USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 916 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 135 THR OG1 : rot 80:sc= 1.16 USER MOD Set 1.2: A 136 ASN : amide:sc= 0.69 K(o=1.9,f=-1.4) USER MOD Set 2.1: A 91 THR OG1 : rot -107:sc= 1.19 USER MOD Set 2.2: A 112 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 29 ASN : amide:sc= -0.0797 K(o=1.1,f=0.5) USER MOD Set 3.2: A 30 THR OG1 : rot 27:sc= 1.17 USER MOD Single : A 22 ASN :FLIP amide:sc= 0 F(o=-1.3,f=0) USER MOD Single : A 34 THR OG1 : rot -12:sc= 0.951 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot -50:sc= 0.0727 USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 TYR OH : rot -100:sc= 0.271 USER MOD Single : A 46 THR OG1 : rot 75:sc= 0.915 USER MOD Single : A 47 GLN :FLIP amide:sc= 0 F(o=-0.71,f=0) USER MOD Single : A 50 TYR OH : rot -142:sc= -0.234 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 110:sc= -0.489 USER MOD Single : A 61 ASN : amide:sc= 1.02 K(o=1,f=-0.27) USER MOD Single : A 64 MET CE :methyl -132:sc= -1.02 (180deg=-1.59) USER MOD Single : A 68 LYS NZ :NH3+ -144:sc= 1.11 (180deg=0.574) USER MOD Single : A 75 ASN :FLIP amide:sc= -0.0383 F(o=-0.66,f=-0.038) USER MOD Single : A 79 LYS NZ :NH3+ 149:sc= 0.755 (180deg=0.0594) USER MOD Single : A 81 GLN : amide:sc= -0.366 X(o=-0.37,f=-0.074) USER MOD Single : A 82 LYS NZ :NH3+ -176:sc= 2.1 (180deg=2.08) USER MOD Single : A 87 HIS : no HD1:sc= 1.02 K(o=1,f=-3.4!) USER MOD Single : A 95 THR OG1 : rot 180:sc= -0.236 USER MOD Single : A 97 THR OG1 : rot 180:sc= -3.54! USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 ASN : amide:sc= -0.0149 X(o=-0.015,f=-0.1) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 150:sc= 0.279 (180deg=-2.26!) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 ASN : amide:sc= -0.395! C(o=-0.39!,f=-9!) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 GLN :FLIP amide:sc= -0.0271 F(o=-0.63,f=-0.027) USER MOD Single : A 125 ASN : amide:sc= -0.0498 K(o=-0.05,f=-3.4!) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 THR OG1 : rot -3:sc= 1.01 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 20 31.171 -1.200 0.364 1.00 0.00 N ATOM 2 CA ASP A 20 30.452 -2.404 0.030 1.00 0.00 C ATOM 3 C ASP A 20 29.759 -2.963 1.258 1.00 0.00 C ATOM 4 O ASP A 20 30.371 -3.119 2.321 1.00 0.00 O ATOM 5 CB ASP A 20 31.415 -3.446 -0.561 1.00 0.00 C ATOM 6 CG ASP A 20 32.167 -2.938 -1.779 1.00 0.00 C ATOM 7 OD1 ASP A 20 33.158 -2.182 -1.608 1.00 0.00 O ATOM 8 OD2 ASP A 20 31.797 -3.285 -2.925 1.00 0.00 O ATOM 0 HA ASP A 20 29.694 -2.164 -0.715 1.00 0.00 H new ATOM 0 HB2 ASP A 20 32.132 -3.744 0.204 1.00 0.00 H new ATOM 0 HB3 ASP A 20 30.852 -4.338 -0.835 1.00 0.00 H new ATOM 13 N CYS A 21 28.503 -3.241 1.119 1.00 0.00 N ATOM 14 CA CYS A 21 27.688 -3.761 2.187 1.00 0.00 C ATOM 15 C CYS A 21 27.949 -5.242 2.355 1.00 0.00 C ATOM 16 O CYS A 21 28.015 -5.976 1.381 1.00 0.00 O ATOM 17 CB CYS A 21 26.210 -3.521 1.868 1.00 0.00 C ATOM 18 SG CYS A 21 25.766 -1.764 1.661 1.00 0.00 S ATOM 0 H CYS A 21 27.997 -3.113 0.243 1.00 0.00 H new ATOM 0 HA CYS A 21 27.940 -3.250 3.116 1.00 0.00 H new ATOM 0 HB2 CYS A 21 25.955 -4.059 0.955 1.00 0.00 H new ATOM 0 HB3 CYS A 21 25.604 -3.946 2.668 1.00 0.00 H new ATOM 23 N ASN A 22 28.134 -5.673 3.585 1.00 0.00 N ATOM 24 CA ASN A 22 28.362 -7.089 3.891 1.00 0.00 C ATOM 25 C ASN A 22 27.111 -7.702 4.472 1.00 0.00 C ATOM 26 O ASN A 22 27.156 -8.717 5.164 1.00 0.00 O ATOM 27 CB ASN A 22 29.536 -7.278 4.870 1.00 0.00 C ATOM 28 CG ASN A 22 30.915 -7.181 4.239 1.00 0.00 C ATOM 29 OD1 ASN A 22 31.065 -6.356 3.238 1.00 0.00 O flip ATOM 30 ND2 ASN A 22 31.855 -7.853 4.674 1.00 0.00 N flip ATOM 0 H ASN A 22 28.133 -5.064 4.403 1.00 0.00 H new ATOM 0 HA ASN A 22 28.617 -7.591 2.958 1.00 0.00 H new ATOM 0 HB2 ASN A 22 29.459 -6.528 5.657 1.00 0.00 H new ATOM 0 HB3 ASN A 22 29.439 -8.253 5.348 1.00 0.00 H new ATOM 0 HD21 ASN A 22 31.707 -8.489 5.457 1.00 0.00 H new ATOM 0 HD22 ASN A 22 32.779 -7.772 4.250 1.00 0.00 H new ATOM 37 N GLU A 23 25.994 -7.113 4.142 1.00 0.00 N ATOM 38 CA GLU A 23 24.714 -7.541 4.620 1.00 0.00 C ATOM 39 C GLU A 23 23.659 -7.182 3.587 1.00 0.00 C ATOM 40 O GLU A 23 23.871 -6.269 2.770 1.00 0.00 O ATOM 41 CB GLU A 23 24.422 -6.866 5.965 1.00 0.00 C ATOM 42 CG GLU A 23 24.469 -5.352 5.898 1.00 0.00 C ATOM 43 CD GLU A 23 24.406 -4.698 7.249 1.00 0.00 C ATOM 44 OE1 GLU A 23 23.297 -4.391 7.724 1.00 0.00 O ATOM 45 OE2 GLU A 23 25.477 -4.440 7.849 1.00 0.00 O ATOM 0 H GLU A 23 25.951 -6.306 3.520 1.00 0.00 H new ATOM 0 HA GLU A 23 24.704 -8.620 4.771 1.00 0.00 H new ATOM 0 HB2 GLU A 23 23.437 -7.177 6.314 1.00 0.00 H new ATOM 0 HB3 GLU A 23 25.146 -7.213 6.703 1.00 0.00 H new ATOM 0 HG2 GLU A 23 25.386 -5.045 5.395 1.00 0.00 H new ATOM 0 HG3 GLU A 23 23.638 -4.996 5.290 1.00 0.00 H new ATOM 52 N LEU A 24 22.568 -7.907 3.601 1.00 0.00 N ATOM 53 CA LEU A 24 21.438 -7.659 2.722 1.00 0.00 C ATOM 54 C LEU A 24 20.628 -6.468 3.218 1.00 0.00 C ATOM 55 O LEU A 24 20.744 -6.078 4.398 1.00 0.00 O ATOM 56 CB LEU A 24 20.551 -8.910 2.657 1.00 0.00 C ATOM 57 CG LEU A 24 21.071 -10.108 1.845 1.00 0.00 C ATOM 58 CD1 LEU A 24 20.024 -11.198 1.825 1.00 0.00 C ATOM 59 CD2 LEU A 24 21.422 -9.666 0.428 1.00 0.00 C ATOM 0 H LEU A 24 22.432 -8.698 4.230 1.00 0.00 H new ATOM 0 HA LEU A 24 21.811 -7.430 1.724 1.00 0.00 H new ATOM 0 HB2 LEU A 24 20.371 -9.248 3.678 1.00 0.00 H new ATOM 0 HB3 LEU A 24 19.586 -8.617 2.244 1.00 0.00 H new ATOM 0 HG LEU A 24 21.974 -10.500 2.312 1.00 0.00 H new ATOM 0 HD11 LEU A 24 20.393 -12.047 1.249 1.00 0.00 H new ATOM 0 HD12 LEU A 24 19.811 -11.517 2.845 1.00 0.00 H new ATOM 0 HD13 LEU A 24 19.112 -10.818 1.366 1.00 0.00 H new ATOM 0 HD21 LEU A 24 21.789 -10.521 -0.139 1.00 0.00 H new ATOM 0 HD22 LEU A 24 20.534 -9.263 -0.058 1.00 0.00 H new ATOM 0 HD23 LEU A 24 22.194 -8.898 0.467 1.00 0.00 H new ATOM 71 N PRO A 25 19.835 -5.834 2.332 1.00 0.00 N ATOM 72 CA PRO A 25 18.958 -4.733 2.718 1.00 0.00 C ATOM 73 C PRO A 25 17.888 -5.230 3.690 1.00 0.00 C ATOM 74 O PRO A 25 17.397 -6.369 3.557 1.00 0.00 O ATOM 75 CB PRO A 25 18.316 -4.296 1.393 1.00 0.00 C ATOM 76 CG PRO A 25 18.450 -5.480 0.506 1.00 0.00 C ATOM 77 CD PRO A 25 19.738 -6.120 0.887 1.00 0.00 C ATOM 0 HA PRO A 25 19.486 -3.922 3.219 1.00 0.00 H new ATOM 0 HB2 PRO A 25 17.271 -4.020 1.531 1.00 0.00 H new ATOM 0 HB3 PRO A 25 18.823 -3.427 0.974 1.00 0.00 H new ATOM 0 HG2 PRO A 25 17.615 -6.168 0.641 1.00 0.00 H new ATOM 0 HG3 PRO A 25 18.454 -5.185 -0.543 1.00 0.00 H new ATOM 0 HD2 PRO A 25 19.731 -7.191 0.687 1.00 0.00 H new ATOM 0 HD3 PRO A 25 20.578 -5.698 0.335 1.00 0.00 H new ATOM 85 N PRO A 26 17.538 -4.441 4.693 1.00 0.00 N ATOM 86 CA PRO A 26 16.560 -4.849 5.664 1.00 0.00 C ATOM 87 C PRO A 26 15.146 -4.740 5.108 1.00 0.00 C ATOM 88 O PRO A 26 14.703 -3.652 4.731 1.00 0.00 O ATOM 89 CB PRO A 26 16.770 -3.880 6.830 1.00 0.00 C ATOM 90 CG PRO A 26 17.361 -2.649 6.219 1.00 0.00 C ATOM 91 CD PRO A 26 18.049 -3.076 4.945 1.00 0.00 C ATOM 0 HA PRO A 26 16.677 -5.892 5.958 1.00 0.00 H new ATOM 0 HB2 PRO A 26 15.828 -3.657 7.331 1.00 0.00 H new ATOM 0 HB3 PRO A 26 17.437 -4.306 7.580 1.00 0.00 H new ATOM 0 HG2 PRO A 26 16.586 -1.912 6.010 1.00 0.00 H new ATOM 0 HG3 PRO A 26 18.070 -2.181 6.902 1.00 0.00 H new ATOM 0 HD2 PRO A 26 17.812 -2.404 4.120 1.00 0.00 H new ATOM 0 HD3 PRO A 26 19.133 -3.072 5.058 1.00 0.00 H new ATOM 99 N ARG A 27 14.448 -5.869 5.023 1.00 0.00 N ATOM 100 CA ARG A 27 13.082 -5.844 4.543 1.00 0.00 C ATOM 101 C ARG A 27 12.225 -5.024 5.462 1.00 0.00 C ATOM 102 O ARG A 27 12.324 -5.118 6.704 1.00 0.00 O ATOM 103 CB ARG A 27 12.500 -7.226 4.238 1.00 0.00 C ATOM 104 CG ARG A 27 12.646 -8.249 5.330 1.00 0.00 C ATOM 105 CD ARG A 27 12.135 -9.590 4.846 1.00 0.00 C ATOM 106 NE ARG A 27 12.515 -10.694 5.723 1.00 0.00 N ATOM 107 CZ ARG A 27 12.839 -11.918 5.291 1.00 0.00 C ATOM 108 NH1 ARG A 27 12.742 -12.218 4.006 1.00 0.00 N ATOM 109 NH2 ARG A 27 13.217 -12.842 6.149 1.00 0.00 N ATOM 0 H ARG A 27 14.802 -6.792 5.276 1.00 0.00 H new ATOM 0 HA ARG A 27 13.093 -5.355 3.569 1.00 0.00 H new ATOM 0 HB2 ARG A 27 11.440 -7.112 4.011 1.00 0.00 H new ATOM 0 HB3 ARG A 27 12.979 -7.611 3.338 1.00 0.00 H new ATOM 0 HG2 ARG A 27 13.692 -8.333 5.625 1.00 0.00 H new ATOM 0 HG3 ARG A 27 12.090 -7.934 6.213 1.00 0.00 H new ATOM 0 HD2 ARG A 27 11.048 -9.552 4.768 1.00 0.00 H new ATOM 0 HD3 ARG A 27 12.520 -9.780 3.844 1.00 0.00 H new ATOM 0 HE ARG A 27 12.535 -10.521 6.728 1.00 0.00 H new ATOM 0 HH11 ARG A 27 12.419 -11.515 3.341 1.00 0.00 H new ATOM 0 HH12 ARG A 27 12.990 -13.152 3.680 1.00 0.00 H new ATOM 0 HH21 ARG A 27 13.263 -12.625 7.145 1.00 0.00 H new ATOM 0 HH22 ARG A 27 13.464 -13.775 5.818 1.00 0.00 H new ATOM 123 N ARG A 28 11.417 -4.221 4.862 1.00 0.00 N ATOM 124 CA ARG A 28 10.722 -3.181 5.562 1.00 0.00 C ATOM 125 C ARG A 28 9.433 -3.681 6.173 1.00 0.00 C ATOM 126 O ARG A 28 9.038 -4.836 5.994 1.00 0.00 O ATOM 127 CB ARG A 28 10.423 -2.016 4.628 1.00 0.00 C ATOM 128 CG ARG A 28 11.610 -1.507 3.783 1.00 0.00 C ATOM 129 CD ARG A 28 12.788 -1.041 4.624 1.00 0.00 C ATOM 130 NE ARG A 28 12.837 0.417 4.984 1.00 0.00 N ATOM 131 CZ ARG A 28 11.969 1.125 5.757 1.00 0.00 C ATOM 132 NH1 ARG A 28 10.654 1.003 5.620 1.00 0.00 N ATOM 133 NH2 ARG A 28 12.426 2.134 6.473 1.00 0.00 N ATOM 0 H ARG A 28 11.214 -4.262 3.863 1.00 0.00 H new ATOM 0 HA ARG A 28 11.374 -2.844 6.368 1.00 0.00 H new ATOM 0 HB2 ARG A 28 9.622 -2.314 3.951 1.00 0.00 H new ATOM 0 HB3 ARG A 28 10.044 -1.186 5.224 1.00 0.00 H new ATOM 0 HG2 ARG A 28 11.941 -2.303 3.116 1.00 0.00 H new ATOM 0 HG3 ARG A 28 11.273 -0.683 3.154 1.00 0.00 H new ATOM 0 HD2 ARG A 28 12.793 -1.618 5.549 1.00 0.00 H new ATOM 0 HD3 ARG A 28 13.705 -1.288 4.089 1.00 0.00 H new ATOM 0 HE ARG A 28 13.621 0.944 4.600 1.00 0.00 H new ATOM 0 HH11 ARG A 28 10.271 0.366 4.922 1.00 0.00 H new ATOM 0 HH12 ARG A 28 10.027 1.546 6.213 1.00 0.00 H new ATOM 0 HH21 ARG A 28 13.417 2.374 6.442 1.00 0.00 H new ATOM 0 HH22 ARG A 28 11.788 2.675 7.057 1.00 0.00 H new ATOM 147 N ASN A 29 8.786 -2.795 6.878 1.00 0.00 N ATOM 148 CA ASN A 29 7.549 -3.081 7.569 1.00 0.00 C ATOM 149 C ASN A 29 6.340 -2.978 6.642 1.00 0.00 C ATOM 150 O ASN A 29 5.303 -3.582 6.909 1.00 0.00 O ATOM 151 CB ASN A 29 7.405 -2.154 8.789 1.00 0.00 C ATOM 152 CG ASN A 29 7.483 -0.676 8.435 1.00 0.00 C ATOM 153 OD1 ASN A 29 8.577 -0.111 8.341 1.00 0.00 O ATOM 154 ND2 ASN A 29 6.359 -0.033 8.284 1.00 0.00 N ATOM 0 H ASN A 29 9.106 -1.833 6.994 1.00 0.00 H new ATOM 0 HA ASN A 29 7.584 -4.113 7.917 1.00 0.00 H new ATOM 0 HB2 ASN A 29 6.451 -2.354 9.278 1.00 0.00 H new ATOM 0 HB3 ASN A 29 8.188 -2.390 9.510 1.00 0.00 H new ATOM 0 HD21 ASN A 29 6.367 0.967 8.082 1.00 0.00 H new ATOM 0 HD22 ASN A 29 5.472 -0.530 8.368 1.00 0.00 H new ATOM 161 N THR A 30 6.464 -2.214 5.570 1.00 0.00 N ATOM 162 CA THR A 30 5.396 -2.086 4.596 1.00 0.00 C ATOM 163 C THR A 30 5.919 -2.255 3.170 1.00 0.00 C ATOM 164 O THR A 30 5.195 -2.036 2.202 1.00 0.00 O ATOM 165 CB THR A 30 4.666 -0.724 4.744 1.00 0.00 C ATOM 166 OG1 THR A 30 5.613 0.322 5.026 1.00 0.00 O ATOM 167 CG2 THR A 30 3.612 -0.770 5.836 1.00 0.00 C ATOM 0 H THR A 30 7.299 -1.670 5.352 1.00 0.00 H new ATOM 0 HA THR A 30 4.681 -2.885 4.792 1.00 0.00 H new ATOM 0 HB THR A 30 4.165 -0.516 3.799 1.00 0.00 H new ATOM 0 HG1 THR A 30 6.488 0.080 4.657 1.00 0.00 H new ATOM 0 HG21 THR A 30 3.122 0.201 5.910 1.00 0.00 H new ATOM 0 HG22 THR A 30 2.871 -1.532 5.595 1.00 0.00 H new ATOM 0 HG23 THR A 30 4.085 -1.012 6.788 1.00 0.00 H new ATOM 175 N GLU A 31 7.166 -2.690 3.045 1.00 0.00 N ATOM 176 CA GLU A 31 7.784 -2.826 1.750 1.00 0.00 C ATOM 177 C GLU A 31 8.489 -4.165 1.648 1.00 0.00 C ATOM 178 O GLU A 31 8.805 -4.785 2.662 1.00 0.00 O ATOM 179 CB GLU A 31 8.789 -1.690 1.448 1.00 0.00 C ATOM 180 CG GLU A 31 8.280 -0.272 1.675 1.00 0.00 C ATOM 181 CD GLU A 31 8.557 0.255 3.073 1.00 0.00 C ATOM 182 OE1 GLU A 31 7.938 -0.199 4.056 1.00 0.00 O ATOM 183 OE2 GLU A 31 9.410 1.121 3.213 1.00 0.00 O ATOM 0 H GLU A 31 7.762 -2.953 3.830 1.00 0.00 H new ATOM 0 HA GLU A 31 6.986 -2.763 1.010 1.00 0.00 H new ATOM 0 HB2 GLU A 31 9.674 -1.841 2.066 1.00 0.00 H new ATOM 0 HB3 GLU A 31 9.107 -1.779 0.409 1.00 0.00 H new ATOM 0 HG2 GLU A 31 8.744 0.393 0.946 1.00 0.00 H new ATOM 0 HG3 GLU A 31 7.206 -0.246 1.492 1.00 0.00 H new ATOM 190 N ILE A 32 8.711 -4.600 0.432 1.00 0.00 N ATOM 191 CA ILE A 32 9.367 -5.883 0.123 1.00 0.00 C ATOM 192 C ILE A 32 10.376 -5.566 -0.922 1.00 0.00 C ATOM 193 O ILE A 32 10.314 -4.532 -1.538 1.00 0.00 O ATOM 194 CB ILE A 32 8.364 -6.910 -0.503 1.00 0.00 C ATOM 195 CG1 ILE A 32 6.933 -6.695 0.019 1.00 0.00 C ATOM 196 CG2 ILE A 32 8.813 -8.337 -0.189 1.00 0.00 C ATOM 197 CD1 ILE A 32 5.873 -7.462 -0.754 1.00 0.00 C ATOM 0 H ILE A 32 8.442 -4.074 -0.400 1.00 0.00 H new ATOM 0 HA ILE A 32 9.781 -6.319 1.032 1.00 0.00 H new ATOM 0 HB ILE A 32 8.359 -6.752 -1.582 1.00 0.00 H new ATOM 0 HG12 ILE A 32 6.891 -6.992 1.067 1.00 0.00 H new ATOM 0 HG13 ILE A 32 6.699 -5.631 -0.020 1.00 0.00 H new ATOM 0 HG21 ILE A 32 8.110 -9.045 -0.628 1.00 0.00 H new ATOM 0 HG22 ILE A 32 9.806 -8.506 -0.606 1.00 0.00 H new ATOM 0 HG23 ILE A 32 8.844 -8.479 0.891 1.00 0.00 H new ATOM 0 HD11 ILE A 32 4.892 -7.258 -0.326 1.00 0.00 H new ATOM 0 HD12 ILE A 32 5.886 -7.148 -1.798 1.00 0.00 H new ATOM 0 HD13 ILE A 32 6.081 -8.530 -0.694 1.00 0.00 H new ATOM 209 N LEU A 33 11.277 -6.430 -1.116 1.00 0.00 N ATOM 210 CA LEU A 33 12.295 -6.248 -2.086 1.00 0.00 C ATOM 211 C LEU A 33 11.822 -6.712 -3.447 1.00 0.00 C ATOM 212 O LEU A 33 10.882 -7.499 -3.553 1.00 0.00 O ATOM 213 CB LEU A 33 13.503 -7.067 -1.704 1.00 0.00 C ATOM 214 CG LEU A 33 14.467 -6.556 -0.652 1.00 0.00 C ATOM 215 CD1 LEU A 33 15.135 -5.253 -1.028 1.00 0.00 C ATOM 216 CD2 LEU A 33 13.893 -6.507 0.713 1.00 0.00 C ATOM 0 H LEU A 33 11.341 -7.308 -0.601 1.00 0.00 H new ATOM 0 HA LEU A 33 12.544 -5.188 -2.127 1.00 0.00 H new ATOM 0 HB2 LEU A 33 13.142 -8.039 -1.367 1.00 0.00 H new ATOM 0 HB3 LEU A 33 14.078 -7.239 -2.614 1.00 0.00 H new ATOM 0 HG LEU A 33 15.253 -7.310 -0.623 1.00 0.00 H new ATOM 0 HD11 LEU A 33 15.811 -4.947 -0.230 1.00 0.00 H new ATOM 0 HD12 LEU A 33 15.700 -5.387 -1.950 1.00 0.00 H new ATOM 0 HD13 LEU A 33 14.376 -4.484 -1.176 1.00 0.00 H new ATOM 0 HD21 LEU A 33 14.642 -6.131 1.410 1.00 0.00 H new ATOM 0 HD22 LEU A 33 13.027 -5.845 0.720 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.587 -7.509 1.015 1.00 0.00 H new ATOM 228 N THR A 34 12.435 -6.188 -4.471 1.00 0.00 N ATOM 229 CA THR A 34 12.239 -6.686 -5.806 1.00 0.00 C ATOM 230 C THR A 34 13.595 -6.916 -6.459 1.00 0.00 C ATOM 231 O THR A 34 14.243 -5.984 -6.939 1.00 0.00 O ATOM 232 CB THR A 34 11.295 -5.799 -6.687 1.00 0.00 C ATOM 233 OG1 THR A 34 11.632 -4.391 -6.600 1.00 0.00 O ATOM 234 CG2 THR A 34 9.842 -5.994 -6.298 1.00 0.00 C ATOM 0 H THR A 34 13.084 -5.404 -4.405 1.00 0.00 H new ATOM 0 HA THR A 34 11.710 -7.636 -5.727 1.00 0.00 H new ATOM 0 HB THR A 34 11.439 -6.123 -7.718 1.00 0.00 H new ATOM 0 HG1 THR A 34 12.257 -4.249 -5.858 1.00 0.00 H new ATOM 0 HG21 THR A 34 9.210 -5.366 -6.926 1.00 0.00 H new ATOM 0 HG22 THR A 34 9.566 -7.039 -6.435 1.00 0.00 H new ATOM 0 HG23 THR A 34 9.705 -5.717 -5.253 1.00 0.00 H new ATOM 242 N GLY A 35 14.047 -8.141 -6.382 1.00 0.00 N ATOM 243 CA GLY A 35 15.336 -8.530 -6.898 1.00 0.00 C ATOM 244 C GLY A 35 15.692 -9.894 -6.369 1.00 0.00 C ATOM 245 O GLY A 35 14.797 -10.691 -6.109 1.00 0.00 O ATOM 0 H GLY A 35 13.525 -8.906 -5.954 1.00 0.00 H new ATOM 0 HA2 GLY A 35 15.315 -8.544 -7.988 1.00 0.00 H new ATOM 0 HA3 GLY A 35 16.093 -7.804 -6.603 1.00 0.00 H new ATOM 249 N SER A 36 16.956 -10.168 -6.191 1.00 0.00 N ATOM 250 CA SER A 36 17.379 -11.445 -5.654 1.00 0.00 C ATOM 251 C SER A 36 18.378 -11.215 -4.523 1.00 0.00 C ATOM 252 O SER A 36 19.449 -10.623 -4.733 1.00 0.00 O ATOM 253 CB SER A 36 17.985 -12.308 -6.761 1.00 0.00 C ATOM 254 OG SER A 36 17.062 -12.462 -7.848 1.00 0.00 O ATOM 0 H SER A 36 17.718 -9.526 -6.409 1.00 0.00 H new ATOM 0 HA SER A 36 16.517 -11.977 -5.252 1.00 0.00 H new ATOM 0 HB2 SER A 36 18.906 -11.851 -7.122 1.00 0.00 H new ATOM 0 HB3 SER A 36 18.250 -13.287 -6.361 1.00 0.00 H new ATOM 0 HG SER A 36 17.469 -13.016 -8.547 1.00 0.00 H new ATOM 260 N TRP A 37 18.026 -11.639 -3.326 1.00 0.00 N ATOM 261 CA TRP A 37 18.862 -11.389 -2.178 1.00 0.00 C ATOM 262 C TRP A 37 19.017 -12.645 -1.336 1.00 0.00 C ATOM 263 O TRP A 37 18.119 -13.003 -0.584 1.00 0.00 O ATOM 264 CB TRP A 37 18.251 -10.303 -1.289 1.00 0.00 C ATOM 265 CG TRP A 37 17.830 -9.051 -1.978 1.00 0.00 C ATOM 266 CD1 TRP A 37 16.561 -8.708 -2.258 1.00 0.00 C ATOM 267 CD2 TRP A 37 18.657 -7.986 -2.484 1.00 0.00 C ATOM 268 NE1 TRP A 37 16.523 -7.490 -2.859 1.00 0.00 N ATOM 269 CE2 TRP A 37 17.791 -7.024 -3.028 1.00 0.00 C ATOM 270 CE3 TRP A 37 20.028 -7.744 -2.518 1.00 0.00 C ATOM 271 CZ2 TRP A 37 18.245 -5.841 -3.605 1.00 0.00 C ATOM 272 CZ3 TRP A 37 20.481 -6.568 -3.096 1.00 0.00 C ATOM 273 CH2 TRP A 37 19.592 -5.632 -3.630 1.00 0.00 C ATOM 0 H TRP A 37 17.170 -12.156 -3.127 1.00 0.00 H new ATOM 0 HA TRP A 37 19.834 -11.067 -2.553 1.00 0.00 H new ATOM 0 HB2 TRP A 37 17.383 -10.724 -0.781 1.00 0.00 H new ATOM 0 HB3 TRP A 37 18.976 -10.043 -0.518 1.00 0.00 H new ATOM 0 HD1 TRP A 37 15.695 -9.314 -2.037 1.00 0.00 H new ATOM 0 HE1 TRP A 37 15.674 -7.000 -3.141 1.00 0.00 H new ATOM 0 HE3 TRP A 37 20.724 -8.458 -2.103 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 17.557 -5.117 -4.017 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 21.542 -6.372 -3.134 1.00 0.00 H new ATOM 0 HH2 TRP A 37 19.979 -4.725 -4.071 1.00 0.00 H new ATOM 284 N SER A 38 20.116 -13.310 -1.469 1.00 0.00 N ATOM 285 CA SER A 38 20.407 -14.465 -0.653 1.00 0.00 C ATOM 286 C SER A 38 21.911 -14.484 -0.454 1.00 0.00 C ATOM 287 O SER A 38 22.546 -15.538 -0.333 1.00 0.00 O ATOM 288 CB SER A 38 19.907 -15.741 -1.368 1.00 0.00 C ATOM 289 OG SER A 38 19.941 -16.895 -0.516 1.00 0.00 O ATOM 0 H SER A 38 20.845 -13.077 -2.144 1.00 0.00 H new ATOM 0 HA SER A 38 19.904 -14.424 0.313 1.00 0.00 H new ATOM 0 HB2 SER A 38 18.887 -15.582 -1.719 1.00 0.00 H new ATOM 0 HB3 SER A 38 20.522 -15.925 -2.249 1.00 0.00 H new ATOM 0 HG SER A 38 20.823 -16.964 -0.094 1.00 0.00 H new ATOM 295 N ASP A 39 22.467 -13.299 -0.360 1.00 0.00 N ATOM 296 CA ASP A 39 23.899 -13.139 -0.268 1.00 0.00 C ATOM 297 C ASP A 39 24.210 -12.268 0.924 1.00 0.00 C ATOM 298 O ASP A 39 23.366 -12.099 1.798 1.00 0.00 O ATOM 299 CB ASP A 39 24.431 -12.504 -1.563 1.00 0.00 C ATOM 300 CG ASP A 39 25.896 -12.795 -1.848 1.00 0.00 C ATOM 301 OD1 ASP A 39 26.797 -12.195 -1.206 1.00 0.00 O ATOM 302 OD2 ASP A 39 26.169 -13.623 -2.736 1.00 0.00 O ATOM 0 H ASP A 39 21.943 -12.424 -0.345 1.00 0.00 H new ATOM 0 HA ASP A 39 24.383 -14.107 -0.140 1.00 0.00 H new ATOM 0 HB2 ASP A 39 23.832 -12.861 -2.401 1.00 0.00 H new ATOM 0 HB3 ASP A 39 24.291 -11.424 -1.508 1.00 0.00 H new ATOM 307 N GLN A 40 25.390 -11.761 0.975 1.00 0.00 N ATOM 308 CA GLN A 40 25.799 -10.871 2.002 1.00 0.00 C ATOM 309 C GLN A 40 26.412 -9.636 1.384 1.00 0.00 C ATOM 310 O GLN A 40 26.014 -8.532 1.681 1.00 0.00 O ATOM 311 CB GLN A 40 26.809 -11.528 2.958 1.00 0.00 C ATOM 312 CG GLN A 40 26.275 -12.721 3.741 1.00 0.00 C ATOM 313 CD GLN A 40 27.300 -13.278 4.707 1.00 0.00 C ATOM 314 OE1 GLN A 40 28.090 -14.164 4.368 1.00 0.00 O ATOM 315 NE2 GLN A 40 27.306 -12.771 5.909 1.00 0.00 N ATOM 0 H GLN A 40 26.116 -11.959 0.286 1.00 0.00 H new ATOM 0 HA GLN A 40 24.918 -10.601 2.584 1.00 0.00 H new ATOM 0 HB2 GLN A 40 27.676 -11.850 2.381 1.00 0.00 H new ATOM 0 HB3 GLN A 40 27.159 -10.776 3.665 1.00 0.00 H new ATOM 0 HG2 GLN A 40 25.384 -12.422 4.293 1.00 0.00 H new ATOM 0 HG3 GLN A 40 25.971 -13.503 3.045 1.00 0.00 H new ATOM 0 HE21 GLN A 40 26.640 -12.040 6.157 1.00 0.00 H new ATOM 0 HE22 GLN A 40 27.977 -13.106 6.600 1.00 0.00 H new ATOM 324 N THR A 41 27.322 -9.820 0.468 1.00 0.00 N ATOM 325 CA THR A 41 28.081 -8.706 -0.009 1.00 0.00 C ATOM 326 C THR A 41 27.518 -8.084 -1.289 1.00 0.00 C ATOM 327 O THR A 41 27.241 -8.766 -2.280 1.00 0.00 O ATOM 328 CB THR A 41 29.580 -9.057 -0.156 1.00 0.00 C ATOM 329 OG1 THR A 41 29.747 -10.172 -1.042 1.00 0.00 O ATOM 330 CG2 THR A 41 30.175 -9.412 1.200 1.00 0.00 C ATOM 0 H THR A 41 27.552 -10.719 0.044 1.00 0.00 H new ATOM 0 HA THR A 41 27.990 -7.937 0.758 1.00 0.00 H new ATOM 0 HB THR A 41 30.093 -8.186 -0.564 1.00 0.00 H new ATOM 0 HG1 THR A 41 30.700 -10.382 -1.127 1.00 0.00 H new ATOM 0 HG21 THR A 41 31.230 -9.657 1.081 1.00 0.00 H new ATOM 0 HG22 THR A 41 30.073 -8.563 1.876 1.00 0.00 H new ATOM 0 HG23 THR A 41 29.648 -10.271 1.615 1.00 0.00 H new ATOM 338 N TYR A 42 27.312 -6.797 -1.233 1.00 0.00 N ATOM 339 CA TYR A 42 26.865 -6.016 -2.353 1.00 0.00 C ATOM 340 C TYR A 42 27.679 -4.752 -2.453 1.00 0.00 C ATOM 341 O TYR A 42 27.963 -4.121 -1.436 1.00 0.00 O ATOM 342 CB TYR A 42 25.356 -5.723 -2.299 1.00 0.00 C ATOM 343 CG TYR A 42 24.523 -6.846 -2.870 1.00 0.00 C ATOM 344 CD1 TYR A 42 24.244 -6.878 -4.227 1.00 0.00 C ATOM 345 CD2 TYR A 42 24.046 -7.883 -2.078 1.00 0.00 C ATOM 346 CE1 TYR A 42 23.512 -7.896 -4.784 1.00 0.00 C ATOM 347 CE2 TYR A 42 23.314 -8.918 -2.632 1.00 0.00 C ATOM 348 CZ TYR A 42 23.050 -8.915 -3.989 1.00 0.00 C ATOM 349 OH TYR A 42 22.332 -9.944 -4.560 1.00 0.00 O ATOM 0 H TYR A 42 27.454 -6.248 -0.385 1.00 0.00 H new ATOM 0 HA TYR A 42 27.022 -6.603 -3.258 1.00 0.00 H new ATOM 0 HB2 TYR A 42 25.061 -5.547 -1.264 1.00 0.00 H new ATOM 0 HB3 TYR A 42 25.148 -4.806 -2.850 1.00 0.00 H new ATOM 0 HD1 TYR A 42 24.611 -6.084 -4.860 1.00 0.00 H new ATOM 0 HD2 TYR A 42 24.249 -7.881 -1.017 1.00 0.00 H new ATOM 0 HE1 TYR A 42 23.300 -7.896 -5.843 1.00 0.00 H new ATOM 0 HE2 TYR A 42 22.952 -9.722 -2.009 1.00 0.00 H new ATOM 0 HH TYR A 42 21.375 -9.799 -4.408 1.00 0.00 H new ATOM 359 N PRO A 43 28.087 -4.378 -3.671 1.00 0.00 N ATOM 360 CA PRO A 43 28.930 -3.206 -3.899 1.00 0.00 C ATOM 361 C PRO A 43 28.222 -1.912 -3.532 1.00 0.00 C ATOM 362 O PRO A 43 26.963 -1.832 -3.574 1.00 0.00 O ATOM 363 CB PRO A 43 29.218 -3.248 -5.404 1.00 0.00 C ATOM 364 CG PRO A 43 28.107 -4.047 -5.980 1.00 0.00 C ATOM 365 CD PRO A 43 27.743 -5.057 -4.931 1.00 0.00 C ATOM 0 HA PRO A 43 29.830 -3.229 -3.284 1.00 0.00 H new ATOM 0 HB2 PRO A 43 29.246 -2.245 -5.830 1.00 0.00 H new ATOM 0 HB3 PRO A 43 30.184 -3.708 -5.609 1.00 0.00 H new ATOM 0 HG2 PRO A 43 27.255 -3.413 -6.224 1.00 0.00 H new ATOM 0 HG3 PRO A 43 28.415 -4.536 -6.904 1.00 0.00 H new ATOM 0 HD2 PRO A 43 26.685 -5.316 -4.972 1.00 0.00 H new ATOM 0 HD3 PRO A 43 28.303 -5.984 -5.054 1.00 0.00 H new ATOM 373 N GLU A 44 29.001 -0.906 -3.184 1.00 0.00 N ATOM 374 CA GLU A 44 28.451 0.364 -2.809 1.00 0.00 C ATOM 375 C GLU A 44 27.812 0.987 -4.040 1.00 0.00 C ATOM 376 O GLU A 44 28.342 0.866 -5.151 1.00 0.00 O ATOM 377 CB GLU A 44 29.521 1.310 -2.258 1.00 0.00 C ATOM 378 CG GLU A 44 28.915 2.503 -1.555 1.00 0.00 C ATOM 379 CD GLU A 44 29.860 3.633 -1.262 1.00 0.00 C ATOM 380 OE1 GLU A 44 30.227 4.370 -2.193 1.00 0.00 O ATOM 381 OE2 GLU A 44 30.185 3.851 -0.087 1.00 0.00 O ATOM 0 H GLU A 44 30.020 -0.953 -3.156 1.00 0.00 H new ATOM 0 HA GLU A 44 27.716 0.206 -2.020 1.00 0.00 H new ATOM 0 HB2 GLU A 44 30.162 0.767 -1.563 1.00 0.00 H new ATOM 0 HB3 GLU A 44 30.156 1.654 -3.075 1.00 0.00 H new ATOM 0 HG2 GLU A 44 28.098 2.886 -2.166 1.00 0.00 H new ATOM 0 HG3 GLU A 44 28.479 2.165 -0.615 1.00 0.00 H new ATOM 388 N GLY A 45 26.681 1.605 -3.856 1.00 0.00 N ATOM 389 CA GLY A 45 25.997 2.208 -4.954 1.00 0.00 C ATOM 390 C GLY A 45 24.865 1.343 -5.430 1.00 0.00 C ATOM 391 O GLY A 45 24.176 1.690 -6.376 1.00 0.00 O ATOM 0 H GLY A 45 26.216 1.703 -2.954 1.00 0.00 H new ATOM 0 HA2 GLY A 45 25.612 3.183 -4.655 1.00 0.00 H new ATOM 0 HA3 GLY A 45 26.697 2.379 -5.772 1.00 0.00 H new ATOM 395 N THR A 46 24.656 0.229 -4.760 1.00 0.00 N ATOM 396 CA THR A 46 23.598 -0.687 -5.139 1.00 0.00 C ATOM 397 C THR A 46 22.269 -0.295 -4.548 1.00 0.00 C ATOM 398 O THR A 46 22.106 -0.293 -3.338 1.00 0.00 O ATOM 399 CB THR A 46 23.954 -2.153 -4.806 1.00 0.00 C ATOM 400 OG1 THR A 46 25.170 -2.520 -5.467 1.00 0.00 O ATOM 401 CG2 THR A 46 22.838 -3.124 -5.188 1.00 0.00 C ATOM 0 H THR A 46 25.203 -0.065 -3.951 1.00 0.00 H new ATOM 0 HA THR A 46 23.501 -0.616 -6.222 1.00 0.00 H new ATOM 0 HB THR A 46 24.084 -2.219 -3.726 1.00 0.00 H new ATOM 0 HG1 THR A 46 25.931 -2.111 -5.004 1.00 0.00 H new ATOM 0 HG21 THR A 46 23.137 -4.141 -4.934 1.00 0.00 H new ATOM 0 HG22 THR A 46 21.929 -2.866 -4.644 1.00 0.00 H new ATOM 0 HG23 THR A 46 22.650 -3.059 -6.260 1.00 0.00 H new ATOM 409 N GLN A 47 21.339 0.059 -5.409 1.00 0.00 N ATOM 410 CA GLN A 47 20.042 0.465 -4.985 1.00 0.00 C ATOM 411 C GLN A 47 19.162 -0.741 -4.738 1.00 0.00 C ATOM 412 O GLN A 47 19.213 -1.727 -5.466 1.00 0.00 O ATOM 413 CB GLN A 47 19.413 1.425 -6.001 1.00 0.00 C ATOM 414 CG GLN A 47 19.109 0.810 -7.360 1.00 0.00 C ATOM 415 CD GLN A 47 18.727 1.840 -8.399 1.00 0.00 C ATOM 416 OE1 GLN A 47 18.140 2.923 -7.970 1.00 0.00 O flip ATOM 417 NE2 GLN A 47 18.968 1.652 -9.591 1.00 0.00 N flip ATOM 0 H GLN A 47 21.474 0.069 -6.420 1.00 0.00 H new ATOM 0 HA GLN A 47 20.138 1.004 -4.042 1.00 0.00 H new ATOM 0 HB2 GLN A 47 18.487 1.820 -5.582 1.00 0.00 H new ATOM 0 HB3 GLN A 47 20.085 2.272 -6.143 1.00 0.00 H new ATOM 0 HG2 GLN A 47 19.982 0.258 -7.707 1.00 0.00 H new ATOM 0 HG3 GLN A 47 18.298 0.090 -7.254 1.00 0.00 H new ATOM 0 HE21 GLN A 47 19.429 0.792 -9.889 1.00 0.00 H new ATOM 0 HE22 GLN A 47 18.707 2.356 -10.281 1.00 0.00 H new ATOM 426 N ALA A 48 18.398 -0.667 -3.707 1.00 0.00 N ATOM 427 CA ALA A 48 17.478 -1.695 -3.365 1.00 0.00 C ATOM 428 C ALA A 48 16.109 -1.190 -3.675 1.00 0.00 C ATOM 429 O ALA A 48 15.615 -0.252 -3.030 1.00 0.00 O ATOM 430 CB ALA A 48 17.596 -2.073 -1.904 1.00 0.00 C ATOM 0 H ALA A 48 18.394 0.125 -3.064 1.00 0.00 H new ATOM 0 HA ALA A 48 17.692 -2.597 -3.939 1.00 0.00 H new ATOM 0 HB1 ALA A 48 16.880 -2.861 -1.673 1.00 0.00 H new ATOM 0 HB2 ALA A 48 18.606 -2.429 -1.701 1.00 0.00 H new ATOM 0 HB3 ALA A 48 17.388 -1.201 -1.285 1.00 0.00 H new ATOM 436 N ILE A 49 15.535 -1.738 -4.695 1.00 0.00 N ATOM 437 CA ILE A 49 14.243 -1.331 -5.140 1.00 0.00 C ATOM 438 C ILE A 49 13.177 -2.112 -4.402 1.00 0.00 C ATOM 439 O ILE A 49 13.099 -3.357 -4.505 1.00 0.00 O ATOM 440 CB ILE A 49 14.105 -1.518 -6.663 1.00 0.00 C ATOM 441 CG1 ILE A 49 15.240 -0.756 -7.366 1.00 0.00 C ATOM 442 CG2 ILE A 49 12.745 -1.012 -7.138 1.00 0.00 C ATOM 443 CD1 ILE A 49 15.278 -0.922 -8.870 1.00 0.00 C ATOM 0 H ILE A 49 15.953 -2.487 -5.247 1.00 0.00 H new ATOM 0 HA ILE A 49 14.114 -0.271 -4.923 1.00 0.00 H new ATOM 0 HB ILE A 49 14.175 -2.578 -6.909 1.00 0.00 H new ATOM 0 HG12 ILE A 49 15.145 0.305 -7.134 1.00 0.00 H new ATOM 0 HG13 ILE A 49 16.192 -1.089 -6.953 1.00 0.00 H new ATOM 0 HG21 ILE A 49 12.662 -1.150 -8.216 1.00 0.00 H new ATOM 0 HG22 ILE A 49 11.954 -1.571 -6.638 1.00 0.00 H new ATOM 0 HG23 ILE A 49 12.647 0.047 -6.900 1.00 0.00 H new ATOM 0 HD11 ILE A 49 16.111 -0.349 -9.278 1.00 0.00 H new ATOM 0 HD12 ILE A 49 15.407 -1.976 -9.117 1.00 0.00 H new ATOM 0 HD13 ILE A 49 14.344 -0.561 -9.300 1.00 0.00 H new ATOM 455 N TYR A 50 12.393 -1.404 -3.638 1.00 0.00 N ATOM 456 CA TYR A 50 11.349 -1.999 -2.867 1.00 0.00 C ATOM 457 C TYR A 50 10.014 -1.938 -3.565 1.00 0.00 C ATOM 458 O TYR A 50 9.744 -1.041 -4.371 1.00 0.00 O ATOM 459 CB TYR A 50 11.246 -1.357 -1.486 1.00 0.00 C ATOM 460 CG TYR A 50 12.387 -1.693 -0.571 1.00 0.00 C ATOM 461 CD1 TYR A 50 12.336 -2.819 0.226 1.00 0.00 C ATOM 462 CD2 TYR A 50 13.513 -0.901 -0.510 1.00 0.00 C ATOM 463 CE1 TYR A 50 13.370 -3.142 1.063 1.00 0.00 C ATOM 464 CE2 TYR A 50 14.553 -1.219 0.323 1.00 0.00 C ATOM 465 CZ TYR A 50 14.479 -2.340 1.106 1.00 0.00 C ATOM 466 OH TYR A 50 15.519 -2.657 1.937 1.00 0.00 O ATOM 0 H TYR A 50 12.465 -0.392 -3.535 1.00 0.00 H new ATOM 0 HA TYR A 50 11.614 -3.050 -2.749 1.00 0.00 H new ATOM 0 HB2 TYR A 50 11.194 -0.275 -1.603 1.00 0.00 H new ATOM 0 HB3 TYR A 50 10.313 -1.673 -1.018 1.00 0.00 H new ATOM 0 HD1 TYR A 50 11.465 -3.456 0.189 1.00 0.00 H new ATOM 0 HD2 TYR A 50 13.576 -0.017 -1.128 1.00 0.00 H new ATOM 0 HE1 TYR A 50 13.311 -4.023 1.685 1.00 0.00 H new ATOM 0 HE2 TYR A 50 15.428 -0.588 0.362 1.00 0.00 H new ATOM 0 HH TYR A 50 15.896 -1.836 2.317 1.00 0.00 H new ATOM 476 N LYS A 51 9.224 -2.924 -3.290 1.00 0.00 N ATOM 477 CA LYS A 51 7.869 -3.009 -3.720 1.00 0.00 C ATOM 478 C LYS A 51 7.030 -2.452 -2.641 1.00 0.00 C ATOM 479 O LYS A 51 7.195 -2.819 -1.464 1.00 0.00 O ATOM 480 CB LYS A 51 7.441 -4.463 -3.971 1.00 0.00 C ATOM 481 CG LYS A 51 5.934 -4.642 -4.172 1.00 0.00 C ATOM 482 CD LYS A 51 5.592 -6.017 -4.703 1.00 0.00 C ATOM 483 CE LYS A 51 4.097 -6.170 -4.915 1.00 0.00 C ATOM 484 NZ LYS A 51 3.753 -7.488 -5.471 1.00 0.00 N ATOM 0 H LYS A 51 9.520 -3.727 -2.735 1.00 0.00 H new ATOM 0 HA LYS A 51 7.757 -2.461 -4.656 1.00 0.00 H new ATOM 0 HB2 LYS A 51 7.962 -4.837 -4.852 1.00 0.00 H new ATOM 0 HB3 LYS A 51 7.760 -5.076 -3.128 1.00 0.00 H new ATOM 0 HG2 LYS A 51 5.420 -4.481 -3.224 1.00 0.00 H new ATOM 0 HG3 LYS A 51 5.568 -3.884 -4.865 1.00 0.00 H new ATOM 0 HD2 LYS A 51 6.114 -6.186 -5.645 1.00 0.00 H new ATOM 0 HD3 LYS A 51 5.942 -6.777 -4.004 1.00 0.00 H new ATOM 0 HE2 LYS A 51 3.580 -6.030 -3.966 1.00 0.00 H new ATOM 0 HE3 LYS A 51 3.744 -5.389 -5.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 2.723 -7.552 -5.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 4.226 -7.612 -6.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 4.067 -8.233 -4.817 1.00 0.00 H new ATOM 498 N CYS A 52 6.164 -1.593 -2.998 1.00 0.00 N ATOM 499 CA CYS A 52 5.269 -1.058 -2.069 1.00 0.00 C ATOM 500 C CYS A 52 4.092 -2.029 -2.047 1.00 0.00 C ATOM 501 O CYS A 52 3.351 -2.132 -3.037 1.00 0.00 O ATOM 502 CB CYS A 52 4.858 0.340 -2.510 1.00 0.00 C ATOM 503 SG CYS A 52 4.199 1.398 -1.195 1.00 0.00 S ATOM 0 H CYS A 52 6.058 -1.241 -3.949 1.00 0.00 H new ATOM 0 HA CYS A 52 5.694 -0.951 -1.071 1.00 0.00 H new ATOM 0 HB2 CYS A 52 5.723 0.833 -2.953 1.00 0.00 H new ATOM 0 HB3 CYS A 52 4.106 0.250 -3.294 1.00 0.00 H new ATOM 508 N ARG A 53 4.073 -2.858 -0.988 1.00 0.00 N ATOM 509 CA ARG A 53 3.047 -3.908 -0.714 1.00 0.00 C ATOM 510 C ARG A 53 1.642 -3.537 -1.204 1.00 0.00 C ATOM 511 O ARG A 53 1.233 -2.376 -1.132 1.00 0.00 O ATOM 512 CB ARG A 53 2.966 -4.227 0.793 1.00 0.00 C ATOM 513 CG ARG A 53 4.202 -4.875 1.375 1.00 0.00 C ATOM 514 CD ARG A 53 4.015 -5.195 2.847 1.00 0.00 C ATOM 515 NE ARG A 53 5.233 -5.760 3.455 1.00 0.00 N ATOM 516 CZ ARG A 53 5.309 -6.244 4.704 1.00 0.00 C ATOM 517 NH1 ARG A 53 4.213 -6.307 5.467 1.00 0.00 N ATOM 518 NH2 ARG A 53 6.477 -6.679 5.178 1.00 0.00 N ATOM 0 H ARG A 53 4.793 -2.823 -0.267 1.00 0.00 H new ATOM 0 HA ARG A 53 3.380 -4.781 -1.275 1.00 0.00 H new ATOM 0 HB2 ARG A 53 2.769 -3.302 1.335 1.00 0.00 H new ATOM 0 HB3 ARG A 53 2.114 -4.885 0.965 1.00 0.00 H new ATOM 0 HG2 ARG A 53 4.428 -5.790 0.827 1.00 0.00 H new ATOM 0 HG3 ARG A 53 5.057 -4.210 1.251 1.00 0.00 H new ATOM 0 HD2 ARG A 53 3.732 -4.288 3.381 1.00 0.00 H new ATOM 0 HD3 ARG A 53 3.193 -5.902 2.962 1.00 0.00 H new ATOM 0 HE ARG A 53 6.079 -5.785 2.885 1.00 0.00 H new ATOM 0 HH11 ARG A 53 3.317 -5.987 5.100 1.00 0.00 H new ATOM 0 HH12 ARG A 53 4.273 -6.675 6.416 1.00 0.00 H new ATOM 0 HH21 ARG A 53 7.311 -6.643 4.591 1.00 0.00 H new ATOM 0 HH22 ARG A 53 6.537 -7.047 6.127 1.00 0.00 H new ATOM 532 N PRO A 54 0.884 -4.539 -1.688 1.00 0.00 N ATOM 533 CA PRO A 54 -0.458 -4.343 -2.230 1.00 0.00 C ATOM 534 C PRO A 54 -1.404 -3.670 -1.228 1.00 0.00 C ATOM 535 O PRO A 54 -1.773 -4.242 -0.188 1.00 0.00 O ATOM 536 CB PRO A 54 -0.928 -5.761 -2.574 1.00 0.00 C ATOM 537 CG PRO A 54 -0.053 -6.651 -1.782 1.00 0.00 C ATOM 538 CD PRO A 54 1.266 -5.956 -1.716 1.00 0.00 C ATOM 0 HA PRO A 54 -0.453 -3.675 -3.091 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -1.977 -5.904 -2.314 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -0.834 -5.961 -3.641 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -0.460 -6.816 -0.784 1.00 0.00 H new ATOM 0 HG3 PRO A 54 0.042 -7.629 -2.253 1.00 0.00 H new ATOM 0 HD2 PRO A 54 1.830 -6.241 -0.828 1.00 0.00 H new ATOM 0 HD3 PRO A 54 1.890 -6.190 -2.578 1.00 0.00 H new ATOM 546 N GLY A 55 -1.750 -2.465 -1.547 1.00 0.00 N ATOM 547 CA GLY A 55 -2.596 -1.649 -0.731 1.00 0.00 C ATOM 548 C GLY A 55 -1.955 -0.306 -0.540 1.00 0.00 C ATOM 549 O GLY A 55 -2.612 0.698 -0.213 1.00 0.00 O ATOM 0 H GLY A 55 -1.445 -2.007 -2.406 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -3.573 -1.535 -1.200 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -2.760 -2.127 0.235 1.00 0.00 H new ATOM 553 N TYR A 56 -0.672 -0.281 -0.765 1.00 0.00 N ATOM 554 CA TYR A 56 0.107 0.898 -0.625 1.00 0.00 C ATOM 555 C TYR A 56 0.598 1.360 -1.983 1.00 0.00 C ATOM 556 O TYR A 56 0.502 0.629 -2.984 1.00 0.00 O ATOM 557 CB TYR A 56 1.294 0.641 0.307 1.00 0.00 C ATOM 558 CG TYR A 56 0.907 0.169 1.684 1.00 0.00 C ATOM 559 CD1 TYR A 56 0.587 1.073 2.684 1.00 0.00 C ATOM 560 CD2 TYR A 56 0.852 -1.185 1.980 1.00 0.00 C ATOM 561 CE1 TYR A 56 0.223 0.639 3.940 1.00 0.00 C ATOM 562 CE2 TYR A 56 0.488 -1.625 3.227 1.00 0.00 C ATOM 563 CZ TYR A 56 0.174 -0.711 4.203 1.00 0.00 C ATOM 564 OH TYR A 56 -0.194 -1.152 5.455 1.00 0.00 O ATOM 0 H TYR A 56 -0.136 -1.099 -1.056 1.00 0.00 H new ATOM 0 HA TYR A 56 -0.514 1.681 -0.190 1.00 0.00 H new ATOM 0 HB2 TYR A 56 1.946 -0.103 -0.150 1.00 0.00 H new ATOM 0 HB3 TYR A 56 1.874 1.559 0.400 1.00 0.00 H new ATOM 0 HD1 TYR A 56 0.623 2.132 2.476 1.00 0.00 H new ATOM 0 HD2 TYR A 56 1.100 -1.906 1.215 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -0.022 1.353 4.712 1.00 0.00 H new ATOM 0 HE2 TYR A 56 0.449 -2.683 3.440 1.00 0.00 H new ATOM 0 HH TYR A 56 -0.179 -2.132 5.474 1.00 0.00 H new ATOM 574 N ARG A 57 1.086 2.562 -2.018 1.00 0.00 N ATOM 575 CA ARG A 57 1.629 3.158 -3.197 1.00 0.00 C ATOM 576 C ARG A 57 2.611 4.237 -2.794 1.00 0.00 C ATOM 577 O ARG A 57 2.656 4.656 -1.624 1.00 0.00 O ATOM 578 CB ARG A 57 0.535 3.809 -4.049 1.00 0.00 C ATOM 579 CG ARG A 57 -0.224 4.897 -3.312 1.00 0.00 C ATOM 580 CD ARG A 57 -0.991 5.790 -4.257 1.00 0.00 C ATOM 581 NE ARG A 57 -1.960 5.077 -5.084 1.00 0.00 N ATOM 582 CZ ARG A 57 -2.956 5.667 -5.752 1.00 0.00 C ATOM 583 NH1 ARG A 57 -3.138 6.986 -5.647 1.00 0.00 N ATOM 584 NH2 ARG A 57 -3.772 4.937 -6.499 1.00 0.00 N ATOM 0 H ARG A 57 1.118 3.173 -1.202 1.00 0.00 H new ATOM 0 HA ARG A 57 2.114 2.374 -3.779 1.00 0.00 H new ATOM 0 HB2 ARG A 57 0.986 4.233 -4.947 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -0.167 3.042 -4.376 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -0.915 4.441 -2.603 1.00 0.00 H new ATOM 0 HG3 ARG A 57 0.476 5.499 -2.732 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -1.512 6.553 -3.679 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -0.285 6.309 -4.906 1.00 0.00 H new ATOM 0 HE ARG A 57 -1.871 4.063 -5.157 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -2.517 7.541 -5.058 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -3.898 7.438 -6.156 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -3.639 3.928 -6.563 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -4.533 5.384 -7.010 1.00 0.00 H new ATOM 598 N SER A 58 3.362 4.676 -3.757 1.00 0.00 N ATOM 599 CA SER A 58 4.283 5.755 -3.642 1.00 0.00 C ATOM 600 C SER A 58 4.816 5.987 -5.017 1.00 0.00 C ATOM 601 O SER A 58 5.278 5.053 -5.673 1.00 0.00 O ATOM 602 CB SER A 58 5.421 5.432 -2.677 1.00 0.00 C ATOM 603 OG SER A 58 6.326 6.517 -2.543 1.00 0.00 O ATOM 0 H SER A 58 3.345 4.267 -4.691 1.00 0.00 H new ATOM 0 HA SER A 58 3.788 6.639 -3.240 1.00 0.00 H new ATOM 0 HB2 SER A 58 5.008 5.181 -1.700 1.00 0.00 H new ATOM 0 HB3 SER A 58 5.959 4.553 -3.031 1.00 0.00 H new ATOM 0 HG SER A 58 6.235 6.910 -1.650 1.00 0.00 H new ATOM 609 N LEU A 59 4.718 7.187 -5.469 1.00 0.00 N ATOM 610 CA LEU A 59 5.146 7.536 -6.793 1.00 0.00 C ATOM 611 C LEU A 59 6.662 7.691 -6.846 1.00 0.00 C ATOM 612 O LEU A 59 7.195 8.798 -6.796 1.00 0.00 O ATOM 613 CB LEU A 59 4.436 8.805 -7.262 1.00 0.00 C ATOM 614 CG LEU A 59 2.926 8.713 -7.656 1.00 0.00 C ATOM 615 CD1 LEU A 59 2.690 7.685 -8.742 1.00 0.00 C ATOM 616 CD2 LEU A 59 2.016 8.448 -6.459 1.00 0.00 C ATOM 0 H LEU A 59 4.337 7.966 -4.932 1.00 0.00 H new ATOM 0 HA LEU A 59 4.875 6.729 -7.474 1.00 0.00 H new ATOM 0 HB2 LEU A 59 4.527 9.548 -6.470 1.00 0.00 H new ATOM 0 HB3 LEU A 59 4.981 9.190 -8.124 1.00 0.00 H new ATOM 0 HG LEU A 59 2.661 9.694 -8.050 1.00 0.00 H new ATOM 0 HD11 LEU A 59 1.628 7.652 -8.987 1.00 0.00 H new ATOM 0 HD12 LEU A 59 3.259 7.957 -9.631 1.00 0.00 H new ATOM 0 HD13 LEU A 59 3.012 6.705 -8.391 1.00 0.00 H new ATOM 0 HD21 LEU A 59 0.980 8.394 -6.794 1.00 0.00 H new ATOM 0 HD22 LEU A 59 2.295 7.504 -5.992 1.00 0.00 H new ATOM 0 HD23 LEU A 59 2.122 9.256 -5.736 1.00 0.00 H new ATOM 628 N GLY A 60 7.331 6.571 -6.879 1.00 0.00 N ATOM 629 CA GLY A 60 8.761 6.524 -6.920 1.00 0.00 C ATOM 630 C GLY A 60 9.253 5.288 -6.222 1.00 0.00 C ATOM 631 O GLY A 60 10.281 4.728 -6.593 1.00 0.00 O ATOM 0 H GLY A 60 6.888 5.652 -6.878 1.00 0.00 H new ATOM 0 HA2 GLY A 60 9.104 6.529 -7.955 1.00 0.00 H new ATOM 0 HA3 GLY A 60 9.176 7.411 -6.442 1.00 0.00 H new ATOM 635 N ASN A 61 8.471 4.846 -5.227 1.00 0.00 N ATOM 636 CA ASN A 61 8.771 3.663 -4.390 1.00 0.00 C ATOM 637 C ASN A 61 9.924 3.890 -3.448 1.00 0.00 C ATOM 638 O ASN A 61 10.749 4.779 -3.645 1.00 0.00 O ATOM 639 CB ASN A 61 8.998 2.358 -5.189 1.00 0.00 C ATOM 640 CG ASN A 61 7.725 1.696 -5.674 1.00 0.00 C ATOM 641 OD1 ASN A 61 6.730 2.347 -5.984 1.00 0.00 O ATOM 642 ND2 ASN A 61 7.734 0.389 -5.723 1.00 0.00 N ATOM 0 H ASN A 61 7.596 5.304 -4.972 1.00 0.00 H new ATOM 0 HA ASN A 61 7.862 3.527 -3.805 1.00 0.00 H new ATOM 0 HB2 ASN A 61 9.630 2.578 -6.049 1.00 0.00 H new ATOM 0 HB3 ASN A 61 9.545 1.653 -4.563 1.00 0.00 H new ATOM 0 HD21 ASN A 61 6.901 -0.116 -6.025 1.00 0.00 H new ATOM 0 HD22 ASN A 61 8.575 -0.125 -5.460 1.00 0.00 H new ATOM 649 N VAL A 62 9.968 3.097 -2.410 1.00 0.00 N ATOM 650 CA VAL A 62 11.033 3.175 -1.449 1.00 0.00 C ATOM 651 C VAL A 62 12.286 2.605 -2.075 1.00 0.00 C ATOM 652 O VAL A 62 12.355 1.418 -2.394 1.00 0.00 O ATOM 653 CB VAL A 62 10.680 2.410 -0.150 1.00 0.00 C ATOM 654 CG1 VAL A 62 11.816 2.479 0.866 1.00 0.00 C ATOM 655 CG2 VAL A 62 9.402 2.970 0.441 1.00 0.00 C ATOM 0 H VAL A 62 9.269 2.382 -2.209 1.00 0.00 H new ATOM 0 HA VAL A 62 11.192 4.218 -1.174 1.00 0.00 H new ATOM 0 HB VAL A 62 10.531 1.360 -0.401 1.00 0.00 H new ATOM 0 HG11 VAL A 62 11.534 1.932 1.765 1.00 0.00 H new ATOM 0 HG12 VAL A 62 12.715 2.035 0.438 1.00 0.00 H new ATOM 0 HG13 VAL A 62 12.013 3.520 1.122 1.00 0.00 H new ATOM 0 HG21 VAL A 62 9.156 2.429 1.355 1.00 0.00 H new ATOM 0 HG22 VAL A 62 9.540 4.027 0.670 1.00 0.00 H new ATOM 0 HG23 VAL A 62 8.589 2.857 -0.277 1.00 0.00 H new ATOM 665 N ILE A 63 13.226 3.458 -2.329 1.00 0.00 N ATOM 666 CA ILE A 63 14.452 3.052 -2.927 1.00 0.00 C ATOM 667 C ILE A 63 15.568 3.288 -1.946 1.00 0.00 C ATOM 668 O ILE A 63 15.769 4.421 -1.463 1.00 0.00 O ATOM 669 CB ILE A 63 14.739 3.833 -4.249 1.00 0.00 C ATOM 670 CG1 ILE A 63 13.558 3.692 -5.234 1.00 0.00 C ATOM 671 CG2 ILE A 63 16.040 3.345 -4.902 1.00 0.00 C ATOM 672 CD1 ILE A 63 13.252 2.268 -5.639 1.00 0.00 C ATOM 0 H ILE A 63 13.163 4.456 -2.127 1.00 0.00 H new ATOM 0 HA ILE A 63 14.380 1.994 -3.181 1.00 0.00 H new ATOM 0 HB ILE A 63 14.856 4.887 -3.998 1.00 0.00 H new ATOM 0 HG12 ILE A 63 12.668 4.128 -4.780 1.00 0.00 H new ATOM 0 HG13 ILE A 63 13.776 4.273 -6.130 1.00 0.00 H new ATOM 0 HG21 ILE A 63 16.218 3.904 -5.821 1.00 0.00 H new ATOM 0 HG22 ILE A 63 16.872 3.501 -4.216 1.00 0.00 H new ATOM 0 HG23 ILE A 63 15.955 2.283 -5.134 1.00 0.00 H new ATOM 0 HD11 ILE A 63 12.410 2.260 -6.331 1.00 0.00 H new ATOM 0 HD12 ILE A 63 14.125 1.832 -6.124 1.00 0.00 H new ATOM 0 HD13 ILE A 63 13.000 1.684 -4.754 1.00 0.00 H new ATOM 684 N MET A 64 16.262 2.251 -1.615 1.00 0.00 N ATOM 685 CA MET A 64 17.408 2.362 -0.740 1.00 0.00 C ATOM 686 C MET A 64 18.634 2.125 -1.548 1.00 0.00 C ATOM 687 O MET A 64 18.532 1.835 -2.726 1.00 0.00 O ATOM 688 CB MET A 64 17.354 1.381 0.430 1.00 0.00 C ATOM 689 CG MET A 64 16.245 1.659 1.421 1.00 0.00 C ATOM 690 SD MET A 64 16.232 0.485 2.794 1.00 0.00 S ATOM 691 CE MET A 64 17.780 0.909 3.605 1.00 0.00 C ATOM 0 H MET A 64 16.063 1.303 -1.935 1.00 0.00 H new ATOM 0 HA MET A 64 17.412 3.361 -0.305 1.00 0.00 H new ATOM 0 HB2 MET A 64 17.231 0.371 0.038 1.00 0.00 H new ATOM 0 HB3 MET A 64 18.309 1.405 0.954 1.00 0.00 H new ATOM 0 HG2 MET A 64 16.358 2.670 1.813 1.00 0.00 H new ATOM 0 HG3 MET A 64 15.285 1.622 0.906 1.00 0.00 H new ATOM 0 HE1 MET A 64 18.345 -0.001 3.810 1.00 0.00 H new ATOM 0 HE2 MET A 64 18.364 1.561 2.955 1.00 0.00 H new ATOM 0 HE3 MET A 64 17.570 1.424 4.542 1.00 0.00 H new ATOM 701 N VAL A 65 19.771 2.250 -0.955 1.00 0.00 N ATOM 702 CA VAL A 65 21.005 2.014 -1.661 1.00 0.00 C ATOM 703 C VAL A 65 22.142 1.738 -0.681 1.00 0.00 C ATOM 704 O VAL A 65 22.170 2.270 0.425 1.00 0.00 O ATOM 705 CB VAL A 65 21.358 3.194 -2.646 1.00 0.00 C ATOM 706 CG1 VAL A 65 21.691 4.433 -1.927 1.00 0.00 C ATOM 707 CG2 VAL A 65 22.483 2.870 -3.584 1.00 0.00 C ATOM 0 H VAL A 65 19.883 2.516 0.023 1.00 0.00 H new ATOM 0 HA VAL A 65 20.868 1.126 -2.278 1.00 0.00 H new ATOM 0 HB VAL A 65 20.452 3.341 -3.234 1.00 0.00 H new ATOM 0 HG11 VAL A 65 21.927 5.218 -2.645 1.00 0.00 H new ATOM 0 HG12 VAL A 65 20.840 4.741 -1.319 1.00 0.00 H new ATOM 0 HG13 VAL A 65 22.553 4.259 -1.283 1.00 0.00 H new ATOM 0 HG21 VAL A 65 22.673 3.725 -4.233 1.00 0.00 H new ATOM 0 HG22 VAL A 65 23.381 2.643 -3.010 1.00 0.00 H new ATOM 0 HG23 VAL A 65 22.213 2.006 -4.192 1.00 0.00 H new ATOM 717 N CYS A 66 22.994 0.849 -1.072 1.00 0.00 N ATOM 718 CA CYS A 66 24.174 0.484 -0.340 1.00 0.00 C ATOM 719 C CYS A 66 25.155 1.637 -0.384 1.00 0.00 C ATOM 720 O CYS A 66 25.525 2.089 -1.473 1.00 0.00 O ATOM 721 CB CYS A 66 24.797 -0.740 -1.010 1.00 0.00 C ATOM 722 SG CYS A 66 26.321 -1.344 -0.243 1.00 0.00 S ATOM 0 H CYS A 66 22.888 0.333 -1.945 1.00 0.00 H new ATOM 0 HA CYS A 66 23.926 0.256 0.697 1.00 0.00 H new ATOM 0 HB2 CYS A 66 24.064 -1.547 -1.010 1.00 0.00 H new ATOM 0 HB3 CYS A 66 25.005 -0.498 -2.052 1.00 0.00 H new ATOM 727 N ARG A 67 25.543 2.135 0.762 1.00 0.00 N ATOM 728 CA ARG A 67 26.478 3.214 0.838 1.00 0.00 C ATOM 729 C ARG A 67 27.248 3.160 2.145 1.00 0.00 C ATOM 730 O ARG A 67 26.659 3.242 3.223 1.00 0.00 O ATOM 731 CB ARG A 67 25.760 4.553 0.640 1.00 0.00 C ATOM 732 CG ARG A 67 26.652 5.779 0.695 1.00 0.00 C ATOM 733 CD ARG A 67 25.906 7.014 0.200 1.00 0.00 C ATOM 734 NE ARG A 67 25.643 6.952 -1.255 1.00 0.00 N ATOM 735 CZ ARG A 67 24.556 7.456 -1.878 1.00 0.00 C ATOM 736 NH1 ARG A 67 23.533 7.932 -1.168 1.00 0.00 N ATOM 737 NH2 ARG A 67 24.484 7.451 -3.214 1.00 0.00 N ATOM 0 H ARG A 67 25.215 1.799 1.668 1.00 0.00 H new ATOM 0 HA ARG A 67 27.207 3.115 0.034 1.00 0.00 H new ATOM 0 HB2 ARG A 67 25.253 4.536 -0.325 1.00 0.00 H new ATOM 0 HB3 ARG A 67 24.989 4.650 1.404 1.00 0.00 H new ATOM 0 HG2 ARG A 67 26.993 5.940 1.717 1.00 0.00 H new ATOM 0 HG3 ARG A 67 27.540 5.616 0.084 1.00 0.00 H new ATOM 0 HD2 ARG A 67 24.962 7.107 0.736 1.00 0.00 H new ATOM 0 HD3 ARG A 67 26.490 7.906 0.426 1.00 0.00 H new ATOM 0 HE ARG A 67 26.342 6.489 -1.836 1.00 0.00 H new ATOM 0 HH11 ARG A 67 23.569 7.917 -0.149 1.00 0.00 H new ATOM 0 HH12 ARG A 67 22.715 8.311 -1.644 1.00 0.00 H new ATOM 0 HH21 ARG A 67 25.251 7.066 -3.765 1.00 0.00 H new ATOM 0 HH22 ARG A 67 23.662 7.832 -3.682 1.00 0.00 H new ATOM 751 N LYS A 68 28.569 2.991 2.030 1.00 0.00 N ATOM 752 CA LYS A 68 29.510 2.921 3.171 1.00 0.00 C ATOM 753 C LYS A 68 29.346 1.669 3.986 1.00 0.00 C ATOM 754 O LYS A 68 29.733 1.610 5.156 1.00 0.00 O ATOM 755 CB LYS A 68 29.418 4.160 4.037 1.00 0.00 C ATOM 756 CG LYS A 68 29.794 5.426 3.279 1.00 0.00 C ATOM 757 CD LYS A 68 31.250 5.381 2.809 1.00 0.00 C ATOM 758 CE LYS A 68 31.563 6.482 1.817 1.00 0.00 C ATOM 759 NZ LYS A 68 30.695 6.392 0.618 1.00 0.00 N ATOM 0 H LYS A 68 29.031 2.896 1.126 1.00 0.00 H new ATOM 0 HA LYS A 68 30.512 2.881 2.744 1.00 0.00 H new ATOM 0 HB2 LYS A 68 28.402 4.257 4.421 1.00 0.00 H new ATOM 0 HB3 LYS A 68 30.075 4.047 4.899 1.00 0.00 H new ATOM 0 HG2 LYS A 68 29.136 5.546 2.419 1.00 0.00 H new ATOM 0 HG3 LYS A 68 29.643 6.295 3.920 1.00 0.00 H new ATOM 0 HD2 LYS A 68 31.912 5.471 3.671 1.00 0.00 H new ATOM 0 HD3 LYS A 68 31.453 4.413 2.351 1.00 0.00 H new ATOM 0 HE2 LYS A 68 31.428 7.453 2.294 1.00 0.00 H new ATOM 0 HE3 LYS A 68 32.609 6.417 1.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 31.238 6.668 -0.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 30.356 5.415 0.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 29.881 7.030 0.730 1.00 0.00 H new ATOM 773 N GLY A 69 28.838 0.658 3.359 1.00 0.00 N ATOM 774 CA GLY A 69 28.683 -0.603 4.000 1.00 0.00 C ATOM 775 C GLY A 69 27.318 -0.779 4.565 1.00 0.00 C ATOM 776 O GLY A 69 26.938 -1.892 4.943 1.00 0.00 O ATOM 0 H GLY A 69 28.520 0.685 2.390 1.00 0.00 H new ATOM 0 HA2 GLY A 69 28.884 -1.400 3.284 1.00 0.00 H new ATOM 0 HA3 GLY A 69 29.420 -0.697 4.798 1.00 0.00 H new ATOM 780 N GLU A 70 26.569 0.292 4.633 1.00 0.00 N ATOM 781 CA GLU A 70 25.243 0.208 5.166 1.00 0.00 C ATOM 782 C GLU A 70 24.223 0.571 4.112 1.00 0.00 C ATOM 783 O GLU A 70 24.530 1.282 3.153 1.00 0.00 O ATOM 784 CB GLU A 70 25.105 1.087 6.410 1.00 0.00 C ATOM 785 CG GLU A 70 25.435 2.540 6.179 1.00 0.00 C ATOM 786 CD GLU A 70 25.402 3.345 7.438 1.00 0.00 C ATOM 787 OE1 GLU A 70 24.315 3.827 7.818 1.00 0.00 O ATOM 788 OE2 GLU A 70 26.473 3.545 8.053 1.00 0.00 O ATOM 0 H GLU A 70 26.855 1.222 4.328 1.00 0.00 H new ATOM 0 HA GLU A 70 25.053 -0.822 5.468 1.00 0.00 H new ATOM 0 HB2 GLU A 70 24.083 1.013 6.782 1.00 0.00 H new ATOM 0 HB3 GLU A 70 25.758 0.697 7.191 1.00 0.00 H new ATOM 0 HG2 GLU A 70 26.425 2.617 5.729 1.00 0.00 H new ATOM 0 HG3 GLU A 70 24.727 2.960 5.465 1.00 0.00 H new ATOM 795 N TRP A 71 23.040 0.062 4.261 1.00 0.00 N ATOM 796 CA TRP A 71 21.975 0.377 3.351 1.00 0.00 C ATOM 797 C TRP A 71 21.279 1.618 3.826 1.00 0.00 C ATOM 798 O TRP A 71 20.739 1.662 4.927 1.00 0.00 O ATOM 799 CB TRP A 71 21.007 -0.800 3.187 1.00 0.00 C ATOM 800 CG TRP A 71 21.612 -1.986 2.489 1.00 0.00 C ATOM 801 CD1 TRP A 71 22.335 -2.998 3.049 1.00 0.00 C ATOM 802 CD2 TRP A 71 21.537 -2.277 1.087 1.00 0.00 C ATOM 803 NE1 TRP A 71 22.714 -3.893 2.079 1.00 0.00 N ATOM 804 CE2 TRP A 71 22.239 -3.474 0.868 1.00 0.00 C ATOM 805 CE3 TRP A 71 20.944 -1.641 0.001 1.00 0.00 C ATOM 806 CZ2 TRP A 71 22.365 -4.044 -0.404 1.00 0.00 C ATOM 807 CZ3 TRP A 71 21.069 -2.207 -1.248 1.00 0.00 C ATOM 808 CH2 TRP A 71 21.772 -3.394 -1.441 1.00 0.00 C ATOM 0 H TRP A 71 22.783 -0.580 5.011 1.00 0.00 H new ATOM 0 HA TRP A 71 22.390 0.565 2.361 1.00 0.00 H new ATOM 0 HB2 TRP A 71 20.655 -1.109 4.171 1.00 0.00 H new ATOM 0 HB3 TRP A 71 20.134 -0.466 2.626 1.00 0.00 H new ATOM 0 HD1 TRP A 71 22.574 -3.083 4.099 1.00 0.00 H new ATOM 0 HE1 TRP A 71 23.264 -4.738 2.237 1.00 0.00 H new ATOM 0 HE3 TRP A 71 20.396 -0.720 0.135 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 22.911 -4.963 -0.556 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 20.612 -1.720 -2.097 1.00 0.00 H new ATOM 0 HH2 TRP A 71 21.848 -3.807 -2.436 1.00 0.00 H new ATOM 819 N VAL A 72 21.322 2.624 3.016 1.00 0.00 N ATOM 820 CA VAL A 72 20.784 3.915 3.348 1.00 0.00 C ATOM 821 C VAL A 72 19.656 4.255 2.405 1.00 0.00 C ATOM 822 O VAL A 72 19.397 3.511 1.458 1.00 0.00 O ATOM 823 CB VAL A 72 21.869 5.022 3.286 1.00 0.00 C ATOM 824 CG1 VAL A 72 22.977 4.751 4.281 1.00 0.00 C ATOM 825 CG2 VAL A 72 22.438 5.166 1.884 1.00 0.00 C ATOM 0 H VAL A 72 21.738 2.578 2.086 1.00 0.00 H new ATOM 0 HA VAL A 72 20.411 3.868 4.371 1.00 0.00 H new ATOM 0 HB VAL A 72 21.389 5.964 3.552 1.00 0.00 H new ATOM 0 HG11 VAL A 72 23.725 5.542 4.217 1.00 0.00 H new ATOM 0 HG12 VAL A 72 22.562 4.724 5.289 1.00 0.00 H new ATOM 0 HG13 VAL A 72 23.443 3.792 4.054 1.00 0.00 H new ATOM 0 HG21 VAL A 72 23.195 5.950 1.877 1.00 0.00 H new ATOM 0 HG22 VAL A 72 22.890 4.223 1.576 1.00 0.00 H new ATOM 0 HG23 VAL A 72 21.638 5.428 1.192 1.00 0.00 H new ATOM 835 N ALA A 73 19.002 5.352 2.642 1.00 0.00 N ATOM 836 CA ALA A 73 17.899 5.755 1.821 1.00 0.00 C ATOM 837 C ALA A 73 18.370 6.572 0.626 1.00 0.00 C ATOM 838 O ALA A 73 19.065 7.584 0.780 1.00 0.00 O ATOM 839 CB ALA A 73 16.886 6.542 2.636 1.00 0.00 C ATOM 0 H ALA A 73 19.216 5.991 3.407 1.00 0.00 H new ATOM 0 HA ALA A 73 17.418 4.853 1.443 1.00 0.00 H new ATOM 0 HB1 ALA A 73 16.056 6.839 1.995 1.00 0.00 H new ATOM 0 HB2 ALA A 73 16.512 5.921 3.450 1.00 0.00 H new ATOM 0 HB3 ALA A 73 17.363 7.431 3.048 1.00 0.00 H new ATOM 845 N LEU A 74 18.039 6.094 -0.556 1.00 0.00 N ATOM 846 CA LEU A 74 18.267 6.821 -1.784 1.00 0.00 C ATOM 847 C LEU A 74 17.179 7.872 -1.845 1.00 0.00 C ATOM 848 O LEU A 74 17.450 9.075 -1.905 1.00 0.00 O ATOM 849 CB LEU A 74 18.117 5.855 -2.976 1.00 0.00 C ATOM 850 CG LEU A 74 18.553 6.315 -4.392 1.00 0.00 C ATOM 851 CD1 LEU A 74 17.864 7.575 -4.899 1.00 0.00 C ATOM 852 CD2 LEU A 74 20.055 6.396 -4.519 1.00 0.00 C ATOM 0 H LEU A 74 17.601 5.183 -0.690 1.00 0.00 H new ATOM 0 HA LEU A 74 19.261 7.266 -1.821 1.00 0.00 H new ATOM 0 HB2 LEU A 74 18.680 4.953 -2.738 1.00 0.00 H new ATOM 0 HB3 LEU A 74 17.067 5.569 -3.034 1.00 0.00 H new ATOM 0 HG LEU A 74 18.201 5.528 -5.059 1.00 0.00 H new ATOM 0 HD11 LEU A 74 18.234 7.816 -5.895 1.00 0.00 H new ATOM 0 HD12 LEU A 74 16.788 7.409 -4.942 1.00 0.00 H new ATOM 0 HD13 LEU A 74 18.076 8.403 -4.223 1.00 0.00 H new ATOM 0 HD21 LEU A 74 20.318 6.722 -5.525 1.00 0.00 H new ATOM 0 HD22 LEU A 74 20.444 7.110 -3.793 1.00 0.00 H new ATOM 0 HD23 LEU A 74 20.490 5.414 -4.330 1.00 0.00 H new ATOM 864 N ASN A 75 15.946 7.389 -1.798 1.00 0.00 N ATOM 865 CA ASN A 75 14.768 8.223 -1.828 1.00 0.00 C ATOM 866 C ASN A 75 14.112 8.212 -0.455 1.00 0.00 C ATOM 867 O ASN A 75 13.314 7.331 -0.159 1.00 0.00 O ATOM 868 CB ASN A 75 13.738 7.745 -2.885 1.00 0.00 C ATOM 869 CG ASN A 75 14.105 8.029 -4.342 1.00 0.00 C ATOM 870 OD1 ASN A 75 14.641 9.184 -4.617 1.00 0.00 O flip ATOM 871 ND2 ASN A 75 13.807 7.235 -5.228 1.00 0.00 N flip ATOM 0 H ASN A 75 15.740 6.392 -1.737 1.00 0.00 H new ATOM 0 HA ASN A 75 15.083 9.230 -2.101 1.00 0.00 H new ATOM 0 HB2 ASN A 75 13.596 6.671 -2.768 1.00 0.00 H new ATOM 0 HB3 ASN A 75 12.779 8.218 -2.672 1.00 0.00 H new ATOM 0 HD21 ASN A 75 13.388 6.336 -4.988 1.00 0.00 H new ATOM 0 HD22 ASN A 75 13.978 7.473 -6.205 1.00 0.00 H new ATOM 878 N PRO A 76 14.472 9.153 0.421 1.00 0.00 N ATOM 879 CA PRO A 76 13.926 9.213 1.782 1.00 0.00 C ATOM 880 C PRO A 76 12.505 9.785 1.823 1.00 0.00 C ATOM 881 O PRO A 76 11.794 9.639 2.814 1.00 0.00 O ATOM 882 CB PRO A 76 14.898 10.137 2.506 1.00 0.00 C ATOM 883 CG PRO A 76 15.469 11.010 1.440 1.00 0.00 C ATOM 884 CD PRO A 76 15.465 10.209 0.176 1.00 0.00 C ATOM 0 HA PRO A 76 13.839 8.223 2.231 1.00 0.00 H new ATOM 0 HB2 PRO A 76 14.388 10.727 3.268 1.00 0.00 H new ATOM 0 HB3 PRO A 76 15.679 9.570 3.012 1.00 0.00 H new ATOM 0 HG2 PRO A 76 14.876 11.917 1.325 1.00 0.00 H new ATOM 0 HG3 PRO A 76 16.481 11.322 1.697 1.00 0.00 H new ATOM 0 HD2 PRO A 76 15.191 10.822 -0.683 1.00 0.00 H new ATOM 0 HD3 PRO A 76 16.449 9.790 -0.033 1.00 0.00 H new ATOM 892 N LEU A 77 12.099 10.423 0.734 1.00 0.00 N ATOM 893 CA LEU A 77 10.764 11.010 0.627 1.00 0.00 C ATOM 894 C LEU A 77 9.740 9.915 0.409 1.00 0.00 C ATOM 895 O LEU A 77 8.572 10.018 0.831 1.00 0.00 O ATOM 896 CB LEU A 77 10.669 12.023 -0.545 1.00 0.00 C ATOM 897 CG LEU A 77 11.468 13.345 -0.452 1.00 0.00 C ATOM 898 CD1 LEU A 77 11.164 14.092 0.830 1.00 0.00 C ATOM 899 CD2 LEU A 77 12.966 13.135 -0.637 1.00 0.00 C ATOM 0 H LEU A 77 12.678 10.550 -0.096 1.00 0.00 H new ATOM 0 HA LEU A 77 10.566 11.541 1.558 1.00 0.00 H new ATOM 0 HB2 LEU A 77 10.985 11.509 -1.453 1.00 0.00 H new ATOM 0 HB3 LEU A 77 9.618 12.281 -0.675 1.00 0.00 H new ATOM 0 HG LEU A 77 11.136 13.968 -1.282 1.00 0.00 H new ATOM 0 HD11 LEU A 77 11.743 15.015 0.860 1.00 0.00 H new ATOM 0 HD12 LEU A 77 10.101 14.330 0.869 1.00 0.00 H new ATOM 0 HD13 LEU A 77 11.429 13.470 1.685 1.00 0.00 H new ATOM 0 HD21 LEU A 77 13.480 14.093 -0.563 1.00 0.00 H new ATOM 0 HD22 LEU A 77 13.338 12.463 0.137 1.00 0.00 H new ATOM 0 HD23 LEU A 77 13.154 12.698 -1.618 1.00 0.00 H new ATOM 911 N ARG A 78 10.180 8.851 -0.210 1.00 0.00 N ATOM 912 CA ARG A 78 9.305 7.786 -0.558 1.00 0.00 C ATOM 913 C ARG A 78 9.120 6.848 0.589 1.00 0.00 C ATOM 914 O ARG A 78 10.070 6.476 1.284 1.00 0.00 O ATOM 915 CB ARG A 78 9.764 7.059 -1.819 1.00 0.00 C ATOM 916 CG ARG A 78 9.873 7.963 -3.040 1.00 0.00 C ATOM 917 CD ARG A 78 8.573 8.689 -3.299 1.00 0.00 C ATOM 918 NE ARG A 78 8.698 9.719 -4.318 1.00 0.00 N ATOM 919 CZ ARG A 78 7.974 10.838 -4.331 1.00 0.00 C ATOM 920 NH1 ARG A 78 7.052 11.046 -3.384 1.00 0.00 N ATOM 921 NH2 ARG A 78 8.154 11.746 -5.284 1.00 0.00 N ATOM 0 H ARG A 78 11.153 8.708 -0.482 1.00 0.00 H new ATOM 0 HA ARG A 78 8.333 8.222 -0.787 1.00 0.00 H new ATOM 0 HB2 ARG A 78 10.734 6.599 -1.630 1.00 0.00 H new ATOM 0 HB3 ARG A 78 9.065 6.251 -2.037 1.00 0.00 H new ATOM 0 HG2 ARG A 78 10.674 8.687 -2.889 1.00 0.00 H new ATOM 0 HG3 ARG A 78 10.141 7.369 -3.913 1.00 0.00 H new ATOM 0 HD2 ARG A 78 7.815 7.969 -3.607 1.00 0.00 H new ATOM 0 HD3 ARG A 78 8.224 9.142 -2.371 1.00 0.00 H new ATOM 0 HE ARG A 78 9.378 9.577 -5.065 1.00 0.00 H new ATOM 0 HH11 ARG A 78 6.904 10.349 -2.654 1.00 0.00 H new ATOM 0 HH12 ARG A 78 6.497 11.902 -3.392 1.00 0.00 H new ATOM 0 HH21 ARG A 78 8.850 11.589 -6.013 1.00 0.00 H new ATOM 0 HH22 ARG A 78 7.596 12.600 -5.287 1.00 0.00 H new ATOM 935 N LYS A 79 7.898 6.509 0.796 1.00 0.00 N ATOM 936 CA LYS A 79 7.477 5.656 1.847 1.00 0.00 C ATOM 937 C LYS A 79 6.201 5.039 1.373 1.00 0.00 C ATOM 938 O LYS A 79 5.578 5.572 0.442 1.00 0.00 O ATOM 939 CB LYS A 79 7.215 6.481 3.117 1.00 0.00 C ATOM 940 CG LYS A 79 6.058 7.473 2.982 1.00 0.00 C ATOM 941 CD LYS A 79 5.883 8.324 4.222 1.00 0.00 C ATOM 942 CE LYS A 79 7.026 9.297 4.401 1.00 0.00 C ATOM 943 NZ LYS A 79 7.106 10.281 3.288 1.00 0.00 N ATOM 0 H LYS A 79 7.129 6.834 0.210 1.00 0.00 H new ATOM 0 HA LYS A 79 8.230 4.905 2.087 1.00 0.00 H new ATOM 0 HB2 LYS A 79 7.004 5.802 3.943 1.00 0.00 H new ATOM 0 HB3 LYS A 79 8.121 7.028 3.377 1.00 0.00 H new ATOM 0 HG2 LYS A 79 6.235 8.119 2.122 1.00 0.00 H new ATOM 0 HG3 LYS A 79 5.135 6.927 2.786 1.00 0.00 H new ATOM 0 HD2 LYS A 79 4.944 8.874 4.156 1.00 0.00 H new ATOM 0 HD3 LYS A 79 5.814 7.680 5.098 1.00 0.00 H new ATOM 0 HE2 LYS A 79 6.904 9.828 5.345 1.00 0.00 H new ATOM 0 HE3 LYS A 79 7.964 8.745 4.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 7.487 11.180 3.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 7.731 9.912 2.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 6.156 10.440 2.896 1.00 0.00 H new ATOM 957 N CYS A 80 5.807 3.965 1.952 1.00 0.00 N ATOM 958 CA CYS A 80 4.567 3.366 1.569 1.00 0.00 C ATOM 959 C CYS A 80 3.381 4.055 2.195 1.00 0.00 C ATOM 960 O CYS A 80 3.220 4.088 3.415 1.00 0.00 O ATOM 961 CB CYS A 80 4.551 1.855 1.777 1.00 0.00 C ATOM 962 SG CYS A 80 5.358 0.958 0.414 1.00 0.00 S ATOM 0 H CYS A 80 6.316 3.479 2.690 1.00 0.00 H new ATOM 0 HA CYS A 80 4.475 3.516 0.493 1.00 0.00 H new ATOM 0 HB2 CYS A 80 5.053 1.615 2.714 1.00 0.00 H new ATOM 0 HB3 CYS A 80 3.520 1.515 1.872 1.00 0.00 H new ATOM 967 N GLN A 81 2.607 4.682 1.352 1.00 0.00 N ATOM 968 CA GLN A 81 1.387 5.339 1.750 1.00 0.00 C ATOM 969 C GLN A 81 0.252 4.513 1.248 1.00 0.00 C ATOM 970 O GLN A 81 0.409 3.812 0.262 1.00 0.00 O ATOM 971 CB GLN A 81 1.306 6.732 1.129 1.00 0.00 C ATOM 972 CG GLN A 81 2.321 7.715 1.643 1.00 0.00 C ATOM 973 CD GLN A 81 2.094 8.057 3.084 1.00 0.00 C ATOM 974 OE1 GLN A 81 1.377 9.002 3.403 1.00 0.00 O ATOM 975 NE2 GLN A 81 2.682 7.305 3.959 1.00 0.00 N ATOM 0 H GLN A 81 2.807 4.753 0.354 1.00 0.00 H new ATOM 0 HA GLN A 81 1.353 5.443 2.835 1.00 0.00 H new ATOM 0 HB2 GLN A 81 1.425 6.640 0.049 1.00 0.00 H new ATOM 0 HB3 GLN A 81 0.309 7.135 1.306 1.00 0.00 H new ATOM 0 HG2 GLN A 81 3.321 7.299 1.523 1.00 0.00 H new ATOM 0 HG3 GLN A 81 2.280 8.625 1.044 1.00 0.00 H new ATOM 0 HE21 GLN A 81 3.270 6.530 3.653 1.00 0.00 H new ATOM 0 HE22 GLN A 81 2.558 7.488 4.955 1.00 0.00 H new ATOM 984 N LYS A 82 -0.875 4.573 1.890 1.00 0.00 N ATOM 985 CA LYS A 82 -2.008 3.808 1.427 1.00 0.00 C ATOM 986 C LYS A 82 -2.580 4.441 0.210 1.00 0.00 C ATOM 987 O LYS A 82 -2.564 5.679 0.067 1.00 0.00 O ATOM 988 CB LYS A 82 -3.121 3.700 2.443 1.00 0.00 C ATOM 989 CG LYS A 82 -2.834 2.887 3.668 1.00 0.00 C ATOM 990 CD LYS A 82 -4.126 2.709 4.408 1.00 0.00 C ATOM 991 CE LYS A 82 -4.002 1.861 5.637 1.00 0.00 C ATOM 992 NZ LYS A 82 -5.336 1.624 6.214 1.00 0.00 N ATOM 0 H LYS A 82 -1.041 5.134 2.726 1.00 0.00 H new ATOM 0 HA LYS A 82 -1.627 2.806 1.229 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -3.393 4.707 2.759 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -3.994 3.274 1.948 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -2.413 1.919 3.395 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -2.099 3.389 4.297 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -4.511 3.689 4.690 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -4.859 2.259 3.739 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -3.529 0.911 5.389 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -3.362 2.355 6.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -5.240 1.093 7.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -5.799 2.536 6.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -5.912 1.076 5.544 1.00 0.00 H new ATOM 1006 N ARG A 83 -3.080 3.636 -0.665 1.00 0.00 N ATOM 1007 CA ARG A 83 -3.720 4.159 -1.816 1.00 0.00 C ATOM 1008 C ARG A 83 -5.152 4.514 -1.463 1.00 0.00 C ATOM 1009 O ARG A 83 -5.768 3.862 -0.598 1.00 0.00 O ATOM 1010 CB ARG A 83 -3.737 3.166 -2.975 1.00 0.00 C ATOM 1011 CG ARG A 83 -4.556 1.921 -2.717 1.00 0.00 C ATOM 1012 CD ARG A 83 -4.922 1.247 -4.012 1.00 0.00 C ATOM 1013 NE ARG A 83 -5.734 2.145 -4.860 1.00 0.00 N ATOM 1014 CZ ARG A 83 -5.923 2.018 -6.179 1.00 0.00 C ATOM 1015 NH1 ARG A 83 -5.386 1.004 -6.843 1.00 0.00 N ATOM 1016 NH2 ARG A 83 -6.652 2.917 -6.827 1.00 0.00 N ATOM 0 H ARG A 83 -3.057 2.618 -0.603 1.00 0.00 H new ATOM 0 HA ARG A 83 -3.158 5.037 -2.135 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -4.128 3.666 -3.861 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -2.712 2.872 -3.201 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -3.991 1.232 -2.090 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -5.461 2.182 -2.169 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -4.016 0.957 -4.545 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -5.478 0.332 -3.807 1.00 0.00 H new ATOM 0 HE ARG A 83 -6.191 2.932 -4.399 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -4.823 0.312 -6.349 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -5.536 0.916 -7.848 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -7.065 3.700 -6.320 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -6.799 2.825 -7.832 1.00 0.00 H new ATOM 1030 N PRO A 84 -5.679 5.564 -2.060 1.00 0.00 N ATOM 1031 CA PRO A 84 -7.082 5.862 -1.962 1.00 0.00 C ATOM 1032 C PRO A 84 -7.844 4.858 -2.841 1.00 0.00 C ATOM 1033 O PRO A 84 -7.283 4.311 -3.817 1.00 0.00 O ATOM 1034 CB PRO A 84 -7.197 7.282 -2.525 1.00 0.00 C ATOM 1035 CG PRO A 84 -6.020 7.431 -3.422 1.00 0.00 C ATOM 1036 CD PRO A 84 -4.943 6.562 -2.843 1.00 0.00 C ATOM 0 HA PRO A 84 -7.488 5.796 -0.952 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -8.130 7.417 -3.071 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -7.184 8.026 -1.728 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -6.264 7.124 -4.439 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -5.697 8.471 -3.472 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -4.344 6.094 -3.624 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -4.259 7.136 -2.217 1.00 0.00 H new ATOM 1044 N CYS A 85 -9.066 4.594 -2.517 1.00 0.00 N ATOM 1045 CA CYS A 85 -9.825 3.589 -3.247 1.00 0.00 C ATOM 1046 C CYS A 85 -10.585 4.223 -4.399 1.00 0.00 C ATOM 1047 O CYS A 85 -10.891 3.562 -5.401 1.00 0.00 O ATOM 1048 CB CYS A 85 -10.804 2.933 -2.299 1.00 0.00 C ATOM 1049 SG CYS A 85 -10.097 2.620 -0.668 1.00 0.00 S ATOM 0 H CYS A 85 -9.574 5.048 -1.758 1.00 0.00 H new ATOM 0 HA CYS A 85 -9.137 2.848 -3.653 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -11.682 3.570 -2.193 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -11.144 1.991 -2.729 1.00 0.00 H new ATOM 1054 N GLY A 86 -10.852 5.506 -4.271 1.00 0.00 N ATOM 1055 CA GLY A 86 -11.657 6.203 -5.228 1.00 0.00 C ATOM 1056 C GLY A 86 -12.971 6.579 -4.591 1.00 0.00 C ATOM 1057 O GLY A 86 -12.997 7.322 -3.610 1.00 0.00 O ATOM 0 H GLY A 86 -10.515 6.085 -3.502 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -11.139 7.097 -5.575 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -11.829 5.575 -6.102 1.00 0.00 H new ATOM 1061 N HIS A 87 -14.036 6.033 -5.083 1.00 0.00 N ATOM 1062 CA HIS A 87 -15.351 6.296 -4.547 1.00 0.00 C ATOM 1063 C HIS A 87 -16.128 4.997 -4.708 1.00 0.00 C ATOM 1064 O HIS A 87 -16.091 4.403 -5.774 1.00 0.00 O ATOM 1065 CB HIS A 87 -16.005 7.458 -5.333 1.00 0.00 C ATOM 1066 CG HIS A 87 -17.182 8.144 -4.662 1.00 0.00 C ATOM 1067 ND1 HIS A 87 -17.061 9.362 -4.037 1.00 0.00 N ATOM 1068 CD2 HIS A 87 -18.499 7.816 -4.566 1.00 0.00 C ATOM 1069 CE1 HIS A 87 -18.235 9.755 -3.588 1.00 0.00 C ATOM 1070 NE2 HIS A 87 -19.126 8.844 -3.892 1.00 0.00 N ATOM 0 H HIS A 87 -14.028 5.387 -5.872 1.00 0.00 H new ATOM 0 HA HIS A 87 -15.327 6.599 -3.500 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -15.240 8.208 -5.534 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -16.337 7.075 -6.298 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -18.966 6.919 -4.946 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -18.431 10.675 -3.057 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -20.120 8.887 -3.667 1.00 0.00 H new ATOM 1079 N PRO A 88 -16.808 4.513 -3.661 1.00 0.00 N ATOM 1080 CA PRO A 88 -17.498 3.197 -3.682 1.00 0.00 C ATOM 1081 C PRO A 88 -18.845 3.235 -4.381 1.00 0.00 C ATOM 1082 O PRO A 88 -19.751 2.457 -4.044 1.00 0.00 O ATOM 1083 CB PRO A 88 -17.694 2.911 -2.196 1.00 0.00 C ATOM 1084 CG PRO A 88 -17.861 4.251 -1.580 1.00 0.00 C ATOM 1085 CD PRO A 88 -16.982 5.190 -2.362 1.00 0.00 C ATOM 0 HA PRO A 88 -16.926 2.447 -4.229 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -18.568 2.283 -2.024 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -16.837 2.385 -1.776 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -18.903 4.570 -1.620 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -17.573 4.234 -0.529 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -17.448 6.168 -2.480 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -16.026 5.351 -1.864 1.00 0.00 H new ATOM 1093 N GLY A 89 -18.953 4.040 -5.395 1.00 0.00 N ATOM 1094 CA GLY A 89 -20.202 4.210 -6.041 1.00 0.00 C ATOM 1095 C GLY A 89 -20.971 5.277 -5.345 1.00 0.00 C ATOM 1096 O GLY A 89 -20.732 5.555 -4.158 1.00 0.00 O ATOM 0 H GLY A 89 -18.186 4.586 -5.787 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -20.051 4.477 -7.087 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -20.762 3.275 -6.029 1.00 0.00 H new ATOM 1100 N ASP A 90 -21.858 5.889 -6.025 1.00 0.00 N ATOM 1101 CA ASP A 90 -22.620 6.933 -5.422 1.00 0.00 C ATOM 1102 C ASP A 90 -24.048 6.704 -5.775 1.00 0.00 C ATOM 1103 O ASP A 90 -24.543 7.187 -6.788 1.00 0.00 O ATOM 1104 CB ASP A 90 -22.139 8.306 -5.883 1.00 0.00 C ATOM 1105 CG ASP A 90 -22.526 9.402 -4.932 1.00 0.00 C ATOM 1106 OD1 ASP A 90 -23.606 9.996 -5.083 1.00 0.00 O ATOM 1107 OD2 ASP A 90 -21.703 9.713 -4.018 1.00 0.00 O ATOM 0 H ASP A 90 -22.083 5.694 -7.001 1.00 0.00 H new ATOM 0 HA ASP A 90 -22.496 6.917 -4.339 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -21.054 8.290 -5.991 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -22.554 8.521 -6.868 1.00 0.00 H new ATOM 1112 N THR A 91 -24.668 5.871 -4.996 1.00 0.00 N ATOM 1113 CA THR A 91 -26.013 5.442 -5.230 1.00 0.00 C ATOM 1114 C THR A 91 -26.994 6.583 -4.890 1.00 0.00 C ATOM 1115 O THR A 91 -26.805 7.292 -3.897 1.00 0.00 O ATOM 1116 CB THR A 91 -26.313 4.139 -4.400 1.00 0.00 C ATOM 1117 OG1 THR A 91 -27.615 3.604 -4.693 1.00 0.00 O ATOM 1118 CG2 THR A 91 -26.175 4.384 -2.898 1.00 0.00 C ATOM 0 H THR A 91 -24.244 5.462 -4.163 1.00 0.00 H new ATOM 0 HA THR A 91 -26.144 5.197 -6.284 1.00 0.00 H new ATOM 0 HB THR A 91 -25.567 3.403 -4.701 1.00 0.00 H new ATOM 0 HG1 THR A 91 -28.216 3.774 -3.938 1.00 0.00 H new ATOM 0 HG21 THR A 91 -26.390 3.462 -2.358 1.00 0.00 H new ATOM 0 HG22 THR A 91 -25.159 4.708 -2.674 1.00 0.00 H new ATOM 0 HG23 THR A 91 -26.878 5.157 -2.589 1.00 0.00 H new ATOM 1126 N PRO A 92 -28.015 6.812 -5.737 1.00 0.00 N ATOM 1127 CA PRO A 92 -29.000 7.867 -5.502 1.00 0.00 C ATOM 1128 C PRO A 92 -29.927 7.526 -4.332 1.00 0.00 C ATOM 1129 O PRO A 92 -30.456 8.413 -3.656 1.00 0.00 O ATOM 1130 CB PRO A 92 -29.781 7.946 -6.817 1.00 0.00 C ATOM 1131 CG PRO A 92 -29.593 6.618 -7.466 1.00 0.00 C ATOM 1132 CD PRO A 92 -28.267 6.081 -6.997 1.00 0.00 C ATOM 0 HA PRO A 92 -28.532 8.813 -5.231 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -30.836 8.150 -6.636 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -29.405 8.750 -7.450 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -30.401 5.939 -7.195 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -29.608 6.714 -8.552 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -28.307 5.004 -6.833 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -27.480 6.263 -7.729 1.00 0.00 H new ATOM 1140 N PHE A 93 -30.128 6.250 -4.112 1.00 0.00 N ATOM 1141 CA PHE A 93 -30.917 5.766 -3.006 1.00 0.00 C ATOM 1142 C PHE A 93 -30.062 4.827 -2.229 1.00 0.00 C ATOM 1143 O PHE A 93 -29.533 3.864 -2.789 1.00 0.00 O ATOM 1144 CB PHE A 93 -32.197 5.077 -3.493 1.00 0.00 C ATOM 1145 CG PHE A 93 -33.092 6.006 -4.251 1.00 0.00 C ATOM 1146 CD1 PHE A 93 -32.892 6.218 -5.596 1.00 0.00 C ATOM 1147 CD2 PHE A 93 -34.106 6.693 -3.613 1.00 0.00 C ATOM 1148 CE1 PHE A 93 -33.677 7.085 -6.297 1.00 0.00 C ATOM 1149 CE2 PHE A 93 -34.901 7.572 -4.313 1.00 0.00 C ATOM 1150 CZ PHE A 93 -34.684 7.768 -5.661 1.00 0.00 C ATOM 0 H PHE A 93 -29.745 5.511 -4.701 1.00 0.00 H new ATOM 0 HA PHE A 93 -31.237 6.597 -2.378 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -31.932 4.232 -4.129 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -32.738 4.674 -2.637 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -32.100 5.689 -6.105 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -34.276 6.540 -2.558 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -33.507 7.234 -7.353 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -35.692 8.107 -3.808 1.00 0.00 H new ATOM 0 HZ PHE A 93 -35.305 8.457 -6.215 1.00 0.00 H new ATOM 1160 N GLY A 94 -29.873 5.131 -0.987 1.00 0.00 N ATOM 1161 CA GLY A 94 -28.987 4.375 -0.168 1.00 0.00 C ATOM 1162 C GLY A 94 -27.859 5.257 0.278 1.00 0.00 C ATOM 1163 O GLY A 94 -27.779 6.414 -0.136 1.00 0.00 O ATOM 0 H GLY A 94 -30.329 5.910 -0.513 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -29.520 3.979 0.697 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -28.600 3.520 -0.722 1.00 0.00 H new ATOM 1167 N THR A 95 -27.029 4.778 1.143 1.00 0.00 N ATOM 1168 CA THR A 95 -25.895 5.532 1.632 1.00 0.00 C ATOM 1169 C THR A 95 -24.850 4.510 2.082 1.00 0.00 C ATOM 1170 O THR A 95 -25.143 3.311 2.114 1.00 0.00 O ATOM 1171 CB THR A 95 -26.321 6.406 2.856 1.00 0.00 C ATOM 1172 OG1 THR A 95 -27.617 6.995 2.607 1.00 0.00 O ATOM 1173 CG2 THR A 95 -25.327 7.540 3.101 1.00 0.00 C ATOM 0 H THR A 95 -27.109 3.843 1.542 1.00 0.00 H new ATOM 0 HA THR A 95 -25.504 6.192 0.858 1.00 0.00 H new ATOM 0 HB THR A 95 -26.350 5.756 3.731 1.00 0.00 H new ATOM 0 HG1 THR A 95 -27.882 7.541 3.377 1.00 0.00 H new ATOM 0 HG21 THR A 95 -25.651 8.129 3.959 1.00 0.00 H new ATOM 0 HG22 THR A 95 -24.340 7.122 3.300 1.00 0.00 H new ATOM 0 HG23 THR A 95 -25.279 8.179 2.219 1.00 0.00 H new ATOM 1181 N PHE A 96 -23.672 4.947 2.410 1.00 0.00 N ATOM 1182 CA PHE A 96 -22.660 4.062 2.900 1.00 0.00 C ATOM 1183 C PHE A 96 -21.971 4.700 4.076 1.00 0.00 C ATOM 1184 O PHE A 96 -22.024 5.926 4.239 1.00 0.00 O ATOM 1185 CB PHE A 96 -21.638 3.701 1.797 1.00 0.00 C ATOM 1186 CG PHE A 96 -20.887 4.879 1.225 1.00 0.00 C ATOM 1187 CD1 PHE A 96 -19.697 5.309 1.801 1.00 0.00 C ATOM 1188 CD2 PHE A 96 -21.369 5.548 0.114 1.00 0.00 C ATOM 1189 CE1 PHE A 96 -19.009 6.385 1.277 1.00 0.00 C ATOM 1190 CE2 PHE A 96 -20.686 6.624 -0.415 1.00 0.00 C ATOM 1191 CZ PHE A 96 -19.505 7.043 0.166 1.00 0.00 C ATOM 0 H PHE A 96 -23.386 5.924 2.346 1.00 0.00 H new ATOM 0 HA PHE A 96 -23.133 3.132 3.215 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -20.918 2.992 2.205 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -22.162 3.193 0.987 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -19.307 4.796 2.667 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -22.291 5.224 -0.345 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -18.086 6.712 1.733 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -21.074 7.138 -1.282 1.00 0.00 H new ATOM 0 HZ PHE A 96 -18.969 7.884 -0.247 1.00 0.00 H new ATOM 1201 N THR A 97 -21.372 3.894 4.889 1.00 0.00 N ATOM 1202 CA THR A 97 -20.623 4.330 6.003 1.00 0.00 C ATOM 1203 C THR A 97 -19.240 3.716 5.924 1.00 0.00 C ATOM 1204 O THR A 97 -19.066 2.698 5.268 1.00 0.00 O ATOM 1205 CB THR A 97 -21.352 3.934 7.294 1.00 0.00 C ATOM 1206 OG1 THR A 97 -22.153 2.756 7.066 1.00 0.00 O ATOM 1207 CG2 THR A 97 -22.252 5.024 7.741 1.00 0.00 C ATOM 0 H THR A 97 -21.396 2.880 4.785 1.00 0.00 H new ATOM 0 HA THR A 97 -20.519 5.415 6.003 1.00 0.00 H new ATOM 0 HB THR A 97 -20.599 3.740 8.058 1.00 0.00 H new ATOM 0 HG1 THR A 97 -22.614 2.508 7.895 1.00 0.00 H new ATOM 0 HG21 THR A 97 -22.760 4.724 8.658 1.00 0.00 H new ATOM 0 HG22 THR A 97 -21.667 5.925 7.928 1.00 0.00 H new ATOM 0 HG23 THR A 97 -22.992 5.226 6.966 1.00 0.00 H new ATOM 1215 N LEU A 98 -18.271 4.326 6.524 1.00 0.00 N ATOM 1216 CA LEU A 98 -16.935 3.811 6.461 1.00 0.00 C ATOM 1217 C LEU A 98 -16.459 3.415 7.815 1.00 0.00 C ATOM 1218 O LEU A 98 -16.599 4.159 8.777 1.00 0.00 O ATOM 1219 CB LEU A 98 -15.976 4.827 5.865 1.00 0.00 C ATOM 1220 CG LEU A 98 -16.180 5.190 4.401 1.00 0.00 C ATOM 1221 CD1 LEU A 98 -15.303 6.346 4.042 1.00 0.00 C ATOM 1222 CD2 LEU A 98 -15.849 4.013 3.517 1.00 0.00 C ATOM 0 H LEU A 98 -18.376 5.184 7.066 1.00 0.00 H new ATOM 0 HA LEU A 98 -16.957 2.933 5.815 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -16.042 5.742 6.454 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -14.962 4.445 5.982 1.00 0.00 H new ATOM 0 HG LEU A 98 -17.225 5.462 4.250 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -15.451 6.603 2.993 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -15.557 7.203 4.666 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -14.260 6.076 4.205 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -16.000 4.288 2.473 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -14.809 3.724 3.670 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -16.499 3.175 3.769 1.00 0.00 H new ATOM 1234 N THR A 99 -15.928 2.256 7.888 1.00 0.00 N ATOM 1235 CA THR A 99 -15.343 1.773 9.092 1.00 0.00 C ATOM 1236 C THR A 99 -13.922 1.340 8.772 1.00 0.00 C ATOM 1237 O THR A 99 -13.645 0.873 7.648 1.00 0.00 O ATOM 1238 CB THR A 99 -16.177 0.632 9.765 1.00 0.00 C ATOM 1239 OG1 THR A 99 -15.599 0.236 11.013 1.00 0.00 O ATOM 1240 CG2 THR A 99 -16.312 -0.579 8.872 1.00 0.00 C ATOM 0 H THR A 99 -15.883 1.601 7.107 1.00 0.00 H new ATOM 0 HA THR A 99 -15.333 2.571 9.834 1.00 0.00 H new ATOM 0 HB THR A 99 -17.172 1.042 9.940 1.00 0.00 H new ATOM 0 HG1 THR A 99 -16.140 -0.476 11.413 1.00 0.00 H new ATOM 0 HG21 THR A 99 -16.898 -1.343 9.382 1.00 0.00 H new ATOM 0 HG22 THR A 99 -16.813 -0.295 7.947 1.00 0.00 H new ATOM 0 HG23 THR A 99 -15.322 -0.974 8.642 1.00 0.00 H new ATOM 1248 N GLY A 100 -13.024 1.551 9.709 1.00 0.00 N ATOM 1249 CA GLY A 100 -11.621 1.284 9.473 1.00 0.00 C ATOM 1250 C GLY A 100 -10.930 2.543 8.990 1.00 0.00 C ATOM 1251 O GLY A 100 -9.721 2.555 8.729 1.00 0.00 O ATOM 0 H GLY A 100 -13.239 1.906 10.641 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -11.150 0.929 10.390 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -11.512 0.492 8.732 1.00 0.00 H new ATOM 1255 N GLY A 101 -11.714 3.589 8.884 1.00 0.00 N ATOM 1256 CA GLY A 101 -11.279 4.880 8.441 1.00 0.00 C ATOM 1257 C GLY A 101 -12.498 5.688 8.074 1.00 0.00 C ATOM 1258 O GLY A 101 -13.595 5.130 8.002 1.00 0.00 O ATOM 0 H GLY A 101 -12.707 3.557 9.114 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -10.714 5.381 9.227 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -10.615 4.783 7.582 1.00 0.00 H new ATOM 1262 N ASN A 102 -12.341 6.975 7.871 1.00 0.00 N ATOM 1263 CA ASN A 102 -13.482 7.849 7.513 1.00 0.00 C ATOM 1264 C ASN A 102 -13.295 8.344 6.112 1.00 0.00 C ATOM 1265 O ASN A 102 -14.045 9.189 5.610 1.00 0.00 O ATOM 1266 CB ASN A 102 -13.530 9.055 8.454 1.00 0.00 C ATOM 1267 CG ASN A 102 -14.882 9.782 8.486 1.00 0.00 C ATOM 1268 OD1 ASN A 102 -15.116 10.747 7.752 1.00 0.00 O ATOM 1269 ND2 ASN A 102 -15.770 9.337 9.334 1.00 0.00 N ATOM 0 H ASN A 102 -11.446 7.458 7.942 1.00 0.00 H new ATOM 0 HA ASN A 102 -14.409 7.282 7.598 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -13.286 8.723 9.463 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -12.757 9.764 8.156 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -16.682 9.789 9.401 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -15.551 8.538 9.929 1.00 0.00 H new ATOM 1276 N VAL A 103 -12.340 7.791 5.451 1.00 0.00 N ATOM 1277 CA VAL A 103 -11.990 8.284 4.183 1.00 0.00 C ATOM 1278 C VAL A 103 -11.785 7.146 3.263 1.00 0.00 C ATOM 1279 O VAL A 103 -12.096 6.012 3.579 1.00 0.00 O ATOM 1280 CB VAL A 103 -10.727 9.172 4.279 1.00 0.00 C ATOM 1281 CG1 VAL A 103 -9.377 8.466 4.353 1.00 0.00 C ATOM 1282 CG2 VAL A 103 -10.771 10.428 3.435 1.00 0.00 C ATOM 0 H VAL A 103 -11.791 6.995 5.775 1.00 0.00 H new ATOM 0 HA VAL A 103 -12.795 8.907 3.793 1.00 0.00 H new ATOM 0 HB VAL A 103 -10.798 9.543 5.301 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -8.581 9.208 4.417 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -9.349 7.827 5.236 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -9.235 7.858 3.460 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -9.844 10.987 3.566 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -10.886 10.157 2.385 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -11.614 11.045 3.745 1.00 0.00 H new ATOM 1292 N PHE A 104 -11.245 7.442 2.185 1.00 0.00 N ATOM 1293 CA PHE A 104 -11.038 6.462 1.160 1.00 0.00 C ATOM 1294 C PHE A 104 -9.595 6.076 1.100 1.00 0.00 C ATOM 1295 O PHE A 104 -8.756 6.818 0.579 1.00 0.00 O ATOM 1296 CB PHE A 104 -11.570 6.922 -0.197 1.00 0.00 C ATOM 1297 CG PHE A 104 -13.033 7.243 -0.163 1.00 0.00 C ATOM 1298 CD1 PHE A 104 -13.942 6.294 0.266 1.00 0.00 C ATOM 1299 CD2 PHE A 104 -13.497 8.495 -0.527 1.00 0.00 C ATOM 1300 CE1 PHE A 104 -15.280 6.577 0.325 1.00 0.00 C ATOM 1301 CE2 PHE A 104 -14.842 8.788 -0.471 1.00 0.00 C ATOM 1302 CZ PHE A 104 -15.736 7.829 -0.043 1.00 0.00 C ATOM 0 H PHE A 104 -10.915 8.378 1.949 1.00 0.00 H new ATOM 0 HA PHE A 104 -11.615 5.575 1.420 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -11.016 7.803 -0.521 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -11.390 6.142 -0.937 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -13.592 5.315 0.559 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -12.798 9.249 -0.858 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -15.978 5.823 0.658 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -15.195 9.766 -0.762 1.00 0.00 H new ATOM 0 HZ PHE A 104 -16.791 8.056 0.005 1.00 0.00 H new ATOM 1312 N GLU A 105 -9.314 4.946 1.669 1.00 0.00 N ATOM 1313 CA GLU A 105 -7.993 4.395 1.735 1.00 0.00 C ATOM 1314 C GLU A 105 -8.124 2.900 1.912 1.00 0.00 C ATOM 1315 O GLU A 105 -9.166 2.420 2.421 1.00 0.00 O ATOM 1316 CB GLU A 105 -7.187 4.992 2.903 1.00 0.00 C ATOM 1317 CG GLU A 105 -7.790 4.724 4.292 1.00 0.00 C ATOM 1318 CD GLU A 105 -6.901 5.164 5.436 1.00 0.00 C ATOM 1319 OE1 GLU A 105 -6.770 6.375 5.688 1.00 0.00 O ATOM 1320 OE2 GLU A 105 -6.311 4.298 6.116 1.00 0.00 O ATOM 0 H GLU A 105 -10.020 4.361 2.116 1.00 0.00 H new ATOM 0 HA GLU A 105 -7.456 4.635 0.817 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -6.175 4.587 2.875 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -7.103 6.069 2.758 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -8.747 5.239 4.368 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -7.993 3.658 4.391 1.00 0.00 H new ATOM 1327 N TYR A 106 -7.127 2.175 1.456 1.00 0.00 N ATOM 1328 CA TYR A 106 -7.090 0.731 1.573 1.00 0.00 C ATOM 1329 C TYR A 106 -7.281 0.290 3.023 1.00 0.00 C ATOM 1330 O TYR A 106 -6.465 0.594 3.893 1.00 0.00 O ATOM 1331 CB TYR A 106 -5.769 0.190 1.015 1.00 0.00 C ATOM 1332 CG TYR A 106 -5.645 -1.316 1.089 1.00 0.00 C ATOM 1333 CD1 TYR A 106 -6.345 -2.122 0.215 1.00 0.00 C ATOM 1334 CD2 TYR A 106 -4.820 -1.927 2.030 1.00 0.00 C ATOM 1335 CE1 TYR A 106 -6.239 -3.492 0.270 1.00 0.00 C ATOM 1336 CE2 TYR A 106 -4.707 -3.302 2.091 1.00 0.00 C ATOM 1337 CZ TYR A 106 -5.421 -4.079 1.206 1.00 0.00 C ATOM 1338 OH TYR A 106 -5.316 -5.450 1.252 1.00 0.00 O ATOM 0 H TYR A 106 -6.312 2.572 0.989 1.00 0.00 H new ATOM 0 HA TYR A 106 -7.914 0.320 0.989 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -5.670 0.503 -0.024 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -4.942 0.641 1.564 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -6.988 -1.669 -0.525 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -4.260 -1.316 2.723 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -6.798 -4.106 -0.421 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -4.065 -3.764 2.826 1.00 0.00 H new ATOM 0 HH TYR A 106 -4.698 -5.707 1.968 1.00 0.00 H new ATOM 1348 N GLY A 107 -8.372 -0.383 3.276 1.00 0.00 N ATOM 1349 CA GLY A 107 -8.635 -0.865 4.597 1.00 0.00 C ATOM 1350 C GLY A 107 -10.017 -0.505 5.080 1.00 0.00 C ATOM 1351 O GLY A 107 -10.531 -1.128 6.017 1.00 0.00 O ATOM 0 H GLY A 107 -9.088 -0.607 2.585 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -8.519 -1.949 4.614 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.895 -0.454 5.284 1.00 0.00 H new ATOM 1355 N VAL A 108 -10.636 0.497 4.466 1.00 0.00 N ATOM 1356 CA VAL A 108 -11.971 0.886 4.890 1.00 0.00 C ATOM 1357 C VAL A 108 -13.028 -0.038 4.316 1.00 0.00 C ATOM 1358 O VAL A 108 -12.862 -0.631 3.226 1.00 0.00 O ATOM 1359 CB VAL A 108 -12.359 2.368 4.569 1.00 0.00 C ATOM 1360 CG1 VAL A 108 -11.360 3.354 5.114 1.00 0.00 C ATOM 1361 CG2 VAL A 108 -12.635 2.616 3.089 1.00 0.00 C ATOM 0 H VAL A 108 -10.247 1.040 3.695 1.00 0.00 H new ATOM 0 HA VAL A 108 -11.938 0.799 5.976 1.00 0.00 H new ATOM 0 HB VAL A 108 -13.302 2.535 5.089 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -11.675 4.367 4.864 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -11.299 3.249 6.197 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -10.381 3.160 4.675 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -12.898 3.663 2.938 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -11.744 2.378 2.508 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -13.461 1.984 2.762 1.00 0.00 H new ATOM 1371 N LYS A 109 -14.075 -0.188 5.059 1.00 0.00 N ATOM 1372 CA LYS A 109 -15.217 -0.926 4.639 1.00 0.00 C ATOM 1373 C LYS A 109 -16.306 0.062 4.353 1.00 0.00 C ATOM 1374 O LYS A 109 -16.701 0.808 5.252 1.00 0.00 O ATOM 1375 CB LYS A 109 -15.689 -1.866 5.752 1.00 0.00 C ATOM 1376 CG LYS A 109 -16.825 -2.790 5.348 1.00 0.00 C ATOM 1377 CD LYS A 109 -17.294 -3.720 6.485 1.00 0.00 C ATOM 1378 CE LYS A 109 -16.364 -4.929 6.755 1.00 0.00 C ATOM 1379 NZ LYS A 109 -15.021 -4.575 7.276 1.00 0.00 N ATOM 0 H LYS A 109 -14.161 0.208 5.995 1.00 0.00 H new ATOM 0 HA LYS A 109 -14.971 -1.523 3.761 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -14.845 -2.470 6.084 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -16.008 -1.268 6.606 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -17.669 -2.189 5.009 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -16.506 -3.397 4.501 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -17.384 -3.136 7.401 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -18.290 -4.091 6.245 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -16.852 -5.593 7.469 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -16.243 -5.491 5.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -14.670 -5.344 7.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -14.366 -4.435 6.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -15.084 -3.698 7.831 1.00 0.00 H new ATOM 1393 N ALA A 110 -16.761 0.108 3.131 1.00 0.00 N ATOM 1394 CA ALA A 110 -17.860 0.954 2.792 1.00 0.00 C ATOM 1395 C ALA A 110 -19.128 0.165 2.998 1.00 0.00 C ATOM 1396 O ALA A 110 -19.521 -0.628 2.146 1.00 0.00 O ATOM 1397 CB ALA A 110 -17.754 1.458 1.364 1.00 0.00 C ATOM 0 H ALA A 110 -16.383 -0.434 2.354 1.00 0.00 H new ATOM 0 HA ALA A 110 -17.858 1.837 3.431 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -18.607 2.099 1.140 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -16.832 2.027 1.247 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -17.747 0.610 0.679 1.00 0.00 H new ATOM 1403 N VAL A 111 -19.695 0.317 4.153 1.00 0.00 N ATOM 1404 CA VAL A 111 -20.865 -0.414 4.551 1.00 0.00 C ATOM 1405 C VAL A 111 -22.137 0.313 4.155 1.00 0.00 C ATOM 1406 O VAL A 111 -22.376 1.451 4.542 1.00 0.00 O ATOM 1407 CB VAL A 111 -20.808 -0.815 6.058 1.00 0.00 C ATOM 1408 CG1 VAL A 111 -20.470 0.328 6.972 1.00 0.00 C ATOM 1409 CG2 VAL A 111 -22.037 -1.589 6.515 1.00 0.00 C ATOM 0 H VAL A 111 -19.354 0.965 4.863 1.00 0.00 H new ATOM 0 HA VAL A 111 -20.882 -1.355 4.001 1.00 0.00 H new ATOM 0 HB VAL A 111 -19.969 -1.506 6.135 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -20.448 -0.025 8.003 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -19.493 0.730 6.705 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -21.224 1.109 6.872 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -21.938 -1.839 7.571 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -22.927 -0.977 6.369 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -22.127 -2.506 5.932 1.00 0.00 H new ATOM 1419 N TYR A 112 -22.927 -0.353 3.375 1.00 0.00 N ATOM 1420 CA TYR A 112 -24.091 0.215 2.749 1.00 0.00 C ATOM 1421 C TYR A 112 -25.269 0.172 3.694 1.00 0.00 C ATOM 1422 O TYR A 112 -25.441 -0.765 4.467 1.00 0.00 O ATOM 1423 CB TYR A 112 -24.370 -0.578 1.467 1.00 0.00 C ATOM 1424 CG TYR A 112 -25.386 -0.007 0.493 1.00 0.00 C ATOM 1425 CD1 TYR A 112 -26.754 -0.144 0.697 1.00 0.00 C ATOM 1426 CD2 TYR A 112 -24.962 0.612 -0.670 1.00 0.00 C ATOM 1427 CE1 TYR A 112 -27.663 0.313 -0.229 1.00 0.00 C ATOM 1428 CE2 TYR A 112 -25.864 1.083 -1.593 1.00 0.00 C ATOM 1429 CZ TYR A 112 -27.214 0.928 -1.370 1.00 0.00 C ATOM 1430 OH TYR A 112 -28.118 1.359 -2.310 1.00 0.00 O ATOM 0 H TYR A 112 -22.781 -1.336 3.146 1.00 0.00 H new ATOM 0 HA TYR A 112 -23.921 1.262 2.499 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -23.426 -0.699 0.935 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -24.704 -1.575 1.755 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -27.110 -0.618 1.600 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -23.904 0.727 -0.855 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -28.722 0.188 -0.059 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -25.516 1.573 -2.490 1.00 0.00 H new ATOM 0 HH TYR A 112 -27.640 1.774 -3.058 1.00 0.00 H new ATOM 1440 N THR A 113 -26.039 1.208 3.659 1.00 0.00 N ATOM 1441 CA THR A 113 -27.213 1.329 4.455 1.00 0.00 C ATOM 1442 C THR A 113 -28.252 2.019 3.570 1.00 0.00 C ATOM 1443 O THR A 113 -27.882 2.581 2.539 1.00 0.00 O ATOM 1444 CB THR A 113 -26.921 2.230 5.665 1.00 0.00 C ATOM 1445 OG1 THR A 113 -25.560 2.046 6.094 1.00 0.00 O ATOM 1446 CG2 THR A 113 -27.826 1.864 6.811 1.00 0.00 C ATOM 0 H THR A 113 -25.864 2.015 3.060 1.00 0.00 H new ATOM 0 HA THR A 113 -27.555 0.358 4.812 1.00 0.00 H new ATOM 0 HB THR A 113 -27.088 3.266 5.371 1.00 0.00 H new ATOM 0 HG1 THR A 113 -25.379 2.624 6.865 1.00 0.00 H new ATOM 0 HG21 THR A 113 -27.612 2.508 7.664 1.00 0.00 H new ATOM 0 HG22 THR A 113 -28.865 1.995 6.510 1.00 0.00 H new ATOM 0 HG23 THR A 113 -27.657 0.824 7.090 1.00 0.00 H new ATOM 1454 N CYS A 114 -29.515 1.977 3.922 1.00 0.00 N ATOM 1455 CA CYS A 114 -30.510 2.642 3.106 1.00 0.00 C ATOM 1456 C CYS A 114 -31.790 2.903 3.881 1.00 0.00 C ATOM 1457 O CYS A 114 -32.182 4.057 4.072 1.00 0.00 O ATOM 1458 CB CYS A 114 -30.792 1.815 1.848 1.00 0.00 C ATOM 1459 SG CYS A 114 -32.024 2.502 0.684 1.00 0.00 S ATOM 0 H CYS A 114 -29.876 1.501 4.749 1.00 0.00 H new ATOM 0 HA CYS A 114 -30.111 3.612 2.810 1.00 0.00 H new ATOM 0 HB2 CYS A 114 -29.853 1.679 1.311 1.00 0.00 H new ATOM 0 HB3 CYS A 114 -31.129 0.826 2.158 1.00 0.00 H new ATOM 1464 N ASN A 115 -32.412 1.856 4.371 1.00 0.00 N ATOM 1465 CA ASN A 115 -33.706 1.981 5.027 1.00 0.00 C ATOM 1466 C ASN A 115 -33.785 0.929 6.126 1.00 0.00 C ATOM 1467 O ASN A 115 -32.786 0.261 6.437 1.00 0.00 O ATOM 1468 CB ASN A 115 -34.817 1.709 3.988 1.00 0.00 C ATOM 1469 CG ASN A 115 -36.220 2.195 4.376 1.00 0.00 C ATOM 1470 OD1 ASN A 115 -36.985 1.468 5.015 1.00 0.00 O ATOM 1471 ND2 ASN A 115 -36.570 3.385 3.976 1.00 0.00 N ATOM 0 H ASN A 115 -32.048 0.904 4.331 1.00 0.00 H new ATOM 0 HA ASN A 115 -33.829 2.979 5.448 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -34.535 2.183 3.048 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -34.862 0.636 3.803 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -37.502 3.741 4.190 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -35.912 3.960 3.449 1.00 0.00 H new ATOM 1478 N GLU A 116 -34.942 0.779 6.687 1.00 0.00 N ATOM 1479 CA GLU A 116 -35.213 -0.181 7.704 1.00 0.00 C ATOM 1480 C GLU A 116 -35.903 -1.396 7.098 1.00 0.00 C ATOM 1481 O GLU A 116 -35.463 -2.531 7.268 1.00 0.00 O ATOM 1482 CB GLU A 116 -36.135 0.457 8.698 1.00 0.00 C ATOM 1483 CG GLU A 116 -36.465 -0.407 9.892 1.00 0.00 C ATOM 1484 CD GLU A 116 -37.570 0.173 10.714 1.00 0.00 C ATOM 1485 OE1 GLU A 116 -38.745 0.015 10.328 1.00 0.00 O ATOM 1486 OE2 GLU A 116 -37.297 0.799 11.757 1.00 0.00 O ATOM 0 H GLU A 116 -35.754 1.344 6.438 1.00 0.00 H new ATOM 0 HA GLU A 116 -34.285 -0.500 8.178 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -35.683 1.384 9.050 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -37.063 0.726 8.193 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -36.750 -1.402 9.552 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -35.576 -0.525 10.511 1.00 0.00 H new ATOM 1493 N GLY A 117 -36.954 -1.131 6.349 1.00 0.00 N ATOM 1494 CA GLY A 117 -37.786 -2.191 5.783 1.00 0.00 C ATOM 1495 C GLY A 117 -37.253 -2.724 4.476 1.00 0.00 C ATOM 1496 O GLY A 117 -37.924 -3.485 3.763 1.00 0.00 O ATOM 0 H GLY A 117 -37.259 -0.187 6.113 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -37.860 -3.009 6.500 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -38.796 -1.810 5.629 1.00 0.00 H new ATOM 1500 N TYR A 118 -36.074 -2.302 4.138 1.00 0.00 N ATOM 1501 CA TYR A 118 -35.410 -2.740 2.955 1.00 0.00 C ATOM 1502 C TYR A 118 -34.006 -3.082 3.290 1.00 0.00 C ATOM 1503 O TYR A 118 -33.318 -2.281 3.936 1.00 0.00 O ATOM 1504 CB TYR A 118 -35.364 -1.635 1.892 1.00 0.00 C ATOM 1505 CG TYR A 118 -36.693 -1.156 1.394 1.00 0.00 C ATOM 1506 CD1 TYR A 118 -37.381 -0.161 2.055 1.00 0.00 C ATOM 1507 CD2 TYR A 118 -37.246 -1.685 0.252 1.00 0.00 C ATOM 1508 CE1 TYR A 118 -38.583 0.293 1.595 1.00 0.00 C ATOM 1509 CE2 TYR A 118 -38.451 -1.243 -0.222 1.00 0.00 C ATOM 1510 CZ TYR A 118 -39.119 -0.251 0.450 1.00 0.00 C ATOM 1511 OH TYR A 118 -40.322 0.206 -0.031 1.00 0.00 O ATOM 0 H TYR A 118 -35.538 -1.631 4.689 1.00 0.00 H new ATOM 0 HA TYR A 118 -35.959 -3.597 2.565 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -34.822 -0.783 2.303 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -34.788 -1.999 1.041 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -36.961 0.267 2.953 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -36.720 -2.463 -0.281 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -39.109 1.073 2.125 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -38.873 -1.672 -1.119 1.00 0.00 H new ATOM 0 HH TYR A 118 -40.555 -0.284 -0.847 1.00 0.00 H new ATOM 1521 N GLN A 119 -33.570 -4.244 2.891 1.00 0.00 N ATOM 1522 CA GLN A 119 -32.189 -4.544 2.941 1.00 0.00 C ATOM 1523 C GLN A 119 -31.681 -4.211 1.592 1.00 0.00 C ATOM 1524 O GLN A 119 -32.060 -3.172 1.031 1.00 0.00 O ATOM 1525 CB GLN A 119 -31.847 -6.001 3.302 1.00 0.00 C ATOM 1526 CG GLN A 119 -32.134 -6.397 4.761 1.00 0.00 C ATOM 1527 CD GLN A 119 -33.613 -6.525 5.133 1.00 0.00 C ATOM 1528 OE1 GLN A 119 -34.429 -6.994 4.229 1.00 0.00 O flip ATOM 1529 NE2 GLN A 119 -33.998 -6.244 6.274 1.00 0.00 N flip ATOM 0 H GLN A 119 -34.161 -4.992 2.529 1.00 0.00 H new ATOM 0 HA GLN A 119 -31.726 -3.970 3.744 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -32.410 -6.664 2.645 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -30.790 -6.171 3.097 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -31.643 -7.349 4.963 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -31.676 -5.656 5.416 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -33.337 -5.879 6.960 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -34.976 -6.377 6.529 1.00 0.00 H new ATOM 1538 N LEU A 120 -30.877 -5.039 1.024 1.00 0.00 N ATOM 1539 CA LEU A 120 -30.341 -4.715 -0.154 1.00 0.00 C ATOM 1540 C LEU A 120 -30.018 -5.991 -0.899 1.00 0.00 C ATOM 1541 O LEU A 120 -29.890 -7.051 -0.283 1.00 0.00 O ATOM 1542 CB LEU A 120 -29.128 -3.861 0.162 1.00 0.00 C ATOM 1543 CG LEU A 120 -27.856 -4.540 0.584 1.00 0.00 C ATOM 1544 CD1 LEU A 120 -26.829 -3.531 0.950 1.00 0.00 C ATOM 1545 CD2 LEU A 120 -27.934 -5.507 1.714 1.00 0.00 C ATOM 0 H LEU A 120 -30.602 -5.947 1.400 1.00 0.00 H new ATOM 0 HA LEU A 120 -31.005 -4.146 -0.805 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -28.906 -3.263 -0.722 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -29.410 -3.167 0.954 1.00 0.00 H new ATOM 0 HG LEU A 120 -27.603 -5.127 -0.299 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -25.913 -4.038 1.254 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -26.623 -2.893 0.090 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -27.196 -2.921 1.775 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -26.944 -5.919 1.909 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -28.297 -4.996 2.606 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -28.619 -6.315 1.455 1.00 0.00 H new ATOM 1557 N LEU A 121 -29.999 -5.916 -2.192 1.00 0.00 N ATOM 1558 CA LEU A 121 -29.623 -7.026 -3.005 1.00 0.00 C ATOM 1559 C LEU A 121 -28.151 -7.163 -3.000 1.00 0.00 C ATOM 1560 O LEU A 121 -27.412 -6.208 -3.273 1.00 0.00 O ATOM 1561 CB LEU A 121 -30.198 -6.961 -4.423 1.00 0.00 C ATOM 1562 CG LEU A 121 -31.645 -7.441 -4.586 1.00 0.00 C ATOM 1563 CD1 LEU A 121 -31.813 -8.905 -4.209 1.00 0.00 C ATOM 1564 CD2 LEU A 121 -32.579 -6.591 -3.803 1.00 0.00 C ATOM 0 H LEU A 121 -30.246 -5.076 -2.716 1.00 0.00 H new ATOM 0 HA LEU A 121 -30.063 -7.924 -2.570 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -30.137 -5.930 -4.771 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -29.563 -7.557 -5.079 1.00 0.00 H new ATOM 0 HG LEU A 121 -31.891 -7.348 -5.644 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -32.855 -9.198 -4.341 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -31.179 -9.520 -4.848 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -31.525 -9.048 -3.167 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -33.599 -6.953 -3.936 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -32.313 -6.635 -2.747 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -32.512 -5.560 -4.151 1.00 0.00 H new ATOM 1576 N GLY A 122 -27.752 -8.323 -2.660 1.00 0.00 N ATOM 1577 CA GLY A 122 -26.386 -8.639 -2.446 1.00 0.00 C ATOM 1578 C GLY A 122 -26.267 -9.270 -1.093 1.00 0.00 C ATOM 1579 O GLY A 122 -27.076 -8.989 -0.207 1.00 0.00 O ATOM 0 H GLY A 122 -28.383 -9.111 -2.516 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -26.026 -9.320 -3.218 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -25.773 -7.740 -2.503 1.00 0.00 H new ATOM 1583 N GLU A 123 -25.324 -10.131 -0.920 1.00 0.00 N ATOM 1584 CA GLU A 123 -25.147 -10.804 0.354 1.00 0.00 C ATOM 1585 C GLU A 123 -24.234 -9.996 1.211 1.00 0.00 C ATOM 1586 O GLU A 123 -24.260 -10.062 2.446 1.00 0.00 O ATOM 1587 CB GLU A 123 -24.539 -12.163 0.134 1.00 0.00 C ATOM 1588 CG GLU A 123 -25.378 -13.067 -0.720 1.00 0.00 C ATOM 1589 CD GLU A 123 -24.744 -14.400 -0.889 1.00 0.00 C ATOM 1590 OE1 GLU A 123 -23.928 -14.562 -1.811 1.00 0.00 O ATOM 1591 OE2 GLU A 123 -25.048 -15.312 -0.100 1.00 0.00 O ATOM 0 H GLU A 123 -24.652 -10.398 -1.639 1.00 0.00 H new ATOM 0 HA GLU A 123 -26.116 -10.915 0.840 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -23.561 -12.043 -0.331 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -24.376 -12.639 1.101 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -26.363 -13.186 -0.268 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -25.530 -12.609 -1.697 1.00 0.00 H new ATOM 1598 N ILE A 124 -23.469 -9.205 0.556 1.00 0.00 N ATOM 1599 CA ILE A 124 -22.487 -8.414 1.168 1.00 0.00 C ATOM 1600 C ILE A 124 -23.030 -7.017 1.203 1.00 0.00 C ATOM 1601 O ILE A 124 -23.175 -6.371 0.172 1.00 0.00 O ATOM 1602 CB ILE A 124 -21.153 -8.485 0.365 1.00 0.00 C ATOM 1603 CG1 ILE A 124 -20.673 -9.949 0.222 1.00 0.00 C ATOM 1604 CG2 ILE A 124 -20.076 -7.649 1.015 1.00 0.00 C ATOM 1605 CD1 ILE A 124 -20.397 -10.659 1.538 1.00 0.00 C ATOM 0 H ILE A 124 -23.517 -9.092 -0.457 1.00 0.00 H new ATOM 0 HA ILE A 124 -22.262 -8.763 2.176 1.00 0.00 H new ATOM 0 HB ILE A 124 -21.348 -8.081 -0.628 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -21.427 -10.512 -0.328 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -19.764 -9.962 -0.380 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -19.158 -7.720 0.431 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -20.399 -6.609 1.058 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -19.892 -8.014 2.025 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -20.066 -11.678 1.339 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -19.619 -10.125 2.083 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -21.308 -10.684 2.136 1.00 0.00 H new ATOM 1617 N ASN A 125 -23.365 -6.563 2.379 1.00 0.00 N ATOM 1618 CA ASN A 125 -24.003 -5.263 2.560 1.00 0.00 C ATOM 1619 C ASN A 125 -22.964 -4.160 2.661 1.00 0.00 C ATOM 1620 O ASN A 125 -23.174 -3.131 3.294 1.00 0.00 O ATOM 1621 CB ASN A 125 -24.917 -5.275 3.806 1.00 0.00 C ATOM 1622 CG ASN A 125 -24.180 -5.428 5.138 1.00 0.00 C ATOM 1623 OD1 ASN A 125 -23.096 -6.019 5.216 1.00 0.00 O ATOM 1624 ND2 ASN A 125 -24.778 -4.935 6.195 1.00 0.00 N ATOM 0 H ASN A 125 -23.209 -7.075 3.247 1.00 0.00 H new ATOM 0 HA ASN A 125 -24.622 -5.062 1.686 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -25.491 -4.348 3.828 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -25.633 -6.091 3.707 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -24.350 -5.033 7.116 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -25.672 -4.453 6.097 1.00 0.00 H new ATOM 1631 N TYR A 126 -21.902 -4.340 1.951 1.00 0.00 N ATOM 1632 CA TYR A 126 -20.785 -3.453 1.995 1.00 0.00 C ATOM 1633 C TYR A 126 -19.885 -3.756 0.858 1.00 0.00 C ATOM 1634 O TYR A 126 -20.124 -4.681 0.094 1.00 0.00 O ATOM 1635 CB TYR A 126 -19.995 -3.597 3.333 1.00 0.00 C ATOM 1636 CG TYR A 126 -19.283 -4.935 3.548 1.00 0.00 C ATOM 1637 CD1 TYR A 126 -17.969 -5.135 3.099 1.00 0.00 C ATOM 1638 CD2 TYR A 126 -19.908 -5.978 4.202 1.00 0.00 C ATOM 1639 CE1 TYR A 126 -17.310 -6.332 3.296 1.00 0.00 C ATOM 1640 CE2 TYR A 126 -19.264 -7.179 4.409 1.00 0.00 C ATOM 1641 CZ TYR A 126 -17.970 -7.357 3.958 1.00 0.00 C ATOM 1642 OH TYR A 126 -17.344 -8.560 4.170 1.00 0.00 O ATOM 0 H TYR A 126 -21.782 -5.124 1.310 1.00 0.00 H new ATOM 0 HA TYR A 126 -21.154 -2.429 1.929 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -19.253 -2.800 3.382 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -20.687 -3.439 4.160 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -17.460 -4.332 2.586 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -20.920 -5.851 4.558 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -16.299 -6.468 2.941 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -19.771 -7.981 4.924 1.00 0.00 H new ATOM 0 HH TYR A 126 -17.949 -9.164 4.649 1.00 0.00 H new ATOM 1652 N ARG A 127 -18.876 -2.980 0.745 1.00 0.00 N ATOM 1653 CA ARG A 127 -17.846 -3.211 -0.176 1.00 0.00 C ATOM 1654 C ARG A 127 -16.560 -2.691 0.433 1.00 0.00 C ATOM 1655 O ARG A 127 -16.474 -1.532 0.831 1.00 0.00 O ATOM 1656 CB ARG A 127 -18.185 -2.599 -1.553 1.00 0.00 C ATOM 1657 CG ARG A 127 -18.350 -1.086 -1.607 1.00 0.00 C ATOM 1658 CD ARG A 127 -18.920 -0.644 -2.954 1.00 0.00 C ATOM 1659 NE ARG A 127 -18.183 -1.221 -4.088 1.00 0.00 N ATOM 1660 CZ ARG A 127 -18.085 -0.704 -5.318 1.00 0.00 C ATOM 1661 NH1 ARG A 127 -18.639 0.449 -5.613 1.00 0.00 N ATOM 1662 NH2 ARG A 127 -17.449 -1.379 -6.252 1.00 0.00 N ATOM 0 H ARG A 127 -18.745 -2.142 1.311 1.00 0.00 H new ATOM 0 HA ARG A 127 -17.721 -4.276 -0.374 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -17.399 -2.881 -2.253 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -19.108 -3.055 -1.910 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -19.011 -0.760 -0.804 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -17.386 -0.605 -1.441 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -19.968 -0.938 -3.017 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -18.890 0.444 -3.020 1.00 0.00 H new ATOM 0 HE ARG A 127 -17.698 -2.103 -3.920 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -19.154 0.965 -4.899 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -18.555 0.829 -6.556 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -17.037 -2.286 -6.034 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -17.368 -0.995 -7.193 1.00 0.00 H new ATOM 1676 N GLU A 128 -15.616 -3.562 0.614 1.00 0.00 N ATOM 1677 CA GLU A 128 -14.362 -3.182 1.205 1.00 0.00 C ATOM 1678 C GLU A 128 -13.399 -2.699 0.166 1.00 0.00 C ATOM 1679 O GLU A 128 -13.535 -3.020 -1.013 1.00 0.00 O ATOM 1680 CB GLU A 128 -13.760 -4.303 2.046 1.00 0.00 C ATOM 1681 CG GLU A 128 -14.345 -4.426 3.416 1.00 0.00 C ATOM 1682 CD GLU A 128 -13.486 -5.243 4.332 1.00 0.00 C ATOM 1683 OE1 GLU A 128 -13.247 -6.429 4.057 1.00 0.00 O ATOM 1684 OE2 GLU A 128 -13.059 -4.707 5.377 1.00 0.00 O ATOM 0 H GLU A 128 -15.687 -4.547 0.361 1.00 0.00 H new ATOM 0 HA GLU A 128 -14.565 -2.353 1.883 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -13.894 -5.248 1.520 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -12.686 -4.138 2.136 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -14.481 -3.431 3.841 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -15.333 -4.881 3.347 1.00 0.00 H new ATOM 1691 N CYS A 129 -12.471 -1.894 0.586 1.00 0.00 N ATOM 1692 CA CYS A 129 -11.482 -1.354 -0.304 1.00 0.00 C ATOM 1693 C CYS A 129 -10.448 -2.410 -0.650 1.00 0.00 C ATOM 1694 O CYS A 129 -10.022 -3.193 0.213 1.00 0.00 O ATOM 1695 CB CYS A 129 -10.821 -0.141 0.323 1.00 0.00 C ATOM 1696 SG CYS A 129 -9.574 0.663 -0.724 1.00 0.00 S ATOM 0 H CYS A 129 -12.376 -1.591 1.555 1.00 0.00 H new ATOM 0 HA CYS A 129 -11.972 -1.042 -1.226 1.00 0.00 H new ATOM 0 HB2 CYS A 129 -11.592 0.588 0.573 1.00 0.00 H new ATOM 0 HB3 CYS A 129 -10.351 -0.442 1.259 1.00 0.00 H new ATOM 1701 N ASP A 130 -10.058 -2.427 -1.889 1.00 0.00 N ATOM 1702 CA ASP A 130 -9.124 -3.386 -2.405 1.00 0.00 C ATOM 1703 C ASP A 130 -7.906 -2.661 -2.961 1.00 0.00 C ATOM 1704 O ASP A 130 -7.924 -1.453 -3.142 1.00 0.00 O ATOM 1705 CB ASP A 130 -9.799 -4.238 -3.514 1.00 0.00 C ATOM 1706 CG ASP A 130 -8.896 -5.294 -4.123 1.00 0.00 C ATOM 1707 OD1 ASP A 130 -8.857 -6.426 -3.615 1.00 0.00 O ATOM 1708 OD2 ASP A 130 -8.165 -4.984 -5.098 1.00 0.00 O ATOM 0 H ASP A 130 -10.387 -1.760 -2.587 1.00 0.00 H new ATOM 0 HA ASP A 130 -8.805 -4.051 -1.602 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -10.680 -4.726 -3.096 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -10.148 -3.574 -4.305 1.00 0.00 H new ATOM 1713 N THR A 131 -6.878 -3.419 -3.226 1.00 0.00 N ATOM 1714 CA THR A 131 -5.628 -2.977 -3.797 1.00 0.00 C ATOM 1715 C THR A 131 -5.808 -2.246 -5.136 1.00 0.00 C ATOM 1716 O THR A 131 -4.983 -1.421 -5.523 1.00 0.00 O ATOM 1717 CB THR A 131 -4.769 -4.213 -4.021 1.00 0.00 C ATOM 1718 OG1 THR A 131 -5.510 -5.197 -4.798 1.00 0.00 O ATOM 1719 CG2 THR A 131 -4.433 -4.817 -2.704 1.00 0.00 C ATOM 0 H THR A 131 -6.887 -4.422 -3.039 1.00 0.00 H new ATOM 0 HA THR A 131 -5.166 -2.268 -3.109 1.00 0.00 H new ATOM 0 HB THR A 131 -3.863 -3.925 -4.555 1.00 0.00 H new ATOM 0 HG1 THR A 131 -6.418 -4.868 -4.962 1.00 0.00 H new ATOM 0 HG21 THR A 131 -3.817 -5.703 -2.857 1.00 0.00 H new ATOM 0 HG22 THR A 131 -3.884 -4.093 -2.101 1.00 0.00 H new ATOM 0 HG23 THR A 131 -5.351 -5.097 -2.187 1.00 0.00 H new ATOM 1727 N ASP A 132 -6.845 -2.590 -5.850 1.00 0.00 N ATOM 1728 CA ASP A 132 -7.118 -1.950 -7.130 1.00 0.00 C ATOM 1729 C ASP A 132 -8.334 -1.021 -7.047 1.00 0.00 C ATOM 1730 O ASP A 132 -8.411 0.001 -7.744 1.00 0.00 O ATOM 1731 CB ASP A 132 -7.316 -3.004 -8.207 1.00 0.00 C ATOM 1732 CG ASP A 132 -7.475 -2.417 -9.588 1.00 0.00 C ATOM 1733 OD1 ASP A 132 -6.454 -2.016 -10.203 1.00 0.00 O ATOM 1734 OD2 ASP A 132 -8.601 -2.384 -10.102 1.00 0.00 O ATOM 0 H ASP A 132 -7.519 -3.306 -5.578 1.00 0.00 H new ATOM 0 HA ASP A 132 -6.257 -1.335 -7.392 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -6.463 -3.683 -8.203 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -8.198 -3.598 -7.968 1.00 0.00 H new ATOM 1739 N GLY A 133 -9.248 -1.342 -6.166 1.00 0.00 N ATOM 1740 CA GLY A 133 -10.458 -0.548 -6.039 1.00 0.00 C ATOM 1741 C GLY A 133 -11.290 -0.975 -4.861 1.00 0.00 C ATOM 1742 O GLY A 133 -10.950 -0.683 -3.724 1.00 0.00 O ATOM 0 H GLY A 133 -9.185 -2.137 -5.530 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -10.192 0.504 -5.933 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -11.048 -0.637 -6.951 1.00 0.00 H new ATOM 1746 N TRP A 134 -12.382 -1.642 -5.131 1.00 0.00 N ATOM 1747 CA TRP A 134 -13.249 -2.181 -4.097 1.00 0.00 C ATOM 1748 C TRP A 134 -13.482 -3.666 -4.371 1.00 0.00 C ATOM 1749 O TRP A 134 -13.555 -4.077 -5.530 1.00 0.00 O ATOM 1750 CB TRP A 134 -14.585 -1.410 -4.036 1.00 0.00 C ATOM 1751 CG TRP A 134 -14.420 0.060 -3.734 1.00 0.00 C ATOM 1752 CD1 TRP A 134 -14.234 1.060 -4.637 1.00 0.00 C ATOM 1753 CD2 TRP A 134 -14.414 0.688 -2.443 1.00 0.00 C ATOM 1754 NE1 TRP A 134 -14.099 2.263 -3.994 1.00 0.00 N ATOM 1755 CE2 TRP A 134 -14.212 2.063 -2.648 1.00 0.00 C ATOM 1756 CE3 TRP A 134 -14.559 0.222 -1.141 1.00 0.00 C ATOM 1757 CZ2 TRP A 134 -14.149 2.974 -1.595 1.00 0.00 C ATOM 1758 CZ3 TRP A 134 -14.498 1.124 -0.098 1.00 0.00 C ATOM 1759 CH2 TRP A 134 -14.295 2.484 -0.330 1.00 0.00 C ATOM 0 H TRP A 134 -12.704 -1.832 -6.080 1.00 0.00 H new ATOM 0 HA TRP A 134 -12.768 -2.065 -3.126 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -15.103 -1.521 -4.989 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -15.220 -1.860 -3.273 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -14.198 0.925 -5.708 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -13.940 3.163 -4.448 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -14.717 -0.829 -0.949 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -13.991 4.027 -1.774 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -14.610 0.770 0.916 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -14.252 3.163 0.509 1.00 0.00 H new ATOM 1770 N THR A 135 -13.596 -4.451 -3.321 1.00 0.00 N ATOM 1771 CA THR A 135 -13.711 -5.902 -3.425 1.00 0.00 C ATOM 1772 C THR A 135 -15.091 -6.358 -3.904 1.00 0.00 C ATOM 1773 O THR A 135 -15.230 -7.412 -4.523 1.00 0.00 O ATOM 1774 CB THR A 135 -13.429 -6.556 -2.051 1.00 0.00 C ATOM 1775 OG1 THR A 135 -14.286 -5.967 -1.050 1.00 0.00 O ATOM 1776 CG2 THR A 135 -11.984 -6.360 -1.640 1.00 0.00 C ATOM 0 H THR A 135 -13.612 -4.104 -2.362 1.00 0.00 H new ATOM 0 HA THR A 135 -12.976 -6.216 -4.166 1.00 0.00 H new ATOM 0 HB THR A 135 -13.627 -7.624 -2.137 1.00 0.00 H new ATOM 0 HG1 THR A 135 -15.176 -6.374 -1.101 1.00 0.00 H new ATOM 0 HG21 THR A 135 -11.814 -6.830 -0.671 1.00 0.00 H new ATOM 0 HG22 THR A 135 -11.329 -6.815 -2.383 1.00 0.00 H new ATOM 0 HG23 THR A 135 -11.767 -5.294 -1.570 1.00 0.00 H new ATOM 1784 N ASN A 136 -16.090 -5.563 -3.646 1.00 0.00 N ATOM 1785 CA ASN A 136 -17.443 -5.939 -3.918 1.00 0.00 C ATOM 1786 C ASN A 136 -18.046 -4.855 -4.710 1.00 0.00 C ATOM 1787 O ASN A 136 -17.439 -3.782 -4.835 1.00 0.00 O ATOM 1788 CB ASN A 136 -18.245 -6.159 -2.619 1.00 0.00 C ATOM 1789 CG ASN A 136 -17.649 -7.226 -1.722 1.00 0.00 C ATOM 1790 OD1 ASN A 136 -16.805 -6.933 -0.863 1.00 0.00 O ATOM 1791 ND2 ASN A 136 -18.059 -8.457 -1.904 1.00 0.00 N ATOM 0 H ASN A 136 -15.986 -4.633 -3.240 1.00 0.00 H new ATOM 0 HA ASN A 136 -17.461 -6.883 -4.463 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -18.298 -5.219 -2.069 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -19.268 -6.437 -2.874 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -17.682 -9.210 -1.329 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -18.755 -8.662 -2.621 1.00 0.00 H new ATOM 1798 N ASP A 137 -19.200 -5.093 -5.223 1.00 0.00 N ATOM 1799 CA ASP A 137 -19.873 -4.151 -6.071 1.00 0.00 C ATOM 1800 C ASP A 137 -20.913 -3.380 -5.282 1.00 0.00 C ATOM 1801 O ASP A 137 -20.926 -3.446 -4.053 1.00 0.00 O ATOM 1802 CB ASP A 137 -20.475 -4.888 -7.260 1.00 0.00 C ATOM 1803 CG ASP A 137 -21.594 -5.859 -6.901 1.00 0.00 C ATOM 1804 OD1 ASP A 137 -21.350 -6.838 -6.157 1.00 0.00 O ATOM 1805 OD2 ASP A 137 -22.719 -5.696 -7.414 1.00 0.00 O ATOM 0 H ASP A 137 -19.718 -5.958 -5.069 1.00 0.00 H new ATOM 0 HA ASP A 137 -19.163 -3.418 -6.454 1.00 0.00 H new ATOM 0 HB2 ASP A 137 -20.861 -4.155 -7.968 1.00 0.00 H new ATOM 0 HB3 ASP A 137 -19.683 -5.438 -7.769 1.00 0.00 H new ATOM 1810 N ILE A 138 -21.744 -2.625 -5.964 1.00 0.00 N ATOM 1811 CA ILE A 138 -22.726 -1.785 -5.305 1.00 0.00 C ATOM 1812 C ILE A 138 -24.033 -2.564 -5.061 1.00 0.00 C ATOM 1813 O ILE A 138 -24.703 -2.973 -6.014 1.00 0.00 O ATOM 1814 CB ILE A 138 -23.021 -0.501 -6.151 1.00 0.00 C ATOM 1815 CG1 ILE A 138 -21.723 0.264 -6.428 1.00 0.00 C ATOM 1816 CG2 ILE A 138 -24.009 0.420 -5.419 1.00 0.00 C ATOM 1817 CD1 ILE A 138 -21.861 1.360 -7.462 1.00 0.00 C ATOM 0 H ILE A 138 -21.761 -2.574 -6.983 1.00 0.00 H new ATOM 0 HA ILE A 138 -22.313 -1.481 -4.343 1.00 0.00 H new ATOM 0 HB ILE A 138 -23.465 -0.816 -7.096 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -21.366 0.702 -5.496 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -20.962 -0.442 -6.761 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -24.199 1.305 -6.026 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -24.945 -0.112 -5.250 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -23.585 0.721 -4.461 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -20.899 1.853 -7.600 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -22.187 0.928 -8.408 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -22.597 2.089 -7.123 1.00 0.00 H new ATOM 1829 N PRO A 139 -24.373 -2.826 -3.787 1.00 0.00 N ATOM 1830 CA PRO A 139 -25.646 -3.447 -3.423 1.00 0.00 C ATOM 1831 C PRO A 139 -26.820 -2.453 -3.664 1.00 0.00 C ATOM 1832 O PRO A 139 -26.634 -1.224 -3.628 1.00 0.00 O ATOM 1833 CB PRO A 139 -25.500 -3.756 -1.927 1.00 0.00 C ATOM 1834 CG PRO A 139 -24.317 -2.988 -1.439 1.00 0.00 C ATOM 1835 CD PRO A 139 -23.520 -2.550 -2.621 1.00 0.00 C ATOM 0 HA PRO A 139 -25.865 -4.337 -4.013 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -26.399 -3.467 -1.383 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -25.360 -4.825 -1.765 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -24.639 -2.124 -0.858 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -23.709 -3.607 -0.780 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -23.271 -1.491 -2.557 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -22.578 -3.095 -2.685 1.00 0.00 H new ATOM 1843 N ILE A 140 -27.998 -2.974 -3.917 1.00 0.00 N ATOM 1844 CA ILE A 140 -29.173 -2.135 -4.228 1.00 0.00 C ATOM 1845 C ILE A 140 -30.203 -2.305 -3.127 1.00 0.00 C ATOM 1846 O ILE A 140 -30.584 -3.425 -2.850 1.00 0.00 O ATOM 1847 CB ILE A 140 -29.854 -2.554 -5.588 1.00 0.00 C ATOM 1848 CG1 ILE A 140 -28.913 -2.440 -6.807 1.00 0.00 C ATOM 1849 CG2 ILE A 140 -31.128 -1.759 -5.842 1.00 0.00 C ATOM 1850 CD1 ILE A 140 -27.881 -3.548 -6.946 1.00 0.00 C ATOM 0 H ILE A 140 -28.187 -3.976 -3.918 1.00 0.00 H new ATOM 0 HA ILE A 140 -28.830 -1.104 -4.309 1.00 0.00 H new ATOM 0 HB ILE A 140 -30.104 -3.609 -5.473 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -29.521 -2.418 -7.712 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -28.390 -1.485 -6.751 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -31.571 -2.073 -6.787 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -31.836 -1.938 -5.033 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -30.891 -0.696 -5.888 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -27.274 -3.370 -7.834 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -27.240 -3.561 -6.064 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -28.388 -4.508 -7.040 1.00 0.00 H new ATOM 1862 N CYS A 141 -30.669 -1.235 -2.510 1.00 0.00 N ATOM 1863 CA CYS A 141 -31.629 -1.393 -1.433 1.00 0.00 C ATOM 1864 C CYS A 141 -33.038 -1.697 -1.902 1.00 0.00 C ATOM 1865 O CYS A 141 -33.730 -0.841 -2.470 1.00 0.00 O ATOM 1866 CB CYS A 141 -31.585 -0.278 -0.398 1.00 0.00 C ATOM 1867 SG CYS A 141 -31.704 1.431 -1.009 1.00 0.00 S ATOM 0 H CYS A 141 -30.408 -0.273 -2.727 1.00 0.00 H new ATOM 0 HA CYS A 141 -31.294 -2.290 -0.913 1.00 0.00 H new ATOM 0 HB2 CYS A 141 -32.399 -0.441 0.309 1.00 0.00 H new ATOM 0 HB3 CYS A 141 -30.654 -0.373 0.161 1.00 0.00 H new ATOM 1872 N GLU A 142 -33.437 -2.927 -1.671 1.00 0.00 N ATOM 1873 CA GLU A 142 -34.713 -3.474 -2.031 1.00 0.00 C ATOM 1874 C GLU A 142 -35.026 -4.569 -1.036 1.00 0.00 C ATOM 1875 O GLU A 142 -36.033 -4.465 -0.314 1.00 0.00 O ATOM 1876 CB GLU A 142 -34.699 -4.041 -3.460 1.00 0.00 C ATOM 1877 CG GLU A 142 -34.705 -3.031 -4.579 1.00 0.00 C ATOM 1878 CD GLU A 142 -35.092 -3.645 -5.891 1.00 0.00 C ATOM 1879 OE1 GLU A 142 -36.308 -3.728 -6.180 1.00 0.00 O ATOM 1880 OE2 GLU A 142 -34.213 -4.071 -6.663 1.00 0.00 O ATOM 1881 OXT GLU A 142 -34.202 -5.495 -0.896 1.00 0.00 O ATOM 0 H GLU A 142 -32.840 -3.607 -1.199 1.00 0.00 H new ATOM 0 HA GLU A 142 -35.473 -2.693 -2.008 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -33.815 -4.669 -3.570 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -35.567 -4.689 -3.579 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -35.399 -2.227 -4.337 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -33.716 -2.582 -4.667 1.00 0.00 H new TER 1888 GLU A 142