 115 -33.420 5.797 3.242 1.00 0.00 O ATOM 1471 ND2 ASN A 115 -34.790 4.745 1.852 1.00 0.00 N ATOM 0 H ASN A 115 -31.726 2.110 3.472 1.00 0.00 H new ATOM 0 HA ASN A 115 -32.631 4.313 5.221 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -34.310 2.696 3.271 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -34.978 3.687 4.553 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -34.793 5.534 1.206 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -35.334 3.909 1.639 1.00 0.00 H new ATOM 1478 N GLU A 116 -34.113 2.370 6.490 1.00 0.00 N ATOM 1479 CA GLU A 116 -34.397 1.407 7.536 1.00 0.00 C ATOM 1480 C GLU A 116 -35.135 0.203 6.974 1.00 0.00 C ATOM 1481 O GLU A 116 -34.741 -0.942 7.181 1.00 0.00 O ATOM 1482 CB GLU A 116 -35.251 2.064 8.601 1.00 0.00 C ATOM 1483 CG GLU A 116 -35.510 1.202 9.806 1.00 0.00 C ATOM 1484 CD GLU A 116 -36.569 1.777 10.681 1.00 0.00 C ATOM 1485 OE1 GLU A 116 -36.345 2.837 11.312 1.00 0.00 O ATOM 1486 OE2 GLU A 116 -37.663 1.187 10.747 1.00 0.00 O ATOM 0 H GLU A 116 -34.810 3.110 6.405 1.00 0.00 H new ATOM 0 HA GLU A 116 -33.454 1.069 7.965 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -34.764 2.984 8.925 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -36.206 2.348 8.160 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -35.808 0.205 9.482 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -34.588 1.089 10.377 1.00 0.00 H new ATOM 1493 N GLY A 117 -36.202 0.484 6.259 1.00 0.00 N ATOM 1494 CA GLY A 117 -37.042 -0.557 5.688 1.00 0.00 C ATOM 1495 C GLY A 117 -36.408 -1.204 4.487 1.00 0.00 C ATOM 1496 O GLY A 117 -36.793 -2.307 4.079 1.00 0.00 O ATOM 0 H GLY A 117 -36.514 1.433 6.055 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -37.242 -1.316 6.444 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -38.004 -0.130 5.403 1.00 0.00 H new ATOM 1500 N TYR A 118 -35.450 -0.512 3.927 1.00 0.00 N ATOM 1501 CA TYR A 118 -34.703 -0.983 2.797 1.00 0.00 C ATOM 1502 C TYR A 118 -33.420 -1.540 3.312 1.00 0.00 C ATOM 1503 O TYR A 118 -32.807 -0.958 4.216 1.00 0.00 O ATOM 1504 CB TYR A 118 -34.398 0.162 1.810 1.00 0.00 C ATOM 1505 CG TYR A 118 -35.614 0.755 1.132 1.00 0.00 C ATOM 1506 CD1 TYR A 118 -36.490 1.576 1.822 1.00 0.00 C ATOM 1507 CD2 TYR A 118 -35.885 0.484 -0.199 1.00 0.00 C ATOM 1508 CE1 TYR A 118 -37.602 2.101 1.212 1.00 0.00 C ATOM 1509 CE2 TYR A 118 -36.996 1.012 -0.819 1.00 0.00 C ATOM 1510 CZ TYR A 118 -37.855 1.817 -0.106 1.00 0.00 C ATOM 1511 OH TYR A 118 -38.983 2.334 -0.715 1.00 0.00 O ATOM 0 H TYR A 118 -35.164 0.412 4.252 1.00 0.00 H new ATOM 0 HA TYR A 118 -35.284 -1.736 2.264 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -33.875 0.955 2.345 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -33.717 -0.209 1.044 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -36.295 1.807 2.859 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -35.215 -0.151 -0.759 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -38.276 2.736 1.768 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -37.192 0.795 -1.859 1.00 0.00 H new ATOM 0 HH TYR A 118 -39.015 2.039 -1.649 1.00 0.00 H new ATOM 1521 N GLN A 119 -33.012 -2.647 2.793 1.00 0.00 N ATOM 1522 CA GLN A 119 -31.799 -3.235 3.183 1.00 0.00 C ATOM 1523 C GLN A 119 -30.881 -3.177 1.997 1.00 0.00 C ATOM 1524 O GLN A 119 -30.452 -2.082 1.610 1.00 0.00 O ATOM 1525 CB GLN A 119 -31.991 -4.683 3.712 1.00 0.00 C ATOM 1526 CG GLN A 119 -32.701 -4.809 5.070 1.00 0.00 C ATOM 1527 CD GLN A 119 -34.172 -4.380 5.105 1.00 0.00 C ATOM 1528 OE1 GLN A 119 -34.653 -3.903 6.136 1.00 0.00 O ATOM 1529 NE2 GLN A 119 -34.901 -4.593 4.038 1.00 0.00 N ATOM 0 H GLN A 119 -33.524 -3.166 2.080 1.00 0.00 H new ATOM 0 HA GLN A 119 -31.366 -2.689 4.021 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -32.559 -5.248 2.972 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -31.011 -5.154 3.790 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -32.639 -5.848 5.394 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -32.153 -4.214 5.800 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -34.475 -4.989 3.200 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -35.895 -4.363 4.045 1.00 0.00 H new ATOM 1538 N LEU A 120 -30.649 -4.315 1.385 1.00 0.00 N ATOM 1539 CA LEU A 120 -29.863 -4.458 0.188 1.00 0.00 C ATOM 1540 C LEU A 120 -29.803 -5.898 -0.205 1.00 0.00 C ATOM 1541 O LEU A 120 -29.783 -6.781 0.651 1.00 0.00 O ATOM 1542 CB LEU A 120 -28.455 -3.840 0.329 1.00 0.00 C ATOM 1543 CG LEU A 120 -27.693 -4.162 1.612 1.00 0.00 C ATOM 1544 CD1 LEU A 120 -27.081 -5.564 1.607 1.00 0.00 C ATOM 1545 CD2 LEU A 120 -26.657 -3.112 1.884 1.00 0.00 C ATOM 0 H LEU A 120 -31.020 -5.202 1.725 1.00 0.00 H new ATOM 0 HA LEU A 120 -30.353 -3.898 -0.608 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -27.852 -4.169 -0.517 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -28.549 -2.757 0.251 1.00 0.00 H new ATOM 0 HG LEU A 120 -28.419 -4.155 2.425 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -26.553 -5.734 2.545 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -27.872 -6.306 1.497 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -26.382 -5.653 0.776 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -26.123 -3.357 2.802 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -25.952 -3.073 1.054 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -27.142 -2.142 1.994 1.00 0.00 H new ATOM 1557 N LEU A 121 -29.861 -6.144 -1.463 1.00 0.00 N ATOM 1558 CA LEU A 121 -29.733 -7.469 -1.957 1.00 0.00 C ATOM 1559 C LEU A 121 -28.300 -7.790 -2.214 1.00 0.00 C ATOM 1560 O LEU A 121 -27.542 -6.974 -2.771 1.00 0.00 O ATOM 1561 CB LEU A 121 -30.620 -7.737 -3.171 1.00 0.00 C ATOM 1562 CG LEU A 121 -32.115 -7.963 -2.880 1.00 0.00 C ATOM 1563 CD1 LEU A 121 -32.339 -9.176 -2.002 1.00 0.00 C ATOM 1564 CD2 LEU A 121 -32.742 -6.758 -2.261 1.00 0.00 C ATOM 0 H LEU A 121 -29.999 -5.433 -2.181 1.00 0.00 H new ATOM 0 HA LEU A 121 -30.095 -8.146 -1.184 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -30.527 -6.895 -3.856 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -30.235 -8.615 -3.690 1.00 0.00 H new ATOM 0 HG LEU A 121 -32.596 -8.145 -3.841 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -33.406 -9.301 -1.820 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -31.950 -10.063 -2.501 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -31.823 -9.038 -1.052 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -33.797 -6.954 -2.070 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -32.240 -6.528 -1.321 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -32.648 -5.910 -2.939 1.00 0.00 H new ATOM 1576 N GLY A 122 -27.936 -8.942 -1.778 1.00 0.00 N ATOM 1577 CA GLY A 122 -26.590 -9.383 -1.818 1.00 0.00 C ATOM 1578 C GLY A 122 -26.194 -9.777 -0.433 1.00 0.00 C ATOM 1579 O GLY A 122 -26.862 -9.392 0.532 1.00 0.00 O ATOM 0 H GLY A 122 -28.582 -9.620 -1.374 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -26.485 -10.227 -2.499 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -25.940 -8.591 -2.190 1.00 0.00 H new ATOM 1583 N GLU A 123 -25.163 -10.535 -0.307 1.00 0.00 N ATOM 1584 CA GLU A 123 -24.735 -11.003 0.990 1.00 0.00 C ATOM 1585 C GLU A 123 -23.718 -10.051 1.554 1.00 0.00 C ATOM 1586 O GLU A 123 -23.497 -9.991 2.755 1.00 0.00 O ATOM 1587 CB GLU A 123 -24.117 -12.406 0.910 1.00 0.00 C ATOM 1588 CG GLU A 123 -25.027 -13.503 0.350 1.00 0.00 C ATOM 1589 CD GLU A 123 -25.252 -13.381 -1.136 1.00 0.00 C ATOM 1590 OE1 GLU A 123 -24.268 -13.432 -1.895 1.00 0.00 O ATOM 1591 OE2 GLU A 123 -26.409 -13.209 -1.576 1.00 0.00 O ATOM 0 H GLU A 123 -24.587 -10.854 -1.086 1.00 0.00 H new ATOM 0 HA GLU A 123 -25.612 -11.052 1.635 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -23.221 -12.353 0.292 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -23.798 -12.700 1.910 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -24.588 -14.477 0.567 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -25.989 -13.466 0.862 1.00 0.00 H new ATOM 1598 N ILE A 124 -23.105 -9.306 0.681 1.00 0.00 N ATOM 1599 CA ILE A 124 -22.068 -8.408 1.068 1.00 0.00 C ATOM 1600 C ILE A 124 -22.609 -6.990 1.043 1.00 0.00 C ATOM 1601 O ILE A 124 -22.812 -6.406 -0.019 1.00 0.00 O ATOM 1602 CB ILE A 124 -20.840 -8.538 0.135 1.00 0.00 C ATOM 1603 CG1 ILE A 124 -20.413 -10.003 0.007 1.00 0.00 C ATOM 1604 CG2 ILE A 124 -19.675 -7.717 0.681 1.00 0.00 C ATOM 1605 CD1 ILE A 124 -19.890 -10.590 1.288 1.00 0.00 C ATOM 0 H ILE A 124 -23.313 -9.307 -0.318 1.00 0.00 H new ATOM 0 HA ILE A 124 -21.739 -8.657 2.077 1.00 0.00 H new ATOM 0 HB ILE A 124 -21.119 -8.162 -0.849 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -21.264 -10.593 -0.333 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -19.643 -10.083 -0.761 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -18.817 -7.816 0.016 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -19.966 -6.669 0.743 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -19.409 -8.079 1.674 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -19.607 -11.630 1.123 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -19.019 -10.024 1.618 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -20.665 -10.542 2.053 1.00 0.00 H new ATOM 1617 N ASN A 125 -22.826 -6.461 2.213 1.00 0.00 N ATOM 1618 CA ASN A 125 -23.426 -5.141 2.430 1.00 0.00 C ATOM 1619 C ASN A 125 -22.366 -4.042 2.439 1.00 0.00 C ATOM 1620 O ASN A 125 -22.583 -2.956 2.971 1.00 0.00 O ATOM 1621 CB ASN A 125 -24.158 -5.137 3.792 1.00 0.00 C ATOM 1622 CG ASN A 125 -23.225 -5.343 4.997 1.00 0.00 C ATOM 1623 OD1 ASN A 125 -22.187 -6.006 4.895 1.00 0.00 O ATOM 1624 ND2 ASN A 125 -23.596 -4.821 6.134 1.00 0.00 N ATOM 0 H ASN A 125 -22.588 -6.939 3.082 1.00 0.00 H new ATOM 0 HA ASN A 125 -24.122 -4.944 1.614 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -24.684 -4.189 3.909 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -24.914 -5.923 3.790 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -23.024 -4.956 6.968 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -24.458 -4.278 6.189 1.00 0.00 H new ATOM 1631 N TYR A 126 -21.262 -4.287 1.794 1.00 0.00 N ATOM 1632 CA TYR A 126 -20.149 -3.370 1.862 1.00 0.00 C ATOM 1633 C TYR A 126 -19.223 -3.575 0.709 1.00 0.00 C ATOM 1634 O TYR A 126 -19.360 -4.533 -0.062 1.00 0.00 O ATOM 1635 CB TYR A 126 -19.361 -3.576 3.183 1.00 0.00 C ATOM 1636 CG TYR A 126 -18.612 -4.907 3.270 1.00 0.00 C ATOM 1637 CD1 TYR A 126 -19.211 -6.039 3.787 1.00 0.00 C ATOM 1638 CD2 TYR A 126 -17.299 -5.017 2.812 1.00 0.00 C ATOM 1639 CE1 TYR A 126 -18.531 -7.239 3.849 1.00 0.00 C ATOM 1640 CE2 TYR A 126 -16.613 -6.202 2.868 1.00 0.00 C ATOM 1641 CZ TYR A 126 -17.234 -7.319 3.389 1.00 0.00 C ATOM 1642 OH TYR A 126 -16.564 -8.519 3.445 1.00 0.00 O ATOM 0 H TYR A 126 -21.104 -5.111 1.214 1.00 0.00 H new ATOM 0 HA TYR A 126 -20.549 -2.357 1.826 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -18.645 -2.762 3.296 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -20.055 -3.508 4.021 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -20.227 -5.985 4.148 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -16.810 -4.145 2.402 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -19.015 -8.114 4.257 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -15.596 -6.261 2.508 1.00 0.00 H new ATOM 0 HH TYR A 126 -15.661 -8.407 3.081 1.00 0.00 H new ATOM 1652 N ARG A 127 -18.292 -2.683 0.601 1.00 0.00 N ATOM 1653 CA ARG A 127 -17.223 -2.778 -0.330 1.00 0.00 C ATOM 1654 C ARG A 127 -15.970 -2.412 0.429 1.00 0.00 C ATOM 1655 O ARG A 127 -15.971 -1.429 1.157 1.00 0.00 O ATOM 1656 CB ARG A 127 -17.406 -1.807 -1.497 1.00 0.00 C ATOM 1657 CG ARG A 127 -18.744 -1.890 -2.205 1.00 0.00 C ATOM 1658 CD ARG A 127 -18.700 -1.182 -3.547 1.00 0.00 C ATOM 1659 NE ARG A 127 -17.796 -1.874 -4.484 1.00 0.00 N ATOM 1660 CZ ARG A 127 -17.404 -1.412 -5.686 1.00 0.00 C ATOM 1661 NH1 ARG A 127 -17.797 -0.220 -6.118 1.00 0.00 N ATOM 1662 NH2 ARG A 127 -16.628 -2.160 -6.449 1.00 0.00 N ATOM 0 H ARG A 127 -18.257 -1.843 1.178 1.00 0.00 H new ATOM 0 HA ARG A 127 -17.178 -3.783 -0.750 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -17.272 -0.791 -1.127 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -16.616 -1.988 -2.226 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -19.017 -2.935 -2.351 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -19.517 -1.443 -1.580 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -19.703 -1.137 -3.971 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -18.367 -0.154 -3.408 1.00 0.00 H new ATOM 0 HE ARG A 127 -17.436 -2.784 -4.196 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -18.404 0.358 -5.537 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -17.492 0.118 -7.031 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -16.330 -3.081 -6.126 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -16.327 -1.817 -7.361 1.00 0.00 H new ATOM 1676 N GLU A 128 -14.941 -3.185 0.319 1.00 0.00 N ATOM 1677 CA GLU A 128 -13.711 -2.872 1.006 1.00 0.00 C ATOM 1678 C GLU A 128 -12.688 -2.329 0.048 1.00 0.00 C ATOM 1679 O GLU A 128 -12.592 -2.794 -1.084 1.00 0.00 O ATOM 1680 CB GLU A 128 -13.140 -4.093 1.729 1.00 0.00 C ATOM 1681 CG GLU A 128 -13.552 -4.235 3.172 1.00 0.00 C ATOM 1682 CD GLU A 128 -12.818 -5.361 3.853 1.00 0.00 C ATOM 1683 OE1 GLU A 128 -11.612 -5.195 4.170 1.00 0.00 O ATOM 1684 OE2 GLU A 128 -13.423 -6.417 4.096 1.00 0.00 O ATOM 0 H GLU A 128 -14.917 -4.040 -0.237 1.00 0.00 H new ATOM 0 HA GLU A 128 -13.945 -2.112 1.751 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -13.446 -4.990 1.191 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -12.052 -4.048 1.681 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -13.357 -3.302 3.700 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -14.626 -4.414 3.228 1.00 0.00 H new ATOM 1691 N CYS A 129 -11.964 -1.319 0.474 1.00 0.00 N ATOM 1692 CA CYS A 129 -10.863 -0.815 -0.306 1.00 0.00 C ATOM 1693 C CYS A 129 -9.711 -1.744 -0.065 1.00 0.00 C ATOM 1694 O CYS A 129 -9.112 -1.750 1.029 1.00 0.00 O ATOM 1695 CB CYS A 129 -10.495 0.614 0.088 1.00 0.00 C ATOM 1696 SG CYS A 129 -9.050 1.311 -0.809 1.00 0.00 S ATOM 0 H CYS A 129 -12.120 -0.832 1.357 1.00 0.00 H new ATOM 0 HA CYS A 129 -11.132 -0.778 -1.362 1.00 0.00 H new ATOM 0 HB2 CYS A 129 -11.358 1.258 -0.085 1.00 0.00 H new ATOM 0 HB3 CYS A 129 -10.288 0.639 1.158 1.00 0.00 H new ATOM 1701 N ASP A 130 -9.457 -2.566 -1.032 1.00 0.00 N ATOM 1702 CA ASP A 130 -8.491 -3.602 -0.912 1.00 0.00 C ATOM 1703 C ASP A 130 -7.225 -3.238 -1.716 1.00 0.00 C ATOM 1704 O ASP A 130 -7.000 -2.077 -2.043 1.00 0.00 O ATOM 1705 CB ASP A 130 -9.132 -4.926 -1.383 1.00 0.00 C ATOM 1706 CG ASP A 130 -8.351 -6.175 -1.001 1.00 0.00 C ATOM 1707 OD1 ASP A 130 -8.491 -6.664 0.135 1.00 0.00 O ATOM 1708 OD2 ASP A 130 -7.568 -6.677 -1.845 1.00 0.00 O ATOM 0 H ASP A 130 -9.923 -2.533 -1.939 1.00 0.00 H new ATOM 0 HA ASP A 130 -8.179 -3.724 0.125 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -10.136 -4.998 -0.965 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -9.240 -4.897 -2.467 1.00 0.00 H new ATOM 1713 N THR A 131 -6.446 -4.229 -2.032 1.00 0.00 N ATOM 1714 CA THR A 131 -5.134 -4.115 -2.615 1.00 0.00 C ATOM 1715 C THR A 131 -5.102 -3.426 -3.960 1.00 0.00 C ATOM 1716 O THR A 131 -4.097 -2.826 -4.324 1.00 0.00 O ATOM 1717 CB THR A 131 -4.550 -5.509 -2.753 1.00 0.00 C ATOM 1718 OG1 THR A 131 -5.481 -6.346 -3.483 1.00 0.00 O ATOM 1719 CG2 THR A 131 -4.335 -6.084 -1.386 1.00 0.00 C ATOM 0 H THR A 131 -6.723 -5.199 -1.882 1.00 0.00 H new ATOM 0 HA THR A 131 -4.547 -3.486 -1.946 1.00 0.00 H new ATOM 0 HB THR A 131 -3.602 -5.463 -3.289 1.00 0.00 H new ATOM 0 HG1 THR A 131 -6.133 -6.730 -2.860 1.00 0.00 H new ATOM 0 HG21 THR A 131 -3.915 -7.086 -1.475 1.00 0.00 H new ATOM 0 HG22 THR A 131 -3.645 -5.450 -0.829 1.00 0.00 H new ATOM 0 HG23 THR A 131 -5.288 -6.135 -0.859 1.00 0.00 H new ATOM 1727 N ASP A 132 -6.166 -3.547 -4.691 1.00 0.00 N ATOM 1728 CA ASP A 132 -6.241 -2.945 -6.013 1.00 0.00 C ATOM 1729 C ASP A 132 -7.360 -1.917 -6.080 1.00 0.00 C ATOM 1730 O ASP A 132 -7.290 -0.930 -6.826 1.00 0.00 O ATOM 1731 CB ASP A 132 -6.466 -4.026 -7.063 1.00 0.00 C ATOM 1732 CG ASP A 132 -6.317 -3.510 -8.471 1.00 0.00 C ATOM 1733 OD1 ASP A 132 -7.310 -3.020 -9.056 1.00 0.00 O ATOM 1734 OD2 ASP A 132 -5.187 -3.587 -9.020 1.00 0.00 O ATOM 0 H ASP A 132 -7.003 -4.055 -4.406 1.00 0.00 H new ATOM 0 HA ASP A 132 -5.297 -2.437 -6.212 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -5.756 -4.837 -6.901 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -7.464 -4.446 -6.938 1.00 0.00 H new ATOM 1739 N GLY A 133 -8.371 -2.125 -5.279 1.00 0.00 N ATOM 1740 CA GLY A 133 -9.515 -1.264 -5.302 1.00 0.00 C ATOM 1741 C GLY A 133 -10.621 -1.843 -4.483 1.00 0.00 C ATOM 1742 O GLY A 133 -10.363 -2.673 -3.616 1.00 0.00 O ATOM 0 H GLY A 133 -8.422 -2.886 -4.602 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -9.245 -0.281 -4.917 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -9.851 -1.123 -6.329 1.00 0.00 H new ATOM 1746 N TRP A 134 -11.835 -1.444 -4.764 1.00 0.00 N ATOM 1747 CA TRP A 134 -12.991 -1.906 -4.024 1.00 0.00 C ATOM 1748 C TRP A 134 -13.346 -3.332 -4.377 1.00 0.00 C ATOM 1749 O TRP A 134 -13.461 -3.687 -5.567 1.00 0.00 O ATOM 1750 CB TRP A 134 -14.221 -1.042 -4.294 1.00 0.00 C ATOM 1751 CG TRP A 134 -14.111 0.379 -3.887 1.00 0.00 C ATOM 1752 CD1 TRP A 134 -13.918 1.444 -4.705 1.00 0.00 C ATOM 1753 CD2 TRP A 134 -14.197 0.899 -2.559 1.00 0.00 C ATOM 1754 NE1 TRP A 134 -13.881 2.593 -3.971 1.00 0.00 N ATOM 1755 CE2 TRP A 134 -14.050 2.284 -2.647 1.00 0.00 C ATOM 1756 CE3 TRP A 134 -14.385 0.324 -1.309 1.00 0.00 C ATOM 1757 CZ2 TRP A 134 -14.083 3.107 -1.529 1.00 0.00 C ATOM 1758 CZ3 TRP A 134 -14.415 1.140 -0.201 1.00 0.00 C ATOM 1759 CH2 TRP A 134 -14.267 2.518 -0.318 1.00 0.00 C ATOM 0 H TRP A 134 -12.055 -0.788 -5.513 1.00 0.00 H new ATOM 0 HA TRP A 134 -12.715 -1.839 -2.972 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -14.441 -1.079 -5.361 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -15.073 -1.484 -3.777 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -13.810 1.390 -5.778 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -13.749 3.532 -4.347 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -14.506 -0.744 -1.208 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -13.967 4.177 -1.619 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -14.556 0.703 0.776 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -14.299 3.132 0.570 1.00 0.00 H new ATOM 1770 N THR A 135 -13.528 -4.126 -3.367 1.00 0.00 N ATOM 1771 CA THR A 135 -13.991 -5.465 -3.512 1.00 0.00 C ATOM 1772 C THR A 135 -15.499 -5.440 -3.650 1.00 0.00 C ATOM 1773 O THR A 135 -16.146 -4.420 -3.271 1.00 0.00 O ATOM 1774 CB THR A 135 -13.613 -6.294 -2.279 1.00 0.00 C ATOM 1775 OG1 THR A 135 -14.056 -5.624 -1.080 1.00 0.00 O ATOM 1776 CG2 THR A 135 -12.122 -6.503 -2.217 1.00 0.00 C ATOM 0 H THR A 135 -13.354 -3.852 -2.400 1.00 0.00 H new ATOM 0 HA THR A 135 -13.533 -5.915 -4.393 1.00 0.00 H new ATOM 0 HB THR A 135 -14.102 -7.265 -2.355 1.00 0.00 H new ATOM 0 HG1 THR A 135 -14.263 -6.289 -0.391 1.00 0.00 H new ATOM 0 HG21 THR A 135 -11.874 -7.093 -1.335 1.00 0.00 H new ATOM 0 HG22 THR A 135 -11.791 -7.030 -3.112 1.00 0.00 H new ATOM 0 HG23 THR A 135 -11.621 -5.537 -2.159 1.00 0.00 H new ATOM 1784 N ASN A 136 -16.066 -6.508 -4.231 1.00 0.00 N ATOM 1785 CA ASN A 136 -17.506 -6.648 -4.384 1.00 0.00 C ATOM 1786 C ASN A 136 -18.007 -5.528 -5.313 1.00 0.00 C ATOM 1787 O ASN A 136 -17.194 -4.827 -5.937 1.00 0.00 O ATOM 1788 CB ASN A 136 -18.179 -6.618 -2.965 1.00 0.00 C ATOM 1789 CG ASN A 136 -19.680 -6.860 -2.947 1.00 0.00 C ATOM 1790 OD1 ASN A 136 -20.229 -7.549 -3.808 1.00 0.00 O ATOM 1791 ND2 ASN A 136 -20.336 -6.321 -1.957 1.00 0.00 N ATOM 0 H ASN A 136 -15.533 -7.293 -4.605 1.00 0.00 H new ATOM 0 HA ASN A 136 -17.772 -7.601 -4.842 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -17.700 -7.371 -2.339 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -17.979 -5.649 -2.508 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -21.343 -6.463 -1.875 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -19.842 -5.757 -1.265 1.00 0.00 H new ATOM 1798 N ASP A 137 -19.270 -5.377 -5.449 1.00 0.00 N ATOM 1799 CA ASP A 137 -19.813 -4.323 -6.249 1.00 0.00 C ATOM 1800 C ASP A 137 -20.795 -3.577 -5.356 1.00 0.00 C ATOM 1801 O ASP A 137 -20.799 -3.797 -4.141 1.00 0.00 O ATOM 1802 CB ASP A 137 -20.503 -4.913 -7.481 1.00 0.00 C ATOM 1803 CG ASP A 137 -20.639 -3.940 -8.657 1.00 0.00 C ATOM 1804 OD1 ASP A 137 -21.249 -2.859 -8.519 1.00 0.00 O ATOM 1805 OD2 ASP A 137 -20.201 -4.290 -9.770 1.00 0.00 O ATOM 0 H ASP A 137 -19.968 -5.978 -5.011 1.00 0.00 H new ATOM 0 HA ASP A 137 -19.043 -3.643 -6.615 1.00 0.00 H new ATOM 0 HB2 ASP A 137 -19.943 -5.788 -7.812 1.00 0.00 H new ATOM 0 HB3 ASP A 137 -21.496 -5.259 -7.195 1.00 0.00 H new ATOM 1810 N ILE A 138 -21.584 -2.732 -5.911 1.00 0.00 N ATOM 1811 CA ILE A 138 -22.534 -1.940 -5.169 1.00 0.00 C ATOM 1812 C ILE A 138 -23.806 -2.772 -4.911 1.00 0.00 C ATOM 1813 O ILE A 138 -24.453 -3.233 -5.863 1.00 0.00 O ATOM 1814 CB ILE A 138 -22.870 -0.667 -5.986 1.00 0.00 C ATOM 1815 CG1 ILE A 138 -21.590 0.131 -6.265 1.00 0.00 C ATOM 1816 CG2 ILE A 138 -23.886 0.224 -5.257 1.00 0.00 C ATOM 1817 CD1 ILE A 138 -21.757 1.101 -7.388 1.00 0.00 C ATOM 0 H ILE A 138 -21.599 -2.557 -6.916 1.00 0.00 H new ATOM 0 HA ILE A 138 -22.113 -1.646 -4.208 1.00 0.00 H new ATOM 0 HB ILE A 138 -23.317 -0.987 -6.927 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -21.297 0.670 -5.364 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -20.780 -0.558 -6.502 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -24.096 1.106 -5.862 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -24.809 -0.333 -5.096 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -23.476 0.532 -4.295 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -20.823 1.640 -7.545 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -22.022 0.562 -8.298 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -22.548 1.810 -7.142 1.00 0.00 H new ATOM 1829 N PRO A 139 -24.132 -3.032 -3.626 1.00 0.00 N ATOM 1830 CA PRO A 139 -25.340 -3.765 -3.249 1.00 0.00 C ATOM 1831 C PRO A 139 -26.604 -2.911 -3.500 1.00 0.00 C ATOM 1832 O PRO A 139 -26.582 -1.692 -3.341 1.00 0.00 O ATOM 1833 CB PRO A 139 -25.138 -4.057 -1.746 1.00 0.00 C ATOM 1834 CG PRO A 139 -24.159 -3.047 -1.270 1.00 0.00 C ATOM 1835 CD PRO A 139 -23.334 -2.629 -2.452 1.00 0.00 C ATOM 0 HA PRO A 139 -25.487 -4.675 -3.831 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -26.079 -3.978 -1.202 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -24.764 -5.069 -1.590 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -24.673 -2.188 -0.838 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -23.525 -3.466 -0.488 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -23.151 -1.554 -2.447 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -22.360 -3.118 -2.448 1.00 0.00 H new ATOM 1843 N ILE A 140 -27.684 -3.544 -3.898 1.00 0.00 N ATOM 1844 CA ILE A 140 -28.894 -2.815 -4.275 1.00 0.00 C ATOM 1845 C ILE A 140 -29.845 -2.688 -3.087 1.00 0.00 C ATOM 1846 O ILE A 140 -30.374 -3.692 -2.619 1.00 0.00 O ATOM 1847 CB ILE A 140 -29.653 -3.490 -5.489 1.00 0.00 C ATOM 1848 CG1 ILE A 140 -28.826 -3.476 -6.803 1.00 0.00 C ATOM 1849 CG2 ILE A 140 -31.013 -2.837 -5.728 1.00 0.00 C ATOM 1850 CD1 ILE A 140 -27.648 -4.434 -6.845 1.00 0.00 C ATOM 0 H ILE A 140 -27.759 -4.559 -3.972 1.00 0.00 H new ATOM 0 HA ILE A 140 -28.570 -1.823 -4.592 1.00 0.00 H new ATOM 0 HB ILE A 140 -29.800 -4.532 -5.204 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -29.492 -3.710 -7.633 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -28.455 -2.464 -6.967 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -31.508 -3.324 -6.568 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -31.629 -2.941 -4.835 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -30.874 -1.779 -5.952 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -27.140 -4.344 -7.805 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -26.952 -4.191 -6.042 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -28.005 -5.456 -6.718 1.00 0.00 H new ATOM 1862 N CYS A 141 -30.033 -1.468 -2.595 1.00 0.00 N ATOM 1863 CA CYS A 141 -30.949 -1.205 -1.480 1.00 0.00 C ATOM 1864 C CYS A 141 -32.392 -1.459 -1.844 1.00 0.00 C ATOM 1865 O CYS A 141 -32.977 -0.752 -2.669 1.00 0.00 O ATOM 1866 CB CYS A 141 -30.803 0.213 -0.931 1.00 0.00 C ATOM 1867 SG CYS A 141 -29.256 0.514 -0.039 1.00 0.00 S ATOM 0 H CYS A 141 -29.561 -0.637 -2.951 1.00 0.00 H new ATOM 0 HA CYS A 141 -30.663 -1.911 -0.700 1.00 0.00 H new ATOM 0 HB2 CYS A 141 -30.874 0.919 -1.758 1.00 0.00 H new ATOM 0 HB3 CYS A 141 -31.639 0.419 -0.263 1.00 0.00 H new ATOM 1872 N GLU A 142 -32.934 -2.466 -1.237 1.00 0.00 N ATOM 1873 CA GLU A 142 -34.293 -2.875 -1.364 1.00 0.00 C ATOM 1874 C GLU A 142 -34.661 -3.457 -0.036 1.00 0.00 C ATOM 1875 O GLU A 142 -35.672 -3.062 0.544 1.00 0.00 O ATOM 1876 CB GLU A 142 -34.468 -3.910 -2.487 1.00 0.00 C ATOM 1877 CG GLU A 142 -34.428 -3.352 -3.894 1.00 0.00 C ATOM 1878 CD GLU A 142 -34.857 -4.356 -4.926 1.00 0.00 C ATOM 1879 OE1 GLU A 142 -36.083 -4.466 -5.184 1.00 0.00 O ATOM 1880 OE2 GLU A 142 -34.004 -5.048 -5.508 1.00 0.00 O ATOM 1881 OXT GLU A 142 -33.835 -4.220 0.506 1.00 0.00 O ATOM 0 H GLU A 142 -32.404 -3.061 -0.600 1.00 0.00 H new ATOM 0 HA GLU A 142 -34.936 -2.036 -1.631 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -33.685 -4.663 -2.390 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -35.420 -4.420 -2.343 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -35.075 -2.477 -3.952 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -33.416 -3.015 -4.119 1.00 0.00 H new