USER MOD reduce.3.24.130724 H: found=0, std=0, add=1093, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1089 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 102 GLN : amide:sc= -0.379 K(o=-0.23,f=-7.8!) USER MOD Set 1.2: A 125 THR OG1 : rot 180:sc= 0.148 USER MOD Set 2.1: A 52 SER OG : rot 73:sc= 1.35 USER MOD Set 2.2: A 120 TYR OH : rot 15:sc= 0.548 USER MOD Set 3.1: A 48 TYR OH : rot -157:sc= 0.6 USER MOD Set 3.2: A 139 LYS NZ :NH3+ -141:sc= 0.752 (180deg=0.177) USER MOD Set 4.1: A 39 THR OG1 : rot -170:sc= 0.596 USER MOD Set 4.2: A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 54:sc= 1.22 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 CYS SG : rot -34:sc= -0.122 USER MOD Single : A 25 MET CE :methyl -151:sc= -1.32 (180deg=-3.58!) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 36 CYS SG : rot 160:sc= 1.11 USER MOD Single : A 49 GLN : amide:sc= -0.0504 K(o=-0.05,f=-1.2) USER MOD Single : A 53 LYS NZ :NH3+ -139:sc= -0.972 (180deg=-3.03!) USER MOD Single : A 55 CYS SG : rot 27:sc= -0.498 USER MOD Single : A 58 MET CE :methyl 166:sc= -0.448 (180deg=-0.657) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 62 ASN : amide:sc= -1.15 K(o=-1.2,f=-6.6!) USER MOD Single : A 63 HIS : no HD1:sc= -1.75 K(o=-1.8,f=-4!) USER MOD Single : A 64 CYS SG : rot 170:sc= -0.358 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= -0.173 K(o=-0.17,f=-4.7!) USER MOD Single : A 69 ASN : amide:sc= -1.54! C(o=-1.5!,f=-9.9!) USER MOD Single : A 73 GLN : amide:sc= -0.0335 K(o=-0.034,f=-1.1) USER MOD Single : A 75 THR OG1 : rot -7:sc= 0.422 USER MOD Single : A 77 MET CE :methyl -119:sc= -0.727 (180deg=-1.33) USER MOD Single : A 79 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot 180:sc= 0.0242 USER MOD Single : A 83 ASN : amide:sc= -0.279 K(o=-0.28,f=-1.8) USER MOD Single : A 88 ASN : amide:sc= -1.95 K(o=-2,f=-4.4!) USER MOD Single : A 98 TYR OH : rot 30:sc= -0.0989 USER MOD Single : A 99 SER OG : rot -77:sc= 0.105 USER MOD Single : A 101 HIS : no HD1:sc= -0.889 X(o=-0.89,f=-0.85) USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 GLN : amide:sc= 0.0115 X(o=0.011,f=0.02) USER MOD Single : A 114 ASN : amide:sc= -0.272 K(o=-0.27,f=-1.6!) USER MOD Single : A 115 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.114) USER MOD Single : A 117 ASN : amide:sc= -1.35 X(o=-1.3,f=-1.2) USER MOD Single : A 122 TYR OH : rot 180:sc= -0.61 USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 CYS SG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot -96:sc= 0.93 USER MOD Single : A 140 SER OG : rot 180:sc= -0.263 USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 31.685 -19.828 16.949 1.00 0.00 N ATOM 2 CA GLY A 1 30.929 -20.639 16.013 1.00 0.00 C ATOM 3 C GLY A 1 29.517 -20.127 15.811 1.00 0.00 C ATOM 4 O GLY A 1 28.615 -20.452 16.584 1.00 0.00 O ATOM 0 H1 GLY A 1 32.643 -20.219 17.052 1.00 0.00 H new ATOM 0 H2 GLY A 1 31.746 -18.853 16.593 1.00 0.00 H new ATOM 0 H3 GLY A 1 31.209 -19.830 17.873 1.00 0.00 H new ATOM 0 HA2 GLY A 1 31.446 -20.658 15.054 1.00 0.00 H new ATOM 0 HA3 GLY A 1 30.891 -21.666 16.375 1.00 0.00 H new ATOM 8 N SER A 2 29.323 -19.324 14.770 1.00 0.00 N ATOM 9 CA SER A 2 28.011 -18.762 14.472 1.00 0.00 C ATOM 10 C SER A 2 27.368 -19.479 13.289 1.00 0.00 C ATOM 11 O SER A 2 26.149 -19.639 13.233 1.00 0.00 O ATOM 12 CB SER A 2 28.129 -17.266 14.173 1.00 0.00 C ATOM 13 OG SER A 2 28.965 -17.035 13.052 1.00 0.00 O ATOM 0 H SER A 2 30.058 -19.048 14.119 1.00 0.00 H new ATOM 0 HA SER A 2 27.377 -18.902 15.347 1.00 0.00 H new ATOM 0 HB2 SER A 2 27.139 -16.850 13.984 1.00 0.00 H new ATOM 0 HB3 SER A 2 28.531 -16.748 15.044 1.00 0.00 H new ATOM 0 HG SER A 2 29.023 -16.072 12.880 1.00 0.00 H new ATOM 19 N SER A 3 28.198 -19.909 12.344 1.00 0.00 N ATOM 20 CA SER A 3 27.712 -20.606 11.159 1.00 0.00 C ATOM 21 C SER A 3 28.875 -21.128 10.320 1.00 0.00 C ATOM 22 O SER A 3 29.965 -20.557 10.327 1.00 0.00 O ATOM 23 CB SER A 3 26.838 -19.676 10.316 1.00 0.00 C ATOM 24 OG SER A 3 25.479 -19.761 10.707 1.00 0.00 O ATOM 0 H SER A 3 29.210 -19.787 12.376 1.00 0.00 H new ATOM 0 HA SER A 3 27.114 -21.456 11.488 1.00 0.00 H new ATOM 0 HB2 SER A 3 27.187 -18.649 10.422 1.00 0.00 H new ATOM 0 HB3 SER A 3 26.934 -19.938 9.262 1.00 0.00 H new ATOM 0 HG SER A 3 25.405 -19.595 11.670 1.00 0.00 H new ATOM 30 N GLY A 4 28.634 -22.218 9.598 1.00 0.00 N ATOM 31 CA GLY A 4 29.670 -22.799 8.764 1.00 0.00 C ATOM 32 C GLY A 4 29.182 -24.010 7.993 1.00 0.00 C ATOM 33 O GLY A 4 29.862 -25.035 7.938 1.00 0.00 O ATOM 0 H GLY A 4 27.740 -22.709 9.576 1.00 0.00 H new ATOM 0 HA2 GLY A 4 30.032 -22.047 8.063 1.00 0.00 H new ATOM 0 HA3 GLY A 4 30.516 -23.086 9.388 1.00 0.00 H new ATOM 37 N SER A 5 27.999 -23.894 7.398 1.00 0.00 N ATOM 38 CA SER A 5 27.418 -24.990 6.632 1.00 0.00 C ATOM 39 C SER A 5 27.247 -24.598 5.167 1.00 0.00 C ATOM 40 O SER A 5 26.967 -23.442 4.851 1.00 0.00 O ATOM 41 CB SER A 5 26.067 -25.395 7.225 1.00 0.00 C ATOM 42 OG SER A 5 26.199 -25.773 8.584 1.00 0.00 O ATOM 0 H SER A 5 27.424 -23.052 7.432 1.00 0.00 H new ATOM 0 HA SER A 5 28.099 -25.839 6.686 1.00 0.00 H new ATOM 0 HB2 SER A 5 25.366 -24.564 7.142 1.00 0.00 H new ATOM 0 HB3 SER A 5 25.649 -26.223 6.653 1.00 0.00 H new ATOM 0 HG SER A 5 25.322 -26.026 8.940 1.00 0.00 H new ATOM 48 N SER A 6 27.417 -25.571 4.277 1.00 0.00 N ATOM 49 CA SER A 6 27.286 -25.328 2.845 1.00 0.00 C ATOM 50 C SER A 6 25.820 -25.359 2.422 1.00 0.00 C ATOM 51 O SER A 6 25.145 -26.378 2.556 1.00 0.00 O ATOM 52 CB SER A 6 28.079 -26.371 2.055 1.00 0.00 C ATOM 53 OG SER A 6 29.448 -26.355 2.421 1.00 0.00 O ATOM 0 H SER A 6 27.646 -26.534 4.522 1.00 0.00 H new ATOM 0 HA SER A 6 27.688 -24.338 2.630 1.00 0.00 H new ATOM 0 HB2 SER A 6 27.663 -27.362 2.235 1.00 0.00 H new ATOM 0 HB3 SER A 6 27.982 -26.174 0.987 1.00 0.00 H new ATOM 0 HG SER A 6 29.933 -27.031 1.904 1.00 0.00 H new ATOM 59 N GLY A 7 25.335 -24.232 1.908 1.00 0.00 N ATOM 60 CA GLY A 7 23.954 -24.150 1.472 1.00 0.00 C ATOM 61 C GLY A 7 23.758 -24.672 0.063 1.00 0.00 C ATOM 62 O GLY A 7 24.653 -25.299 -0.505 1.00 0.00 O ATOM 0 H GLY A 7 25.874 -23.375 1.786 1.00 0.00 H new ATOM 0 HA2 GLY A 7 23.326 -24.719 2.157 1.00 0.00 H new ATOM 0 HA3 GLY A 7 23.622 -23.113 1.521 1.00 0.00 H new ATOM 66 N VAL A 8 22.584 -24.416 -0.505 1.00 0.00 N ATOM 67 CA VAL A 8 22.273 -24.865 -1.856 1.00 0.00 C ATOM 68 C VAL A 8 21.607 -23.757 -2.664 1.00 0.00 C ATOM 69 O VAL A 8 20.532 -23.273 -2.307 1.00 0.00 O ATOM 70 CB VAL A 8 21.352 -26.099 -1.840 1.00 0.00 C ATOM 71 CG1 VAL A 8 21.149 -26.632 -3.250 1.00 0.00 C ATOM 72 CG2 VAL A 8 21.921 -27.176 -0.930 1.00 0.00 C ATOM 0 H VAL A 8 21.832 -23.899 -0.049 1.00 0.00 H new ATOM 0 HA VAL A 8 23.219 -25.134 -2.325 1.00 0.00 H new ATOM 0 HB VAL A 8 20.380 -25.801 -1.447 1.00 0.00 H new ATOM 0 HG11 VAL A 8 20.496 -27.504 -3.219 1.00 0.00 H new ATOM 0 HG12 VAL A 8 20.694 -25.859 -3.869 1.00 0.00 H new ATOM 0 HG13 VAL A 8 22.112 -26.916 -3.674 1.00 0.00 H new ATOM 0 HG21 VAL A 8 21.257 -28.041 -0.931 1.00 0.00 H new ATOM 0 HG22 VAL A 8 22.906 -27.474 -1.290 1.00 0.00 H new ATOM 0 HG23 VAL A 8 22.008 -26.786 0.084 1.00 0.00 H new ATOM 82 N THR A 9 22.251 -23.358 -3.756 1.00 0.00 N ATOM 83 CA THR A 9 21.722 -22.307 -4.615 1.00 0.00 C ATOM 84 C THR A 9 21.946 -22.634 -6.087 1.00 0.00 C ATOM 85 O THR A 9 22.694 -23.551 -6.422 1.00 0.00 O ATOM 86 CB THR A 9 22.368 -20.945 -4.300 1.00 0.00 C ATOM 87 OG1 THR A 9 23.795 -21.053 -4.361 1.00 0.00 O ATOM 88 CG2 THR A 9 21.951 -20.454 -2.921 1.00 0.00 C ATOM 0 H THR A 9 23.141 -23.748 -4.066 1.00 0.00 H new ATOM 0 HA THR A 9 20.652 -22.248 -4.418 1.00 0.00 H new ATOM 0 HB THR A 9 22.026 -20.225 -5.044 1.00 0.00 H new ATOM 0 HG1 THR A 9 24.198 -20.182 -4.161 1.00 0.00 H new ATOM 0 HG21 THR A 9 22.420 -19.490 -2.721 1.00 0.00 H new ATOM 0 HG22 THR A 9 20.867 -20.345 -2.886 1.00 0.00 H new ATOM 0 HG23 THR A 9 22.267 -21.175 -2.167 1.00 0.00 H new ATOM 96 N GLY A 10 21.293 -21.876 -6.964 1.00 0.00 N ATOM 97 CA GLY A 10 21.436 -22.102 -8.390 1.00 0.00 C ATOM 98 C GLY A 10 20.112 -22.019 -9.125 1.00 0.00 C ATOM 99 O GLY A 10 19.624 -23.019 -9.651 1.00 0.00 O ATOM 0 H GLY A 10 20.668 -21.110 -6.712 1.00 0.00 H new ATOM 0 HA2 GLY A 10 22.125 -21.366 -8.804 1.00 0.00 H new ATOM 0 HA3 GLY A 10 21.880 -23.083 -8.557 1.00 0.00 H new ATOM 103 N ASP A 11 19.531 -20.826 -9.160 1.00 0.00 N ATOM 104 CA ASP A 11 18.255 -20.616 -9.835 1.00 0.00 C ATOM 105 C ASP A 11 17.973 -19.128 -10.014 1.00 0.00 C ATOM 106 O ASP A 11 18.144 -18.337 -9.086 1.00 0.00 O ATOM 107 CB ASP A 11 17.122 -21.272 -9.045 1.00 0.00 C ATOM 108 CG ASP A 11 16.655 -20.416 -7.884 1.00 0.00 C ATOM 109 OD1 ASP A 11 15.825 -19.510 -8.109 1.00 0.00 O ATOM 110 OD2 ASP A 11 17.120 -20.651 -6.749 1.00 0.00 O ATOM 0 H ASP A 11 19.923 -19.989 -8.729 1.00 0.00 H new ATOM 0 HA ASP A 11 18.314 -21.077 -10.821 1.00 0.00 H new ATOM 0 HB2 ASP A 11 16.282 -21.464 -9.712 1.00 0.00 H new ATOM 0 HB3 ASP A 11 17.458 -22.238 -8.668 1.00 0.00 H new ATOM 115 N ARG A 12 17.540 -18.753 -11.214 1.00 0.00 N ATOM 116 CA ARG A 12 17.237 -17.359 -11.515 1.00 0.00 C ATOM 117 C ARG A 12 15.831 -17.222 -12.094 1.00 0.00 C ATOM 118 O ARG A 12 15.630 -16.561 -13.112 1.00 0.00 O ATOM 119 CB ARG A 12 18.262 -16.793 -12.499 1.00 0.00 C ATOM 120 CG ARG A 12 18.249 -15.275 -12.587 1.00 0.00 C ATOM 121 CD ARG A 12 19.077 -14.646 -11.477 1.00 0.00 C ATOM 122 NE ARG A 12 18.535 -13.357 -11.054 1.00 0.00 N ATOM 123 CZ ARG A 12 19.075 -12.612 -10.096 1.00 0.00 C ATOM 124 NH1 ARG A 12 20.166 -13.025 -9.466 1.00 0.00 N ATOM 125 NH2 ARG A 12 18.524 -11.450 -9.767 1.00 0.00 N ATOM 0 H ARG A 12 17.391 -19.395 -11.993 1.00 0.00 H new ATOM 0 HA ARG A 12 17.286 -16.793 -10.585 1.00 0.00 H new ATOM 0 HB2 ARG A 12 19.258 -17.123 -12.203 1.00 0.00 H new ATOM 0 HB3 ARG A 12 18.070 -17.207 -13.489 1.00 0.00 H new ATOM 0 HG2 ARG A 12 18.639 -14.962 -13.555 1.00 0.00 H new ATOM 0 HG3 ARG A 12 17.222 -14.915 -12.525 1.00 0.00 H new ATOM 0 HD2 ARG A 12 19.112 -15.322 -10.623 1.00 0.00 H new ATOM 0 HD3 ARG A 12 20.103 -14.513 -11.821 1.00 0.00 H new ATOM 0 HE ARG A 12 17.696 -13.010 -11.520 1.00 0.00 H new ATOM 0 HH11 ARG A 12 20.593 -13.917 -9.717 1.00 0.00 H new ATOM 0 HH12 ARG A 12 20.579 -12.451 -8.731 1.00 0.00 H new ATOM 0 HH21 ARG A 12 17.685 -11.128 -10.250 1.00 0.00 H new ATOM 0 HH22 ARG A 12 18.939 -10.879 -9.031 1.00 0.00 H new ATOM 139 N ALA A 13 14.862 -17.851 -11.437 1.00 0.00 N ATOM 140 CA ALA A 13 13.476 -17.798 -11.884 1.00 0.00 C ATOM 141 C ALA A 13 12.520 -18.157 -10.753 1.00 0.00 C ATOM 142 O ALA A 13 12.362 -19.328 -10.408 1.00 0.00 O ATOM 143 CB ALA A 13 13.268 -18.729 -13.070 1.00 0.00 C ATOM 0 H ALA A 13 15.012 -18.404 -10.593 1.00 0.00 H new ATOM 0 HA ALA A 13 13.260 -16.776 -12.196 1.00 0.00 H new ATOM 0 HB1 ALA A 13 12.228 -18.679 -13.394 1.00 0.00 H new ATOM 0 HB2 ALA A 13 13.918 -18.424 -13.890 1.00 0.00 H new ATOM 0 HB3 ALA A 13 13.508 -19.751 -12.777 1.00 0.00 H new ATOM 149 N GLY A 14 11.883 -17.142 -10.177 1.00 0.00 N ATOM 150 CA GLY A 14 10.951 -17.372 -9.089 1.00 0.00 C ATOM 151 C GLY A 14 9.506 -17.322 -9.544 1.00 0.00 C ATOM 152 O GLY A 14 9.176 -16.642 -10.515 1.00 0.00 O ATOM 0 H GLY A 14 11.996 -16.164 -10.445 1.00 0.00 H new ATOM 0 HA2 GLY A 14 11.154 -18.344 -8.640 1.00 0.00 H new ATOM 0 HA3 GLY A 14 11.111 -16.623 -8.313 1.00 0.00 H new ATOM 156 N GLY A 15 8.640 -18.046 -8.841 1.00 0.00 N ATOM 157 CA GLY A 15 7.233 -18.070 -9.194 1.00 0.00 C ATOM 158 C GLY A 15 6.635 -16.680 -9.287 1.00 0.00 C ATOM 159 O GLY A 15 7.290 -15.692 -8.955 1.00 0.00 O ATOM 0 H GLY A 15 8.888 -18.617 -8.033 1.00 0.00 H new ATOM 0 HA2 GLY A 15 7.110 -18.580 -10.150 1.00 0.00 H new ATOM 0 HA3 GLY A 15 6.685 -18.649 -8.451 1.00 0.00 H new ATOM 163 N ARG A 16 5.389 -16.603 -9.741 1.00 0.00 N ATOM 164 CA ARG A 16 4.704 -15.323 -9.880 1.00 0.00 C ATOM 165 C ARG A 16 4.769 -14.528 -8.579 1.00 0.00 C ATOM 166 O ARG A 16 4.836 -15.102 -7.492 1.00 0.00 O ATOM 167 CB ARG A 16 3.245 -15.542 -10.284 1.00 0.00 C ATOM 168 CG ARG A 16 3.023 -15.546 -11.787 1.00 0.00 C ATOM 169 CD ARG A 16 2.938 -16.963 -12.334 1.00 0.00 C ATOM 170 NE ARG A 16 3.281 -17.024 -13.752 1.00 0.00 N ATOM 171 CZ ARG A 16 3.415 -18.160 -14.428 1.00 0.00 C ATOM 172 NH1 ARG A 16 3.235 -19.323 -13.817 1.00 0.00 N ATOM 173 NH2 ARG A 16 3.728 -18.134 -15.717 1.00 0.00 N ATOM 0 H ARG A 16 4.833 -17.412 -10.019 1.00 0.00 H new ATOM 0 HA ARG A 16 5.208 -14.753 -10.660 1.00 0.00 H new ATOM 0 HB2 ARG A 16 2.901 -16.491 -9.872 1.00 0.00 H new ATOM 0 HB3 ARG A 16 2.632 -14.760 -9.837 1.00 0.00 H new ATOM 0 HG2 ARG A 16 2.104 -15.009 -12.022 1.00 0.00 H new ATOM 0 HG3 ARG A 16 3.838 -15.014 -12.278 1.00 0.00 H new ATOM 0 HD2 ARG A 16 3.610 -17.610 -11.770 1.00 0.00 H new ATOM 0 HD3 ARG A 16 1.929 -17.348 -12.188 1.00 0.00 H new ATOM 0 HE ARG A 16 3.426 -16.146 -14.251 1.00 0.00 H new ATOM 0 HH11 ARG A 16 2.993 -19.347 -12.826 1.00 0.00 H new ATOM 0 HH12 ARG A 16 3.338 -20.194 -14.338 1.00 0.00 H new ATOM 0 HH21 ARG A 16 3.866 -17.241 -16.190 1.00 0.00 H new ATOM 0 HH22 ARG A 16 3.831 -19.007 -16.235 1.00 0.00 H new ATOM 187 N SER A 17 4.748 -13.204 -8.698 1.00 0.00 N ATOM 188 CA SER A 17 4.809 -12.331 -7.533 1.00 0.00 C ATOM 189 C SER A 17 3.834 -11.165 -7.676 1.00 0.00 C ATOM 190 O SER A 17 4.034 -10.272 -8.499 1.00 0.00 O ATOM 191 CB SER A 17 6.231 -11.800 -7.340 1.00 0.00 C ATOM 192 OG SER A 17 6.958 -12.609 -6.432 1.00 0.00 O ATOM 0 H SER A 17 4.689 -12.713 -9.590 1.00 0.00 H new ATOM 0 HA SER A 17 4.525 -12.915 -6.658 1.00 0.00 H new ATOM 0 HB2 SER A 17 6.746 -11.773 -8.300 1.00 0.00 H new ATOM 0 HB3 SER A 17 6.193 -10.776 -6.969 1.00 0.00 H new ATOM 0 HG SER A 17 7.864 -12.250 -6.327 1.00 0.00 H new ATOM 198 N TRP A 18 2.780 -11.182 -6.868 1.00 0.00 N ATOM 199 CA TRP A 18 1.773 -10.127 -6.904 1.00 0.00 C ATOM 200 C TRP A 18 2.422 -8.752 -6.791 1.00 0.00 C ATOM 201 O TRP A 18 3.603 -8.638 -6.460 1.00 0.00 O ATOM 202 CB TRP A 18 0.761 -10.322 -5.775 1.00 0.00 C ATOM 203 CG TRP A 18 -0.143 -11.499 -5.984 1.00 0.00 C ATOM 204 CD1 TRP A 18 0.169 -12.815 -5.800 1.00 0.00 C ATOM 205 CD2 TRP A 18 -1.507 -11.465 -6.418 1.00 0.00 C ATOM 206 NE1 TRP A 18 -0.918 -13.602 -6.094 1.00 0.00 N ATOM 207 CE2 TRP A 18 -1.959 -12.798 -6.475 1.00 0.00 C ATOM 208 CE3 TRP A 18 -2.391 -10.439 -6.763 1.00 0.00 C ATOM 209 CZ2 TRP A 18 -3.255 -13.128 -6.863 1.00 0.00 C ATOM 210 CZ3 TRP A 18 -3.676 -10.769 -7.148 1.00 0.00 C ATOM 211 CH2 TRP A 18 -4.099 -12.104 -7.195 1.00 0.00 C ATOM 0 H TRP A 18 2.600 -11.914 -6.181 1.00 0.00 H new ATOM 0 HA TRP A 18 1.254 -10.185 -7.861 1.00 0.00 H new ATOM 0 HB2 TRP A 18 1.297 -10.447 -4.834 1.00 0.00 H new ATOM 0 HB3 TRP A 18 0.156 -9.421 -5.680 1.00 0.00 H new ATOM 0 HD1 TRP A 18 1.130 -13.184 -5.471 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -0.945 -14.620 -6.038 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -2.075 -9.407 -6.729 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -3.582 -14.157 -6.900 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -4.367 -9.984 -7.418 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -5.111 -12.329 -7.499 1.00 0.00 H new ATOM 222 N CYS A 19 1.644 -7.711 -7.067 1.00 0.00 N ATOM 223 CA CYS A 19 2.144 -6.343 -6.996 1.00 0.00 C ATOM 224 C CYS A 19 1.006 -5.340 -7.154 1.00 0.00 C ATOM 225 O CYS A 19 -0.154 -5.721 -7.317 1.00 0.00 O ATOM 226 CB CYS A 19 3.200 -6.107 -8.077 1.00 0.00 C ATOM 227 SG CYS A 19 2.534 -6.030 -9.756 1.00 0.00 S ATOM 0 H CYS A 19 0.665 -7.788 -7.342 1.00 0.00 H new ATOM 0 HA CYS A 19 2.599 -6.199 -6.016 1.00 0.00 H new ATOM 0 HB2 CYS A 19 3.722 -5.175 -7.862 1.00 0.00 H new ATOM 0 HB3 CYS A 19 3.940 -6.906 -8.027 1.00 0.00 H new ATOM 0 HG CYS A 19 1.522 -6.839 -9.859 1.00 0.00 H new ATOM 233 N LEU A 20 1.344 -4.056 -7.102 1.00 0.00 N ATOM 234 CA LEU A 20 0.351 -2.997 -7.237 1.00 0.00 C ATOM 235 C LEU A 20 0.619 -2.154 -8.480 1.00 0.00 C ATOM 236 O LEU A 20 1.178 -1.061 -8.392 1.00 0.00 O ATOM 237 CB LEU A 20 0.353 -2.107 -5.993 1.00 0.00 C ATOM 238 CG LEU A 20 -0.035 -2.787 -4.680 1.00 0.00 C ATOM 239 CD1 LEU A 20 0.234 -1.865 -3.501 1.00 0.00 C ATOM 240 CD2 LEU A 20 -1.498 -3.206 -4.709 1.00 0.00 C ATOM 0 H LEU A 20 2.299 -3.724 -6.967 1.00 0.00 H new ATOM 0 HA LEU A 20 -0.629 -3.463 -7.341 1.00 0.00 H new ATOM 0 HB2 LEU A 20 1.350 -1.681 -5.877 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -0.331 -1.276 -6.164 1.00 0.00 H new ATOM 0 HG LEU A 20 0.577 -3.681 -4.562 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -0.048 -2.366 -2.575 1.00 0.00 H new ATOM 0 HD12 LEU A 20 1.294 -1.615 -3.469 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -0.351 -0.952 -3.612 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -1.757 -3.688 -3.767 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -2.126 -2.326 -4.851 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -1.660 -3.904 -5.530 1.00 0.00 H new ATOM 252 N ARG A 21 0.214 -2.669 -9.636 1.00 0.00 N ATOM 253 CA ARG A 21 0.409 -1.963 -10.897 1.00 0.00 C ATOM 254 C ARG A 21 -0.134 -0.540 -10.813 1.00 0.00 C ATOM 255 O ARG A 21 -1.342 -0.331 -10.702 1.00 0.00 O ATOM 256 CB ARG A 21 -0.276 -2.716 -12.039 1.00 0.00 C ATOM 257 CG ARG A 21 0.409 -2.537 -13.384 1.00 0.00 C ATOM 258 CD ARG A 21 0.168 -3.731 -14.294 1.00 0.00 C ATOM 259 NE ARG A 21 -0.003 -3.330 -15.688 1.00 0.00 N ATOM 260 CZ ARG A 21 0.168 -4.154 -16.716 1.00 0.00 C ATOM 261 NH1 ARG A 21 0.512 -5.417 -16.507 1.00 0.00 N ATOM 262 NH2 ARG A 21 -0.006 -3.715 -17.956 1.00 0.00 N ATOM 0 H ARG A 21 -0.251 -3.572 -9.726 1.00 0.00 H new ATOM 0 HA ARG A 21 1.480 -1.913 -11.095 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -0.307 -3.778 -11.795 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -1.309 -2.377 -12.119 1.00 0.00 H new ATOM 0 HG2 ARG A 21 0.039 -1.631 -13.864 1.00 0.00 H new ATOM 0 HG3 ARG A 21 1.480 -2.403 -13.233 1.00 0.00 H new ATOM 0 HD2 ARG A 21 1.007 -4.422 -14.216 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -0.719 -4.268 -13.960 1.00 0.00 H new ATOM 0 HE ARG A 21 -0.268 -2.365 -15.883 1.00 0.00 H new ATOM 0 HH11 ARG A 21 0.646 -5.758 -15.555 1.00 0.00 H new ATOM 0 HH12 ARG A 21 0.643 -6.048 -17.298 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -0.271 -2.744 -18.121 1.00 0.00 H new ATOM 0 HH22 ARG A 21 0.126 -4.349 -18.744 1.00 0.00 H new ATOM 276 N ARG A 22 0.767 0.436 -10.866 1.00 0.00 N ATOM 277 CA ARG A 22 0.378 1.839 -10.794 1.00 0.00 C ATOM 278 C ARG A 22 -0.559 2.203 -11.942 1.00 0.00 C ATOM 279 O ARG A 22 -0.259 1.946 -13.108 1.00 0.00 O ATOM 280 CB ARG A 22 1.617 2.736 -10.829 1.00 0.00 C ATOM 281 CG ARG A 22 1.307 4.211 -10.633 1.00 0.00 C ATOM 282 CD ARG A 22 1.177 4.561 -9.159 1.00 0.00 C ATOM 283 NE ARG A 22 1.331 5.994 -8.921 1.00 0.00 N ATOM 284 CZ ARG A 22 2.509 6.602 -8.835 1.00 0.00 C ATOM 285 NH1 ARG A 22 3.630 5.905 -8.968 1.00 0.00 N ATOM 286 NH2 ARG A 22 2.568 7.909 -8.617 1.00 0.00 N ATOM 0 H ARG A 22 1.771 0.281 -10.959 1.00 0.00 H new ATOM 0 HA ARG A 22 -0.150 1.996 -9.853 1.00 0.00 H new ATOM 0 HB2 ARG A 22 2.311 2.413 -10.053 1.00 0.00 H new ATOM 0 HB3 ARG A 22 2.124 2.604 -11.785 1.00 0.00 H new ATOM 0 HG2 ARG A 22 2.097 4.813 -11.083 1.00 0.00 H new ATOM 0 HG3 ARG A 22 0.381 4.461 -11.151 1.00 0.00 H new ATOM 0 HD2 ARG A 22 0.203 4.235 -8.794 1.00 0.00 H new ATOM 0 HD3 ARG A 22 1.930 4.016 -8.589 1.00 0.00 H new ATOM 0 HE ARG A 22 0.488 6.559 -8.815 1.00 0.00 H new ATOM 0 HH11 ARG A 22 3.589 4.900 -9.137 1.00 0.00 H new ATOM 0 HH12 ARG A 22 4.533 6.374 -8.902 1.00 0.00 H new ATOM 0 HH21 ARG A 22 1.708 8.448 -8.515 1.00 0.00 H new ATOM 0 HH22 ARG A 22 3.473 8.375 -8.551 1.00 0.00 H new ATOM 300 N VAL A 23 -1.696 2.803 -11.604 1.00 0.00 N ATOM 301 CA VAL A 23 -2.677 3.203 -12.606 1.00 0.00 C ATOM 302 C VAL A 23 -2.213 4.440 -13.367 1.00 0.00 C ATOM 303 O VAL A 23 -1.776 5.422 -12.768 1.00 0.00 O ATOM 304 CB VAL A 23 -4.048 3.492 -11.966 1.00 0.00 C ATOM 305 CG1 VAL A 23 -5.052 3.921 -13.024 1.00 0.00 C ATOM 306 CG2 VAL A 23 -4.549 2.272 -11.207 1.00 0.00 C ATOM 0 H VAL A 23 -1.961 3.023 -10.644 1.00 0.00 H new ATOM 0 HA VAL A 23 -2.777 2.369 -13.301 1.00 0.00 H new ATOM 0 HB VAL A 23 -3.933 4.311 -11.256 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -6.014 4.121 -12.553 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -4.696 4.825 -13.519 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -5.167 3.126 -13.760 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -5.519 2.494 -10.761 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -4.649 1.432 -11.894 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -3.839 2.015 -10.421 1.00 0.00 H new ATOM 316 N GLY A 24 -2.312 4.385 -14.692 1.00 0.00 N ATOM 317 CA GLY A 24 -1.898 5.508 -15.513 1.00 0.00 C ATOM 318 C GLY A 24 -0.392 5.600 -15.653 1.00 0.00 C ATOM 319 O GLY A 24 0.140 6.644 -16.029 1.00 0.00 O ATOM 0 H GLY A 24 -2.671 3.584 -15.211 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -2.347 5.416 -16.502 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -2.276 6.432 -15.076 1.00 0.00 H new ATOM 323 N MET A 25 0.298 4.506 -15.347 1.00 0.00 N ATOM 324 CA MET A 25 1.752 4.469 -15.441 1.00 0.00 C ATOM 325 C MET A 25 2.259 3.030 -15.464 1.00 0.00 C ATOM 326 O MET A 25 1.742 2.168 -14.753 1.00 0.00 O ATOM 327 CB MET A 25 2.379 5.224 -14.267 1.00 0.00 C ATOM 328 CG MET A 25 2.973 6.568 -14.656 1.00 0.00 C ATOM 329 SD MET A 25 4.338 7.061 -13.587 1.00 0.00 S ATOM 330 CE MET A 25 3.664 6.668 -11.974 1.00 0.00 C ATOM 0 H MET A 25 -0.127 3.634 -15.032 1.00 0.00 H new ATOM 0 HA MET A 25 2.044 4.953 -16.373 1.00 0.00 H new ATOM 0 HB2 MET A 25 1.621 5.380 -13.499 1.00 0.00 H new ATOM 0 HB3 MET A 25 3.160 4.606 -13.823 1.00 0.00 H new ATOM 0 HG2 MET A 25 3.323 6.521 -15.687 1.00 0.00 H new ATOM 0 HG3 MET A 25 2.194 7.329 -14.618 1.00 0.00 H new ATOM 0 HE1 MET A 25 4.094 7.335 -11.227 1.00 0.00 H new ATOM 0 HE2 MET A 25 2.581 6.793 -11.992 1.00 0.00 H new ATOM 0 HE3 MET A 25 3.906 5.636 -11.720 1.00 0.00 H new ATOM 340 N SER A 26 3.273 2.778 -16.286 1.00 0.00 N ATOM 341 CA SER A 26 3.847 1.443 -16.404 1.00 0.00 C ATOM 342 C SER A 26 5.049 1.284 -15.479 1.00 0.00 C ATOM 343 O SER A 26 5.863 0.377 -15.650 1.00 0.00 O ATOM 344 CB SER A 26 4.263 1.170 -17.851 1.00 0.00 C ATOM 345 OG SER A 26 3.137 0.876 -18.659 1.00 0.00 O ATOM 0 H SER A 26 3.714 3.481 -16.880 1.00 0.00 H new ATOM 0 HA SER A 26 3.086 0.720 -16.109 1.00 0.00 H new ATOM 0 HB2 SER A 26 4.786 2.038 -18.252 1.00 0.00 H new ATOM 0 HB3 SER A 26 4.963 0.335 -17.880 1.00 0.00 H new ATOM 0 HG SER A 26 3.430 0.707 -19.579 1.00 0.00 H new ATOM 351 N ALA A 27 5.154 2.173 -14.496 1.00 0.00 N ATOM 352 CA ALA A 27 6.254 2.132 -13.542 1.00 0.00 C ATOM 353 C ALA A 27 5.741 2.208 -12.108 1.00 0.00 C ATOM 354 O ALA A 27 4.534 2.255 -11.872 1.00 0.00 O ATOM 355 CB ALA A 27 7.233 3.264 -13.815 1.00 0.00 C ATOM 0 H ALA A 27 4.489 2.931 -14.340 1.00 0.00 H new ATOM 0 HA ALA A 27 6.772 1.181 -13.665 1.00 0.00 H new ATOM 0 HB1 ALA A 27 8.050 3.221 -13.094 1.00 0.00 H new ATOM 0 HB2 ALA A 27 7.634 3.163 -14.824 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.718 4.220 -13.723 1.00 0.00 H new ATOM 361 N GLY A 28 6.665 2.220 -11.153 1.00 0.00 N ATOM 362 CA GLY A 28 6.286 2.290 -9.754 1.00 0.00 C ATOM 363 C GLY A 28 5.467 1.093 -9.315 1.00 0.00 C ATOM 364 O GLY A 28 4.490 1.237 -8.579 1.00 0.00 O ATOM 0 H GLY A 28 7.670 2.182 -11.323 1.00 0.00 H new ATOM 0 HA2 GLY A 28 7.184 2.357 -9.140 1.00 0.00 H new ATOM 0 HA3 GLY A 28 5.714 3.201 -9.581 1.00 0.00 H new ATOM 368 N TRP A 29 5.863 -0.091 -9.768 1.00 0.00 N ATOM 369 CA TRP A 29 5.157 -1.318 -9.418 1.00 0.00 C ATOM 370 C TRP A 29 5.642 -1.863 -8.079 1.00 0.00 C ATOM 371 O TRP A 29 6.763 -2.363 -7.970 1.00 0.00 O ATOM 372 CB TRP A 29 5.350 -2.371 -10.511 1.00 0.00 C ATOM 373 CG TRP A 29 4.702 -2.003 -11.811 1.00 0.00 C ATOM 374 CD1 TRP A 29 4.058 -0.835 -12.104 1.00 0.00 C ATOM 375 CD2 TRP A 29 4.635 -2.808 -12.993 1.00 0.00 C ATOM 376 NE1 TRP A 29 3.594 -0.866 -13.397 1.00 0.00 N ATOM 377 CE2 TRP A 29 3.936 -2.064 -13.964 1.00 0.00 C ATOM 378 CE3 TRP A 29 5.100 -4.083 -13.327 1.00 0.00 C ATOM 379 CZ2 TRP A 29 3.691 -2.556 -15.244 1.00 0.00 C ATOM 380 CZ3 TRP A 29 4.855 -4.570 -14.597 1.00 0.00 C ATOM 381 CH2 TRP A 29 4.157 -3.808 -15.543 1.00 0.00 C ATOM 0 H TRP A 29 6.669 -0.227 -10.378 1.00 0.00 H new ATOM 0 HA TRP A 29 4.096 -1.085 -9.331 1.00 0.00 H new ATOM 0 HB2 TRP A 29 6.417 -2.523 -10.675 1.00 0.00 H new ATOM 0 HB3 TRP A 29 4.942 -3.321 -10.166 1.00 0.00 H new ATOM 0 HD1 TRP A 29 3.932 -0.009 -11.420 1.00 0.00 H new ATOM 0 HE1 TRP A 29 3.078 -0.117 -13.859 1.00 0.00 H new ATOM 0 HE3 TRP A 29 5.641 -4.677 -12.605 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 3.153 -1.971 -15.975 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 5.208 -5.555 -14.865 1.00 0.00 H new ATOM 0 HH2 TRP A 29 3.983 -4.216 -16.528 1.00 0.00 H new ATOM 392 N LEU A 30 4.793 -1.763 -7.062 1.00 0.00 N ATOM 393 CA LEU A 30 5.136 -2.247 -5.729 1.00 0.00 C ATOM 394 C LEU A 30 5.068 -3.769 -5.668 1.00 0.00 C ATOM 395 O LEU A 30 3.989 -4.357 -5.750 1.00 0.00 O ATOM 396 CB LEU A 30 4.194 -1.640 -4.687 1.00 0.00 C ATOM 397 CG LEU A 30 3.775 -0.189 -4.926 1.00 0.00 C ATOM 398 CD1 LEU A 30 2.869 0.295 -3.805 1.00 0.00 C ATOM 399 CD2 LEU A 30 4.999 0.706 -5.050 1.00 0.00 C ATOM 0 H LEU A 30 3.863 -1.351 -7.135 1.00 0.00 H new ATOM 0 HA LEU A 30 6.158 -1.939 -5.509 1.00 0.00 H new ATOM 0 HB2 LEU A 30 3.294 -2.254 -4.638 1.00 0.00 H new ATOM 0 HB3 LEU A 30 4.675 -1.702 -3.711 1.00 0.00 H new ATOM 0 HG LEU A 30 3.219 -0.140 -5.862 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.580 1.329 -3.991 1.00 0.00 H new ATOM 0 HD12 LEU A 30 1.976 -0.329 -3.764 1.00 0.00 H new ATOM 0 HD13 LEU A 30 3.400 0.232 -2.855 1.00 0.00 H new ATOM 0 HD21 LEU A 30 4.682 1.735 -5.220 1.00 0.00 H new ATOM 0 HD22 LEU A 30 5.583 0.653 -4.131 1.00 0.00 H new ATOM 0 HD23 LEU A 30 5.611 0.372 -5.888 1.00 0.00 H new ATOM 411 N LEU A 31 6.226 -4.403 -5.521 1.00 0.00 N ATOM 412 CA LEU A 31 6.299 -5.858 -5.446 1.00 0.00 C ATOM 413 C LEU A 31 5.644 -6.370 -4.167 1.00 0.00 C ATOM 414 O LEU A 31 5.734 -5.738 -3.114 1.00 0.00 O ATOM 415 CB LEU A 31 7.756 -6.319 -5.507 1.00 0.00 C ATOM 416 CG LEU A 31 7.997 -7.812 -5.280 1.00 0.00 C ATOM 417 CD1 LEU A 31 7.651 -8.605 -6.531 1.00 0.00 C ATOM 418 CD2 LEU A 31 9.441 -8.063 -4.870 1.00 0.00 C ATOM 0 H LEU A 31 7.128 -3.932 -5.451 1.00 0.00 H new ATOM 0 HA LEU A 31 5.759 -6.269 -6.299 1.00 0.00 H new ATOM 0 HB2 LEU A 31 8.161 -6.050 -6.483 1.00 0.00 H new ATOM 0 HB3 LEU A 31 8.324 -5.762 -4.762 1.00 0.00 H new ATOM 0 HG LEU A 31 7.347 -8.146 -4.471 1.00 0.00 H new ATOM 0 HD11 LEU A 31 7.829 -9.665 -6.351 1.00 0.00 H new ATOM 0 HD12 LEU A 31 6.601 -8.451 -6.781 1.00 0.00 H new ATOM 0 HD13 LEU A 31 8.275 -8.268 -7.359 1.00 0.00 H new ATOM 0 HD21 LEU A 31 9.594 -9.131 -4.713 1.00 0.00 H new ATOM 0 HD22 LEU A 31 10.109 -7.713 -5.657 1.00 0.00 H new ATOM 0 HD23 LEU A 31 9.656 -7.526 -3.946 1.00 0.00 H new ATOM 430 N LEU A 32 4.987 -7.520 -4.265 1.00 0.00 N ATOM 431 CA LEU A 32 4.318 -8.120 -3.116 1.00 0.00 C ATOM 432 C LEU A 32 4.818 -9.541 -2.875 1.00 0.00 C ATOM 433 O LEU A 32 4.098 -10.510 -3.110 1.00 0.00 O ATOM 434 CB LEU A 32 2.803 -8.130 -3.330 1.00 0.00 C ATOM 435 CG LEU A 32 2.105 -6.772 -3.248 1.00 0.00 C ATOM 436 CD1 LEU A 32 0.675 -6.876 -3.756 1.00 0.00 C ATOM 437 CD2 LEU A 32 2.130 -6.244 -1.822 1.00 0.00 C ATOM 0 H LEU A 32 4.903 -8.056 -5.129 1.00 0.00 H new ATOM 0 HA LEU A 32 4.551 -7.519 -2.237 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.597 -8.563 -4.309 1.00 0.00 H new ATOM 0 HB3 LEU A 32 2.356 -8.791 -2.588 1.00 0.00 H new ATOM 0 HG LEU A 32 2.644 -6.069 -3.883 1.00 0.00 H new ATOM 0 HD11 LEU A 32 0.194 -5.900 -3.690 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.681 -7.208 -4.794 1.00 0.00 H new ATOM 0 HD13 LEU A 32 0.124 -7.594 -3.148 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.629 -5.277 -1.783 1.00 0.00 H new ATOM 0 HD22 LEU A 32 1.616 -6.946 -1.165 1.00 0.00 H new ATOM 0 HD23 LEU A 32 3.163 -6.130 -1.494 1.00 0.00 H new ATOM 449 N GLU A 33 6.056 -9.655 -2.404 1.00 0.00 N ATOM 450 CA GLU A 33 6.652 -10.958 -2.130 1.00 0.00 C ATOM 451 C GLU A 33 5.791 -11.755 -1.153 1.00 0.00 C ATOM 452 O GLU A 33 5.286 -11.213 -0.170 1.00 0.00 O ATOM 453 CB GLU A 33 8.063 -10.789 -1.563 1.00 0.00 C ATOM 454 CG GLU A 33 9.158 -11.256 -2.508 1.00 0.00 C ATOM 455 CD GLU A 33 10.531 -11.231 -1.866 1.00 0.00 C ATOM 456 OE1 GLU A 33 10.626 -10.853 -0.680 1.00 0.00 O ATOM 457 OE2 GLU A 33 11.512 -11.591 -2.551 1.00 0.00 O ATOM 0 H GLU A 33 6.665 -8.862 -2.204 1.00 0.00 H new ATOM 0 HA GLU A 33 6.709 -11.508 -3.069 1.00 0.00 H new ATOM 0 HB2 GLU A 33 8.226 -9.738 -1.323 1.00 0.00 H new ATOM 0 HB3 GLU A 33 8.139 -11.345 -0.629 1.00 0.00 H new ATOM 0 HG2 GLU A 33 8.936 -12.269 -2.843 1.00 0.00 H new ATOM 0 HG3 GLU A 33 9.164 -10.621 -3.394 1.00 0.00 H new ATOM 464 N ASP A 34 5.629 -13.043 -1.432 1.00 0.00 N ATOM 465 CA ASP A 34 4.831 -13.916 -0.579 1.00 0.00 C ATOM 466 C ASP A 34 5.448 -14.030 0.811 1.00 0.00 C ATOM 467 O ASP A 34 6.584 -14.478 0.962 1.00 0.00 O ATOM 468 CB ASP A 34 4.704 -15.304 -1.210 1.00 0.00 C ATOM 469 CG ASP A 34 4.253 -16.353 -0.213 1.00 0.00 C ATOM 470 OD1 ASP A 34 5.091 -16.800 0.598 1.00 0.00 O ATOM 471 OD2 ASP A 34 3.062 -16.727 -0.243 1.00 0.00 O ATOM 0 H ASP A 34 6.040 -13.506 -2.243 1.00 0.00 H new ATOM 0 HA ASP A 34 3.838 -13.478 -0.481 1.00 0.00 H new ATOM 0 HB2 ASP A 34 3.993 -15.261 -2.035 1.00 0.00 H new ATOM 0 HB3 ASP A 34 5.665 -15.597 -1.632 1.00 0.00 H new ATOM 476 N GLY A 35 4.692 -13.619 1.824 1.00 0.00 N ATOM 477 CA GLY A 35 5.182 -13.682 3.189 1.00 0.00 C ATOM 478 C GLY A 35 6.027 -12.479 3.558 1.00 0.00 C ATOM 479 O GLY A 35 6.775 -12.513 4.536 1.00 0.00 O ATOM 0 H GLY A 35 3.749 -13.243 1.724 1.00 0.00 H new ATOM 0 HA2 GLY A 35 4.336 -13.751 3.873 1.00 0.00 H new ATOM 0 HA3 GLY A 35 5.771 -14.590 3.319 1.00 0.00 H new ATOM 483 N CYS A 36 5.909 -11.413 2.774 1.00 0.00 N ATOM 484 CA CYS A 36 6.670 -10.194 3.021 1.00 0.00 C ATOM 485 C CYS A 36 5.740 -8.998 3.197 1.00 0.00 C ATOM 486 O CYS A 36 5.022 -8.618 2.273 1.00 0.00 O ATOM 487 CB CYS A 36 7.644 -9.933 1.872 1.00 0.00 C ATOM 488 SG CYS A 36 9.286 -10.648 2.119 1.00 0.00 S ATOM 0 H CYS A 36 5.293 -11.368 1.962 1.00 0.00 H new ATOM 0 HA CYS A 36 7.236 -10.330 3.943 1.00 0.00 H new ATOM 0 HB2 CYS A 36 7.219 -10.334 0.952 1.00 0.00 H new ATOM 0 HB3 CYS A 36 7.745 -8.857 1.733 1.00 0.00 H new ATOM 0 HG CYS A 36 9.889 -10.757 0.972 1.00 0.00 H new ATOM 494 N GLU A 37 5.757 -8.411 4.389 1.00 0.00 N ATOM 495 CA GLU A 37 4.912 -7.260 4.686 1.00 0.00 C ATOM 496 C GLU A 37 5.291 -6.067 3.812 1.00 0.00 C ATOM 497 O GLU A 37 6.468 -5.734 3.673 1.00 0.00 O ATOM 498 CB GLU A 37 5.029 -6.880 6.163 1.00 0.00 C ATOM 499 CG GLU A 37 3.727 -6.385 6.770 1.00 0.00 C ATOM 500 CD GLU A 37 3.948 -5.416 7.915 1.00 0.00 C ATOM 501 OE1 GLU A 37 4.863 -4.573 7.811 1.00 0.00 O ATOM 502 OE2 GLU A 37 3.205 -5.502 8.915 1.00 0.00 O ATOM 0 H GLU A 37 6.346 -8.713 5.165 1.00 0.00 H new ATOM 0 HA GLU A 37 3.880 -7.535 4.470 1.00 0.00 H new ATOM 0 HB2 GLU A 37 5.376 -7.747 6.726 1.00 0.00 H new ATOM 0 HB3 GLU A 37 5.788 -6.105 6.271 1.00 0.00 H new ATOM 0 HG2 GLU A 37 3.132 -5.898 5.997 1.00 0.00 H new ATOM 0 HG3 GLU A 37 3.150 -7.238 7.127 1.00 0.00 H new ATOM 509 N VAL A 38 4.285 -5.429 3.224 1.00 0.00 N ATOM 510 CA VAL A 38 4.511 -4.273 2.364 1.00 0.00 C ATOM 511 C VAL A 38 3.825 -3.031 2.921 1.00 0.00 C ATOM 512 O VAL A 38 2.604 -2.894 2.844 1.00 0.00 O ATOM 513 CB VAL A 38 4.000 -4.530 0.933 1.00 0.00 C ATOM 514 CG1 VAL A 38 4.394 -3.386 0.012 1.00 0.00 C ATOM 515 CG2 VAL A 38 4.531 -5.855 0.408 1.00 0.00 C ATOM 0 H VAL A 38 3.305 -5.693 3.327 1.00 0.00 H new ATOM 0 HA VAL A 38 5.588 -4.107 2.334 1.00 0.00 H new ATOM 0 HB VAL A 38 2.912 -4.585 0.959 1.00 0.00 H new ATOM 0 HG11 VAL A 38 4.025 -3.585 -0.994 1.00 0.00 H new ATOM 0 HG12 VAL A 38 3.960 -2.456 0.380 1.00 0.00 H new ATOM 0 HG13 VAL A 38 5.480 -3.295 -0.012 1.00 0.00 H new ATOM 0 HG21 VAL A 38 4.160 -6.020 -0.604 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.621 -5.831 0.396 1.00 0.00 H new ATOM 0 HG23 VAL A 38 4.193 -6.664 1.055 1.00 0.00 H new ATOM 525 N THR A 39 4.620 -2.125 3.483 1.00 0.00 N ATOM 526 CA THR A 39 4.090 -0.893 4.054 1.00 0.00 C ATOM 527 C THR A 39 4.332 0.292 3.126 1.00 0.00 C ATOM 528 O THR A 39 5.463 0.550 2.714 1.00 0.00 O ATOM 529 CB THR A 39 4.722 -0.593 5.426 1.00 0.00 C ATOM 530 OG1 THR A 39 6.095 -0.221 5.262 1.00 0.00 O ATOM 531 CG2 THR A 39 4.625 -1.803 6.343 1.00 0.00 C ATOM 0 H THR A 39 5.633 -2.222 3.555 1.00 0.00 H new ATOM 0 HA THR A 39 3.017 -1.039 4.180 1.00 0.00 H new ATOM 0 HB THR A 39 4.174 0.232 5.881 1.00 0.00 H new ATOM 0 HG1 THR A 39 6.531 -0.186 6.139 1.00 0.00 H new ATOM 0 HG21 THR A 39 5.078 -1.567 7.306 1.00 0.00 H new ATOM 0 HG22 THR A 39 3.577 -2.065 6.489 1.00 0.00 H new ATOM 0 HG23 THR A 39 5.150 -2.645 5.892 1.00 0.00 H new ATOM 539 N VAL A 40 3.262 1.010 2.800 1.00 0.00 N ATOM 540 CA VAL A 40 3.358 2.170 1.922 1.00 0.00 C ATOM 541 C VAL A 40 3.090 3.462 2.685 1.00 0.00 C ATOM 542 O VAL A 40 2.347 3.473 3.666 1.00 0.00 O ATOM 543 CB VAL A 40 2.369 2.067 0.746 1.00 0.00 C ATOM 544 CG1 VAL A 40 2.630 3.169 -0.270 1.00 0.00 C ATOM 545 CG2 VAL A 40 2.459 0.696 0.092 1.00 0.00 C ATOM 0 H VAL A 40 2.318 0.809 3.131 1.00 0.00 H new ATOM 0 HA VAL A 40 4.376 2.187 1.532 1.00 0.00 H new ATOM 0 HB VAL A 40 1.358 2.194 1.133 1.00 0.00 H new ATOM 0 HG11 VAL A 40 1.922 3.080 -1.094 1.00 0.00 H new ATOM 0 HG12 VAL A 40 2.510 4.141 0.208 1.00 0.00 H new ATOM 0 HG13 VAL A 40 3.646 3.077 -0.654 1.00 0.00 H new ATOM 0 HG21 VAL A 40 1.753 0.641 -0.737 1.00 0.00 H new ATOM 0 HG22 VAL A 40 3.471 0.537 -0.282 1.00 0.00 H new ATOM 0 HG23 VAL A 40 2.218 -0.073 0.825 1.00 0.00 H new ATOM 555 N GLY A 41 3.701 4.551 2.228 1.00 0.00 N ATOM 556 CA GLY A 41 3.515 5.834 2.879 1.00 0.00 C ATOM 557 C GLY A 41 4.500 6.879 2.394 1.00 0.00 C ATOM 558 O GLY A 41 5.161 6.691 1.373 1.00 0.00 O ATOM 0 H GLY A 41 4.321 4.567 1.419 1.00 0.00 H new ATOM 0 HA2 GLY A 41 2.499 6.185 2.699 1.00 0.00 H new ATOM 0 HA3 GLY A 41 3.623 5.710 3.957 1.00 0.00 H new ATOM 562 N ARG A 42 4.598 7.984 3.126 1.00 0.00 N ATOM 563 CA ARG A 42 5.507 9.064 2.763 1.00 0.00 C ATOM 564 C ARG A 42 6.578 9.256 3.833 1.00 0.00 C ATOM 565 O ARG A 42 7.666 9.757 3.553 1.00 0.00 O ATOM 566 CB ARG A 42 4.731 10.367 2.562 1.00 0.00 C ATOM 567 CG ARG A 42 3.931 10.793 3.782 1.00 0.00 C ATOM 568 CD ARG A 42 3.816 12.306 3.872 1.00 0.00 C ATOM 569 NE ARG A 42 4.978 12.906 4.522 1.00 0.00 N ATOM 570 CZ ARG A 42 5.186 12.868 5.834 1.00 0.00 C ATOM 571 NH1 ARG A 42 4.316 12.263 6.630 1.00 0.00 N ATOM 572 NH2 ARG A 42 6.268 13.437 6.351 1.00 0.00 N ATOM 0 H ARG A 42 4.058 8.155 3.975 1.00 0.00 H new ATOM 0 HA ARG A 42 5.997 8.794 1.828 1.00 0.00 H new ATOM 0 HB2 ARG A 42 5.431 11.161 2.302 1.00 0.00 H new ATOM 0 HB3 ARG A 42 4.053 10.250 1.716 1.00 0.00 H new ATOM 0 HG2 ARG A 42 2.935 10.353 3.737 1.00 0.00 H new ATOM 0 HG3 ARG A 42 4.408 10.409 4.684 1.00 0.00 H new ATOM 0 HD2 ARG A 42 3.706 12.721 2.870 1.00 0.00 H new ATOM 0 HD3 ARG A 42 2.915 12.569 4.426 1.00 0.00 H new ATOM 0 HE ARG A 42 5.667 13.380 3.938 1.00 0.00 H new ATOM 0 HH11 ARG A 42 3.484 11.825 6.236 1.00 0.00 H new ATOM 0 HH12 ARG A 42 4.479 12.236 7.637 1.00 0.00 H new ATOM 0 HH21 ARG A 42 6.940 13.903 5.741 1.00 0.00 H new ATOM 0 HH22 ARG A 42 6.428 13.408 7.358 1.00 0.00 H new ATOM 586 N GLY A 43 6.260 8.855 5.060 1.00 0.00 N ATOM 587 CA GLY A 43 7.204 8.992 6.153 1.00 0.00 C ATOM 588 C GLY A 43 8.534 8.326 5.858 1.00 0.00 C ATOM 589 O GLY A 43 8.714 7.726 4.798 1.00 0.00 O ATOM 0 H GLY A 43 5.365 8.438 5.316 1.00 0.00 H new ATOM 0 HA2 GLY A 43 7.368 10.050 6.356 1.00 0.00 H new ATOM 0 HA3 GLY A 43 6.776 8.557 7.056 1.00 0.00 H new ATOM 593 N PHE A 44 9.468 8.433 6.797 1.00 0.00 N ATOM 594 CA PHE A 44 10.790 7.838 6.631 1.00 0.00 C ATOM 595 C PHE A 44 10.893 6.522 7.396 1.00 0.00 C ATOM 596 O PHE A 44 11.817 6.320 8.183 1.00 0.00 O ATOM 597 CB PHE A 44 11.872 8.807 7.112 1.00 0.00 C ATOM 598 CG PHE A 44 11.928 10.083 6.322 1.00 0.00 C ATOM 599 CD1 PHE A 44 12.141 10.057 4.953 1.00 0.00 C ATOM 600 CD2 PHE A 44 11.769 11.309 6.948 1.00 0.00 C ATOM 601 CE1 PHE A 44 12.193 11.230 4.223 1.00 0.00 C ATOM 602 CE2 PHE A 44 11.819 12.484 6.224 1.00 0.00 C ATOM 603 CZ PHE A 44 12.033 12.445 4.860 1.00 0.00 C ATOM 0 H PHE A 44 9.335 8.926 7.680 1.00 0.00 H new ATOM 0 HA PHE A 44 10.940 7.634 5.571 1.00 0.00 H new ATOM 0 HB2 PHE A 44 11.695 9.046 8.161 1.00 0.00 H new ATOM 0 HB3 PHE A 44 12.842 8.312 7.057 1.00 0.00 H new ATOM 0 HD1 PHE A 44 12.268 9.109 4.450 1.00 0.00 H new ATOM 0 HD2 PHE A 44 11.604 11.346 8.015 1.00 0.00 H new ATOM 0 HE1 PHE A 44 12.358 11.196 3.156 1.00 0.00 H new ATOM 0 HE2 PHE A 44 11.691 13.433 6.724 1.00 0.00 H new ATOM 0 HZ PHE A 44 12.075 13.363 4.293 1.00 0.00 H new ATOM 613 N GLY A 45 9.938 5.629 7.157 1.00 0.00 N ATOM 614 CA GLY A 45 9.939 4.343 7.831 1.00 0.00 C ATOM 615 C GLY A 45 8.961 3.364 7.213 1.00 0.00 C ATOM 616 O GLY A 45 8.107 2.809 7.904 1.00 0.00 O ATOM 0 H GLY A 45 9.164 5.773 6.509 1.00 0.00 H new ATOM 0 HA2 GLY A 45 10.943 3.919 7.797 1.00 0.00 H new ATOM 0 HA3 GLY A 45 9.689 4.487 8.882 1.00 0.00 H new ATOM 620 N VAL A 46 9.084 3.152 5.906 1.00 0.00 N ATOM 621 CA VAL A 46 8.203 2.234 5.194 1.00 0.00 C ATOM 622 C VAL A 46 8.949 1.511 4.078 1.00 0.00 C ATOM 623 O VAL A 46 10.031 1.931 3.665 1.00 0.00 O ATOM 624 CB VAL A 46 6.991 2.970 4.593 1.00 0.00 C ATOM 625 CG1 VAL A 46 6.109 3.535 5.696 1.00 0.00 C ATOM 626 CG2 VAL A 46 7.452 4.072 3.651 1.00 0.00 C ATOM 0 H VAL A 46 9.785 3.604 5.319 1.00 0.00 H new ATOM 0 HA VAL A 46 7.850 1.505 5.924 1.00 0.00 H new ATOM 0 HB VAL A 46 6.401 2.255 4.019 1.00 0.00 H new ATOM 0 HG11 VAL A 46 5.258 4.052 5.252 1.00 0.00 H new ATOM 0 HG12 VAL A 46 5.751 2.722 6.328 1.00 0.00 H new ATOM 0 HG13 VAL A 46 6.685 4.237 6.299 1.00 0.00 H new ATOM 0 HG21 VAL A 46 6.583 4.582 3.235 1.00 0.00 H new ATOM 0 HG22 VAL A 46 8.064 4.787 4.200 1.00 0.00 H new ATOM 0 HG23 VAL A 46 8.039 3.637 2.842 1.00 0.00 H new ATOM 636 N THR A 47 8.364 0.420 3.592 1.00 0.00 N ATOM 637 CA THR A 47 8.973 -0.362 2.524 1.00 0.00 C ATOM 638 C THR A 47 8.882 0.366 1.188 1.00 0.00 C ATOM 639 O THR A 47 9.727 0.184 0.312 1.00 0.00 O ATOM 640 CB THR A 47 8.306 -1.744 2.390 1.00 0.00 C ATOM 641 OG1 THR A 47 8.381 -2.448 3.634 1.00 0.00 O ATOM 642 CG2 THR A 47 8.974 -2.564 1.296 1.00 0.00 C ATOM 0 H THR A 47 7.469 0.058 3.922 1.00 0.00 H new ATOM 0 HA THR A 47 10.022 -0.497 2.789 1.00 0.00 H new ATOM 0 HB THR A 47 7.260 -1.593 2.122 1.00 0.00 H new ATOM 0 HG1 THR A 47 7.953 -3.325 3.540 1.00 0.00 H new ATOM 0 HG21 THR A 47 8.486 -3.536 1.220 1.00 0.00 H new ATOM 0 HG22 THR A 47 8.888 -2.039 0.344 1.00 0.00 H new ATOM 0 HG23 THR A 47 10.027 -2.705 1.539 1.00 0.00 H new ATOM 650 N TYR A 48 7.852 1.192 1.039 1.00 0.00 N ATOM 651 CA TYR A 48 7.650 1.947 -0.191 1.00 0.00 C ATOM 652 C TYR A 48 7.295 3.400 0.113 1.00 0.00 C ATOM 653 O TYR A 48 6.249 3.685 0.694 1.00 0.00 O ATOM 654 CB TYR A 48 6.545 1.306 -1.032 1.00 0.00 C ATOM 655 CG TYR A 48 6.962 0.013 -1.696 1.00 0.00 C ATOM 656 CD1 TYR A 48 7.783 0.018 -2.817 1.00 0.00 C ATOM 657 CD2 TYR A 48 6.537 -1.214 -1.201 1.00 0.00 C ATOM 658 CE1 TYR A 48 8.166 -1.161 -3.428 1.00 0.00 C ATOM 659 CE2 TYR A 48 6.916 -2.397 -1.804 1.00 0.00 C ATOM 660 CZ TYR A 48 7.730 -2.366 -2.917 1.00 0.00 C ATOM 661 OH TYR A 48 8.111 -3.542 -3.521 1.00 0.00 O ATOM 0 H TYR A 48 7.144 1.355 1.755 1.00 0.00 H new ATOM 0 HA TYR A 48 8.583 1.930 -0.755 1.00 0.00 H new ATOM 0 HB2 TYR A 48 5.680 1.116 -0.396 1.00 0.00 H new ATOM 0 HB3 TYR A 48 6.228 2.013 -1.799 1.00 0.00 H new ATOM 0 HD1 TYR A 48 8.128 0.960 -3.218 1.00 0.00 H new ATOM 0 HD2 TYR A 48 5.899 -1.243 -0.330 1.00 0.00 H new ATOM 0 HE1 TYR A 48 8.803 -1.139 -4.300 1.00 0.00 H new ATOM 0 HE2 TYR A 48 6.577 -3.342 -1.406 1.00 0.00 H new ATOM 0 HH TYR A 48 7.467 -4.247 -3.300 1.00 0.00 H new ATOM 671 N GLN A 49 8.175 4.313 -0.286 1.00 0.00 N ATOM 672 CA GLN A 49 7.955 5.736 -0.057 1.00 0.00 C ATOM 673 C GLN A 49 7.488 6.427 -1.333 1.00 0.00 C ATOM 674 O GLN A 49 8.121 6.309 -2.383 1.00 0.00 O ATOM 675 CB GLN A 49 9.237 6.395 0.455 1.00 0.00 C ATOM 676 CG GLN A 49 9.093 7.887 0.712 1.00 0.00 C ATOM 677 CD GLN A 49 10.430 8.587 0.851 1.00 0.00 C ATOM 678 OE1 GLN A 49 11.415 8.200 0.221 1.00 0.00 O ATOM 679 NE2 GLN A 49 10.473 9.623 1.680 1.00 0.00 N ATOM 0 H GLN A 49 9.046 4.093 -0.769 1.00 0.00 H new ATOM 0 HA GLN A 49 7.175 5.841 0.697 1.00 0.00 H new ATOM 0 HB2 GLN A 49 9.545 5.904 1.378 1.00 0.00 H new ATOM 0 HB3 GLN A 49 10.033 6.235 -0.272 1.00 0.00 H new ATOM 0 HG2 GLN A 49 8.533 8.340 -0.106 1.00 0.00 H new ATOM 0 HG3 GLN A 49 8.511 8.041 1.620 1.00 0.00 H new ATOM 0 HE21 GLN A 49 9.633 9.910 2.182 1.00 0.00 H new ATOM 0 HE22 GLN A 49 11.346 10.132 1.815 1.00 0.00 H new ATOM 688 N LEU A 50 6.376 7.148 -1.236 1.00 0.00 N ATOM 689 CA LEU A 50 5.823 7.859 -2.384 1.00 0.00 C ATOM 690 C LEU A 50 5.912 9.369 -2.184 1.00 0.00 C ATOM 691 O LEU A 50 5.620 9.880 -1.103 1.00 0.00 O ATOM 692 CB LEU A 50 4.367 7.448 -2.611 1.00 0.00 C ATOM 693 CG LEU A 50 4.084 5.945 -2.594 1.00 0.00 C ATOM 694 CD1 LEU A 50 2.616 5.682 -2.297 1.00 0.00 C ATOM 695 CD2 LEU A 50 4.484 5.312 -3.919 1.00 0.00 C ATOM 0 H LEU A 50 5.840 7.256 -0.375 1.00 0.00 H new ATOM 0 HA LEU A 50 6.410 7.592 -3.263 1.00 0.00 H new ATOM 0 HB2 LEU A 50 3.753 7.922 -1.845 1.00 0.00 H new ATOM 0 HB3 LEU A 50 4.043 7.848 -3.572 1.00 0.00 H new ATOM 0 HG LEU A 50 4.681 5.491 -1.803 1.00 0.00 H new ATOM 0 HD11 LEU A 50 2.433 4.607 -2.289 1.00 0.00 H new ATOM 0 HD12 LEU A 50 2.361 6.101 -1.323 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.000 6.149 -3.065 1.00 0.00 H new ATOM 0 HD21 LEU A 50 4.276 4.243 -3.889 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.914 5.770 -4.728 1.00 0.00 H new ATOM 0 HD23 LEU A 50 5.549 5.469 -4.091 1.00 0.00 H new ATOM 707 N VAL A 51 6.314 10.077 -3.234 1.00 0.00 N ATOM 708 CA VAL A 51 6.438 11.529 -3.175 1.00 0.00 C ATOM 709 C VAL A 51 5.957 12.175 -4.470 1.00 0.00 C ATOM 710 O VAL A 51 6.260 11.697 -5.563 1.00 0.00 O ATOM 711 CB VAL A 51 7.893 11.958 -2.910 1.00 0.00 C ATOM 712 CG1 VAL A 51 7.996 13.473 -2.823 1.00 0.00 C ATOM 713 CG2 VAL A 51 8.417 11.306 -1.639 1.00 0.00 C ATOM 0 H VAL A 51 6.560 9.669 -4.136 1.00 0.00 H new ATOM 0 HA VAL A 51 5.812 11.867 -2.349 1.00 0.00 H new ATOM 0 HB VAL A 51 8.510 11.623 -3.744 1.00 0.00 H new ATOM 0 HG11 VAL A 51 9.031 13.757 -2.635 1.00 0.00 H new ATOM 0 HG12 VAL A 51 7.663 13.915 -3.762 1.00 0.00 H new ATOM 0 HG13 VAL A 51 7.367 13.834 -2.009 1.00 0.00 H new ATOM 0 HG21 VAL A 51 9.446 11.620 -1.467 1.00 0.00 H new ATOM 0 HG22 VAL A 51 7.799 11.608 -0.794 1.00 0.00 H new ATOM 0 HG23 VAL A 51 8.381 10.222 -1.745 1.00 0.00 H new ATOM 723 N SER A 52 5.206 13.263 -4.338 1.00 0.00 N ATOM 724 CA SER A 52 4.679 13.973 -5.498 1.00 0.00 C ATOM 725 C SER A 52 4.951 15.471 -5.387 1.00 0.00 C ATOM 726 O SER A 52 5.287 15.975 -4.316 1.00 0.00 O ATOM 727 CB SER A 52 3.176 13.725 -5.636 1.00 0.00 C ATOM 728 OG SER A 52 2.920 12.476 -6.254 1.00 0.00 O ATOM 0 H SER A 52 4.949 13.672 -3.440 1.00 0.00 H new ATOM 0 HA SER A 52 5.185 13.594 -6.386 1.00 0.00 H new ATOM 0 HB2 SER A 52 2.708 13.750 -4.652 1.00 0.00 H new ATOM 0 HB3 SER A 52 2.725 14.524 -6.224 1.00 0.00 H new ATOM 0 HG SER A 52 3.115 11.752 -5.622 1.00 0.00 H new ATOM 734 N LYS A 53 4.802 16.177 -6.503 1.00 0.00 N ATOM 735 CA LYS A 53 5.029 17.617 -6.534 1.00 0.00 C ATOM 736 C LYS A 53 3.715 18.378 -6.393 1.00 0.00 C ATOM 737 O LYS A 53 3.701 19.543 -5.994 1.00 0.00 O ATOM 738 CB LYS A 53 5.725 18.016 -7.837 1.00 0.00 C ATOM 739 CG LYS A 53 7.233 17.832 -7.802 1.00 0.00 C ATOM 740 CD LYS A 53 7.618 16.367 -7.927 1.00 0.00 C ATOM 741 CE LYS A 53 7.934 15.757 -6.570 1.00 0.00 C ATOM 742 NZ LYS A 53 7.695 14.287 -6.554 1.00 0.00 N ATOM 0 H LYS A 53 4.525 15.775 -7.398 1.00 0.00 H new ATOM 0 HA LYS A 53 5.671 17.877 -5.692 1.00 0.00 H new ATOM 0 HB2 LYS A 53 5.314 17.424 -8.655 1.00 0.00 H new ATOM 0 HB3 LYS A 53 5.500 19.060 -8.055 1.00 0.00 H new ATOM 0 HG2 LYS A 53 7.689 18.400 -8.613 1.00 0.00 H new ATOM 0 HG3 LYS A 53 7.628 18.235 -6.870 1.00 0.00 H new ATOM 0 HD2 LYS A 53 6.804 15.814 -8.395 1.00 0.00 H new ATOM 0 HD3 LYS A 53 8.485 16.272 -8.581 1.00 0.00 H new ATOM 0 HE2 LYS A 53 8.974 15.959 -6.314 1.00 0.00 H new ATOM 0 HE3 LYS A 53 7.320 16.233 -5.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 7.245 14.018 -5.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 7.071 14.028 -7.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 8.602 13.787 -6.650 1.00 0.00 H new ATOM 756 N ILE A 54 2.613 17.712 -6.722 1.00 0.00 N ATOM 757 CA ILE A 54 1.294 18.326 -6.629 1.00 0.00 C ATOM 758 C ILE A 54 0.834 18.424 -5.179 1.00 0.00 C ATOM 759 O ILE A 54 0.801 19.511 -4.600 1.00 0.00 O ATOM 760 CB ILE A 54 0.247 17.535 -7.436 1.00 0.00 C ATOM 761 CG1 ILE A 54 0.661 17.451 -8.907 1.00 0.00 C ATOM 762 CG2 ILE A 54 -1.124 18.181 -7.302 1.00 0.00 C ATOM 763 CD1 ILE A 54 1.498 16.233 -9.230 1.00 0.00 C ATOM 0 H ILE A 54 2.607 16.748 -7.055 1.00 0.00 H new ATOM 0 HA ILE A 54 1.382 19.328 -7.048 1.00 0.00 H new ATOM 0 HB ILE A 54 0.191 16.523 -7.036 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -0.235 17.442 -9.528 1.00 0.00 H new ATOM 0 HG13 ILE A 54 1.222 18.348 -9.170 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -1.853 17.611 -7.878 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -1.420 18.193 -6.253 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -1.083 19.203 -7.679 1.00 0.00 H new ATOM 0 HD11 ILE A 54 1.755 16.239 -10.289 1.00 0.00 H new ATOM 0 HD12 ILE A 54 2.411 16.251 -8.635 1.00 0.00 H new ATOM 0 HD13 ILE A 54 0.932 15.331 -8.999 1.00 0.00 H new ATOM 775 N CYS A 55 0.481 17.283 -4.598 1.00 0.00 N ATOM 776 CA CYS A 55 0.023 17.240 -3.213 1.00 0.00 C ATOM 777 C CYS A 55 0.622 16.044 -2.480 1.00 0.00 C ATOM 778 O CYS A 55 -0.046 15.041 -2.227 1.00 0.00 O ATOM 779 CB CYS A 55 -1.504 17.173 -3.161 1.00 0.00 C ATOM 780 SG CYS A 55 -2.306 18.781 -2.957 1.00 0.00 S ATOM 0 H CYS A 55 0.503 16.376 -5.064 1.00 0.00 H new ATOM 0 HA CYS A 55 0.356 18.152 -2.717 1.00 0.00 H new ATOM 0 HB2 CYS A 55 -1.868 16.711 -4.079 1.00 0.00 H new ATOM 0 HB3 CYS A 55 -1.801 16.524 -2.337 1.00 0.00 H new ATOM 0 HG CYS A 55 -1.544 19.712 -3.450 1.00 0.00 H new ATOM 786 N PRO A 56 1.913 16.150 -2.130 1.00 0.00 N ATOM 787 CA PRO A 56 2.631 15.086 -1.422 1.00 0.00 C ATOM 788 C PRO A 56 2.153 14.923 0.017 1.00 0.00 C ATOM 789 O PRO A 56 2.456 13.926 0.673 1.00 0.00 O ATOM 790 CB PRO A 56 4.086 15.560 -1.452 1.00 0.00 C ATOM 791 CG PRO A 56 4.000 17.042 -1.578 1.00 0.00 C ATOM 792 CD PRO A 56 2.770 17.317 -2.399 1.00 0.00 C ATOM 0 HA PRO A 56 2.476 14.111 -1.885 1.00 0.00 H new ATOM 0 HB2 PRO A 56 4.615 15.270 -0.544 1.00 0.00 H new ATOM 0 HB3 PRO A 56 4.628 15.122 -2.291 1.00 0.00 H new ATOM 0 HG2 PRO A 56 3.928 17.514 -0.598 1.00 0.00 H new ATOM 0 HG3 PRO A 56 4.890 17.445 -2.061 1.00 0.00 H new ATOM 0 HD2 PRO A 56 2.287 18.248 -2.100 1.00 0.00 H new ATOM 0 HD3 PRO A 56 3.006 17.406 -3.459 1.00 0.00 H new ATOM 800 N LEU A 57 1.404 15.907 0.502 1.00 0.00 N ATOM 801 CA LEU A 57 0.884 15.873 1.864 1.00 0.00 C ATOM 802 C LEU A 57 -0.303 14.920 1.970 1.00 0.00 C ATOM 803 O LEU A 57 -0.616 14.419 3.049 1.00 0.00 O ATOM 804 CB LEU A 57 0.466 17.276 2.308 1.00 0.00 C ATOM 805 CG LEU A 57 1.542 18.358 2.212 1.00 0.00 C ATOM 806 CD1 LEU A 57 0.928 19.738 2.386 1.00 0.00 C ATOM 807 CD2 LEU A 57 2.630 18.122 3.250 1.00 0.00 C ATOM 0 H LEU A 57 1.143 16.739 -0.028 1.00 0.00 H new ATOM 0 HA LEU A 57 1.677 15.512 2.519 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.388 17.587 1.706 1.00 0.00 H new ATOM 0 HB3 LEU A 57 0.125 17.222 3.342 1.00 0.00 H new ATOM 0 HG LEU A 57 1.995 18.306 1.222 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.709 20.495 2.315 1.00 0.00 H new ATOM 0 HD12 LEU A 57 0.186 19.907 1.606 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.448 19.802 3.363 1.00 0.00 H new ATOM 0 HD21 LEU A 57 3.387 18.902 3.167 1.00 0.00 H new ATOM 0 HD22 LEU A 57 2.192 18.146 4.248 1.00 0.00 H new ATOM 0 HD23 LEU A 57 3.091 17.149 3.079 1.00 0.00 H new ATOM 819 N MET A 58 -0.958 14.672 0.840 1.00 0.00 N ATOM 820 CA MET A 58 -2.108 13.776 0.805 1.00 0.00 C ATOM 821 C MET A 58 -1.773 12.436 1.453 1.00 0.00 C ATOM 822 O MET A 58 -2.488 11.970 2.341 1.00 0.00 O ATOM 823 CB MET A 58 -2.568 13.558 -0.638 1.00 0.00 C ATOM 824 CG MET A 58 -3.901 12.835 -0.748 1.00 0.00 C ATOM 825 SD MET A 58 -5.277 13.818 -0.122 1.00 0.00 S ATOM 826 CE MET A 58 -5.388 15.086 -1.383 1.00 0.00 C ATOM 0 H MET A 58 -0.712 15.079 -0.063 1.00 0.00 H new ATOM 0 HA MET A 58 -2.916 14.240 1.370 1.00 0.00 H new ATOM 0 HB2 MET A 58 -2.646 14.525 -1.136 1.00 0.00 H new ATOM 0 HB3 MET A 58 -1.808 12.986 -1.170 1.00 0.00 H new ATOM 0 HG2 MET A 58 -4.087 12.580 -1.791 1.00 0.00 H new ATOM 0 HG3 MET A 58 -3.848 11.897 -0.195 1.00 0.00 H new ATOM 0 HE1 MET A 58 -6.333 15.620 -1.280 1.00 0.00 H new ATOM 0 HE2 MET A 58 -4.561 15.787 -1.268 1.00 0.00 H new ATOM 0 HE3 MET A 58 -5.338 14.624 -2.369 1.00 0.00 H new ATOM 836 N ILE A 59 -0.684 11.822 1.003 1.00 0.00 N ATOM 837 CA ILE A 59 -0.255 10.537 1.540 1.00 0.00 C ATOM 838 C ILE A 59 0.350 10.696 2.931 1.00 0.00 C ATOM 839 O ILE A 59 1.058 11.666 3.203 1.00 0.00 O ATOM 840 CB ILE A 59 0.775 9.857 0.619 1.00 0.00 C ATOM 841 CG1 ILE A 59 0.188 9.658 -0.780 1.00 0.00 C ATOM 842 CG2 ILE A 59 1.216 8.526 1.209 1.00 0.00 C ATOM 843 CD1 ILE A 59 -1.029 8.760 -0.802 1.00 0.00 C ATOM 0 H ILE A 59 -0.083 12.194 0.268 1.00 0.00 H new ATOM 0 HA ILE A 59 -1.144 9.909 1.603 1.00 0.00 H new ATOM 0 HB ILE A 59 1.649 10.503 0.537 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -0.080 10.630 -1.194 1.00 0.00 H new ATOM 0 HG13 ILE A 59 0.954 9.235 -1.430 1.00 0.00 H new ATOM 0 HG21 ILE A 59 1.944 8.058 0.546 1.00 0.00 H new ATOM 0 HG22 ILE A 59 1.670 8.693 2.186 1.00 0.00 H new ATOM 0 HG23 ILE A 59 0.351 7.872 1.318 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -1.392 8.664 -1.825 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -0.762 7.776 -0.418 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -1.812 9.193 -0.179 1.00 0.00 H new ATOM 855 N SER A 60 0.068 9.737 3.806 1.00 0.00 N ATOM 856 CA SER A 60 0.583 9.772 5.170 1.00 0.00 C ATOM 857 C SER A 60 1.424 8.533 5.465 1.00 0.00 C ATOM 858 O SER A 60 1.235 7.482 4.853 1.00 0.00 O ATOM 859 CB SER A 60 -0.571 9.868 6.171 1.00 0.00 C ATOM 860 OG SER A 60 -0.267 10.781 7.212 1.00 0.00 O ATOM 0 H SER A 60 -0.514 8.926 3.595 1.00 0.00 H new ATOM 0 HA SER A 60 1.217 10.653 5.270 1.00 0.00 H new ATOM 0 HB2 SER A 60 -1.478 10.187 5.657 1.00 0.00 H new ATOM 0 HB3 SER A 60 -0.773 8.884 6.593 1.00 0.00 H new ATOM 0 HG SER A 60 -1.020 10.826 7.838 1.00 0.00 H new ATOM 866 N ARG A 61 2.353 8.667 6.405 1.00 0.00 N ATOM 867 CA ARG A 61 3.225 7.561 6.781 1.00 0.00 C ATOM 868 C ARG A 61 2.410 6.314 7.112 1.00 0.00 C ATOM 869 O ARG A 61 1.467 6.369 7.900 1.00 0.00 O ATOM 870 CB ARG A 61 4.091 7.950 7.980 1.00 0.00 C ATOM 871 CG ARG A 61 3.320 8.652 9.086 1.00 0.00 C ATOM 872 CD ARG A 61 3.904 8.343 10.455 1.00 0.00 C ATOM 873 NE ARG A 61 3.528 7.011 10.922 1.00 0.00 N ATOM 874 CZ ARG A 61 3.932 6.497 12.078 1.00 0.00 C ATOM 875 NH1 ARG A 61 4.720 7.199 12.881 1.00 0.00 N ATOM 876 NH2 ARG A 61 3.548 5.278 12.434 1.00 0.00 N ATOM 0 H ARG A 61 2.521 9.531 6.921 1.00 0.00 H new ATOM 0 HA ARG A 61 3.871 7.337 5.932 1.00 0.00 H new ATOM 0 HB2 ARG A 61 4.557 7.053 8.387 1.00 0.00 H new ATOM 0 HB3 ARG A 61 4.896 8.601 7.640 1.00 0.00 H new ATOM 0 HG2 ARG A 61 3.338 9.729 8.916 1.00 0.00 H new ATOM 0 HG3 ARG A 61 2.276 8.342 9.056 1.00 0.00 H new ATOM 0 HD2 ARG A 61 4.990 8.419 10.411 1.00 0.00 H new ATOM 0 HD3 ARG A 61 3.561 9.089 11.172 1.00 0.00 H new ATOM 0 HE ARG A 61 2.922 6.445 10.328 1.00 0.00 H new ATOM 0 HH11 ARG A 61 5.018 8.137 12.611 1.00 0.00 H new ATOM 0 HH12 ARG A 61 5.028 6.801 13.768 1.00 0.00 H new ATOM 0 HH21 ARG A 61 2.942 4.734 11.820 1.00 0.00 H new ATOM 0 HH22 ARG A 61 3.859 4.884 13.322 1.00 0.00 H new ATOM 890 N ASN A 62 2.780 5.192 6.504 1.00 0.00 N ATOM 891 CA ASN A 62 2.082 3.932 6.733 1.00 0.00 C ATOM 892 C ASN A 62 0.616 4.040 6.326 1.00 0.00 C ATOM 893 O ASN A 62 -0.274 3.579 7.042 1.00 0.00 O ATOM 894 CB ASN A 62 2.186 3.528 8.205 1.00 0.00 C ATOM 895 CG ASN A 62 3.565 3.788 8.780 1.00 0.00 C ATOM 896 OD1 ASN A 62 3.902 4.919 9.130 1.00 0.00 O ATOM 897 ND2 ASN A 62 4.372 2.737 8.880 1.00 0.00 N ATOM 0 H ASN A 62 3.559 5.129 5.849 1.00 0.00 H new ATOM 0 HA ASN A 62 2.555 3.166 6.118 1.00 0.00 H new ATOM 0 HB2 ASN A 62 1.444 4.079 8.783 1.00 0.00 H new ATOM 0 HB3 ASN A 62 1.947 2.469 8.306 1.00 0.00 H new ATOM 0 HD21 ASN A 62 5.312 2.850 9.259 1.00 0.00 H new ATOM 0 HD22 ASN A 62 4.051 1.817 8.578 1.00 0.00 H new ATOM 904 N HIS A 63 0.372 4.652 5.172 1.00 0.00 N ATOM 905 CA HIS A 63 -0.987 4.820 4.668 1.00 0.00 C ATOM 906 C HIS A 63 -1.728 3.487 4.649 1.00 0.00 C ATOM 907 O HIS A 63 -2.946 3.440 4.824 1.00 0.00 O ATOM 908 CB HIS A 63 -0.962 5.423 3.263 1.00 0.00 C ATOM 909 CG HIS A 63 -2.215 6.161 2.906 1.00 0.00 C ATOM 910 ND1 HIS A 63 -2.393 7.506 3.151 1.00 0.00 N ATOM 911 CD2 HIS A 63 -3.356 5.733 2.317 1.00 0.00 C ATOM 912 CE1 HIS A 63 -3.590 7.874 2.729 1.00 0.00 C ATOM 913 NE2 HIS A 63 -4.194 6.817 2.218 1.00 0.00 N ATOM 0 H HIS A 63 1.097 5.040 4.568 1.00 0.00 H new ATOM 0 HA HIS A 63 -1.515 5.499 5.337 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -0.114 6.103 3.184 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -0.800 4.626 2.537 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -3.568 4.727 1.986 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -4.004 8.870 2.791 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -5.131 6.807 1.815 1.00 0.00 H new ATOM 921 N CYS A 64 -0.985 2.406 4.434 1.00 0.00 N ATOM 922 CA CYS A 64 -1.572 1.072 4.390 1.00 0.00 C ATOM 923 C CYS A 64 -0.504 0.001 4.586 1.00 0.00 C ATOM 924 O CYS A 64 0.692 0.275 4.481 1.00 0.00 O ATOM 925 CB CYS A 64 -2.293 0.852 3.059 1.00 0.00 C ATOM 926 SG CYS A 64 -1.281 1.211 1.604 1.00 0.00 S ATOM 0 H CYS A 64 0.024 2.428 4.288 1.00 0.00 H new ATOM 0 HA CYS A 64 -2.294 0.993 5.203 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -2.630 -0.183 3.007 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -3.184 1.479 3.033 1.00 0.00 H new ATOM 0 HG CYS A 64 -1.895 0.796 0.536 1.00 0.00 H new ATOM 932 N VAL A 65 -0.943 -1.220 4.874 1.00 0.00 N ATOM 933 CA VAL A 65 -0.025 -2.333 5.086 1.00 0.00 C ATOM 934 C VAL A 65 -0.581 -3.625 4.498 1.00 0.00 C ATOM 935 O VAL A 65 -1.649 -4.092 4.897 1.00 0.00 O ATOM 936 CB VAL A 65 0.264 -2.545 6.584 1.00 0.00 C ATOM 937 CG1 VAL A 65 1.291 -3.650 6.779 1.00 0.00 C ATOM 938 CG2 VAL A 65 0.735 -1.249 7.224 1.00 0.00 C ATOM 0 H VAL A 65 -1.929 -1.464 4.966 1.00 0.00 H new ATOM 0 HA VAL A 65 0.904 -2.077 4.577 1.00 0.00 H new ATOM 0 HB VAL A 65 -0.660 -2.851 7.075 1.00 0.00 H new ATOM 0 HG11 VAL A 65 1.482 -3.785 7.844 1.00 0.00 H new ATOM 0 HG12 VAL A 65 0.909 -4.580 6.358 1.00 0.00 H new ATOM 0 HG13 VAL A 65 2.219 -3.378 6.275 1.00 0.00 H new ATOM 0 HG21 VAL A 65 0.934 -1.417 8.282 1.00 0.00 H new ATOM 0 HG22 VAL A 65 1.647 -0.911 6.732 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -0.038 -0.488 7.117 1.00 0.00 H new ATOM 948 N LEU A 66 0.148 -4.199 3.548 1.00 0.00 N ATOM 949 CA LEU A 66 -0.272 -5.439 2.905 1.00 0.00 C ATOM 950 C LEU A 66 0.454 -6.638 3.507 1.00 0.00 C ATOM 951 O LEU A 66 1.618 -6.542 3.895 1.00 0.00 O ATOM 952 CB LEU A 66 -0.007 -5.371 1.400 1.00 0.00 C ATOM 953 CG LEU A 66 -0.997 -4.542 0.581 1.00 0.00 C ATOM 954 CD1 LEU A 66 -0.363 -3.229 0.146 1.00 0.00 C ATOM 955 CD2 LEU A 66 -1.479 -5.329 -0.629 1.00 0.00 C ATOM 0 H LEU A 66 1.033 -3.826 3.206 1.00 0.00 H new ATOM 0 HA LEU A 66 -1.342 -5.563 3.074 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.992 -4.964 1.245 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -0.002 -6.387 1.006 1.00 0.00 H new ATOM 0 HG LEU A 66 -1.858 -4.316 1.210 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -1.082 -2.653 -0.436 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.068 -2.658 1.026 1.00 0.00 H new ATOM 0 HD13 LEU A 66 0.516 -3.434 -0.465 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.183 -4.723 -1.200 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -0.627 -5.586 -1.259 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.973 -6.242 -0.296 1.00 0.00 H new ATOM 967 N LYS A 67 -0.242 -7.768 3.580 1.00 0.00 N ATOM 968 CA LYS A 67 0.336 -8.987 4.131 1.00 0.00 C ATOM 969 C LYS A 67 -0.620 -10.165 3.966 1.00 0.00 C ATOM 970 O LYS A 67 -1.837 -9.988 3.939 1.00 0.00 O ATOM 971 CB LYS A 67 0.672 -8.794 5.612 1.00 0.00 C ATOM 972 CG LYS A 67 -0.537 -8.475 6.474 1.00 0.00 C ATOM 973 CD LYS A 67 -0.282 -7.277 7.372 1.00 0.00 C ATOM 974 CE LYS A 67 0.218 -7.705 8.743 1.00 0.00 C ATOM 975 NZ LYS A 67 -0.761 -7.381 9.817 1.00 0.00 N ATOM 0 H LYS A 67 -1.207 -7.864 3.264 1.00 0.00 H new ATOM 0 HA LYS A 67 1.252 -9.204 3.582 1.00 0.00 H new ATOM 0 HB2 LYS A 67 1.148 -9.699 5.989 1.00 0.00 H new ATOM 0 HB3 LYS A 67 1.399 -7.988 5.709 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -1.398 -8.275 5.835 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -0.788 -9.342 7.085 1.00 0.00 H new ATOM 0 HD2 LYS A 67 0.452 -6.620 6.905 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -1.201 -6.701 7.482 1.00 0.00 H new ATOM 0 HE2 LYS A 67 0.412 -8.778 8.740 1.00 0.00 H new ATOM 0 HE3 LYS A 67 1.166 -7.210 8.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -0.383 -7.689 10.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -0.927 -6.355 9.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -1.658 -7.873 9.629 1.00 0.00 H new ATOM 989 N GLN A 68 -0.059 -11.365 3.859 1.00 0.00 N ATOM 990 CA GLN A 68 -0.863 -12.571 3.697 1.00 0.00 C ATOM 991 C GLN A 68 -1.250 -13.153 5.053 1.00 0.00 C ATOM 992 O GLN A 68 -0.392 -13.583 5.822 1.00 0.00 O ATOM 993 CB GLN A 68 -0.098 -13.614 2.881 1.00 0.00 C ATOM 994 CG GLN A 68 0.226 -13.162 1.467 1.00 0.00 C ATOM 995 CD GLN A 68 0.996 -14.206 0.682 1.00 0.00 C ATOM 996 OE1 GLN A 68 2.135 -14.534 1.014 1.00 0.00 O ATOM 997 NE2 GLN A 68 0.376 -14.736 -0.366 1.00 0.00 N ATOM 0 H GLN A 68 0.948 -11.528 3.881 1.00 0.00 H new ATOM 0 HA GLN A 68 -1.775 -12.301 3.164 1.00 0.00 H new ATOM 0 HB2 GLN A 68 0.831 -13.857 3.397 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -0.687 -14.530 2.835 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -0.701 -12.929 0.943 1.00 0.00 H new ATOM 0 HG3 GLN A 68 0.808 -12.242 1.508 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -0.569 -14.435 -0.606 1.00 0.00 H new ATOM 0 HE22 GLN A 68 0.844 -15.444 -0.931 1.00 0.00 H new ATOM 1006 N ASN A 69 -2.548 -13.161 5.339 1.00 0.00 N ATOM 1007 CA ASN A 69 -3.049 -13.689 6.603 1.00 0.00 C ATOM 1008 C ASN A 69 -2.504 -15.091 6.861 1.00 0.00 C ATOM 1009 O ASN A 69 -2.052 -15.785 5.950 1.00 0.00 O ATOM 1010 CB ASN A 69 -4.579 -13.717 6.598 1.00 0.00 C ATOM 1011 CG ASN A 69 -5.140 -14.381 5.355 1.00 0.00 C ATOM 1012 OD1 ASN A 69 -4.621 -15.396 4.891 1.00 0.00 O ATOM 1013 ND2 ASN A 69 -6.207 -13.808 4.810 1.00 0.00 N ATOM 0 H ASN A 69 -3.272 -12.808 4.713 1.00 0.00 H new ATOM 0 HA ASN A 69 -2.707 -13.032 7.403 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -4.933 -14.248 7.482 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -4.959 -12.698 6.665 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -6.629 -14.209 3.973 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -6.604 -12.967 5.229 1.00 0.00 H new ATOM 1020 N PRO A 70 -2.549 -15.518 8.131 1.00 0.00 N ATOM 1021 CA PRO A 70 -2.066 -16.841 8.539 1.00 0.00 C ATOM 1022 C PRO A 70 -2.610 -17.956 7.652 1.00 0.00 C ATOM 1023 O PRO A 70 -1.982 -19.004 7.503 1.00 0.00 O ATOM 1024 CB PRO A 70 -2.596 -16.988 9.968 1.00 0.00 C ATOM 1025 CG PRO A 70 -2.729 -15.591 10.467 1.00 0.00 C ATOM 1026 CD PRO A 70 -3.075 -14.744 9.268 1.00 0.00 C ATOM 0 HA PRO A 70 -0.982 -16.920 8.462 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -3.554 -17.507 9.984 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -1.910 -17.566 10.587 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -3.506 -15.523 11.229 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -1.801 -15.253 10.927 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -4.151 -14.589 9.184 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -2.615 -13.758 9.328 1.00 0.00 H new ATOM 1034 N GLU A 71 -3.779 -17.722 7.066 1.00 0.00 N ATOM 1035 CA GLU A 71 -4.407 -18.708 6.194 1.00 0.00 C ATOM 1036 C GLU A 71 -3.591 -18.905 4.919 1.00 0.00 C ATOM 1037 O GLU A 71 -3.439 -20.025 4.433 1.00 0.00 O ATOM 1038 CB GLU A 71 -5.831 -18.274 5.838 1.00 0.00 C ATOM 1039 CG GLU A 71 -6.635 -17.788 7.033 1.00 0.00 C ATOM 1040 CD GLU A 71 -8.127 -17.994 6.854 1.00 0.00 C ATOM 1041 OE1 GLU A 71 -8.599 -19.130 7.068 1.00 0.00 O ATOM 1042 OE2 GLU A 71 -8.821 -17.018 6.501 1.00 0.00 O ATOM 0 H GLU A 71 -4.311 -16.859 7.179 1.00 0.00 H new ATOM 0 HA GLU A 71 -4.447 -19.656 6.730 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -5.784 -17.479 5.094 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -6.353 -19.112 5.376 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -6.304 -18.315 7.928 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -6.435 -16.729 7.195 1.00 0.00 H new ATOM 1049 N GLY A 72 -3.067 -17.806 4.383 1.00 0.00 N ATOM 1050 CA GLY A 72 -2.274 -17.879 3.170 1.00 0.00 C ATOM 1051 C GLY A 72 -2.860 -17.051 2.043 1.00 0.00 C ATOM 1052 O GLY A 72 -2.574 -17.296 0.872 1.00 0.00 O ATOM 0 H GLY A 72 -3.178 -16.868 4.767 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -1.261 -17.535 3.381 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -2.198 -18.919 2.851 1.00 0.00 H new ATOM 1056 N GLN A 73 -3.685 -16.071 2.398 1.00 0.00 N ATOM 1057 CA GLN A 73 -4.314 -15.207 1.407 1.00 0.00 C ATOM 1058 C GLN A 73 -3.964 -13.744 1.659 1.00 0.00 C ATOM 1059 O GLN A 73 -3.982 -13.279 2.799 1.00 0.00 O ATOM 1060 CB GLN A 73 -5.833 -15.392 1.429 1.00 0.00 C ATOM 1061 CG GLN A 73 -6.583 -14.362 0.600 1.00 0.00 C ATOM 1062 CD GLN A 73 -6.205 -14.405 -0.867 1.00 0.00 C ATOM 1063 OE1 GLN A 73 -5.697 -15.413 -1.359 1.00 0.00 O ATOM 1064 NE2 GLN A 73 -6.451 -13.309 -1.575 1.00 0.00 N ATOM 0 H GLN A 73 -3.933 -15.856 3.364 1.00 0.00 H new ATOM 0 HA GLN A 73 -3.935 -15.488 0.424 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -6.075 -16.389 1.060 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -6.182 -15.340 2.460 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -7.655 -14.532 0.700 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -6.380 -13.366 0.994 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -6.873 -12.496 -1.126 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -6.218 -13.280 -2.568 1.00 0.00 H new ATOM 1073 N TRP A 74 -3.647 -13.024 0.589 1.00 0.00 N ATOM 1074 CA TRP A 74 -3.293 -11.613 0.695 1.00 0.00 C ATOM 1075 C TRP A 74 -4.448 -10.803 1.272 1.00 0.00 C ATOM 1076 O TRP A 74 -5.611 -11.035 0.938 1.00 0.00 O ATOM 1077 CB TRP A 74 -2.901 -11.060 -0.677 1.00 0.00 C ATOM 1078 CG TRP A 74 -1.460 -11.285 -1.018 1.00 0.00 C ATOM 1079 CD1 TRP A 74 -0.964 -12.147 -1.954 1.00 0.00 C ATOM 1080 CD2 TRP A 74 -0.328 -10.639 -0.425 1.00 0.00 C ATOM 1081 NE1 TRP A 74 0.408 -12.075 -1.979 1.00 0.00 N ATOM 1082 CE2 TRP A 74 0.823 -11.157 -1.051 1.00 0.00 C ATOM 1083 CE3 TRP A 74 -0.174 -9.672 0.572 1.00 0.00 C ATOM 1084 CZ2 TRP A 74 2.107 -10.741 -0.710 1.00 0.00 C ATOM 1085 CZ3 TRP A 74 1.101 -9.260 0.909 1.00 0.00 C ATOM 1086 CH2 TRP A 74 2.228 -9.793 0.269 1.00 0.00 C ATOM 0 H TRP A 74 -3.628 -13.394 -0.361 1.00 0.00 H new ATOM 0 HA TRP A 74 -2.442 -11.528 1.370 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -3.525 -11.526 -1.440 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -3.110 -9.991 -0.703 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -1.562 -12.791 -2.582 1.00 0.00 H new ATOM 0 HE1 TRP A 74 1.019 -12.617 -2.590 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -1.036 -9.254 1.070 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 2.977 -11.152 -1.201 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 1.231 -8.514 1.679 1.00 0.00 H new ATOM 0 HH2 TRP A 74 3.211 -9.449 0.554 1.00 0.00 H new ATOM 1097 N THR A 75 -4.122 -9.852 2.142 1.00 0.00 N ATOM 1098 CA THR A 75 -5.133 -9.008 2.767 1.00 0.00 C ATOM 1099 C THR A 75 -4.575 -7.627 3.087 1.00 0.00 C ATOM 1100 O THR A 75 -3.607 -7.497 3.838 1.00 0.00 O ATOM 1101 CB THR A 75 -5.674 -9.645 4.061 1.00 0.00 C ATOM 1102 OG1 THR A 75 -4.593 -9.927 4.957 1.00 0.00 O ATOM 1103 CG2 THR A 75 -6.435 -10.926 3.757 1.00 0.00 C ATOM 0 H THR A 75 -3.165 -9.647 2.430 1.00 0.00 H new ATOM 0 HA THR A 75 -5.949 -8.909 2.051 1.00 0.00 H new ATOM 0 HB THR A 75 -6.359 -8.938 4.529 1.00 0.00 H new ATOM 0 HG1 THR A 75 -3.740 -9.756 4.505 1.00 0.00 H new ATOM 0 HG21 THR A 75 -6.807 -11.357 4.686 1.00 0.00 H new ATOM 0 HG22 THR A 75 -7.275 -10.703 3.099 1.00 0.00 H new ATOM 0 HG23 THR A 75 -5.769 -11.637 3.268 1.00 0.00 H new ATOM 1111 N ILE A 76 -5.191 -6.598 2.516 1.00 0.00 N ATOM 1112 CA ILE A 76 -4.756 -5.225 2.743 1.00 0.00 C ATOM 1113 C ILE A 76 -5.405 -4.643 3.994 1.00 0.00 C ATOM 1114 O ILE A 76 -6.621 -4.718 4.166 1.00 0.00 O ATOM 1115 CB ILE A 76 -5.085 -4.323 1.539 1.00 0.00 C ATOM 1116 CG1 ILE A 76 -4.536 -2.913 1.766 1.00 0.00 C ATOM 1117 CG2 ILE A 76 -6.588 -4.281 1.305 1.00 0.00 C ATOM 1118 CD1 ILE A 76 -4.403 -2.105 0.493 1.00 0.00 C ATOM 0 H ILE A 76 -5.993 -6.689 1.893 1.00 0.00 H new ATOM 0 HA ILE A 76 -3.675 -5.255 2.878 1.00 0.00 H new ATOM 0 HB ILE A 76 -4.610 -4.739 0.651 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -5.192 -2.383 2.457 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -3.560 -2.985 2.245 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -6.805 -3.640 0.451 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -6.953 -5.288 1.105 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -7.083 -3.885 2.192 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -4.008 -1.117 0.729 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -3.724 -2.613 -0.191 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -5.381 -2.002 0.023 1.00 0.00 H new ATOM 1130 N MET A 77 -4.586 -4.060 4.863 1.00 0.00 N ATOM 1131 CA MET A 77 -5.081 -3.461 6.097 1.00 0.00 C ATOM 1132 C MET A 77 -4.489 -2.070 6.302 1.00 0.00 C ATOM 1133 O MET A 77 -3.273 -1.913 6.415 1.00 0.00 O ATOM 1134 CB MET A 77 -4.744 -4.353 7.293 1.00 0.00 C ATOM 1135 CG MET A 77 -5.205 -3.784 8.625 1.00 0.00 C ATOM 1136 SD MET A 77 -3.957 -3.941 9.917 1.00 0.00 S ATOM 1137 CE MET A 77 -2.986 -2.463 9.631 1.00 0.00 C ATOM 0 H MET A 77 -3.576 -3.990 4.736 1.00 0.00 H new ATOM 0 HA MET A 77 -6.164 -3.367 6.017 1.00 0.00 H new ATOM 0 HB2 MET A 77 -5.203 -5.331 7.147 1.00 0.00 H new ATOM 0 HB3 MET A 77 -3.666 -4.508 7.327 1.00 0.00 H new ATOM 0 HG2 MET A 77 -5.460 -2.732 8.497 1.00 0.00 H new ATOM 0 HG3 MET A 77 -6.114 -4.296 8.939 1.00 0.00 H new ATOM 0 HE1 MET A 77 -1.961 -2.743 9.386 1.00 0.00 H new ATOM 0 HE2 MET A 77 -3.416 -1.899 8.803 1.00 0.00 H new ATOM 0 HE3 MET A 77 -2.989 -1.846 10.530 1.00 0.00 H new ATOM 1147 N ASP A 78 -5.356 -1.065 6.349 1.00 0.00 N ATOM 1148 CA ASP A 78 -4.919 0.313 6.541 1.00 0.00 C ATOM 1149 C ASP A 78 -4.412 0.529 7.964 1.00 0.00 C ATOM 1150 O ASP A 78 -4.970 -0.007 8.920 1.00 0.00 O ATOM 1151 CB ASP A 78 -6.065 1.281 6.242 1.00 0.00 C ATOM 1152 CG ASP A 78 -7.362 0.864 6.906 1.00 0.00 C ATOM 1153 OD1 ASP A 78 -7.315 0.014 7.820 1.00 0.00 O ATOM 1154 OD2 ASP A 78 -8.425 1.389 6.512 1.00 0.00 O ATOM 0 H ASP A 78 -6.365 -1.178 6.257 1.00 0.00 H new ATOM 0 HA ASP A 78 -4.100 0.508 5.849 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -5.791 2.280 6.581 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -6.215 1.341 5.164 1.00 0.00 H new ATOM 1159 N ASN A 79 -3.350 1.317 8.095 1.00 0.00 N ATOM 1160 CA ASN A 79 -2.766 1.602 9.401 1.00 0.00 C ATOM 1161 C ASN A 79 -3.259 2.944 9.935 1.00 0.00 C ATOM 1162 O ASN A 79 -2.484 3.888 10.085 1.00 0.00 O ATOM 1163 CB ASN A 79 -1.239 1.607 9.310 1.00 0.00 C ATOM 1164 CG ASN A 79 -0.581 1.232 10.624 1.00 0.00 C ATOM 1165 OD1 ASN A 79 -1.203 1.301 11.685 1.00 0.00 O ATOM 1166 ND2 ASN A 79 0.684 0.833 10.560 1.00 0.00 N ATOM 0 H ASN A 79 -2.876 1.770 7.313 1.00 0.00 H new ATOM 0 HA ASN A 79 -3.079 0.818 10.091 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -0.921 0.909 8.535 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -0.899 2.597 9.006 1.00 0.00 H new ATOM 0 HD21 ASN A 79 1.179 0.569 11.412 1.00 0.00 H new ATOM 0 HD22 ASN A 79 1.161 0.791 9.659 1.00 0.00 H new ATOM 1173 N LYS A 80 -4.554 3.020 10.223 1.00 0.00 N ATOM 1174 CA LYS A 80 -5.152 4.244 10.743 1.00 0.00 C ATOM 1175 C LYS A 80 -4.787 5.441 9.871 1.00 0.00 C ATOM 1176 O LYS A 80 -4.082 6.349 10.310 1.00 0.00 O ATOM 1177 CB LYS A 80 -4.692 4.489 12.182 1.00 0.00 C ATOM 1178 CG LYS A 80 -5.567 3.813 13.223 1.00 0.00 C ATOM 1179 CD LYS A 80 -6.556 4.788 13.840 1.00 0.00 C ATOM 1180 CE LYS A 80 -7.976 4.515 13.367 1.00 0.00 C ATOM 1181 NZ LYS A 80 -8.961 5.420 14.021 1.00 0.00 N ATOM 0 H LYS A 80 -5.210 2.248 10.105 1.00 0.00 H new ATOM 0 HA LYS A 80 -6.235 4.124 10.729 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -3.668 4.132 12.293 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -4.678 5.562 12.373 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -6.109 2.987 12.763 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -4.939 3.386 14.005 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -6.513 4.713 14.927 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -6.274 5.808 13.579 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -8.029 4.641 12.286 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -8.237 3.479 13.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -9.917 5.203 13.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -8.928 5.282 15.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -8.727 6.408 13.796 1.00 0.00 H new ATOM 1195 N SER A 81 -5.273 5.436 8.634 1.00 0.00 N ATOM 1196 CA SER A 81 -4.995 6.521 7.699 1.00 0.00 C ATOM 1197 C SER A 81 -5.881 7.729 7.991 1.00 0.00 C ATOM 1198 O SER A 81 -7.028 7.585 8.414 1.00 0.00 O ATOM 1199 CB SER A 81 -5.213 6.050 6.260 1.00 0.00 C ATOM 1200 OG SER A 81 -6.427 5.330 6.137 1.00 0.00 O ATOM 0 H SER A 81 -5.861 4.693 8.256 1.00 0.00 H new ATOM 0 HA SER A 81 -3.953 6.818 7.823 1.00 0.00 H new ATOM 0 HB2 SER A 81 -5.228 6.910 5.591 1.00 0.00 H new ATOM 0 HB3 SER A 81 -4.380 5.419 5.950 1.00 0.00 H new ATOM 0 HG SER A 81 -6.544 5.042 5.208 1.00 0.00 H new ATOM 1206 N LEU A 82 -5.339 8.920 7.761 1.00 0.00 N ATOM 1207 CA LEU A 82 -6.079 10.155 7.999 1.00 0.00 C ATOM 1208 C LEU A 82 -7.117 10.387 6.906 1.00 0.00 C ATOM 1209 O LEU A 82 -8.309 10.505 7.184 1.00 0.00 O ATOM 1210 CB LEU A 82 -5.117 11.343 8.065 1.00 0.00 C ATOM 1211 CG LEU A 82 -5.763 12.721 8.215 1.00 0.00 C ATOM 1212 CD1 LEU A 82 -6.074 13.009 9.675 1.00 0.00 C ATOM 1213 CD2 LEU A 82 -4.858 13.800 7.637 1.00 0.00 C ATOM 0 H LEU A 82 -4.391 9.057 7.410 1.00 0.00 H new ATOM 0 HA LEU A 82 -6.598 10.061 8.953 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -4.438 11.189 8.903 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -4.510 11.345 7.159 1.00 0.00 H new ATOM 0 HG LEU A 82 -6.700 12.724 7.658 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -6.533 13.994 9.762 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -6.761 12.254 10.057 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -5.151 12.986 10.255 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -5.334 14.774 7.752 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -3.905 13.797 8.165 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -4.687 13.603 6.579 1.00 0.00 H new ATOM 1225 N ASN A 83 -6.655 10.449 5.661 1.00 0.00 N ATOM 1226 CA ASN A 83 -7.544 10.665 4.525 1.00 0.00 C ATOM 1227 C ASN A 83 -8.450 9.457 4.307 1.00 0.00 C ATOM 1228 O ASN A 83 -9.649 9.602 4.072 1.00 0.00 O ATOM 1229 CB ASN A 83 -6.730 10.941 3.259 1.00 0.00 C ATOM 1230 CG ASN A 83 -5.599 11.922 3.502 1.00 0.00 C ATOM 1231 OD1 ASN A 83 -4.519 11.542 3.953 1.00 0.00 O ATOM 1232 ND2 ASN A 83 -5.844 13.193 3.203 1.00 0.00 N ATOM 0 H ASN A 83 -5.670 10.353 5.413 1.00 0.00 H new ATOM 0 HA ASN A 83 -8.169 11.531 4.743 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -6.320 10.004 2.882 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -7.389 11.335 2.485 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -5.122 13.899 3.345 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -6.755 13.463 2.831 1.00 0.00 H new ATOM 1239 N GLY A 84 -7.868 8.264 4.387 1.00 0.00 N ATOM 1240 CA GLY A 84 -8.637 7.049 4.196 1.00 0.00 C ATOM 1241 C GLY A 84 -8.263 6.320 2.921 1.00 0.00 C ATOM 1242 O GLY A 84 -7.814 6.935 1.953 1.00 0.00 O ATOM 0 H GLY A 84 -6.877 8.118 4.581 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -8.482 6.387 5.048 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -9.699 7.295 4.172 1.00 0.00 H new ATOM 1246 N VAL A 85 -8.445 5.003 2.918 1.00 0.00 N ATOM 1247 CA VAL A 85 -8.122 4.188 1.753 1.00 0.00 C ATOM 1248 C VAL A 85 -9.387 3.687 1.066 1.00 0.00 C ATOM 1249 O VAL A 85 -10.376 3.364 1.724 1.00 0.00 O ATOM 1250 CB VAL A 85 -7.246 2.981 2.137 1.00 0.00 C ATOM 1251 CG1 VAL A 85 -5.824 3.428 2.439 1.00 0.00 C ATOM 1252 CG2 VAL A 85 -7.846 2.244 3.325 1.00 0.00 C ATOM 0 H VAL A 85 -8.815 4.478 3.710 1.00 0.00 H new ATOM 0 HA VAL A 85 -7.566 4.825 1.065 1.00 0.00 H new ATOM 0 HB VAL A 85 -7.213 2.294 1.291 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -5.220 2.562 2.708 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -5.398 3.907 1.557 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -5.833 4.136 3.268 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -7.214 1.394 3.583 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -7.911 2.920 4.178 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -8.844 1.889 3.067 1.00 0.00 H new ATOM 1262 N TRP A 86 -9.348 3.623 -0.260 1.00 0.00 N ATOM 1263 CA TRP A 86 -10.492 3.160 -1.037 1.00 0.00 C ATOM 1264 C TRP A 86 -10.130 1.926 -1.856 1.00 0.00 C ATOM 1265 O TRP A 86 -9.075 1.877 -2.490 1.00 0.00 O ATOM 1266 CB TRP A 86 -10.991 4.272 -1.961 1.00 0.00 C ATOM 1267 CG TRP A 86 -11.210 5.576 -1.256 1.00 0.00 C ATOM 1268 CD1 TRP A 86 -10.279 6.548 -1.022 1.00 0.00 C ATOM 1269 CD2 TRP A 86 -12.438 6.050 -0.692 1.00 0.00 C ATOM 1270 NE1 TRP A 86 -10.855 7.597 -0.346 1.00 0.00 N ATOM 1271 CE2 TRP A 86 -12.178 7.317 -0.133 1.00 0.00 C ATOM 1272 CE3 TRP A 86 -13.732 5.529 -0.608 1.00 0.00 C ATOM 1273 CZ2 TRP A 86 -13.165 8.066 0.502 1.00 0.00 C ATOM 1274 CZ3 TRP A 86 -14.710 6.275 0.023 1.00 0.00 C ATOM 1275 CH2 TRP A 86 -14.423 7.532 0.571 1.00 0.00 C ATOM 0 H TRP A 86 -8.537 3.886 -0.820 1.00 0.00 H new ATOM 0 HA TRP A 86 -11.287 2.891 -0.341 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -10.269 4.418 -2.764 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -11.925 3.957 -2.425 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -9.243 6.499 -1.324 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -10.374 8.447 -0.051 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -13.964 4.561 -1.028 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -12.945 9.035 0.925 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -15.713 5.882 0.095 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -15.210 8.090 1.057 1.00 0.00 H new ATOM 1286 N LEU A 87 -11.010 0.930 -1.838 1.00 0.00 N ATOM 1287 CA LEU A 87 -10.782 -0.305 -2.580 1.00 0.00 C ATOM 1288 C LEU A 87 -11.985 -0.644 -3.455 1.00 0.00 C ATOM 1289 O LEU A 87 -13.039 -1.034 -2.954 1.00 0.00 O ATOM 1290 CB LEU A 87 -10.497 -1.457 -1.616 1.00 0.00 C ATOM 1291 CG LEU A 87 -10.563 -2.864 -2.212 1.00 0.00 C ATOM 1292 CD1 LEU A 87 -9.439 -3.072 -3.215 1.00 0.00 C ATOM 1293 CD2 LEU A 87 -10.500 -3.913 -1.112 1.00 0.00 C ATOM 0 H LEU A 87 -11.887 0.954 -1.318 1.00 0.00 H new ATOM 0 HA LEU A 87 -9.916 -0.158 -3.226 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -9.504 -1.311 -1.190 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -11.209 -1.399 -0.792 1.00 0.00 H new ATOM 0 HG LEU A 87 -11.513 -2.972 -2.735 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -9.502 -4.079 -3.629 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -9.530 -2.343 -4.020 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -8.478 -2.944 -2.716 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -10.548 -4.908 -1.555 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -9.566 -3.806 -0.560 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -11.341 -3.778 -0.432 1.00 0.00 H new ATOM 1305 N ASN A 88 -11.818 -0.494 -4.765 1.00 0.00 N ATOM 1306 CA ASN A 88 -12.890 -0.787 -5.710 1.00 0.00 C ATOM 1307 C ASN A 88 -14.120 0.069 -5.420 1.00 0.00 C ATOM 1308 O ASN A 88 -15.235 -0.442 -5.322 1.00 0.00 O ATOM 1309 CB ASN A 88 -13.262 -2.270 -5.649 1.00 0.00 C ATOM 1310 CG ASN A 88 -12.319 -3.135 -6.464 1.00 0.00 C ATOM 1311 OD1 ASN A 88 -11.804 -2.708 -7.497 1.00 0.00 O ATOM 1312 ND2 ASN A 88 -12.091 -4.359 -6.001 1.00 0.00 N ATOM 0 H ASN A 88 -10.952 -0.172 -5.196 1.00 0.00 H new ATOM 0 HA ASN A 88 -12.531 -0.550 -6.712 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -13.251 -2.603 -4.611 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -14.280 -2.402 -6.015 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -11.467 -4.987 -6.507 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -12.540 -4.670 -5.140 1.00 0.00 H new ATOM 1319 N ARG A 89 -13.907 1.374 -5.283 1.00 0.00 N ATOM 1320 CA ARG A 89 -14.997 2.301 -5.004 1.00 0.00 C ATOM 1321 C ARG A 89 -15.686 1.949 -3.688 1.00 0.00 C ATOM 1322 O ARG A 89 -16.913 1.928 -3.605 1.00 0.00 O ATOM 1323 CB ARG A 89 -16.015 2.283 -6.145 1.00 0.00 C ATOM 1324 CG ARG A 89 -15.386 2.398 -7.524 1.00 0.00 C ATOM 1325 CD ARG A 89 -14.630 3.708 -7.684 1.00 0.00 C ATOM 1326 NE ARG A 89 -14.548 4.125 -9.082 1.00 0.00 N ATOM 1327 CZ ARG A 89 -13.800 3.510 -9.990 1.00 0.00 C ATOM 1328 NH1 ARG A 89 -13.073 2.455 -9.650 1.00 0.00 N ATOM 1329 NH2 ARG A 89 -13.778 3.950 -11.242 1.00 0.00 N ATOM 0 H ARG A 89 -12.990 1.813 -5.361 1.00 0.00 H new ATOM 0 HA ARG A 89 -14.576 3.303 -4.918 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -16.590 1.358 -6.093 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -16.718 3.104 -6.006 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -14.706 1.562 -7.686 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -16.162 2.329 -8.286 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -15.125 4.486 -7.102 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -13.624 3.598 -7.279 1.00 0.00 H new ATOM 0 HE ARG A 89 -15.096 4.933 -9.377 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -13.088 2.114 -8.689 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -12.499 1.984 -10.350 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -14.336 4.761 -11.507 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -13.203 3.477 -11.939 1.00 0.00 H new ATOM 1343 N ALA A 90 -14.886 1.673 -2.663 1.00 0.00 N ATOM 1344 CA ALA A 90 -15.419 1.324 -1.352 1.00 0.00 C ATOM 1345 C ALA A 90 -14.498 1.810 -0.238 1.00 0.00 C ATOM 1346 O ALA A 90 -13.274 1.755 -0.363 1.00 0.00 O ATOM 1347 CB ALA A 90 -15.625 -0.180 -1.250 1.00 0.00 C ATOM 0 H ALA A 90 -13.867 1.684 -2.715 1.00 0.00 H new ATOM 0 HA ALA A 90 -16.382 1.821 -1.234 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -16.023 -0.427 -0.266 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -16.328 -0.504 -2.018 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -14.672 -0.688 -1.393 1.00 0.00 H new ATOM 1353 N ARG A 91 -15.093 2.287 0.850 1.00 0.00 N ATOM 1354 CA ARG A 91 -14.325 2.785 1.985 1.00 0.00 C ATOM 1355 C ARG A 91 -13.918 1.642 2.909 1.00 0.00 C ATOM 1356 O ARG A 91 -14.735 0.786 3.253 1.00 0.00 O ATOM 1357 CB ARG A 91 -15.140 3.820 2.764 1.00 0.00 C ATOM 1358 CG ARG A 91 -14.362 4.488 3.886 1.00 0.00 C ATOM 1359 CD ARG A 91 -13.172 5.269 3.350 1.00 0.00 C ATOM 1360 NE ARG A 91 -12.610 6.167 4.355 1.00 0.00 N ATOM 1361 CZ ARG A 91 -13.175 7.315 4.714 1.00 0.00 C ATOM 1362 NH1 ARG A 91 -14.312 7.701 4.153 1.00 0.00 N ATOM 1363 NH2 ARG A 91 -12.602 8.078 5.636 1.00 0.00 N ATOM 0 H ARG A 91 -16.105 2.339 0.970 1.00 0.00 H new ATOM 0 HA ARG A 91 -13.421 3.258 1.601 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -15.495 4.585 2.074 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -16.022 3.335 3.183 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -15.020 5.159 4.438 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -14.015 3.732 4.590 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -12.403 4.573 3.015 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -13.480 5.847 2.479 1.00 0.00 H new ATOM 0 HE ARG A 91 -11.736 5.898 4.806 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -14.755 7.117 3.444 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -14.744 8.583 4.430 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -11.727 7.784 6.070 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -13.036 8.959 5.911 1.00 0.00 H new ATOM 1377 N LEU A 92 -12.651 1.634 3.309 1.00 0.00 N ATOM 1378 CA LEU A 92 -12.135 0.595 4.194 1.00 0.00 C ATOM 1379 C LEU A 92 -11.935 1.134 5.607 1.00 0.00 C ATOM 1380 O LEU A 92 -11.480 2.262 5.793 1.00 0.00 O ATOM 1381 CB LEU A 92 -10.812 0.048 3.653 1.00 0.00 C ATOM 1382 CG LEU A 92 -10.811 -0.370 2.182 1.00 0.00 C ATOM 1383 CD1 LEU A 92 -9.490 -0.001 1.524 1.00 0.00 C ATOM 1384 CD2 LEU A 92 -11.074 -1.863 2.052 1.00 0.00 C ATOM 0 H LEU A 92 -11.962 2.335 3.035 1.00 0.00 H new ATOM 0 HA LEU A 92 -12.867 -0.212 4.232 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -10.043 0.807 3.795 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -10.525 -0.814 4.255 1.00 0.00 H new ATOM 0 HG LEU A 92 -11.611 0.166 1.671 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -9.507 -0.306 0.478 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -9.342 1.077 1.586 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -8.674 -0.510 2.037 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -11.070 -2.143 0.999 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -10.296 -2.417 2.578 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -12.045 -2.101 2.487 1.00 0.00 H new ATOM 1396 N GLU A 93 -12.277 0.318 6.599 1.00 0.00 N ATOM 1397 CA GLU A 93 -12.134 0.712 7.996 1.00 0.00 C ATOM 1398 C GLU A 93 -10.679 0.608 8.444 1.00 0.00 C ATOM 1399 O GLU A 93 -9.899 -0.190 7.925 1.00 0.00 O ATOM 1400 CB GLU A 93 -13.018 -0.160 8.889 1.00 0.00 C ATOM 1401 CG GLU A 93 -14.185 0.589 9.509 1.00 0.00 C ATOM 1402 CD GLU A 93 -15.528 0.006 9.115 1.00 0.00 C ATOM 1403 OE1 GLU A 93 -15.830 -0.021 7.904 1.00 0.00 O ATOM 1404 OE2 GLU A 93 -16.277 -0.423 10.018 1.00 0.00 O ATOM 0 H GLU A 93 -12.655 -0.619 6.461 1.00 0.00 H new ATOM 0 HA GLU A 93 -12.451 1.751 8.088 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -13.403 -0.993 8.301 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -12.407 -0.587 9.685 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -14.089 0.569 10.595 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -14.144 1.635 9.204 1.00 0.00 H new ATOM 1411 N PRO A 94 -10.304 1.435 9.432 1.00 0.00 N ATOM 1412 CA PRO A 94 -8.942 1.456 9.972 1.00 0.00 C ATOM 1413 C PRO A 94 -8.615 0.198 10.769 1.00 0.00 C ATOM 1414 O PRO A 94 -9.413 -0.253 11.593 1.00 0.00 O ATOM 1415 CB PRO A 94 -8.942 2.683 10.887 1.00 0.00 C ATOM 1416 CG PRO A 94 -10.368 2.864 11.278 1.00 0.00 C ATOM 1417 CD PRO A 94 -11.182 2.413 10.097 1.00 0.00 C ATOM 0 HA PRO A 94 -8.191 1.496 9.183 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -8.309 2.526 11.760 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -8.559 3.563 10.370 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -10.607 2.276 12.164 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -10.577 3.906 11.521 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -12.124 1.962 10.407 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -11.429 3.245 9.438 1.00 0.00 H new ATOM 1425 N LEU A 95 -7.438 -0.366 10.519 1.00 0.00 N ATOM 1426 CA LEU A 95 -7.005 -1.573 11.214 1.00 0.00 C ATOM 1427 C LEU A 95 -7.934 -2.743 10.904 1.00 0.00 C ATOM 1428 O LEU A 95 -8.081 -3.662 11.709 1.00 0.00 O ATOM 1429 CB LEU A 95 -6.962 -1.329 12.724 1.00 0.00 C ATOM 1430 CG LEU A 95 -6.275 -0.039 13.175 1.00 0.00 C ATOM 1431 CD1 LEU A 95 -6.187 0.016 14.693 1.00 0.00 C ATOM 1432 CD2 LEU A 95 -4.890 0.073 12.555 1.00 0.00 C ATOM 0 H LEU A 95 -6.767 -0.007 9.840 1.00 0.00 H new ATOM 0 HA LEU A 95 -6.004 -1.824 10.864 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -7.985 -1.323 13.100 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -6.454 -2.171 13.194 1.00 0.00 H new ATOM 0 HG LEU A 95 -6.873 0.806 12.835 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -5.695 0.941 14.996 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -7.191 -0.017 15.117 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -5.612 -0.836 15.055 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -4.416 0.997 12.887 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -4.283 -0.778 12.865 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -4.977 0.080 11.469 1.00 0.00 H new ATOM 1444 N ARG A 96 -8.557 -2.702 9.731 1.00 0.00 N ATOM 1445 CA ARG A 96 -9.470 -3.759 9.313 1.00 0.00 C ATOM 1446 C ARG A 96 -8.826 -4.647 8.252 1.00 0.00 C ATOM 1447 O ARG A 96 -7.926 -4.217 7.531 1.00 0.00 O ATOM 1448 CB ARG A 96 -10.767 -3.157 8.770 1.00 0.00 C ATOM 1449 CG ARG A 96 -11.924 -4.141 8.726 1.00 0.00 C ATOM 1450 CD ARG A 96 -13.244 -3.465 9.062 1.00 0.00 C ATOM 1451 NE ARG A 96 -14.187 -4.386 9.690 1.00 0.00 N ATOM 1452 CZ ARG A 96 -15.499 -4.184 9.725 1.00 0.00 C ATOM 1453 NH1 ARG A 96 -16.021 -3.099 9.170 1.00 0.00 N ATOM 1454 NH2 ARG A 96 -16.292 -5.069 10.315 1.00 0.00 N ATOM 0 H ARG A 96 -8.446 -1.948 9.053 1.00 0.00 H new ATOM 0 HA ARG A 96 -9.699 -4.372 10.185 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -11.049 -2.305 9.389 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -10.587 -2.775 7.765 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -11.985 -4.588 7.734 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -11.740 -4.952 9.430 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -13.060 -2.623 9.730 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -13.685 -3.059 8.152 1.00 0.00 H new ATOM 0 HE ARG A 96 -13.818 -5.231 10.126 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -15.414 -2.417 8.715 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -17.029 -2.946 9.198 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -15.894 -5.905 10.742 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -17.300 -4.913 10.341 1.00 0.00 H new ATOM 1468 N VAL A 97 -9.292 -5.888 8.164 1.00 0.00 N ATOM 1469 CA VAL A 97 -8.762 -6.837 7.192 1.00 0.00 C ATOM 1470 C VAL A 97 -9.646 -6.904 5.951 1.00 0.00 C ATOM 1471 O VAL A 97 -10.858 -7.096 6.050 1.00 0.00 O ATOM 1472 CB VAL A 97 -8.637 -8.248 7.796 1.00 0.00 C ATOM 1473 CG1 VAL A 97 -7.971 -9.194 6.808 1.00 0.00 C ATOM 1474 CG2 VAL A 97 -7.863 -8.200 9.104 1.00 0.00 C ATOM 0 H VAL A 97 -10.036 -6.260 8.754 1.00 0.00 H new ATOM 0 HA VAL A 97 -7.771 -6.481 6.910 1.00 0.00 H new ATOM 0 HB VAL A 97 -9.638 -8.625 8.006 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -7.891 -10.186 7.252 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -8.569 -9.250 5.899 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -6.975 -8.824 6.565 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -7.784 -9.206 9.517 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -6.864 -7.803 8.921 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -8.385 -7.557 9.812 1.00 0.00 H new ATOM 1484 N TYR A 98 -9.032 -6.744 4.785 1.00 0.00 N ATOM 1485 CA TYR A 98 -9.763 -6.784 3.524 1.00 0.00 C ATOM 1486 C TYR A 98 -9.009 -7.607 2.483 1.00 0.00 C ATOM 1487 O TYR A 98 -7.935 -7.216 2.026 1.00 0.00 O ATOM 1488 CB TYR A 98 -9.995 -5.366 2.999 1.00 0.00 C ATOM 1489 CG TYR A 98 -11.081 -4.618 3.737 1.00 0.00 C ATOM 1490 CD1 TYR A 98 -12.423 -4.881 3.492 1.00 0.00 C ATOM 1491 CD2 TYR A 98 -10.766 -3.647 4.680 1.00 0.00 C ATOM 1492 CE1 TYR A 98 -13.419 -4.199 4.163 1.00 0.00 C ATOM 1493 CE2 TYR A 98 -11.756 -2.961 5.357 1.00 0.00 C ATOM 1494 CZ TYR A 98 -13.081 -3.240 5.095 1.00 0.00 C ATOM 1495 OH TYR A 98 -14.069 -2.558 5.767 1.00 0.00 O ATOM 0 H TYR A 98 -8.029 -6.585 4.686 1.00 0.00 H new ATOM 0 HA TYR A 98 -10.727 -7.258 3.707 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -9.064 -4.804 3.072 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -10.255 -5.417 1.942 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -12.692 -5.632 2.764 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -9.730 -3.425 4.887 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -14.457 -4.415 3.959 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -11.494 -2.210 6.088 1.00 0.00 H new ATOM 0 HH TYR A 98 -14.859 -3.131 5.858 1.00 0.00 H new ATOM 1505 N SER A 99 -9.581 -8.748 2.113 1.00 0.00 N ATOM 1506 CA SER A 99 -8.963 -9.629 1.129 1.00 0.00 C ATOM 1507 C SER A 99 -9.021 -9.011 -0.265 1.00 0.00 C ATOM 1508 O SER A 99 -10.074 -8.554 -0.710 1.00 0.00 O ATOM 1509 CB SER A 99 -9.659 -10.992 1.124 1.00 0.00 C ATOM 1510 OG SER A 99 -10.844 -10.962 1.901 1.00 0.00 O ATOM 0 H SER A 99 -10.471 -9.084 2.480 1.00 0.00 H new ATOM 0 HA SER A 99 -7.917 -9.764 1.405 1.00 0.00 H new ATOM 0 HB2 SER A 99 -9.899 -11.278 0.100 1.00 0.00 H new ATOM 0 HB3 SER A 99 -8.982 -11.751 1.516 1.00 0.00 H new ATOM 0 HG SER A 99 -10.612 -11.000 2.852 1.00 0.00 H new ATOM 1516 N ILE A 100 -7.882 -9.002 -0.949 1.00 0.00 N ATOM 1517 CA ILE A 100 -7.802 -8.442 -2.292 1.00 0.00 C ATOM 1518 C ILE A 100 -7.688 -9.543 -3.341 1.00 0.00 C ATOM 1519 O ILE A 100 -7.271 -10.661 -3.039 1.00 0.00 O ATOM 1520 CB ILE A 100 -6.602 -7.487 -2.434 1.00 0.00 C ATOM 1521 CG1 ILE A 100 -5.291 -8.244 -2.213 1.00 0.00 C ATOM 1522 CG2 ILE A 100 -6.726 -6.332 -1.451 1.00 0.00 C ATOM 1523 CD1 ILE A 100 -4.061 -7.375 -2.354 1.00 0.00 C ATOM 0 H ILE A 100 -7.002 -9.376 -0.595 1.00 0.00 H new ATOM 0 HA ILE A 100 -8.723 -7.882 -2.455 1.00 0.00 H new ATOM 0 HB ILE A 100 -6.598 -7.079 -3.445 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -5.300 -8.688 -1.217 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -5.230 -9.065 -2.927 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -5.871 -5.665 -1.563 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -7.645 -5.781 -1.652 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -6.752 -6.722 -0.433 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -3.169 -7.977 -2.184 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -4.028 -6.952 -3.358 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -4.099 -6.569 -1.621 1.00 0.00 H new ATOM 1535 N HIS A 101 -8.059 -9.217 -4.575 1.00 0.00 N ATOM 1536 CA HIS A 101 -7.996 -10.178 -5.671 1.00 0.00 C ATOM 1537 C HIS A 101 -7.745 -9.472 -6.999 1.00 0.00 C ATOM 1538 O HIS A 101 -7.911 -8.257 -7.107 1.00 0.00 O ATOM 1539 CB HIS A 101 -9.293 -10.984 -5.746 1.00 0.00 C ATOM 1540 CG HIS A 101 -9.635 -11.689 -4.469 1.00 0.00 C ATOM 1541 ND1 HIS A 101 -9.084 -12.900 -4.107 1.00 0.00 N ATOM 1542 CD2 HIS A 101 -10.477 -11.345 -3.466 1.00 0.00 C ATOM 1543 CE1 HIS A 101 -9.573 -13.271 -2.937 1.00 0.00 C ATOM 1544 NE2 HIS A 101 -10.420 -12.345 -2.527 1.00 0.00 N ATOM 0 H HIS A 101 -8.406 -8.296 -4.841 1.00 0.00 H new ATOM 0 HA HIS A 101 -7.166 -10.857 -5.478 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -10.112 -10.316 -6.013 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -9.208 -11.719 -6.546 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -11.081 -10.451 -3.414 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -9.322 -14.178 -2.406 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -10.947 -12.369 -1.654 1.00 0.00 H new ATOM 1552 N GLN A 102 -7.344 -10.241 -8.007 1.00 0.00 N ATOM 1553 CA GLN A 102 -7.069 -9.687 -9.327 1.00 0.00 C ATOM 1554 C GLN A 102 -8.245 -8.853 -9.824 1.00 0.00 C ATOM 1555 O GLN A 102 -9.318 -9.382 -10.111 1.00 0.00 O ATOM 1556 CB GLN A 102 -6.769 -10.810 -10.322 1.00 0.00 C ATOM 1557 CG GLN A 102 -6.255 -10.313 -11.663 1.00 0.00 C ATOM 1558 CD GLN A 102 -4.741 -10.251 -11.722 1.00 0.00 C ATOM 1559 OE1 GLN A 102 -4.057 -10.596 -10.758 1.00 0.00 O ATOM 1560 NE2 GLN A 102 -4.210 -9.808 -12.855 1.00 0.00 N ATOM 0 H GLN A 102 -7.203 -11.249 -7.934 1.00 0.00 H new ATOM 0 HA GLN A 102 -6.196 -9.039 -9.246 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -6.031 -11.483 -9.886 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -7.676 -11.393 -10.483 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -6.619 -10.970 -12.453 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -6.663 -9.322 -11.859 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -4.815 -9.533 -13.629 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -3.197 -9.743 -12.952 1.00 0.00 H new ATOM 1569 N GLY A 103 -8.036 -7.543 -9.922 1.00 0.00 N ATOM 1570 CA GLY A 103 -9.088 -6.656 -10.383 1.00 0.00 C ATOM 1571 C GLY A 103 -9.546 -5.691 -9.308 1.00 0.00 C ATOM 1572 O GLY A 103 -10.742 -5.434 -9.163 1.00 0.00 O ATOM 0 H GLY A 103 -7.157 -7.081 -9.690 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -8.732 -6.092 -11.245 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -9.938 -7.250 -10.720 1.00 0.00 H new ATOM 1576 N ASP A 104 -8.595 -5.158 -8.550 1.00 0.00 N ATOM 1577 CA ASP A 104 -8.907 -4.216 -7.481 1.00 0.00 C ATOM 1578 C ASP A 104 -8.278 -2.854 -7.756 1.00 0.00 C ATOM 1579 O ASP A 104 -7.455 -2.710 -8.660 1.00 0.00 O ATOM 1580 CB ASP A 104 -8.416 -4.756 -6.137 1.00 0.00 C ATOM 1581 CG ASP A 104 -9.354 -5.793 -5.552 1.00 0.00 C ATOM 1582 OD1 ASP A 104 -9.929 -6.581 -6.333 1.00 0.00 O ATOM 1583 OD2 ASP A 104 -9.512 -5.819 -4.314 1.00 0.00 O ATOM 0 H ASP A 104 -7.601 -5.362 -8.656 1.00 0.00 H new ATOM 0 HA ASP A 104 -9.990 -4.095 -7.442 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -7.427 -5.196 -6.265 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -8.309 -3.930 -5.434 1.00 0.00 H new ATOM 1588 N TYR A 105 -8.672 -1.856 -6.972 1.00 0.00 N ATOM 1589 CA TYR A 105 -8.150 -0.505 -7.134 1.00 0.00 C ATOM 1590 C TYR A 105 -7.970 0.175 -5.780 1.00 0.00 C ATOM 1591 O TYR A 105 -8.939 0.611 -5.158 1.00 0.00 O ATOM 1592 CB TYR A 105 -9.088 0.325 -8.012 1.00 0.00 C ATOM 1593 CG TYR A 105 -8.615 0.461 -9.442 1.00 0.00 C ATOM 1594 CD1 TYR A 105 -8.640 -0.626 -10.308 1.00 0.00 C ATOM 1595 CD2 TYR A 105 -8.144 1.674 -9.927 1.00 0.00 C ATOM 1596 CE1 TYR A 105 -8.209 -0.507 -11.616 1.00 0.00 C ATOM 1597 CE2 TYR A 105 -7.712 1.803 -11.233 1.00 0.00 C ATOM 1598 CZ TYR A 105 -7.746 0.709 -12.073 1.00 0.00 C ATOM 1599 OH TYR A 105 -7.316 0.833 -13.374 1.00 0.00 O ATOM 0 H TYR A 105 -9.351 -1.958 -6.218 1.00 0.00 H new ATOM 0 HA TYR A 105 -7.176 -0.575 -7.618 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -10.077 -0.133 -8.007 1.00 0.00 H new ATOM 0 HB3 TYR A 105 -9.195 1.319 -7.577 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -9.002 -1.579 -9.953 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -8.115 2.532 -9.272 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -8.235 -1.361 -12.276 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -7.350 2.754 -11.594 1.00 0.00 H new ATOM 0 HH TYR A 105 -7.023 1.754 -13.535 1.00 0.00 H new ATOM 1609 N ILE A 106 -6.722 0.261 -5.331 1.00 0.00 N ATOM 1610 CA ILE A 106 -6.413 0.889 -4.052 1.00 0.00 C ATOM 1611 C ILE A 106 -6.132 2.378 -4.224 1.00 0.00 C ATOM 1612 O ILE A 106 -5.239 2.768 -4.975 1.00 0.00 O ATOM 1613 CB ILE A 106 -5.199 0.224 -3.377 1.00 0.00 C ATOM 1614 CG1 ILE A 106 -5.469 -1.264 -3.145 1.00 0.00 C ATOM 1615 CG2 ILE A 106 -4.876 0.920 -2.063 1.00 0.00 C ATOM 1616 CD1 ILE A 106 -5.065 -2.140 -4.310 1.00 0.00 C ATOM 0 H ILE A 106 -5.909 -0.096 -5.833 1.00 0.00 H new ATOM 0 HA ILE A 106 -7.289 0.758 -3.417 1.00 0.00 H new ATOM 0 HB ILE A 106 -4.337 0.319 -4.038 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -4.931 -1.588 -2.254 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -6.531 -1.406 -2.946 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -4.016 0.438 -1.598 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -4.646 1.968 -2.253 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -5.735 0.853 -1.395 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -5.285 -3.181 -4.076 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -5.621 -1.843 -5.199 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -3.997 -2.028 -4.496 1.00 0.00 H new ATOM 1628 N GLN A 107 -6.901 3.205 -3.522 1.00 0.00 N ATOM 1629 CA GLN A 107 -6.733 4.651 -3.596 1.00 0.00 C ATOM 1630 C GLN A 107 -6.249 5.213 -2.264 1.00 0.00 C ATOM 1631 O GLN A 107 -7.020 5.330 -1.310 1.00 0.00 O ATOM 1632 CB GLN A 107 -8.051 5.318 -3.995 1.00 0.00 C ATOM 1633 CG GLN A 107 -7.867 6.603 -4.786 1.00 0.00 C ATOM 1634 CD GLN A 107 -9.185 7.222 -5.209 1.00 0.00 C ATOM 1635 OE1 GLN A 107 -9.595 7.109 -6.364 1.00 0.00 O ATOM 1636 NE2 GLN A 107 -9.857 7.882 -4.272 1.00 0.00 N ATOM 0 H GLN A 107 -7.646 2.898 -2.896 1.00 0.00 H new ATOM 0 HA GLN A 107 -5.980 4.865 -4.354 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -8.638 4.617 -4.588 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -8.626 5.534 -3.095 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -7.310 7.320 -4.183 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -7.266 6.397 -5.672 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -9.480 7.951 -3.327 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -10.750 8.320 -4.498 1.00 0.00 H new ATOM 1645 N LEU A 108 -4.967 5.557 -2.204 1.00 0.00 N ATOM 1646 CA LEU A 108 -4.379 6.107 -0.987 1.00 0.00 C ATOM 1647 C LEU A 108 -4.787 7.564 -0.795 1.00 0.00 C ATOM 1648 O LEU A 108 -4.070 8.479 -1.196 1.00 0.00 O ATOM 1649 CB LEU A 108 -2.854 5.996 -1.040 1.00 0.00 C ATOM 1650 CG LEU A 108 -2.293 4.610 -1.360 1.00 0.00 C ATOM 1651 CD1 LEU A 108 -0.772 4.638 -1.366 1.00 0.00 C ATOM 1652 CD2 LEU A 108 -2.804 3.583 -0.359 1.00 0.00 C ATOM 0 H LEU A 108 -4.315 5.465 -2.983 1.00 0.00 H new ATOM 0 HA LEU A 108 -4.751 5.530 -0.140 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -2.484 6.697 -1.788 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -2.453 6.315 -0.078 1.00 0.00 H new ATOM 0 HG LEU A 108 -2.635 4.322 -2.354 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -0.391 3.643 -1.596 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -0.424 5.343 -2.121 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -0.410 4.948 -0.386 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -2.394 2.603 -0.602 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -2.492 3.868 0.646 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -3.892 3.543 -0.403 1.00 0.00 H new ATOM 1664 N GLY A 109 -5.945 7.771 -0.175 1.00 0.00 N ATOM 1665 CA GLY A 109 -6.429 9.119 0.062 1.00 0.00 C ATOM 1666 C GLY A 109 -7.577 9.493 -0.854 1.00 0.00 C ATOM 1667 O GLY A 109 -8.161 8.632 -1.513 1.00 0.00 O ATOM 0 H GLY A 109 -6.556 7.030 0.167 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -6.752 9.208 1.099 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -5.611 9.825 -0.079 1.00 0.00 H new ATOM 1671 N VAL A 110 -7.904 10.780 -0.895 1.00 0.00 N ATOM 1672 CA VAL A 110 -8.991 11.267 -1.736 1.00 0.00 C ATOM 1673 C VAL A 110 -8.480 12.259 -2.774 1.00 0.00 C ATOM 1674 O VAL A 110 -7.441 12.896 -2.602 1.00 0.00 O ATOM 1675 CB VAL A 110 -10.093 11.941 -0.896 1.00 0.00 C ATOM 1676 CG1 VAL A 110 -10.959 10.894 -0.213 1.00 0.00 C ATOM 1677 CG2 VAL A 110 -9.480 12.886 0.125 1.00 0.00 C ATOM 0 H VAL A 110 -7.431 11.505 -0.355 1.00 0.00 H new ATOM 0 HA VAL A 110 -9.412 10.399 -2.243 1.00 0.00 H new ATOM 0 HB VAL A 110 -10.728 12.525 -1.562 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -11.732 11.389 0.376 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -11.427 10.261 -0.967 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -10.340 10.281 0.442 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -10.272 13.354 0.710 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -8.821 12.327 0.789 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -8.907 13.656 -0.391 1.00 0.00 H new ATOM 1687 N PRO A 111 -9.227 12.396 -3.880 1.00 0.00 N ATOM 1688 CA PRO A 111 -8.870 13.310 -4.969 1.00 0.00 C ATOM 1689 C PRO A 111 -9.020 14.774 -4.569 1.00 0.00 C ATOM 1690 O PRO A 111 -9.745 15.100 -3.628 1.00 0.00 O ATOM 1691 CB PRO A 111 -9.867 12.953 -6.074 1.00 0.00 C ATOM 1692 CG PRO A 111 -11.038 12.376 -5.355 1.00 0.00 C ATOM 1693 CD PRO A 111 -10.478 11.668 -4.153 1.00 0.00 C ATOM 0 HA PRO A 111 -7.827 13.202 -5.266 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -10.151 13.833 -6.651 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -9.441 12.236 -6.776 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -11.737 13.158 -5.057 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -11.587 11.685 -5.995 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -11.162 11.713 -3.306 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -10.293 10.614 -4.358 1.00 0.00 H new ATOM 1701 N LEU A 112 -8.330 15.652 -5.288 1.00 0.00 N ATOM 1702 CA LEU A 112 -8.387 17.083 -5.008 1.00 0.00 C ATOM 1703 C LEU A 112 -9.422 17.770 -5.893 1.00 0.00 C ATOM 1704 O LEU A 112 -10.121 17.118 -6.668 1.00 0.00 O ATOM 1705 CB LEU A 112 -7.013 17.720 -5.223 1.00 0.00 C ATOM 1706 CG LEU A 112 -5.886 17.203 -4.328 1.00 0.00 C ATOM 1707 CD1 LEU A 112 -4.547 17.304 -5.042 1.00 0.00 C ATOM 1708 CD2 LEU A 112 -5.853 17.972 -3.015 1.00 0.00 C ATOM 0 H LEU A 112 -7.725 15.399 -6.069 1.00 0.00 H new ATOM 0 HA LEU A 112 -8.682 17.213 -3.967 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -6.723 17.568 -6.263 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -7.106 18.795 -5.072 1.00 0.00 H new ATOM 0 HG LEU A 112 -6.077 16.153 -4.106 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -3.758 16.931 -4.389 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -4.575 16.708 -5.954 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -4.347 18.345 -5.295 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -5.045 17.591 -2.390 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -5.687 19.030 -3.217 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -6.803 17.846 -2.496 1.00 0.00 H new ATOM 1720 N GLU A 113 -9.513 19.091 -5.773 1.00 0.00 N ATOM 1721 CA GLU A 113 -10.462 19.866 -6.563 1.00 0.00 C ATOM 1722 C GLU A 113 -9.957 20.052 -7.991 1.00 0.00 C ATOM 1723 O GLU A 113 -10.733 20.334 -8.903 1.00 0.00 O ATOM 1724 CB GLU A 113 -10.706 21.230 -5.914 1.00 0.00 C ATOM 1725 CG GLU A 113 -9.549 22.201 -6.086 1.00 0.00 C ATOM 1726 CD GLU A 113 -9.454 23.201 -4.950 1.00 0.00 C ATOM 1727 OE1 GLU A 113 -9.799 22.837 -3.807 1.00 0.00 O ATOM 1728 OE2 GLU A 113 -9.035 24.350 -5.206 1.00 0.00 O ATOM 0 H GLU A 113 -8.941 19.646 -5.137 1.00 0.00 H new ATOM 0 HA GLU A 113 -11.402 19.315 -6.598 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -11.606 21.671 -6.342 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -10.895 21.088 -4.850 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -8.616 21.641 -6.151 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -9.666 22.737 -7.028 1.00 0.00 H new ATOM 1735 N ASN A 114 -8.651 19.893 -8.175 1.00 0.00 N ATOM 1736 CA ASN A 114 -8.041 20.044 -9.491 1.00 0.00 C ATOM 1737 C ASN A 114 -7.514 18.707 -10.004 1.00 0.00 C ATOM 1738 O ASN A 114 -6.623 18.662 -10.852 1.00 0.00 O ATOM 1739 CB ASN A 114 -6.902 21.065 -9.434 1.00 0.00 C ATOM 1740 CG ASN A 114 -7.212 22.322 -10.225 1.00 0.00 C ATOM 1741 OD1 ASN A 114 -8.374 22.635 -10.484 1.00 0.00 O ATOM 1742 ND2 ASN A 114 -6.171 23.049 -10.612 1.00 0.00 N ATOM 0 H ASN A 114 -7.995 19.660 -7.430 1.00 0.00 H new ATOM 0 HA ASN A 114 -8.807 20.401 -10.180 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -6.708 21.331 -8.395 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -5.990 20.610 -9.822 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -6.317 23.905 -11.147 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -5.225 22.751 -10.375 1.00 0.00 H new ATOM 1749 N LYS A 115 -8.073 17.619 -9.485 1.00 0.00 N ATOM 1750 CA LYS A 115 -7.664 16.280 -9.891 1.00 0.00 C ATOM 1751 C LYS A 115 -8.877 15.384 -10.116 1.00 0.00 C ATOM 1752 O LYS A 115 -9.551 14.987 -9.166 1.00 0.00 O ATOM 1753 CB LYS A 115 -6.749 15.662 -8.831 1.00 0.00 C ATOM 1754 CG LYS A 115 -5.441 16.411 -8.644 1.00 0.00 C ATOM 1755 CD LYS A 115 -4.549 16.288 -9.868 1.00 0.00 C ATOM 1756 CE LYS A 115 -3.276 17.106 -9.713 1.00 0.00 C ATOM 1757 NZ LYS A 115 -2.583 17.305 -11.016 1.00 0.00 N ATOM 0 H LYS A 115 -8.811 17.639 -8.782 1.00 0.00 H new ATOM 0 HA LYS A 115 -7.118 16.363 -10.831 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -7.279 15.631 -7.879 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -6.531 14.631 -9.108 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -5.648 17.463 -8.447 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -4.918 16.020 -7.771 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -4.293 15.241 -10.029 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -5.093 16.623 -10.751 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -3.518 18.076 -9.279 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -2.604 16.604 -9.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -1.820 18.002 -10.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -2.181 16.401 -11.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -3.264 17.651 -11.722 1.00 0.00 H new ATOM 1771 N GLU A 116 -9.149 15.070 -11.378 1.00 0.00 N ATOM 1772 CA GLU A 116 -10.282 14.220 -11.726 1.00 0.00 C ATOM 1773 C GLU A 116 -10.258 12.924 -10.920 1.00 0.00 C ATOM 1774 O GLU A 116 -11.302 12.346 -10.624 1.00 0.00 O ATOM 1775 CB GLU A 116 -10.269 13.903 -13.223 1.00 0.00 C ATOM 1776 CG GLU A 116 -10.118 15.131 -14.105 1.00 0.00 C ATOM 1777 CD GLU A 116 -10.620 14.901 -15.517 1.00 0.00 C ATOM 1778 OE1 GLU A 116 -11.128 13.795 -15.794 1.00 0.00 O ATOM 1779 OE2 GLU A 116 -10.504 15.829 -16.345 1.00 0.00 O ATOM 0 H GLU A 116 -8.601 15.391 -12.176 1.00 0.00 H new ATOM 0 HA GLU A 116 -11.197 14.761 -11.484 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -9.451 13.213 -13.432 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.194 13.390 -13.485 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -10.665 15.963 -13.660 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -9.068 15.422 -14.140 1.00 0.00 H new ATOM 1786 N ASN A 117 -9.057 12.474 -10.570 1.00 0.00 N ATOM 1787 CA ASN A 117 -8.896 11.247 -9.800 1.00 0.00 C ATOM 1788 C ASN A 117 -7.638 11.306 -8.939 1.00 0.00 C ATOM 1789 O ASN A 117 -6.709 12.059 -9.231 1.00 0.00 O ATOM 1790 CB ASN A 117 -8.831 10.038 -10.735 1.00 0.00 C ATOM 1791 CG ASN A 117 -9.936 10.050 -11.774 1.00 0.00 C ATOM 1792 OD1 ASN A 117 -11.035 9.551 -11.533 1.00 0.00 O ATOM 1793 ND2 ASN A 117 -9.647 10.622 -12.937 1.00 0.00 N ATOM 0 H ASN A 117 -8.182 12.941 -10.808 1.00 0.00 H new ATOM 0 HA ASN A 117 -9.760 11.144 -9.143 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -7.864 10.022 -11.237 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -8.899 9.123 -10.147 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -10.350 10.660 -13.675 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -8.722 11.023 -13.092 1.00 0.00 H new ATOM 1800 N ALA A 118 -7.615 10.507 -7.877 1.00 0.00 N ATOM 1801 CA ALA A 118 -6.471 10.466 -6.976 1.00 0.00 C ATOM 1802 C ALA A 118 -5.173 10.249 -7.746 1.00 0.00 C ATOM 1803 O ALA A 118 -5.033 9.272 -8.481 1.00 0.00 O ATOM 1804 CB ALA A 118 -6.658 9.373 -5.934 1.00 0.00 C ATOM 0 H ALA A 118 -8.377 9.879 -7.620 1.00 0.00 H new ATOM 0 HA ALA A 118 -6.405 11.429 -6.469 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -5.796 9.354 -5.268 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -7.560 9.573 -5.355 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -6.753 8.408 -6.432 1.00 0.00 H new ATOM 1810 N GLU A 119 -4.227 11.166 -7.572 1.00 0.00 N ATOM 1811 CA GLU A 119 -2.940 11.075 -8.253 1.00 0.00 C ATOM 1812 C GLU A 119 -2.263 9.739 -7.959 1.00 0.00 C ATOM 1813 O GLU A 119 -1.457 9.252 -8.752 1.00 0.00 O ATOM 1814 CB GLU A 119 -2.028 12.226 -7.825 1.00 0.00 C ATOM 1815 CG GLU A 119 -1.554 12.124 -6.385 1.00 0.00 C ATOM 1816 CD GLU A 119 -0.519 13.176 -6.036 1.00 0.00 C ATOM 1817 OE1 GLU A 119 -0.032 13.860 -6.961 1.00 0.00 O ATOM 1818 OE2 GLU A 119 -0.196 13.315 -4.838 1.00 0.00 O ATOM 0 H GLU A 119 -4.327 11.980 -6.966 1.00 0.00 H new ATOM 0 HA GLU A 119 -3.120 11.144 -9.326 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -1.160 12.254 -8.483 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -2.560 13.168 -7.958 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -2.409 12.225 -5.717 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -1.132 11.134 -6.215 1.00 0.00 H new ATOM 1825 N TYR A 120 -2.597 9.153 -6.815 1.00 0.00 N ATOM 1826 CA TYR A 120 -2.020 7.875 -6.414 1.00 0.00 C ATOM 1827 C TYR A 120 -3.043 6.751 -6.542 1.00 0.00 C ATOM 1828 O TYR A 120 -3.976 6.654 -5.747 1.00 0.00 O ATOM 1829 CB TYR A 120 -1.508 7.952 -4.975 1.00 0.00 C ATOM 1830 CG TYR A 120 -0.146 8.598 -4.850 1.00 0.00 C ATOM 1831 CD1 TYR A 120 0.965 8.049 -5.478 1.00 0.00 C ATOM 1832 CD2 TYR A 120 0.029 9.758 -4.105 1.00 0.00 C ATOM 1833 CE1 TYR A 120 2.211 8.635 -5.366 1.00 0.00 C ATOM 1834 CE2 TYR A 120 1.271 10.351 -3.989 1.00 0.00 C ATOM 1835 CZ TYR A 120 2.359 9.786 -4.620 1.00 0.00 C ATOM 1836 OH TYR A 120 3.598 10.374 -4.507 1.00 0.00 O ATOM 0 H TYR A 120 -3.264 9.542 -6.149 1.00 0.00 H new ATOM 0 HA TYR A 120 -1.184 7.658 -7.079 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -2.223 8.513 -4.373 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -1.463 6.945 -4.560 1.00 0.00 H new ATOM 0 HD1 TYR A 120 0.853 7.149 -6.064 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -0.820 10.203 -3.608 1.00 0.00 H new ATOM 0 HE1 TYR A 120 3.065 8.194 -5.860 1.00 0.00 H new ATOM 0 HE2 TYR A 120 1.389 11.253 -3.407 1.00 0.00 H new ATOM 0 HH TYR A 120 4.198 10.005 -5.188 1.00 0.00 H new ATOM 1846 N GLU A 121 -2.858 5.904 -7.550 1.00 0.00 N ATOM 1847 CA GLU A 121 -3.765 4.786 -7.783 1.00 0.00 C ATOM 1848 C GLU A 121 -3.002 3.561 -8.281 1.00 0.00 C ATOM 1849 O GLU A 121 -2.018 3.683 -9.010 1.00 0.00 O ATOM 1850 CB GLU A 121 -4.841 5.176 -8.798 1.00 0.00 C ATOM 1851 CG GLU A 121 -6.027 5.897 -8.180 1.00 0.00 C ATOM 1852 CD GLU A 121 -6.710 6.838 -9.154 1.00 0.00 C ATOM 1853 OE1 GLU A 121 -6.012 7.400 -10.023 1.00 0.00 O ATOM 1854 OE2 GLU A 121 -7.942 7.013 -9.046 1.00 0.00 O ATOM 0 H GLU A 121 -2.089 5.971 -8.217 1.00 0.00 H new ATOM 0 HA GLU A 121 -4.242 4.536 -6.836 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -4.395 5.815 -9.560 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -5.195 4.277 -9.303 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -6.749 5.162 -7.824 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -5.691 6.461 -7.310 1.00 0.00 H new ATOM 1861 N TYR A 122 -3.463 2.382 -7.880 1.00 0.00 N ATOM 1862 CA TYR A 122 -2.824 1.134 -8.282 1.00 0.00 C ATOM 1863 C TYR A 122 -3.862 0.109 -8.727 1.00 0.00 C ATOM 1864 O TYR A 122 -5.056 0.402 -8.781 1.00 0.00 O ATOM 1865 CB TYR A 122 -1.993 0.569 -7.129 1.00 0.00 C ATOM 1866 CG TYR A 122 -1.130 1.602 -6.440 1.00 0.00 C ATOM 1867 CD1 TYR A 122 -1.644 2.399 -5.425 1.00 0.00 C ATOM 1868 CD2 TYR A 122 0.199 1.780 -6.804 1.00 0.00 C ATOM 1869 CE1 TYR A 122 -0.859 3.345 -4.794 1.00 0.00 C ATOM 1870 CE2 TYR A 122 0.991 2.722 -6.177 1.00 0.00 C ATOM 1871 CZ TYR A 122 0.458 3.503 -5.173 1.00 0.00 C ATOM 1872 OH TYR A 122 1.243 4.443 -4.546 1.00 0.00 O ATOM 0 H TYR A 122 -4.277 2.264 -7.277 1.00 0.00 H new ATOM 0 HA TYR A 122 -2.167 1.346 -9.125 1.00 0.00 H new ATOM 0 HB2 TYR A 122 -2.663 0.120 -6.396 1.00 0.00 H new ATOM 0 HB3 TYR A 122 -1.356 -0.229 -7.509 1.00 0.00 H new ATOM 0 HD1 TYR A 122 -2.674 2.277 -5.124 1.00 0.00 H new ATOM 0 HD2 TYR A 122 0.620 1.171 -7.591 1.00 0.00 H new ATOM 0 HE1 TYR A 122 -1.275 3.958 -4.008 1.00 0.00 H new ATOM 0 HE2 TYR A 122 2.023 2.846 -6.472 1.00 0.00 H new ATOM 0 HH TYR A 122 2.144 4.426 -4.930 1.00 0.00 H new ATOM 1882 N GLU A 123 -3.396 -1.096 -9.043 1.00 0.00 N ATOM 1883 CA GLU A 123 -4.284 -2.166 -9.484 1.00 0.00 C ATOM 1884 C GLU A 123 -3.690 -3.533 -9.159 1.00 0.00 C ATOM 1885 O GLU A 123 -2.708 -3.957 -9.770 1.00 0.00 O ATOM 1886 CB GLU A 123 -4.546 -2.055 -10.987 1.00 0.00 C ATOM 1887 CG GLU A 123 -5.568 -3.054 -11.502 1.00 0.00 C ATOM 1888 CD GLU A 123 -5.522 -3.211 -13.010 1.00 0.00 C ATOM 1889 OE1 GLU A 123 -4.874 -2.374 -13.673 1.00 0.00 O ATOM 1890 OE2 GLU A 123 -6.132 -4.170 -13.526 1.00 0.00 O ATOM 0 H GLU A 123 -2.410 -1.355 -9.002 1.00 0.00 H new ATOM 0 HA GLU A 123 -5.229 -2.063 -8.950 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -4.891 -1.046 -11.214 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -3.608 -2.199 -11.522 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -5.392 -4.023 -11.034 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -6.566 -2.733 -11.204 1.00 0.00 H new ATOM 1897 N VAL A 124 -4.292 -4.220 -8.194 1.00 0.00 N ATOM 1898 CA VAL A 124 -3.824 -5.540 -7.788 1.00 0.00 C ATOM 1899 C VAL A 124 -3.757 -6.489 -8.978 1.00 0.00 C ATOM 1900 O VAL A 124 -4.779 -6.833 -9.572 1.00 0.00 O ATOM 1901 CB VAL A 124 -4.737 -6.151 -6.708 1.00 0.00 C ATOM 1902 CG1 VAL A 124 -4.156 -7.460 -6.196 1.00 0.00 C ATOM 1903 CG2 VAL A 124 -4.944 -5.168 -5.566 1.00 0.00 C ATOM 0 H VAL A 124 -5.105 -3.884 -7.678 1.00 0.00 H new ATOM 0 HA VAL A 124 -2.824 -5.409 -7.376 1.00 0.00 H new ATOM 0 HB VAL A 124 -5.708 -6.362 -7.156 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -4.814 -7.877 -5.434 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -4.065 -8.165 -7.022 1.00 0.00 H new ATOM 0 HG13 VAL A 124 -3.172 -7.277 -5.765 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -5.591 -5.617 -4.813 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -3.981 -4.923 -5.118 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -5.408 -4.259 -5.948 1.00 0.00 H new ATOM 1913 N THR A 125 -2.544 -6.911 -9.324 1.00 0.00 N ATOM 1914 CA THR A 125 -2.342 -7.821 -10.444 1.00 0.00 C ATOM 1915 C THR A 125 -1.170 -8.760 -10.186 1.00 0.00 C ATOM 1916 O THR A 125 -0.186 -8.379 -9.553 1.00 0.00 O ATOM 1917 CB THR A 125 -2.089 -7.051 -11.754 1.00 0.00 C ATOM 1918 OG1 THR A 125 -2.108 -7.955 -12.865 1.00 0.00 O ATOM 1919 CG2 THR A 125 -0.753 -6.326 -11.707 1.00 0.00 C ATOM 0 H THR A 125 -1.687 -6.637 -8.844 1.00 0.00 H new ATOM 0 HA THR A 125 -3.256 -8.406 -10.545 1.00 0.00 H new ATOM 0 HB THR A 125 -2.881 -6.312 -11.873 1.00 0.00 H new ATOM 0 HG1 THR A 125 -1.948 -7.458 -13.694 1.00 0.00 H new ATOM 0 HG21 THR A 125 -0.597 -5.790 -12.643 1.00 0.00 H new ATOM 0 HG22 THR A 125 -0.752 -5.618 -10.878 1.00 0.00 H new ATOM 0 HG23 THR A 125 0.049 -7.050 -11.566 1.00 0.00 H new ATOM 1927 N GLU A 126 -1.282 -9.989 -10.680 1.00 0.00 N ATOM 1928 CA GLU A 126 -0.229 -10.983 -10.501 1.00 0.00 C ATOM 1929 C GLU A 126 0.707 -11.006 -11.705 1.00 0.00 C ATOM 1930 O GLU A 126 0.269 -11.182 -12.841 1.00 0.00 O ATOM 1931 CB GLU A 126 -0.838 -12.370 -10.287 1.00 0.00 C ATOM 1932 CG GLU A 126 0.072 -13.324 -9.531 1.00 0.00 C ATOM 1933 CD GLU A 126 -0.676 -14.512 -8.958 1.00 0.00 C ATOM 1934 OE1 GLU A 126 -1.899 -14.612 -9.190 1.00 0.00 O ATOM 1935 OE2 GLU A 126 -0.037 -15.342 -8.278 1.00 0.00 O ATOM 0 H GLU A 126 -2.090 -10.320 -11.207 1.00 0.00 H new ATOM 0 HA GLU A 126 0.349 -10.708 -9.619 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -1.775 -12.266 -9.741 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -1.081 -12.805 -11.257 1.00 0.00 H new ATOM 0 HG2 GLU A 126 0.855 -13.681 -10.200 1.00 0.00 H new ATOM 0 HG3 GLU A 126 0.565 -12.785 -8.722 1.00 0.00 H new ATOM 1942 N GLU A 127 1.999 -10.826 -11.447 1.00 0.00 N ATOM 1943 CA GLU A 127 2.997 -10.825 -12.510 1.00 0.00 C ATOM 1944 C GLU A 127 4.323 -11.394 -12.012 1.00 0.00 C ATOM 1945 O GLU A 127 4.702 -11.194 -10.858 1.00 0.00 O ATOM 1946 CB GLU A 127 3.206 -9.406 -13.042 1.00 0.00 C ATOM 1947 CG GLU A 127 2.031 -8.879 -13.849 1.00 0.00 C ATOM 1948 CD GLU A 127 1.733 -9.729 -15.069 1.00 0.00 C ATOM 1949 OE1 GLU A 127 2.664 -10.396 -15.568 1.00 0.00 O ATOM 1950 OE2 GLU A 127 0.570 -9.727 -15.524 1.00 0.00 O ATOM 0 H GLU A 127 2.379 -10.679 -10.512 1.00 0.00 H new ATOM 0 HA GLU A 127 2.631 -11.458 -13.318 1.00 0.00 H new ATOM 0 HB2 GLU A 127 3.389 -8.736 -12.202 1.00 0.00 H new ATOM 0 HB3 GLU A 127 4.100 -9.389 -13.665 1.00 0.00 H new ATOM 0 HG2 GLU A 127 1.147 -8.840 -13.213 1.00 0.00 H new ATOM 0 HG3 GLU A 127 2.241 -7.857 -14.165 1.00 0.00 H new ATOM 1957 N ASP A 128 5.023 -12.103 -12.890 1.00 0.00 N ATOM 1958 CA ASP A 128 6.306 -12.700 -12.541 1.00 0.00 C ATOM 1959 C ASP A 128 7.329 -11.624 -12.191 1.00 0.00 C ATOM 1960 O ASP A 128 7.229 -10.486 -12.650 1.00 0.00 O ATOM 1961 CB ASP A 128 6.825 -13.558 -13.697 1.00 0.00 C ATOM 1962 CG ASP A 128 5.975 -14.791 -13.929 1.00 0.00 C ATOM 1963 OD1 ASP A 128 4.813 -14.639 -14.363 1.00 0.00 O ATOM 1964 OD2 ASP A 128 6.471 -15.909 -13.679 1.00 0.00 O ATOM 0 H ASP A 128 4.723 -12.278 -13.849 1.00 0.00 H new ATOM 0 HA ASP A 128 6.158 -13.333 -11.666 1.00 0.00 H new ATOM 0 HB2 ASP A 128 6.848 -12.960 -14.608 1.00 0.00 H new ATOM 0 HB3 ASP A 128 7.851 -13.861 -13.488 1.00 0.00 H new ATOM 1969 N TRP A 129 8.311 -11.992 -11.375 1.00 0.00 N ATOM 1970 CA TRP A 129 9.352 -11.057 -10.963 1.00 0.00 C ATOM 1971 C TRP A 129 10.084 -10.489 -12.173 1.00 0.00 C ATOM 1972 O TRP A 129 10.516 -9.336 -12.163 1.00 0.00 O ATOM 1973 CB TRP A 129 10.346 -11.749 -10.028 1.00 0.00 C ATOM 1974 CG TRP A 129 11.621 -10.983 -9.846 1.00 0.00 C ATOM 1975 CD1 TRP A 129 12.833 -11.263 -10.410 1.00 0.00 C ATOM 1976 CD2 TRP A 129 11.810 -9.813 -9.043 1.00 0.00 C ATOM 1977 NE1 TRP A 129 13.764 -10.337 -10.006 1.00 0.00 N ATOM 1978 CE2 TRP A 129 13.162 -9.436 -9.168 1.00 0.00 C ATOM 1979 CE3 TRP A 129 10.970 -9.045 -8.233 1.00 0.00 C ATOM 1980 CZ2 TRP A 129 13.689 -8.328 -8.511 1.00 0.00 C ATOM 1981 CZ3 TRP A 129 11.495 -7.945 -7.581 1.00 0.00 C ATOM 1982 CH2 TRP A 129 12.844 -7.594 -7.724 1.00 0.00 C ATOM 0 H TRP A 129 8.408 -12.930 -10.986 1.00 0.00 H new ATOM 0 HA TRP A 129 8.876 -10.233 -10.431 1.00 0.00 H new ATOM 0 HB2 TRP A 129 9.877 -11.896 -9.055 1.00 0.00 H new ATOM 0 HB3 TRP A 129 10.578 -12.738 -10.423 1.00 0.00 H new ATOM 0 HD1 TRP A 129 13.030 -12.090 -11.075 1.00 0.00 H new ATOM 0 HE1 TRP A 129 14.745 -10.323 -10.285 1.00 0.00 H new ATOM 0 HE3 TRP A 129 9.928 -9.306 -8.118 1.00 0.00 H new ATOM 0 HZ2 TRP A 129 14.729 -8.057 -8.619 1.00 0.00 H new ATOM 0 HZ3 TRP A 129 10.855 -7.346 -6.951 1.00 0.00 H new ATOM 0 HH2 TRP A 129 13.224 -6.728 -7.203 1.00 0.00 H new ATOM 1993 N GLU A 130 10.219 -11.304 -13.214 1.00 0.00 N ATOM 1994 CA GLU A 130 10.900 -10.880 -14.432 1.00 0.00 C ATOM 1995 C GLU A 130 10.040 -9.899 -15.223 1.00 0.00 C ATOM 1996 O GLU A 130 10.486 -9.324 -16.217 1.00 0.00 O ATOM 1997 CB GLU A 130 11.241 -12.092 -15.301 1.00 0.00 C ATOM 1998 CG GLU A 130 11.851 -13.246 -14.523 1.00 0.00 C ATOM 1999 CD GLU A 130 13.058 -13.845 -15.219 1.00 0.00 C ATOM 2000 OE1 GLU A 130 13.053 -13.906 -16.467 1.00 0.00 O ATOM 2001 OE2 GLU A 130 14.007 -14.252 -14.517 1.00 0.00 O ATOM 0 H GLU A 130 9.866 -12.261 -13.239 1.00 0.00 H new ATOM 0 HA GLU A 130 11.823 -10.377 -14.145 1.00 0.00 H new ATOM 0 HB2 GLU A 130 10.335 -12.439 -15.798 1.00 0.00 H new ATOM 0 HB3 GLU A 130 11.936 -11.784 -16.083 1.00 0.00 H new ATOM 0 HG2 GLU A 130 12.143 -12.897 -13.533 1.00 0.00 H new ATOM 0 HG3 GLU A 130 11.098 -14.021 -14.379 1.00 0.00 H new ATOM 2008 N THR A 131 8.802 -9.712 -14.776 1.00 0.00 N ATOM 2009 CA THR A 131 7.877 -8.803 -15.442 1.00 0.00 C ATOM 2010 C THR A 131 7.805 -7.464 -14.716 1.00 0.00 C ATOM 2011 O THR A 131 7.614 -6.419 -15.340 1.00 0.00 O ATOM 2012 CB THR A 131 6.462 -9.404 -15.527 1.00 0.00 C ATOM 2013 OG1 THR A 131 6.495 -10.632 -16.263 1.00 0.00 O ATOM 2014 CG2 THR A 131 5.501 -8.432 -16.195 1.00 0.00 C ATOM 0 H THR A 131 8.417 -10.178 -13.955 1.00 0.00 H new ATOM 0 HA THR A 131 8.258 -8.647 -16.451 1.00 0.00 H new ATOM 0 HB THR A 131 6.112 -9.598 -14.513 1.00 0.00 H new ATOM 0 HG1 THR A 131 5.592 -11.009 -16.311 1.00 0.00 H new ATOM 0 HG21 THR A 131 4.508 -8.878 -16.244 1.00 0.00 H new ATOM 0 HG22 THR A 131 5.456 -7.509 -15.617 1.00 0.00 H new ATOM 0 HG23 THR A 131 5.850 -8.211 -17.204 1.00 0.00 H new ATOM 2022 N ILE A 132 7.960 -7.502 -13.397 1.00 0.00 N ATOM 2023 CA ILE A 132 7.914 -6.290 -12.588 1.00 0.00 C ATOM 2024 C ILE A 132 9.317 -5.766 -12.303 1.00 0.00 C ATOM 2025 O ILE A 132 9.492 -4.614 -11.906 1.00 0.00 O ATOM 2026 CB ILE A 132 7.187 -6.532 -11.252 1.00 0.00 C ATOM 2027 CG1 ILE A 132 5.826 -7.187 -11.498 1.00 0.00 C ATOM 2028 CG2 ILE A 132 7.022 -5.224 -10.494 1.00 0.00 C ATOM 2029 CD1 ILE A 132 5.293 -7.941 -10.300 1.00 0.00 C ATOM 0 H ILE A 132 8.118 -8.358 -12.866 1.00 0.00 H new ATOM 0 HA ILE A 132 7.361 -5.547 -13.163 1.00 0.00 H new ATOM 0 HB ILE A 132 7.790 -7.207 -10.645 1.00 0.00 H new ATOM 0 HG12 ILE A 132 5.108 -6.418 -11.782 1.00 0.00 H new ATOM 0 HG13 ILE A 132 5.909 -7.873 -12.341 1.00 0.00 H new ATOM 0 HG21 ILE A 132 6.507 -5.412 -9.552 1.00 0.00 H new ATOM 0 HG22 ILE A 132 8.003 -4.795 -10.291 1.00 0.00 H new ATOM 0 HG23 ILE A 132 6.438 -4.527 -11.095 1.00 0.00 H new ATOM 0 HD11 ILE A 132 4.326 -8.379 -10.547 1.00 0.00 H new ATOM 0 HD12 ILE A 132 5.991 -8.733 -10.028 1.00 0.00 H new ATOM 0 HD13 ILE A 132 5.177 -7.255 -9.461 1.00 0.00 H new ATOM 2041 N TYR A 133 10.314 -6.618 -12.510 1.00 0.00 N ATOM 2042 CA TYR A 133 11.703 -6.242 -12.275 1.00 0.00 C ATOM 2043 C TYR A 133 12.064 -4.979 -13.051 1.00 0.00 C ATOM 2044 O TYR A 133 12.513 -3.980 -12.488 1.00 0.00 O ATOM 2045 CB TYR A 133 12.638 -7.384 -12.675 1.00 0.00 C ATOM 2046 CG TYR A 133 14.005 -6.919 -13.125 1.00 0.00 C ATOM 2047 CD1 TYR A 133 14.745 -6.030 -12.357 1.00 0.00 C ATOM 2048 CD2 TYR A 133 14.555 -7.368 -14.320 1.00 0.00 C ATOM 2049 CE1 TYR A 133 15.994 -5.601 -12.764 1.00 0.00 C ATOM 2050 CE2 TYR A 133 15.803 -6.946 -14.734 1.00 0.00 C ATOM 2051 CZ TYR A 133 16.518 -6.063 -13.953 1.00 0.00 C ATOM 2052 OH TYR A 133 17.762 -5.639 -14.364 1.00 0.00 O ATOM 0 H TYR A 133 10.186 -7.575 -12.840 1.00 0.00 H new ATOM 0 HA TYR A 133 11.823 -6.040 -11.211 1.00 0.00 H new ATOM 0 HB2 TYR A 133 12.754 -8.061 -11.828 1.00 0.00 H new ATOM 0 HB3 TYR A 133 12.175 -7.956 -13.479 1.00 0.00 H new ATOM 0 HD1 TYR A 133 14.337 -5.667 -11.425 1.00 0.00 H new ATOM 0 HD2 TYR A 133 13.997 -8.058 -14.935 1.00 0.00 H new ATOM 0 HE1 TYR A 133 16.556 -4.908 -12.155 1.00 0.00 H new ATOM 0 HE2 TYR A 133 16.217 -7.306 -15.665 1.00 0.00 H new ATOM 0 HH TYR A 133 17.984 -6.059 -15.221 1.00 0.00 H new ATOM 2062 N PRO A 134 11.863 -5.023 -14.377 1.00 0.00 N ATOM 2063 CA PRO A 134 12.159 -3.891 -15.260 1.00 0.00 C ATOM 2064 C PRO A 134 11.507 -2.597 -14.783 1.00 0.00 C ATOM 2065 O PRO A 134 12.160 -1.557 -14.697 1.00 0.00 O ATOM 2066 CB PRO A 134 11.567 -4.325 -16.603 1.00 0.00 C ATOM 2067 CG PRO A 134 11.589 -5.814 -16.563 1.00 0.00 C ATOM 2068 CD PRO A 134 11.331 -6.180 -15.115 1.00 0.00 C ATOM 0 HA PRO A 134 13.226 -3.673 -15.299 1.00 0.00 H new ATOM 0 HB2 PRO A 134 10.552 -3.947 -16.729 1.00 0.00 H new ATOM 0 HB3 PRO A 134 12.155 -3.943 -17.437 1.00 0.00 H new ATOM 0 HG2 PRO A 134 10.826 -6.236 -17.217 1.00 0.00 H new ATOM 0 HG3 PRO A 134 12.550 -6.202 -16.902 1.00 0.00 H new ATOM 0 HD2 PRO A 134 10.269 -6.328 -14.920 1.00 0.00 H new ATOM 0 HD3 PRO A 134 11.838 -7.104 -14.836 1.00 0.00 H new ATOM 2076 N CYS A 135 10.217 -2.670 -14.475 1.00 0.00 N ATOM 2077 CA CYS A 135 9.476 -1.504 -14.007 1.00 0.00 C ATOM 2078 C CYS A 135 9.120 -1.642 -12.531 1.00 0.00 C ATOM 2079 O CYS A 135 7.945 -1.642 -12.162 1.00 0.00 O ATOM 2080 CB CYS A 135 8.204 -1.315 -14.836 1.00 0.00 C ATOM 2081 SG CYS A 135 8.486 -1.266 -16.621 1.00 0.00 S ATOM 0 H CYS A 135 9.663 -3.524 -14.541 1.00 0.00 H new ATOM 0 HA CYS A 135 10.113 -0.628 -14.128 1.00 0.00 H new ATOM 0 HB2 CYS A 135 7.512 -2.127 -14.611 1.00 0.00 H new ATOM 0 HB3 CYS A 135 7.718 -0.388 -14.530 1.00 0.00 H new ATOM 0 HG CYS A 135 7.352 -1.105 -17.235 1.00 0.00 H new ATOM 2087 N LEU A 136 10.142 -1.762 -11.690 1.00 0.00 N ATOM 2088 CA LEU A 136 9.937 -1.903 -10.253 1.00 0.00 C ATOM 2089 C LEU A 136 9.731 -0.542 -9.596 1.00 0.00 C ATOM 2090 O LEU A 136 9.924 0.498 -10.225 1.00 0.00 O ATOM 2091 CB LEU A 136 11.133 -2.614 -9.615 1.00 0.00 C ATOM 2092 CG LEU A 136 10.871 -4.025 -9.088 1.00 0.00 C ATOM 2093 CD1 LEU A 136 12.108 -4.572 -8.391 1.00 0.00 C ATOM 2094 CD2 LEU A 136 9.679 -4.029 -8.143 1.00 0.00 C ATOM 0 H LEU A 136 11.120 -1.764 -11.979 1.00 0.00 H new ATOM 0 HA LEU A 136 9.039 -2.501 -10.096 1.00 0.00 H new ATOM 0 HB2 LEU A 136 11.935 -2.666 -10.352 1.00 0.00 H new ATOM 0 HB3 LEU A 136 11.497 -2.001 -8.790 1.00 0.00 H new ATOM 0 HG LEU A 136 10.640 -4.671 -9.935 1.00 0.00 H new ATOM 0 HD11 LEU A 136 11.903 -5.577 -8.022 1.00 0.00 H new ATOM 0 HD12 LEU A 136 12.938 -4.606 -9.097 1.00 0.00 H new ATOM 0 HD13 LEU A 136 12.370 -3.925 -7.554 1.00 0.00 H new ATOM 0 HD21 LEU A 136 9.508 -5.042 -7.778 1.00 0.00 H new ATOM 0 HD22 LEU A 136 9.881 -3.369 -7.300 1.00 0.00 H new ATOM 0 HD23 LEU A 136 8.793 -3.680 -8.673 1.00 0.00 H new ATOM 2106 N SER A 137 9.339 -0.557 -8.326 1.00 0.00 N ATOM 2107 CA SER A 137 9.104 0.676 -7.584 1.00 0.00 C ATOM 2108 C SER A 137 10.226 0.928 -6.580 1.00 0.00 C ATOM 2109 O SER A 137 10.966 0.021 -6.197 1.00 0.00 O ATOM 2110 CB SER A 137 7.760 0.611 -6.857 1.00 0.00 C ATOM 2111 OG SER A 137 7.880 1.064 -5.520 1.00 0.00 O ATOM 0 H SER A 137 9.177 -1.409 -7.790 1.00 0.00 H new ATOM 0 HA SER A 137 9.084 1.501 -8.296 1.00 0.00 H new ATOM 0 HB2 SER A 137 7.027 1.220 -7.386 1.00 0.00 H new ATOM 0 HB3 SER A 137 7.388 -0.414 -6.865 1.00 0.00 H new ATOM 0 HG SER A 137 8.007 0.296 -4.925 1.00 0.00 H new ATOM 2117 N PRO A 138 10.356 2.189 -6.144 1.00 0.00 N ATOM 2118 CA PRO A 138 11.384 2.591 -5.179 1.00 0.00 C ATOM 2119 C PRO A 138 11.121 2.032 -3.785 1.00 0.00 C ATOM 2120 O PRO A 138 10.079 2.297 -3.185 1.00 0.00 O ATOM 2121 CB PRO A 138 11.284 4.118 -5.170 1.00 0.00 C ATOM 2122 CG PRO A 138 9.885 4.409 -5.592 1.00 0.00 C ATOM 2123 CD PRO A 138 9.509 3.321 -6.558 1.00 0.00 C ATOM 0 HA PRO A 138 12.370 2.216 -5.454 1.00 0.00 H new ATOM 0 HB2 PRO A 138 11.491 4.522 -4.179 1.00 0.00 H new ATOM 0 HB3 PRO A 138 12.005 4.566 -5.854 1.00 0.00 H new ATOM 0 HG2 PRO A 138 9.213 4.419 -4.734 1.00 0.00 H new ATOM 0 HG3 PRO A 138 9.815 5.390 -6.063 1.00 0.00 H new ATOM 0 HD2 PRO A 138 8.449 3.075 -6.493 1.00 0.00 H new ATOM 0 HD3 PRO A 138 9.706 3.614 -7.589 1.00 0.00 H new ATOM 2131 N LYS A 139 12.071 1.257 -3.274 1.00 0.00 N ATOM 2132 CA LYS A 139 11.944 0.661 -1.949 1.00 0.00 C ATOM 2133 C LYS A 139 12.835 1.381 -0.941 1.00 0.00 C ATOM 2134 O LYS A 139 13.815 2.026 -1.314 1.00 0.00 O ATOM 2135 CB LYS A 139 12.309 -0.824 -1.999 1.00 0.00 C ATOM 2136 CG LYS A 139 11.171 -1.714 -2.467 1.00 0.00 C ATOM 2137 CD LYS A 139 11.622 -3.156 -2.633 1.00 0.00 C ATOM 2138 CE LYS A 139 11.329 -3.979 -1.388 1.00 0.00 C ATOM 2139 NZ LYS A 139 9.934 -4.501 -1.384 1.00 0.00 N ATOM 0 H LYS A 139 12.939 1.026 -3.758 1.00 0.00 H new ATOM 0 HA LYS A 139 10.907 0.764 -1.629 1.00 0.00 H new ATOM 0 HB2 LYS A 139 13.161 -0.958 -2.665 1.00 0.00 H new ATOM 0 HB3 LYS A 139 12.626 -1.145 -1.007 1.00 0.00 H new ATOM 0 HG2 LYS A 139 10.353 -1.668 -1.748 1.00 0.00 H new ATOM 0 HG3 LYS A 139 10.783 -1.342 -3.415 1.00 0.00 H new ATOM 0 HD2 LYS A 139 11.117 -3.600 -3.491 1.00 0.00 H new ATOM 0 HD3 LYS A 139 12.691 -3.182 -2.844 1.00 0.00 H new ATOM 0 HE2 LYS A 139 12.029 -4.813 -1.331 1.00 0.00 H new ATOM 0 HE3 LYS A 139 11.490 -3.366 -0.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 9.547 -4.450 -0.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 9.347 -3.928 -2.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 9.932 -5.490 -1.706 1.00 0.00 H new ATOM 2153 N SER A 140 12.488 1.265 0.337 1.00 0.00 N ATOM 2154 CA SER A 140 13.254 1.907 1.398 1.00 0.00 C ATOM 2155 C SER A 140 13.285 1.034 2.649 1.00 0.00 C ATOM 2156 O SER A 140 12.514 0.084 2.776 1.00 0.00 O ATOM 2157 CB SER A 140 12.658 3.275 1.731 1.00 0.00 C ATOM 2158 OG SER A 140 13.341 3.879 2.816 1.00 0.00 O ATOM 0 H SER A 140 11.681 0.732 0.662 1.00 0.00 H new ATOM 0 HA SER A 140 14.276 2.042 1.044 1.00 0.00 H new ATOM 0 HB2 SER A 140 12.715 3.922 0.856 1.00 0.00 H new ATOM 0 HB3 SER A 140 11.602 3.165 1.978 1.00 0.00 H new ATOM 0 HG SER A 140 12.942 4.753 3.008 1.00 0.00 H new ATOM 2164 N GLY A 141 14.183 1.366 3.572 1.00 0.00 N ATOM 2165 CA GLY A 141 14.299 0.603 4.802 1.00 0.00 C ATOM 2166 C GLY A 141 15.732 0.494 5.283 1.00 0.00 C ATOM 2167 O GLY A 141 16.679 0.797 4.556 1.00 0.00 O ATOM 0 H GLY A 141 14.832 2.149 3.490 1.00 0.00 H new ATOM 0 HA2 GLY A 141 13.694 1.074 5.577 1.00 0.00 H new ATOM 0 HA3 GLY A 141 13.894 -0.397 4.645 1.00 0.00 H new ATOM 2171 N PRO A 142 15.907 0.053 6.538 1.00 0.00 N ATOM 2172 CA PRO A 142 17.233 -0.104 7.144 1.00 0.00 C ATOM 2173 C PRO A 142 18.020 -1.254 6.526 1.00 0.00 C ATOM 2174 O PRO A 142 19.229 -1.151 6.320 1.00 0.00 O ATOM 2175 CB PRO A 142 16.918 -0.399 8.613 1.00 0.00 C ATOM 2176 CG PRO A 142 15.552 -0.993 8.595 1.00 0.00 C ATOM 2177 CD PRO A 142 14.825 -0.326 7.461 1.00 0.00 C ATOM 0 HA PRO A 142 17.856 0.778 6.996 1.00 0.00 H new ATOM 0 HB2 PRO A 142 17.644 -1.089 9.043 1.00 0.00 H new ATOM 0 HB3 PRO A 142 16.947 0.510 9.214 1.00 0.00 H new ATOM 0 HG2 PRO A 142 15.598 -2.072 8.448 1.00 0.00 H new ATOM 0 HG3 PRO A 142 15.039 -0.822 9.542 1.00 0.00 H new ATOM 0 HD2 PRO A 142 14.112 -1.001 6.988 1.00 0.00 H new ATOM 0 HD3 PRO A 142 14.263 0.544 7.800 1.00 0.00 H new ATOM 2185 N SER A 143 17.327 -2.349 6.232 1.00 0.00 N ATOM 2186 CA SER A 143 17.962 -3.521 5.640 1.00 0.00 C ATOM 2187 C SER A 143 17.461 -3.750 4.217 1.00 0.00 C ATOM 2188 O SER A 143 18.206 -3.589 3.251 1.00 0.00 O ATOM 2189 CB SER A 143 17.692 -4.760 6.495 1.00 0.00 C ATOM 2190 OG SER A 143 18.494 -4.760 7.662 1.00 0.00 O ATOM 0 H SER A 143 16.325 -2.449 6.394 1.00 0.00 H new ATOM 0 HA SER A 143 19.037 -3.342 5.603 1.00 0.00 H new ATOM 0 HB2 SER A 143 16.639 -4.790 6.774 1.00 0.00 H new ATOM 0 HB3 SER A 143 17.893 -5.659 5.912 1.00 0.00 H new ATOM 0 HG SER A 143 18.301 -5.562 8.192 1.00 0.00 H new ATOM 2196 N SER A 144 16.192 -4.129 4.098 1.00 0.00 N ATOM 2197 CA SER A 144 15.590 -4.385 2.794 1.00 0.00 C ATOM 2198 C SER A 144 16.353 -5.476 2.049 1.00 0.00 C ATOM 2199 O SER A 144 16.504 -5.420 0.829 1.00 0.00 O ATOM 2200 CB SER A 144 15.565 -3.103 1.960 1.00 0.00 C ATOM 2201 OG SER A 144 15.161 -1.993 2.743 1.00 0.00 O ATOM 0 H SER A 144 15.561 -4.265 4.888 1.00 0.00 H new ATOM 0 HA SER A 144 14.567 -4.726 2.953 1.00 0.00 H new ATOM 0 HB2 SER A 144 16.555 -2.917 1.543 1.00 0.00 H new ATOM 0 HB3 SER A 144 14.883 -3.226 1.119 1.00 0.00 H new ATOM 0 HG SER A 144 15.155 -1.186 2.187 1.00 0.00 H new ATOM 2207 N GLY A 145 16.834 -6.467 2.793 1.00 0.00 N ATOM 2208 CA GLY A 145 17.575 -7.557 2.187 1.00 0.00 C ATOM 2209 C GLY A 145 19.047 -7.530 2.550 1.00 0.00 C ATOM 2210 O GLY A 145 19.889 -7.164 1.729 1.00 0.00 O ATOM 0 H GLY A 145 16.724 -6.534 3.805 1.00 0.00 H new ATOM 0 HA2 GLY A 145 17.143 -8.506 2.504 1.00 0.00 H new ATOM 0 HA3 GLY A 145 17.470 -7.505 1.103 1.00 0.00 H new TER 2214 GLY A 145