USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=29 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 84:sc= 0.943 USER MOD Set 1.2: A 136 ASN :FLIP amide:sc= 0.0352 F(o=0.26,f=0.98) USER MOD Set 2.1: A 91 THR OG1 : rot 165:sc= 1.13 USER MOD Set 2.2: A 112 TYR OH : rot 68:sc= 0.962 USER MOD Set 3.1: A 36 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 22 ASN :FLIP amide:sc= -0.107 F(o=-1.9,f=-0.11) USER MOD Single : A 29 ASN : amide:sc= -0.0185 X(o=-0.018,f=0) USER MOD Single : A 30 THR OG1 : rot 56:sc= 1.18 USER MOD Single : A 34 THR OG1 : rot -79:sc= 0.0823 USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 THR OG1 : rot 35:sc= 0.261 USER MOD Single : A 42 TYR OH : rot 180:sc= -0.15 USER MOD Single : A 46 THR OG1 : rot 84:sc= -0.422 USER MOD Single : A 47 GLN :FLIP amide:sc= 0 F(o=-1.2,f=0) USER MOD Single : A 50 TYR OH : rot -142:sc= 0.503 USER MOD Single : A 51 LYS NZ :NH3+ 150:sc= 1.27 (180deg=1.25) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -0.21 K(o=-0.21,f=-3.5!) USER MOD Single : A 64 MET CE :methyl -138:sc= -1.12 (180deg=-1.28) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= -3.01! C(o=-3!,f=-7.9!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 GLN : amide:sc= -0.653 K(o=-0.65,f=-1.4) USER MOD Single : A 82 LYS NZ :NH3+ -164:sc= 1.17 (180deg=0.77) USER MOD Single : A 87 HIS :FLIP no HE2:sc= -0.139 F(o=-0.85,f=-0.14) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 83:sc= -2.37! USER MOD Single : A 99 THR OG1 : rot -42:sc= 0.802 USER MOD Single : A 102 ASN :FLIP amide:sc=-0.00481 F(o=-1.8,f=-0.0048) USER MOD Single : A 106 TYR OH : rot 77:sc= 0.0153 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= -0.0347 USER MOD Single : A 115 ASN : amide:sc= 0.0276 K(o=0.028,f=-3.7!) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 ASN : amide:sc= 0.0781 K(o=0.078,f=-2.9!) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 THR OG1 : rot 94:sc= 1.16 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 20 30.432 -1.870 2.017 1.00 0.00 N ATOM 2 CA ASP A 20 29.582 -2.926 1.494 1.00 0.00 C ATOM 3 C ASP A 20 28.812 -3.611 2.600 1.00 0.00 C ATOM 4 O ASP A 20 29.365 -3.977 3.652 1.00 0.00 O ATOM 5 CB ASP A 20 30.327 -3.935 0.591 1.00 0.00 C ATOM 6 CG ASP A 20 31.428 -4.703 1.261 1.00 0.00 C ATOM 7 OD1 ASP A 20 32.509 -4.117 1.512 1.00 0.00 O ATOM 8 OD2 ASP A 20 31.283 -5.921 1.463 1.00 0.00 O ATOM 0 HA ASP A 20 28.862 -2.436 0.839 1.00 0.00 H new ATOM 0 HB2 ASP A 20 29.602 -4.644 0.192 1.00 0.00 H new ATOM 0 HB3 ASP A 20 30.747 -3.396 -0.258 1.00 0.00 H new ATOM 13 N CYS A 21 27.541 -3.736 2.372 1.00 0.00 N ATOM 14 CA CYS A 21 26.604 -4.288 3.319 1.00 0.00 C ATOM 15 C CYS A 21 26.739 -5.786 3.364 1.00 0.00 C ATOM 16 O CYS A 21 26.947 -6.415 2.345 1.00 0.00 O ATOM 17 CB CYS A 21 25.187 -3.909 2.895 1.00 0.00 C ATOM 18 SG CYS A 21 24.916 -2.119 2.744 1.00 0.00 S ATOM 0 H CYS A 21 27.107 -3.449 1.495 1.00 0.00 H new ATOM 0 HA CYS A 21 26.811 -3.888 4.312 1.00 0.00 H new ATOM 0 HB2 CYS A 21 24.966 -4.382 1.938 1.00 0.00 H new ATOM 0 HB3 CYS A 21 24.481 -4.313 3.621 1.00 0.00 H new ATOM 23 N ASN A 22 26.650 -6.353 4.547 1.00 0.00 N ATOM 24 CA ASN A 22 26.744 -7.808 4.731 1.00 0.00 C ATOM 25 C ASN A 22 25.362 -8.385 5.028 1.00 0.00 C ATOM 26 O ASN A 22 25.223 -9.501 5.522 1.00 0.00 O ATOM 27 CB ASN A 22 27.713 -8.154 5.883 1.00 0.00 C ATOM 28 CG ASN A 22 29.194 -8.045 5.532 1.00 0.00 C ATOM 29 OD1 ASN A 22 29.546 -7.161 4.646 1.00 0.00 O flip ATOM 30 ND2 ASN A 22 30.019 -8.770 6.077 1.00 0.00 N flip ATOM 0 H ASN A 22 26.511 -5.832 5.413 1.00 0.00 H new ATOM 0 HA ASN A 22 27.130 -8.246 3.811 1.00 0.00 H new ATOM 0 HB2 ASN A 22 27.504 -7.493 6.724 1.00 0.00 H new ATOM 0 HB3 ASN A 22 27.508 -9.171 6.218 1.00 0.00 H new ATOM 0 HD21 ASN A 22 29.717 -9.456 6.769 1.00 0.00 H new ATOM 0 HD22 ASN A 22 31.007 -8.687 5.838 1.00 0.00 H new ATOM 37 N GLU A 23 24.362 -7.631 4.670 1.00 0.00 N ATOM 38 CA GLU A 23 22.965 -7.961 4.889 1.00 0.00 C ATOM 39 C GLU A 23 22.194 -7.331 3.791 1.00 0.00 C ATOM 40 O GLU A 23 22.675 -6.397 3.134 1.00 0.00 O ATOM 41 CB GLU A 23 22.514 -7.422 6.247 1.00 0.00 C ATOM 42 CG GLU A 23 22.683 -5.907 6.350 1.00 0.00 C ATOM 43 CD GLU A 23 22.439 -5.343 7.723 1.00 0.00 C ATOM 44 OE1 GLU A 23 21.294 -4.991 8.051 1.00 0.00 O ATOM 45 OE2 GLU A 23 23.407 -5.185 8.490 1.00 0.00 O ATOM 0 H GLU A 23 24.492 -6.735 4.200 1.00 0.00 H new ATOM 0 HA GLU A 23 22.807 -9.040 4.893 1.00 0.00 H new ATOM 0 HB2 GLU A 23 21.468 -7.681 6.410 1.00 0.00 H new ATOM 0 HB3 GLU A 23 23.089 -7.905 7.037 1.00 0.00 H new ATOM 0 HG2 GLU A 23 23.694 -5.645 6.038 1.00 0.00 H new ATOM 0 HG3 GLU A 23 21.999 -5.429 5.648 1.00 0.00 H new ATOM 52 N LEU A 24 21.068 -7.890 3.545 1.00 0.00 N ATOM 53 CA LEU A 24 20.219 -7.517 2.540 1.00 0.00 C ATOM 54 C LEU A 24 19.283 -6.450 3.021 1.00 0.00 C ATOM 55 O LEU A 24 19.081 -6.289 4.222 1.00 0.00 O ATOM 56 CB LEU A 24 19.484 -8.788 2.106 1.00 0.00 C ATOM 57 CG LEU A 24 20.416 -9.948 1.822 1.00 0.00 C ATOM 58 CD1 LEU A 24 21.647 -9.527 1.102 1.00 0.00 C ATOM 59 CD2 LEU A 24 20.650 -10.762 3.035 1.00 0.00 C ATOM 0 H LEU A 24 20.715 -8.673 4.095 1.00 0.00 H new ATOM 0 HA LEU A 24 20.751 -7.087 1.691 1.00 0.00 H new ATOM 0 HB2 LEU A 24 18.781 -9.078 2.887 1.00 0.00 H new ATOM 0 HB3 LEU A 24 18.898 -8.574 1.212 1.00 0.00 H new ATOM 0 HG LEU A 24 19.918 -10.617 1.120 1.00 0.00 H new ATOM 0 HD11 LEU A 24 22.280 -10.397 0.924 1.00 0.00 H new ATOM 0 HD12 LEU A 24 21.374 -9.075 0.148 1.00 0.00 H new ATOM 0 HD13 LEU A 24 22.191 -8.800 1.705 1.00 0.00 H new ATOM 0 HD21 LEU A 24 21.323 -11.586 2.796 1.00 0.00 H new ATOM 0 HD22 LEU A 24 21.099 -10.140 3.810 1.00 0.00 H new ATOM 0 HD23 LEU A 24 19.701 -11.161 3.394 1.00 0.00 H new ATOM 71 N PRO A 25 18.735 -5.708 2.100 1.00 0.00 N ATOM 72 CA PRO A 25 17.822 -4.613 2.388 1.00 0.00 C ATOM 73 C PRO A 25 16.590 -5.088 3.175 1.00 0.00 C ATOM 74 O PRO A 25 15.954 -6.108 2.825 1.00 0.00 O ATOM 75 CB PRO A 25 17.429 -4.086 1.012 1.00 0.00 C ATOM 76 CG PRO A 25 17.830 -5.151 0.051 1.00 0.00 C ATOM 77 CD PRO A 25 18.952 -5.901 0.685 1.00 0.00 C ATOM 0 HA PRO A 25 18.282 -3.849 3.015 1.00 0.00 H new ATOM 0 HB2 PRO A 25 16.358 -3.891 0.957 1.00 0.00 H new ATOM 0 HB3 PRO A 25 17.936 -3.147 0.792 1.00 0.00 H new ATOM 0 HG2 PRO A 25 16.992 -5.815 -0.162 1.00 0.00 H new ATOM 0 HG3 PRO A 25 18.143 -4.717 -0.899 1.00 0.00 H new ATOM 0 HD2 PRO A 25 18.930 -6.957 0.417 1.00 0.00 H new ATOM 0 HD3 PRO A 25 19.921 -5.513 0.372 1.00 0.00 H new ATOM 85 N PRO A 26 16.275 -4.404 4.265 1.00 0.00 N ATOM 86 CA PRO A 26 15.165 -4.765 5.114 1.00 0.00 C ATOM 87 C PRO A 26 13.829 -4.332 4.542 1.00 0.00 C ATOM 88 O PRO A 26 13.604 -3.151 4.256 1.00 0.00 O ATOM 89 CB PRO A 26 15.461 -4.033 6.418 1.00 0.00 C ATOM 90 CG PRO A 26 16.273 -2.844 6.034 1.00 0.00 C ATOM 91 CD PRO A 26 16.986 -3.201 4.758 1.00 0.00 C ATOM 0 HA PRO A 26 15.078 -5.845 5.231 1.00 0.00 H new ATOM 0 HB2 PRO A 26 14.540 -3.734 6.918 1.00 0.00 H new ATOM 0 HB3 PRO A 26 16.006 -4.673 7.112 1.00 0.00 H new ATOM 0 HG2 PRO A 26 15.637 -1.971 5.890 1.00 0.00 H new ATOM 0 HG3 PRO A 26 16.987 -2.593 6.819 1.00 0.00 H new ATOM 0 HD2 PRO A 26 16.939 -2.387 4.035 1.00 0.00 H new ATOM 0 HD3 PRO A 26 18.041 -3.408 4.937 1.00 0.00 H new ATOM 99 N ARG A 27 12.949 -5.299 4.365 1.00 0.00 N ATOM 100 CA ARG A 27 11.621 -5.026 3.900 1.00 0.00 C ATOM 101 C ARG A 27 10.879 -4.237 4.962 1.00 0.00 C ATOM 102 O ARG A 27 11.185 -4.343 6.171 1.00 0.00 O ATOM 103 CB ARG A 27 10.836 -6.318 3.560 1.00 0.00 C ATOM 104 CG ARG A 27 10.290 -7.159 4.743 1.00 0.00 C ATOM 105 CD ARG A 27 11.351 -7.876 5.570 1.00 0.00 C ATOM 106 NE ARG A 27 12.054 -7.000 6.517 1.00 0.00 N ATOM 107 CZ ARG A 27 13.145 -7.355 7.209 1.00 0.00 C ATOM 108 NH1 ARG A 27 13.661 -8.571 7.060 1.00 0.00 N ATOM 109 NH2 ARG A 27 13.711 -6.502 8.055 1.00 0.00 N ATOM 0 H ARG A 27 13.141 -6.285 4.540 1.00 0.00 H new ATOM 0 HA ARG A 27 11.700 -4.449 2.979 1.00 0.00 H new ATOM 0 HB2 ARG A 27 9.993 -6.042 2.927 1.00 0.00 H new ATOM 0 HB3 ARG A 27 11.486 -6.959 2.964 1.00 0.00 H new ATOM 0 HG2 ARG A 27 9.719 -6.504 5.401 1.00 0.00 H new ATOM 0 HG3 ARG A 27 9.594 -7.901 4.351 1.00 0.00 H new ATOM 0 HD2 ARG A 27 10.880 -8.689 6.122 1.00 0.00 H new ATOM 0 HD3 ARG A 27 12.080 -8.328 4.897 1.00 0.00 H new ATOM 0 HE ARG A 27 11.687 -6.059 6.657 1.00 0.00 H new ATOM 0 HH11 ARG A 27 13.226 -9.234 6.419 1.00 0.00 H new ATOM 0 HH12 ARG A 27 14.492 -8.841 7.587 1.00 0.00 H new ATOM 0 HH21 ARG A 27 13.315 -5.570 8.181 1.00 0.00 H new ATOM 0 HH22 ARG A 27 14.541 -6.779 8.579 1.00 0.00 H new ATOM 123 N ARG A 28 9.923 -3.494 4.547 1.00 0.00 N ATOM 124 CA ARG A 28 9.176 -2.670 5.450 1.00 0.00 C ATOM 125 C ARG A 28 7.749 -3.156 5.423 1.00 0.00 C ATOM 126 O ARG A 28 7.424 -4.036 4.625 1.00 0.00 O ATOM 127 CB ARG A 28 9.271 -1.197 5.033 1.00 0.00 C ATOM 128 CG ARG A 28 10.707 -0.703 4.836 1.00 0.00 C ATOM 129 CD ARG A 28 10.762 0.782 4.510 1.00 0.00 C ATOM 130 NE ARG A 28 10.411 1.626 5.667 1.00 0.00 N ATOM 131 CZ ARG A 28 9.945 2.885 5.596 1.00 0.00 C ATOM 132 NH1 ARG A 28 9.495 3.377 4.443 1.00 0.00 N ATOM 133 NH2 ARG A 28 9.858 3.623 6.701 1.00 0.00 N ATOM 0 H ARG A 28 9.628 -3.432 3.573 1.00 0.00 H new ATOM 0 HA ARG A 28 9.575 -2.739 6.462 1.00 0.00 H new ATOM 0 HB2 ARG A 28 8.717 -1.055 4.105 1.00 0.00 H new ATOM 0 HB3 ARG A 28 8.786 -0.582 5.791 1.00 0.00 H new ATOM 0 HG2 ARG A 28 11.284 -0.897 5.740 1.00 0.00 H new ATOM 0 HG3 ARG A 28 11.177 -1.268 4.031 1.00 0.00 H new ATOM 0 HD2 ARG A 28 11.764 1.039 4.167 1.00 0.00 H new ATOM 0 HD3 ARG A 28 10.079 0.996 3.688 1.00 0.00 H new ATOM 0 HE ARG A 28 10.531 1.222 6.596 1.00 0.00 H new ATOM 0 HH11 ARG A 28 9.502 2.797 3.604 1.00 0.00 H new ATOM 0 HH12 ARG A 28 9.143 4.333 4.399 1.00 0.00 H new ATOM 0 HH21 ARG A 28 10.145 3.233 7.599 1.00 0.00 H new ATOM 0 HH22 ARG A 28 9.505 4.579 6.650 1.00 0.00 H new ATOM 147 N ASN A 29 6.896 -2.596 6.234 1.00 0.00 N ATOM 148 CA ASN A 29 5.512 -3.059 6.314 1.00 0.00 C ATOM 149 C ASN A 29 4.738 -2.737 5.035 1.00 0.00 C ATOM 150 O ASN A 29 3.751 -3.397 4.701 1.00 0.00 O ATOM 151 CB ASN A 29 4.814 -2.483 7.560 1.00 0.00 C ATOM 152 CG ASN A 29 3.389 -2.988 7.741 1.00 0.00 C ATOM 153 OD1 ASN A 29 3.158 -4.051 8.337 1.00 0.00 O ATOM 154 ND2 ASN A 29 2.427 -2.216 7.310 1.00 0.00 N ATOM 0 H ASN A 29 7.121 -1.818 6.854 1.00 0.00 H new ATOM 0 HA ASN A 29 5.527 -4.144 6.413 1.00 0.00 H new ATOM 0 HB2 ASN A 29 5.397 -2.738 8.445 1.00 0.00 H new ATOM 0 HB3 ASN A 29 4.800 -1.395 7.490 1.00 0.00 H new ATOM 0 HD21 ASN A 29 1.454 -2.482 7.460 1.00 0.00 H new ATOM 0 HD22 ASN A 29 2.649 -1.348 6.823 1.00 0.00 H new ATOM 161 N THR A 30 5.195 -1.747 4.304 1.00 0.00 N ATOM 162 CA THR A 30 4.549 -1.378 3.070 1.00 0.00 C ATOM 163 C THR A 30 5.489 -1.525 1.863 1.00 0.00 C ATOM 164 O THR A 30 5.133 -1.162 0.757 1.00 0.00 O ATOM 165 CB THR A 30 3.967 0.062 3.155 1.00 0.00 C ATOM 166 OG1 THR A 30 4.965 0.967 3.644 1.00 0.00 O ATOM 167 CG2 THR A 30 2.767 0.107 4.088 1.00 0.00 C ATOM 0 H THR A 30 6.011 -1.184 4.544 1.00 0.00 H new ATOM 0 HA THR A 30 3.721 -2.071 2.918 1.00 0.00 H new ATOM 0 HB THR A 30 3.654 0.357 2.153 1.00 0.00 H new ATOM 0 HG1 THR A 30 5.761 0.916 3.074 1.00 0.00 H new ATOM 0 HG21 THR A 30 2.378 1.124 4.131 1.00 0.00 H new ATOM 0 HG22 THR A 30 1.992 -0.563 3.716 1.00 0.00 H new ATOM 0 HG23 THR A 30 3.070 -0.208 5.086 1.00 0.00 H new ATOM 175 N GLU A 31 6.683 -2.096 2.081 1.00 0.00 N ATOM 176 CA GLU A 31 7.665 -2.226 1.002 1.00 0.00 C ATOM 177 C GLU A 31 8.331 -3.583 0.998 1.00 0.00 C ATOM 178 O GLU A 31 8.648 -4.144 2.047 1.00 0.00 O ATOM 179 CB GLU A 31 8.773 -1.162 1.042 1.00 0.00 C ATOM 180 CG GLU A 31 8.328 0.269 0.858 1.00 0.00 C ATOM 181 CD GLU A 31 8.098 1.002 2.149 1.00 0.00 C ATOM 182 OE1 GLU A 31 7.385 0.502 3.029 1.00 0.00 O ATOM 183 OE2 GLU A 31 8.640 2.096 2.326 1.00 0.00 O ATOM 0 H GLU A 31 6.986 -2.469 2.981 1.00 0.00 H new ATOM 0 HA GLU A 31 7.078 -2.087 0.094 1.00 0.00 H new ATOM 0 HB2 GLU A 31 9.289 -1.240 1.999 1.00 0.00 H new ATOM 0 HB3 GLU A 31 9.502 -1.397 0.266 1.00 0.00 H new ATOM 0 HG2 GLU A 31 9.081 0.802 0.277 1.00 0.00 H new ATOM 0 HG3 GLU A 31 7.407 0.281 0.275 1.00 0.00 H new ATOM 190 N ILE A 32 8.557 -4.085 -0.183 1.00 0.00 N ATOM 191 CA ILE A 32 9.216 -5.373 -0.413 1.00 0.00 C ATOM 192 C ILE A 32 10.126 -5.151 -1.563 1.00 0.00 C ATOM 193 O ILE A 32 9.870 -4.302 -2.387 1.00 0.00 O ATOM 194 CB ILE A 32 8.197 -6.479 -0.826 1.00 0.00 C ATOM 195 CG1 ILE A 32 6.942 -6.454 0.043 1.00 0.00 C ATOM 196 CG2 ILE A 32 8.843 -7.854 -0.741 1.00 0.00 C ATOM 197 CD1 ILE A 32 5.859 -7.380 -0.455 1.00 0.00 C ATOM 0 H ILE A 32 8.287 -3.610 -1.045 1.00 0.00 H new ATOM 0 HA ILE A 32 9.720 -5.702 0.496 1.00 0.00 H new ATOM 0 HB ILE A 32 7.901 -6.273 -1.855 1.00 0.00 H new ATOM 0 HG12 ILE A 32 7.208 -6.731 1.063 1.00 0.00 H new ATOM 0 HG13 ILE A 32 6.553 -5.436 0.080 1.00 0.00 H new ATOM 0 HG21 ILE A 32 8.119 -8.615 -1.032 1.00 0.00 H new ATOM 0 HG22 ILE A 32 9.702 -7.895 -1.411 1.00 0.00 H new ATOM 0 HG23 ILE A 32 9.172 -8.039 0.282 1.00 0.00 H new ATOM 0 HD11 ILE A 32 4.994 -7.316 0.205 1.00 0.00 H new ATOM 0 HD12 ILE A 32 5.567 -7.089 -1.464 1.00 0.00 H new ATOM 0 HD13 ILE A 32 6.232 -8.404 -0.466 1.00 0.00 H new ATOM 209 N LEU A 33 11.159 -5.884 -1.608 1.00 0.00 N ATOM 210 CA LEU A 33 12.125 -5.780 -2.642 1.00 0.00 C ATOM 211 C LEU A 33 11.560 -6.231 -3.964 1.00 0.00 C ATOM 212 O LEU A 33 10.579 -6.970 -4.012 1.00 0.00 O ATOM 213 CB LEU A 33 13.335 -6.604 -2.291 1.00 0.00 C ATOM 214 CG LEU A 33 14.235 -6.086 -1.189 1.00 0.00 C ATOM 215 CD1 LEU A 33 14.706 -4.683 -1.456 1.00 0.00 C ATOM 216 CD2 LEU A 33 13.665 -6.242 0.193 1.00 0.00 C ATOM 0 H LEU A 33 11.373 -6.598 -0.911 1.00 0.00 H new ATOM 0 HA LEU A 33 12.412 -4.733 -2.738 1.00 0.00 H new ATOM 0 HB2 LEU A 33 12.994 -7.600 -2.007 1.00 0.00 H new ATOM 0 HB3 LEU A 33 13.938 -6.718 -3.192 1.00 0.00 H new ATOM 0 HG LEU A 33 15.112 -6.733 -1.208 1.00 0.00 H new ATOM 0 HD11 LEU A 33 15.348 -4.353 -0.639 1.00 0.00 H new ATOM 0 HD12 LEU A 33 15.266 -4.659 -2.391 1.00 0.00 H new ATOM 0 HD13 LEU A 33 13.845 -4.018 -1.532 1.00 0.00 H new ATOM 0 HD21 LEU A 33 14.370 -5.847 0.924 1.00 0.00 H new ATOM 0 HD22 LEU A 33 12.725 -5.694 0.263 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.486 -7.298 0.396 1.00 0.00 H new ATOM 228 N THR A 34 12.129 -5.744 -5.012 1.00 0.00 N ATOM 229 CA THR A 34 11.739 -6.127 -6.337 1.00 0.00 C ATOM 230 C THR A 34 12.675 -7.206 -6.876 1.00 0.00 C ATOM 231 O THR A 34 12.241 -8.157 -7.539 1.00 0.00 O ATOM 232 CB THR A 34 11.754 -4.904 -7.261 1.00 0.00 C ATOM 233 OG1 THR A 34 12.973 -4.183 -7.060 1.00 0.00 O ATOM 234 CG2 THR A 34 10.571 -3.988 -6.979 1.00 0.00 C ATOM 0 H THR A 34 12.886 -5.061 -4.980 1.00 0.00 H new ATOM 0 HA THR A 34 10.728 -6.532 -6.302 1.00 0.00 H new ATOM 0 HB THR A 34 11.681 -5.246 -8.293 1.00 0.00 H new ATOM 0 HG1 THR A 34 12.901 -3.639 -6.248 1.00 0.00 H new ATOM 0 HG21 THR A 34 10.608 -3.129 -7.649 1.00 0.00 H new ATOM 0 HG22 THR A 34 9.642 -4.534 -7.140 1.00 0.00 H new ATOM 0 HG23 THR A 34 10.615 -3.644 -5.946 1.00 0.00 H new ATOM 242 N GLY A 35 13.942 -7.072 -6.547 1.00 0.00 N ATOM 243 CA GLY A 35 14.939 -7.994 -7.009 1.00 0.00 C ATOM 244 C GLY A 35 15.087 -9.197 -6.106 1.00 0.00 C ATOM 245 O GLY A 35 14.219 -9.471 -5.268 1.00 0.00 O ATOM 0 H GLY A 35 14.301 -6.323 -5.955 1.00 0.00 H new ATOM 0 HA2 GLY A 35 14.680 -8.329 -8.013 1.00 0.00 H new ATOM 0 HA3 GLY A 35 15.897 -7.480 -7.082 1.00 0.00 H new ATOM 249 N SER A 36 16.176 -9.904 -6.255 1.00 0.00 N ATOM 250 CA SER A 36 16.416 -11.089 -5.493 1.00 0.00 C ATOM 251 C SER A 36 17.710 -10.925 -4.698 1.00 0.00 C ATOM 252 O SER A 36 18.812 -10.905 -5.265 1.00 0.00 O ATOM 253 CB SER A 36 16.496 -12.301 -6.444 1.00 0.00 C ATOM 254 OG SER A 36 16.509 -13.553 -5.743 1.00 0.00 O ATOM 0 H SER A 36 16.920 -9.669 -6.912 1.00 0.00 H new ATOM 0 HA SER A 36 15.600 -11.257 -4.790 1.00 0.00 H new ATOM 0 HB2 SER A 36 15.646 -12.280 -7.126 1.00 0.00 H new ATOM 0 HB3 SER A 36 17.396 -12.221 -7.054 1.00 0.00 H new ATOM 0 HG SER A 36 16.559 -14.289 -6.388 1.00 0.00 H new ATOM 260 N TRP A 37 17.574 -10.769 -3.406 1.00 0.00 N ATOM 261 CA TRP A 37 18.721 -10.628 -2.537 1.00 0.00 C ATOM 262 C TRP A 37 18.862 -11.896 -1.757 1.00 0.00 C ATOM 263 O TRP A 37 18.270 -12.057 -0.690 1.00 0.00 O ATOM 264 CB TRP A 37 18.562 -9.453 -1.570 1.00 0.00 C ATOM 265 CG TRP A 37 18.070 -8.207 -2.234 1.00 0.00 C ATOM 266 CD1 TRP A 37 16.774 -7.891 -2.488 1.00 0.00 C ATOM 267 CD2 TRP A 37 18.848 -7.114 -2.734 1.00 0.00 C ATOM 268 NE1 TRP A 37 16.695 -6.680 -3.103 1.00 0.00 N ATOM 269 CE2 TRP A 37 17.947 -6.176 -3.265 1.00 0.00 C ATOM 270 CE3 TRP A 37 20.208 -6.830 -2.779 1.00 0.00 C ATOM 271 CZ2 TRP A 37 18.361 -4.981 -3.832 1.00 0.00 C ATOM 272 CZ3 TRP A 37 20.619 -5.641 -3.341 1.00 0.00 C ATOM 273 CH2 TRP A 37 19.695 -4.731 -3.860 1.00 0.00 C ATOM 0 H TRP A 37 16.674 -10.736 -2.927 1.00 0.00 H new ATOM 0 HA TRP A 37 19.604 -10.433 -3.145 1.00 0.00 H new ATOM 0 HB2 TRP A 37 17.867 -9.734 -0.778 1.00 0.00 H new ATOM 0 HB3 TRP A 37 19.522 -9.249 -1.095 1.00 0.00 H new ATOM 0 HD1 TRP A 37 15.927 -8.512 -2.238 1.00 0.00 H new ATOM 0 HE1 TRP A 37 15.832 -6.222 -3.396 1.00 0.00 H new ATOM 0 HE3 TRP A 37 20.929 -7.528 -2.381 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 17.650 -4.276 -4.236 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 21.673 -5.409 -3.381 1.00 0.00 H new ATOM 0 HH2 TRP A 37 20.050 -3.808 -4.293 1.00 0.00 H new ATOM 284 N SER A 38 19.566 -12.817 -2.312 1.00 0.00 N ATOM 285 CA SER A 38 19.746 -14.096 -1.686 1.00 0.00 C ATOM 286 C SER A 38 21.134 -14.182 -1.086 1.00 0.00 C ATOM 287 O SER A 38 21.541 -15.226 -0.563 1.00 0.00 O ATOM 288 CB SER A 38 19.552 -15.191 -2.730 1.00 0.00 C ATOM 289 OG SER A 38 18.326 -15.009 -3.437 1.00 0.00 O ATOM 0 H SER A 38 20.036 -12.715 -3.211 1.00 0.00 H new ATOM 0 HA SER A 38 19.015 -14.224 -0.888 1.00 0.00 H new ATOM 0 HB2 SER A 38 20.386 -15.182 -3.432 1.00 0.00 H new ATOM 0 HB3 SER A 38 19.555 -16.167 -2.244 1.00 0.00 H new ATOM 0 HG SER A 38 18.223 -15.721 -4.102 1.00 0.00 H new ATOM 295 N ASP A 39 21.863 -13.088 -1.150 1.00 0.00 N ATOM 296 CA ASP A 39 23.228 -13.110 -0.673 1.00 0.00 C ATOM 297 C ASP A 39 23.320 -12.448 0.679 1.00 0.00 C ATOM 298 O ASP A 39 22.410 -12.573 1.465 1.00 0.00 O ATOM 299 CB ASP A 39 24.211 -12.534 -1.727 1.00 0.00 C ATOM 300 CG ASP A 39 25.676 -12.913 -1.492 1.00 0.00 C ATOM 301 OD1 ASP A 39 26.392 -12.201 -0.745 1.00 0.00 O ATOM 302 OD2 ASP A 39 26.118 -13.939 -2.040 1.00 0.00 O ATOM 0 H ASP A 39 21.543 -12.192 -1.519 1.00 0.00 H new ATOM 0 HA ASP A 39 23.541 -14.145 -0.532 1.00 0.00 H new ATOM 0 HB2 ASP A 39 23.911 -12.882 -2.715 1.00 0.00 H new ATOM 0 HB3 ASP A 39 24.125 -11.447 -1.732 1.00 0.00 H new ATOM 307 N GLN A 40 24.432 -11.860 0.976 1.00 0.00 N ATOM 308 CA GLN A 40 24.640 -11.121 2.178 1.00 0.00 C ATOM 309 C GLN A 40 25.309 -9.844 1.782 1.00 0.00 C ATOM 310 O GLN A 40 24.792 -8.760 1.980 1.00 0.00 O ATOM 311 CB GLN A 40 25.582 -11.851 3.143 1.00 0.00 C ATOM 312 CG GLN A 40 25.200 -13.261 3.498 1.00 0.00 C ATOM 313 CD GLN A 40 26.147 -13.840 4.521 1.00 0.00 C ATOM 314 OE1 GLN A 40 25.905 -13.742 5.726 1.00 0.00 O ATOM 315 NE2 GLN A 40 27.245 -14.384 4.070 1.00 0.00 N ATOM 0 H GLN A 40 25.250 -11.882 0.367 1.00 0.00 H new ATOM 0 HA GLN A 40 23.683 -10.975 2.678 1.00 0.00 H new ATOM 0 HB2 GLN A 40 26.579 -11.866 2.704 1.00 0.00 H new ATOM 0 HB3 GLN A 40 25.648 -11.271 4.063 1.00 0.00 H new ATOM 0 HG2 GLN A 40 24.183 -13.278 3.889 1.00 0.00 H new ATOM 0 HG3 GLN A 40 25.207 -13.880 2.601 1.00 0.00 H new ATOM 0 HE21 GLN A 40 27.408 -14.446 3.065 1.00 0.00 H new ATOM 0 HE22 GLN A 40 27.940 -14.747 4.723 1.00 0.00 H new ATOM 324 N THR A 41 26.432 -9.996 1.148 1.00 0.00 N ATOM 325 CA THR A 41 27.262 -8.900 0.833 1.00 0.00 C ATOM 326 C THR A 41 26.897 -8.269 -0.499 1.00 0.00 C ATOM 327 O THR A 41 26.878 -8.937 -1.542 1.00 0.00 O ATOM 328 CB THR A 41 28.726 -9.330 0.837 1.00 0.00 C ATOM 329 OG1 THR A 41 28.898 -10.412 -0.110 1.00 0.00 O ATOM 330 CG2 THR A 41 29.128 -9.825 2.222 1.00 0.00 C ATOM 0 H THR A 41 26.791 -10.898 0.837 1.00 0.00 H new ATOM 0 HA THR A 41 27.108 -8.142 1.601 1.00 0.00 H new ATOM 0 HB THR A 41 29.349 -8.478 0.565 1.00 0.00 H new ATOM 0 HG1 THR A 41 28.309 -10.269 -0.880 1.00 0.00 H new ATOM 0 HG21 THR A 41 30.175 -10.129 2.210 1.00 0.00 H new ATOM 0 HG22 THR A 41 28.990 -9.024 2.949 1.00 0.00 H new ATOM 0 HG23 THR A 41 28.506 -10.677 2.499 1.00 0.00 H new ATOM 338 N TYR A 42 26.591 -7.016 -0.451 1.00 0.00 N ATOM 339 CA TYR A 42 26.294 -6.240 -1.617 1.00 0.00 C ATOM 340 C TYR A 42 27.114 -4.980 -1.603 1.00 0.00 C ATOM 341 O TYR A 42 27.300 -4.372 -0.541 1.00 0.00 O ATOM 342 CB TYR A 42 24.793 -5.960 -1.779 1.00 0.00 C ATOM 343 CG TYR A 42 24.028 -7.143 -2.332 1.00 0.00 C ATOM 344 CD1 TYR A 42 23.508 -8.115 -1.501 1.00 0.00 C ATOM 345 CD2 TYR A 42 23.842 -7.287 -3.701 1.00 0.00 C ATOM 346 CE1 TYR A 42 22.821 -9.198 -2.011 1.00 0.00 C ATOM 347 CE2 TYR A 42 23.154 -8.367 -4.222 1.00 0.00 C ATOM 348 CZ TYR A 42 22.644 -9.326 -3.360 1.00 0.00 C ATOM 349 OH TYR A 42 21.943 -10.413 -3.849 1.00 0.00 O ATOM 0 H TYR A 42 26.538 -6.487 0.419 1.00 0.00 H new ATOM 0 HA TYR A 42 26.569 -6.825 -2.495 1.00 0.00 H new ATOM 0 HB2 TYR A 42 24.374 -5.683 -0.812 1.00 0.00 H new ATOM 0 HB3 TYR A 42 24.658 -5.105 -2.441 1.00 0.00 H new ATOM 0 HD1 TYR A 42 23.641 -8.026 -0.433 1.00 0.00 H new ATOM 0 HD2 TYR A 42 24.243 -6.541 -4.371 1.00 0.00 H new ATOM 0 HE1 TYR A 42 22.422 -9.946 -1.342 1.00 0.00 H new ATOM 0 HE2 TYR A 42 23.015 -8.463 -5.289 1.00 0.00 H new ATOM 0 HH TYR A 42 21.901 -10.362 -4.827 1.00 0.00 H new ATOM 359 N PRO A 43 27.642 -4.593 -2.768 1.00 0.00 N ATOM 360 CA PRO A 43 28.546 -3.459 -2.899 1.00 0.00 C ATOM 361 C PRO A 43 27.930 -2.141 -2.436 1.00 0.00 C ATOM 362 O PRO A 43 26.721 -1.890 -2.599 1.00 0.00 O ATOM 363 CB PRO A 43 28.885 -3.420 -4.399 1.00 0.00 C ATOM 364 CG PRO A 43 27.802 -4.198 -5.061 1.00 0.00 C ATOM 365 CD PRO A 43 27.374 -5.230 -4.069 1.00 0.00 C ATOM 0 HA PRO A 43 29.424 -3.579 -2.264 1.00 0.00 H new ATOM 0 HB2 PRO A 43 28.917 -2.395 -4.769 1.00 0.00 H new ATOM 0 HB3 PRO A 43 29.863 -3.861 -4.594 1.00 0.00 H new ATOM 0 HG2 PRO A 43 26.969 -3.551 -5.336 1.00 0.00 H new ATOM 0 HG3 PRO A 43 28.161 -4.664 -5.979 1.00 0.00 H new ATOM 0 HD2 PRO A 43 26.320 -5.482 -4.182 1.00 0.00 H new ATOM 0 HD3 PRO A 43 27.937 -6.156 -4.186 1.00 0.00 H new ATOM 373 N GLU A 44 28.757 -1.319 -1.836 1.00 0.00 N ATOM 374 CA GLU A 44 28.343 -0.030 -1.350 1.00 0.00 C ATOM 375 C GLU A 44 27.911 0.823 -2.524 1.00 0.00 C ATOM 376 O GLU A 44 28.616 0.894 -3.537 1.00 0.00 O ATOM 377 CB GLU A 44 29.487 0.653 -0.634 1.00 0.00 C ATOM 378 CG GLU A 44 29.055 1.883 0.120 1.00 0.00 C ATOM 379 CD GLU A 44 30.186 2.627 0.736 1.00 0.00 C ATOM 380 OE1 GLU A 44 31.295 2.634 0.162 1.00 0.00 O ATOM 381 OE2 GLU A 44 29.992 3.172 1.839 1.00 0.00 O ATOM 0 H GLU A 44 29.741 -1.529 -1.671 1.00 0.00 H new ATOM 0 HA GLU A 44 27.516 -0.160 -0.652 1.00 0.00 H new ATOM 0 HB2 GLU A 44 29.946 -0.050 0.061 1.00 0.00 H new ATOM 0 HB3 GLU A 44 30.251 0.928 -1.361 1.00 0.00 H new ATOM 0 HG2 GLU A 44 28.520 2.547 -0.559 1.00 0.00 H new ATOM 0 HG3 GLU A 44 28.352 1.593 0.901 1.00 0.00 H new ATOM 388 N GLY A 45 26.775 1.437 -2.405 1.00 0.00 N ATOM 389 CA GLY A 45 26.257 2.238 -3.476 1.00 0.00 C ATOM 390 C GLY A 45 25.159 1.517 -4.204 1.00 0.00 C ATOM 391 O GLY A 45 24.635 2.004 -5.208 1.00 0.00 O ATOM 0 H GLY A 45 26.185 1.400 -1.574 1.00 0.00 H new ATOM 0 HA2 GLY A 45 25.878 3.180 -3.080 1.00 0.00 H new ATOM 0 HA3 GLY A 45 27.059 2.484 -4.172 1.00 0.00 H new ATOM 395 N THR A 46 24.801 0.356 -3.699 1.00 0.00 N ATOM 396 CA THR A 46 23.761 -0.435 -4.304 1.00 0.00 C ATOM 397 C THR A 46 22.391 -0.048 -3.822 1.00 0.00 C ATOM 398 O THR A 46 22.076 -0.166 -2.645 1.00 0.00 O ATOM 399 CB THR A 46 24.025 -1.957 -4.185 1.00 0.00 C ATOM 400 OG1 THR A 46 25.202 -2.294 -4.913 1.00 0.00 O ATOM 401 CG2 THR A 46 22.851 -2.805 -4.677 1.00 0.00 C ATOM 0 H THR A 46 25.220 -0.059 -2.867 1.00 0.00 H new ATOM 0 HA THR A 46 23.786 -0.206 -5.369 1.00 0.00 H new ATOM 0 HB THR A 46 24.155 -2.180 -3.126 1.00 0.00 H new ATOM 0 HG1 THR A 46 25.990 -2.131 -4.354 1.00 0.00 H new ATOM 0 HG21 THR A 46 23.095 -3.862 -4.569 1.00 0.00 H new ATOM 0 HG22 THR A 46 21.964 -2.575 -4.087 1.00 0.00 H new ATOM 0 HG23 THR A 46 22.656 -2.583 -5.726 1.00 0.00 H new ATOM 409 N GLN A 47 21.600 0.450 -4.747 1.00 0.00 N ATOM 410 CA GLN A 47 20.279 0.888 -4.465 1.00 0.00 C ATOM 411 C GLN A 47 19.312 -0.285 -4.508 1.00 0.00 C ATOM 412 O GLN A 47 19.461 -1.204 -5.317 1.00 0.00 O ATOM 413 CB GLN A 47 19.874 2.010 -5.436 1.00 0.00 C ATOM 414 CG GLN A 47 19.741 1.584 -6.890 1.00 0.00 C ATOM 415 CD GLN A 47 19.652 2.752 -7.855 1.00 0.00 C ATOM 416 OE1 GLN A 47 19.147 3.884 -7.404 1.00 0.00 O flip ATOM 417 NE2 GLN A 47 20.074 2.640 -9.011 1.00 0.00 N flip ATOM 0 H GLN A 47 21.873 0.557 -5.724 1.00 0.00 H new ATOM 0 HA GLN A 47 20.242 1.300 -3.456 1.00 0.00 H new ATOM 0 HB2 GLN A 47 18.923 2.429 -5.107 1.00 0.00 H new ATOM 0 HB3 GLN A 47 20.613 2.809 -5.373 1.00 0.00 H new ATOM 0 HG2 GLN A 47 20.597 0.965 -7.159 1.00 0.00 H new ATOM 0 HG3 GLN A 47 18.851 0.964 -6.999 1.00 0.00 H new ATOM 0 HE21 GLN A 47 20.459 1.751 -9.330 1.00 0.00 H new ATOM 0 HE22 GLN A 47 20.038 3.437 -9.647 1.00 0.00 H new ATOM 426 N ALA A 48 18.372 -0.264 -3.624 1.00 0.00 N ATOM 427 CA ALA A 48 17.373 -1.275 -3.528 1.00 0.00 C ATOM 428 C ALA A 48 16.068 -0.676 -3.927 1.00 0.00 C ATOM 429 O ALA A 48 15.656 0.357 -3.377 1.00 0.00 O ATOM 430 CB ALA A 48 17.283 -1.814 -2.115 1.00 0.00 C ATOM 0 H ALA A 48 18.275 0.477 -2.930 1.00 0.00 H new ATOM 0 HA ALA A 48 17.630 -2.106 -4.185 1.00 0.00 H new ATOM 0 HB1 ALA A 48 16.513 -2.584 -2.068 1.00 0.00 H new ATOM 0 HB2 ALA A 48 18.243 -2.242 -1.827 1.00 0.00 H new ATOM 0 HB3 ALA A 48 17.028 -1.004 -1.432 1.00 0.00 H new ATOM 436 N ILE A 49 15.448 -1.273 -4.887 1.00 0.00 N ATOM 437 CA ILE A 49 14.185 -0.808 -5.376 1.00 0.00 C ATOM 438 C ILE A 49 13.089 -1.566 -4.650 1.00 0.00 C ATOM 439 O ILE A 49 13.184 -2.796 -4.476 1.00 0.00 O ATOM 440 CB ILE A 49 14.080 -1.043 -6.903 1.00 0.00 C ATOM 441 CG1 ILE A 49 15.295 -0.405 -7.597 1.00 0.00 C ATOM 442 CG2 ILE A 49 12.781 -0.445 -7.445 1.00 0.00 C ATOM 443 CD1 ILE A 49 15.406 -0.702 -9.079 1.00 0.00 C ATOM 0 H ILE A 49 15.802 -2.104 -5.361 1.00 0.00 H new ATOM 0 HA ILE A 49 14.084 0.262 -5.194 1.00 0.00 H new ATOM 0 HB ILE A 49 14.071 -2.114 -7.105 1.00 0.00 H new ATOM 0 HG12 ILE A 49 15.249 0.675 -7.459 1.00 0.00 H new ATOM 0 HG13 ILE A 49 16.202 -0.751 -7.102 1.00 0.00 H new ATOM 0 HG21 ILE A 49 12.721 -0.618 -8.520 1.00 0.00 H new ATOM 0 HG22 ILE A 49 11.930 -0.917 -6.954 1.00 0.00 H new ATOM 0 HG23 ILE A 49 12.764 0.627 -7.249 1.00 0.00 H new ATOM 0 HD11 ILE A 49 16.292 -0.211 -9.483 1.00 0.00 H new ATOM 0 HD12 ILE A 49 15.487 -1.779 -9.229 1.00 0.00 H new ATOM 0 HD13 ILE A 49 14.519 -0.330 -9.592 1.00 0.00 H new ATOM 455 N TYR A 50 12.115 -0.856 -4.159 1.00 0.00 N ATOM 456 CA TYR A 50 11.026 -1.481 -3.462 1.00 0.00 C ATOM 457 C TYR A 50 9.731 -1.427 -4.222 1.00 0.00 C ATOM 458 O TYR A 50 9.450 -0.473 -4.945 1.00 0.00 O ATOM 459 CB TYR A 50 10.820 -0.870 -2.082 1.00 0.00 C ATOM 460 CG TYR A 50 11.890 -1.223 -1.097 1.00 0.00 C ATOM 461 CD1 TYR A 50 11.813 -2.398 -0.371 1.00 0.00 C ATOM 462 CD2 TYR A 50 12.971 -0.396 -0.888 1.00 0.00 C ATOM 463 CE1 TYR A 50 12.781 -2.741 0.533 1.00 0.00 C ATOM 464 CE2 TYR A 50 13.944 -0.732 0.014 1.00 0.00 C ATOM 465 CZ TYR A 50 13.849 -1.902 0.722 1.00 0.00 C ATOM 466 OH TYR A 50 14.824 -2.230 1.624 1.00 0.00 O ATOM 0 H TYR A 50 12.052 0.160 -4.228 1.00 0.00 H new ATOM 0 HA TYR A 50 11.313 -2.528 -3.360 1.00 0.00 H new ATOM 0 HB2 TYR A 50 10.773 0.215 -2.179 1.00 0.00 H new ATOM 0 HB3 TYR A 50 9.857 -1.197 -1.690 1.00 0.00 H new ATOM 0 HD1 TYR A 50 10.971 -3.058 -0.521 1.00 0.00 H new ATOM 0 HD2 TYR A 50 13.052 0.528 -1.442 1.00 0.00 H new ATOM 0 HE1 TYR A 50 12.705 -3.662 1.091 1.00 0.00 H new ATOM 0 HE2 TYR A 50 14.787 -0.075 0.168 1.00 0.00 H new ATOM 0 HH TYR A 50 15.124 -1.422 2.090 1.00 0.00 H new ATOM 476 N LYS A 51 8.973 -2.484 -4.079 1.00 0.00 N ATOM 477 CA LYS A 51 7.634 -2.529 -4.537 1.00 0.00 C ATOM 478 C LYS A 51 6.804 -2.129 -3.343 1.00 0.00 C ATOM 479 O LYS A 51 7.114 -2.521 -2.201 1.00 0.00 O ATOM 480 CB LYS A 51 7.200 -3.940 -5.045 1.00 0.00 C ATOM 481 CG LYS A 51 7.139 -5.031 -3.984 1.00 0.00 C ATOM 482 CD LYS A 51 6.399 -6.277 -4.483 1.00 0.00 C ATOM 483 CE LYS A 51 7.168 -7.097 -5.527 1.00 0.00 C ATOM 484 NZ LYS A 51 8.266 -7.901 -4.932 1.00 0.00 N ATOM 0 H LYS A 51 9.287 -3.345 -3.632 1.00 0.00 H new ATOM 0 HA LYS A 51 7.506 -1.869 -5.395 1.00 0.00 H new ATOM 0 HB2 LYS A 51 6.217 -3.853 -5.508 1.00 0.00 H new ATOM 0 HB3 LYS A 51 7.893 -4.255 -5.825 1.00 0.00 H new ATOM 0 HG2 LYS A 51 8.151 -5.305 -3.687 1.00 0.00 H new ATOM 0 HG3 LYS A 51 6.640 -4.645 -3.095 1.00 0.00 H new ATOM 0 HD2 LYS A 51 6.175 -6.917 -3.630 1.00 0.00 H new ATOM 0 HD3 LYS A 51 5.445 -5.970 -4.911 1.00 0.00 H new ATOM 0 HE2 LYS A 51 6.475 -7.762 -6.042 1.00 0.00 H new ATOM 0 HE3 LYS A 51 7.582 -6.424 -6.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 8.411 -8.762 -5.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 9.142 -7.340 -4.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 8.015 -8.164 -3.958 1.00 0.00 H new ATOM 498 N CYS A 52 5.782 -1.400 -3.577 1.00 0.00 N ATOM 499 CA CYS A 52 4.942 -0.873 -2.509 1.00 0.00 C ATOM 500 C CYS A 52 3.890 -1.858 -2.058 1.00 0.00 C ATOM 501 O CYS A 52 2.908 -1.471 -1.459 1.00 0.00 O ATOM 502 CB CYS A 52 4.265 0.394 -2.977 1.00 0.00 C ATOM 503 SG CYS A 52 5.364 1.831 -3.127 1.00 0.00 S ATOM 0 H CYS A 52 5.480 -1.135 -4.514 1.00 0.00 H new ATOM 0 HA CYS A 52 5.592 -0.672 -1.658 1.00 0.00 H new ATOM 0 HB2 CYS A 52 3.802 0.206 -3.945 1.00 0.00 H new ATOM 0 HB3 CYS A 52 3.462 0.639 -2.282 1.00 0.00 H new ATOM 508 N ARG A 53 4.128 -3.135 -2.307 1.00 0.00 N ATOM 509 CA ARG A 53 3.157 -4.210 -2.029 1.00 0.00 C ATOM 510 C ARG A 53 1.909 -4.039 -2.916 1.00 0.00 C ATOM 511 O ARG A 53 1.706 -2.981 -3.538 1.00 0.00 O ATOM 512 CB ARG A 53 2.741 -4.257 -0.529 1.00 0.00 C ATOM 513 CG ARG A 53 3.859 -4.568 0.432 1.00 0.00 C ATOM 514 CD ARG A 53 3.340 -4.710 1.851 1.00 0.00 C ATOM 515 NE ARG A 53 2.375 -5.807 1.984 1.00 0.00 N ATOM 516 CZ ARG A 53 1.653 -6.072 3.080 1.00 0.00 C ATOM 517 NH1 ARG A 53 1.825 -5.350 4.195 1.00 0.00 N ATOM 518 NH2 ARG A 53 0.772 -7.071 3.062 1.00 0.00 N ATOM 0 H ARG A 53 5.003 -3.470 -2.711 1.00 0.00 H new ATOM 0 HA ARG A 53 3.646 -5.156 -2.261 1.00 0.00 H new ATOM 0 HB2 ARG A 53 2.306 -3.295 -0.258 1.00 0.00 H new ATOM 0 HB3 ARG A 53 1.959 -5.006 -0.408 1.00 0.00 H new ATOM 0 HG2 ARG A 53 4.356 -5.490 0.130 1.00 0.00 H new ATOM 0 HG3 ARG A 53 4.606 -3.776 0.393 1.00 0.00 H new ATOM 0 HD2 ARG A 53 4.178 -4.882 2.526 1.00 0.00 H new ATOM 0 HD3 ARG A 53 2.870 -3.776 2.159 1.00 0.00 H new ATOM 0 HE ARG A 53 2.244 -6.417 1.177 1.00 0.00 H new ATOM 0 HH11 ARG A 53 2.509 -4.594 4.212 1.00 0.00 H new ATOM 0 HH12 ARG A 53 1.272 -5.557 5.027 1.00 0.00 H new ATOM 0 HH21 ARG A 53 0.651 -7.629 2.217 1.00 0.00 H new ATOM 0 HH22 ARG A 53 0.219 -7.278 3.894 1.00 0.00 H new ATOM 532 N PRO A 54 1.105 -5.065 -3.074 1.00 0.00 N ATOM 533 CA PRO A 54 -0.134 -4.917 -3.781 1.00 0.00 C ATOM 534 C PRO A 54 -1.142 -4.106 -2.942 1.00 0.00 C ATOM 535 O PRO A 54 -1.566 -4.527 -1.856 1.00 0.00 O ATOM 536 CB PRO A 54 -0.596 -6.361 -4.016 1.00 0.00 C ATOM 537 CG PRO A 54 0.049 -7.151 -2.935 1.00 0.00 C ATOM 538 CD PRO A 54 1.347 -6.464 -2.640 1.00 0.00 C ATOM 0 HA PRO A 54 -0.038 -4.368 -4.718 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -1.682 -6.441 -3.969 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -0.293 -6.717 -5.000 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -0.583 -7.188 -2.048 1.00 0.00 H new ATOM 0 HG3 PRO A 54 0.216 -8.181 -3.251 1.00 0.00 H new ATOM 0 HD2 PRO A 54 1.598 -6.518 -1.581 1.00 0.00 H new ATOM 0 HD3 PRO A 54 2.174 -6.917 -3.187 1.00 0.00 H new ATOM 546 N GLY A 55 -1.457 -2.919 -3.410 1.00 0.00 N ATOM 547 CA GLY A 55 -2.418 -2.092 -2.739 1.00 0.00 C ATOM 548 C GLY A 55 -1.879 -0.733 -2.364 1.00 0.00 C ATOM 549 O GLY A 55 -2.633 0.224 -2.233 1.00 0.00 O ATOM 0 H GLY A 55 -1.058 -2.510 -4.255 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -3.289 -1.965 -3.382 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -2.759 -2.601 -1.838 1.00 0.00 H new ATOM 553 N TYR A 56 -0.603 -0.626 -2.183 1.00 0.00 N ATOM 554 CA TYR A 56 -0.038 0.657 -1.830 1.00 0.00 C ATOM 555 C TYR A 56 0.612 1.284 -3.044 1.00 0.00 C ATOM 556 O TYR A 56 0.874 0.602 -4.054 1.00 0.00 O ATOM 557 CB TYR A 56 0.969 0.551 -0.678 1.00 0.00 C ATOM 558 CG TYR A 56 0.411 0.007 0.620 1.00 0.00 C ATOM 559 CD1 TYR A 56 0.406 -1.356 0.883 1.00 0.00 C ATOM 560 CD2 TYR A 56 -0.098 0.858 1.585 1.00 0.00 C ATOM 561 CE1 TYR A 56 -0.092 -1.854 2.069 1.00 0.00 C ATOM 562 CE2 TYR A 56 -0.600 0.373 2.775 1.00 0.00 C ATOM 563 CZ TYR A 56 -0.594 -0.986 3.013 1.00 0.00 C ATOM 564 OH TYR A 56 -1.096 -1.477 4.202 1.00 0.00 O ATOM 0 H TYR A 56 0.067 -1.390 -2.269 1.00 0.00 H new ATOM 0 HA TYR A 56 -0.853 1.293 -1.484 1.00 0.00 H new ATOM 0 HB2 TYR A 56 1.794 -0.087 -0.996 1.00 0.00 H new ATOM 0 HB3 TYR A 56 1.386 1.540 -0.489 1.00 0.00 H new ATOM 0 HD1 TYR A 56 0.799 -2.039 0.145 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -0.102 1.923 1.403 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -0.088 -2.918 2.256 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -0.995 1.053 3.515 1.00 0.00 H new ATOM 0 HH TYR A 56 -1.409 -0.733 4.757 1.00 0.00 H new ATOM 574 N ARG A 57 0.862 2.553 -2.966 1.00 0.00 N ATOM 575 CA ARG A 57 1.490 3.279 -4.035 1.00 0.00 C ATOM 576 C ARG A 57 2.453 4.256 -3.448 1.00 0.00 C ATOM 577 O ARG A 57 2.594 4.343 -2.249 1.00 0.00 O ATOM 578 CB ARG A 57 0.480 4.057 -4.899 1.00 0.00 C ATOM 579 CG ARG A 57 -0.265 5.169 -4.159 1.00 0.00 C ATOM 580 CD ARG A 57 -0.950 6.122 -5.128 1.00 0.00 C ATOM 581 NE ARG A 57 0.028 6.851 -5.967 1.00 0.00 N ATOM 582 CZ ARG A 57 -0.263 7.805 -6.870 1.00 0.00 C ATOM 583 NH1 ARG A 57 -1.523 8.174 -7.087 1.00 0.00 N ATOM 584 NH2 ARG A 57 0.723 8.370 -7.566 1.00 0.00 N ATOM 0 H ARG A 57 0.635 3.124 -2.152 1.00 0.00 H new ATOM 0 HA ARG A 57 1.988 2.551 -4.676 1.00 0.00 H new ATOM 0 HB2 ARG A 57 1.007 4.493 -5.748 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -0.249 3.355 -5.303 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -1.008 4.730 -3.493 1.00 0.00 H new ATOM 0 HG3 ARG A 57 0.435 5.724 -3.535 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -1.631 5.562 -5.768 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -1.553 6.837 -4.569 1.00 0.00 H new ATOM 0 HE ARG A 57 1.012 6.608 -5.850 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -2.281 7.732 -6.566 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -1.731 8.898 -7.774 1.00 0.00 H new ATOM 0 HH21 ARG A 57 1.688 8.078 -7.412 1.00 0.00 H new ATOM 0 HH22 ARG A 57 0.513 9.094 -8.253 1.00 0.00 H new ATOM 598 N SER A 58 3.075 4.996 -4.276 1.00 0.00 N ATOM 599 CA SER A 58 3.941 6.013 -3.848 1.00 0.00 C ATOM 600 C SER A 58 3.786 7.154 -4.812 1.00 0.00 C ATOM 601 O SER A 58 2.927 7.094 -5.709 1.00 0.00 O ATOM 602 CB SER A 58 5.372 5.482 -3.790 1.00 0.00 C ATOM 603 OG SER A 58 5.798 5.006 -5.052 1.00 0.00 O ATOM 0 H SER A 58 2.995 4.910 -5.289 1.00 0.00 H new ATOM 0 HA SER A 58 3.702 6.359 -2.842 1.00 0.00 H new ATOM 0 HB2 SER A 58 6.042 6.273 -3.453 1.00 0.00 H new ATOM 0 HB3 SER A 58 5.434 4.678 -3.057 1.00 0.00 H new ATOM 0 HG SER A 58 6.718 4.674 -4.983 1.00 0.00 H new ATOM 609 N LEU A 59 4.547 8.185 -4.634 1.00 0.00 N ATOM 610 CA LEU A 59 4.484 9.313 -5.524 1.00 0.00 C ATOM 611 C LEU A 59 5.679 9.292 -6.466 1.00 0.00 C ATOM 612 O LEU A 59 5.886 10.212 -7.246 1.00 0.00 O ATOM 613 CB LEU A 59 4.433 10.637 -4.737 1.00 0.00 C ATOM 614 CG LEU A 59 3.179 10.934 -3.871 1.00 0.00 C ATOM 615 CD1 LEU A 59 1.889 10.799 -4.671 1.00 0.00 C ATOM 616 CD2 LEU A 59 3.143 10.088 -2.602 1.00 0.00 C ATOM 0 H LEU A 59 5.225 8.275 -3.878 1.00 0.00 H new ATOM 0 HA LEU A 59 3.568 9.243 -6.111 1.00 0.00 H new ATOM 0 HB2 LEU A 59 5.304 10.667 -4.082 1.00 0.00 H new ATOM 0 HB3 LEU A 59 4.543 11.452 -5.452 1.00 0.00 H new ATOM 0 HG LEU A 59 3.257 11.975 -3.558 1.00 0.00 H new ATOM 0 HD11 LEU A 59 1.037 11.015 -4.027 1.00 0.00 H new ATOM 0 HD12 LEU A 59 1.902 11.502 -5.504 1.00 0.00 H new ATOM 0 HD13 LEU A 59 1.804 9.783 -5.056 1.00 0.00 H new ATOM 0 HD21 LEU A 59 2.248 10.330 -2.028 1.00 0.00 H new ATOM 0 HD22 LEU A 59 3.127 9.031 -2.869 1.00 0.00 H new ATOM 0 HD23 LEU A 59 4.027 10.297 -2.000 1.00 0.00 H new ATOM 628 N GLY A 60 6.456 8.228 -6.393 1.00 0.00 N ATOM 629 CA GLY A 60 7.609 8.096 -7.231 1.00 0.00 C ATOM 630 C GLY A 60 8.156 6.702 -7.175 1.00 0.00 C ATOM 631 O GLY A 60 7.488 5.753 -7.575 1.00 0.00 O ATOM 0 H GLY A 60 6.300 7.446 -5.757 1.00 0.00 H new ATOM 0 HA2 GLY A 60 7.347 8.347 -8.259 1.00 0.00 H new ATOM 0 HA3 GLY A 60 8.375 8.804 -6.916 1.00 0.00 H new ATOM 635 N ASN A 61 9.351 6.574 -6.676 1.00 0.00 N ATOM 636 CA ASN A 61 10.006 5.288 -6.521 1.00 0.00 C ATOM 637 C ASN A 61 10.727 5.239 -5.193 1.00 0.00 C ATOM 638 O ASN A 61 11.550 6.105 -4.893 1.00 0.00 O ATOM 639 CB ASN A 61 10.979 4.976 -7.700 1.00 0.00 C ATOM 640 CG ASN A 61 12.063 6.038 -7.956 1.00 0.00 C ATOM 641 OD1 ASN A 61 11.863 7.230 -7.715 1.00 0.00 O ATOM 642 ND2 ASN A 61 13.184 5.622 -8.485 1.00 0.00 N ATOM 0 H ASN A 61 9.913 7.364 -6.358 1.00 0.00 H new ATOM 0 HA ASN A 61 9.238 4.515 -6.540 1.00 0.00 H new ATOM 0 HB2 ASN A 61 11.468 4.022 -7.503 1.00 0.00 H new ATOM 0 HB3 ASN A 61 10.393 4.852 -8.610 1.00 0.00 H new ATOM 0 HD21 ASN A 61 13.921 6.290 -8.709 1.00 0.00 H new ATOM 0 HD22 ASN A 61 13.321 4.629 -8.673 1.00 0.00 H new ATOM 649 N VAL A 62 10.387 4.262 -4.381 1.00 0.00 N ATOM 650 CA VAL A 62 10.995 4.110 -3.074 1.00 0.00 C ATOM 651 C VAL A 62 12.290 3.357 -3.231 1.00 0.00 C ATOM 652 O VAL A 62 12.304 2.166 -3.580 1.00 0.00 O ATOM 653 CB VAL A 62 10.059 3.383 -2.077 1.00 0.00 C ATOM 654 CG1 VAL A 62 10.711 3.262 -0.700 1.00 0.00 C ATOM 655 CG2 VAL A 62 8.743 4.129 -1.971 1.00 0.00 C ATOM 0 H VAL A 62 9.687 3.555 -4.604 1.00 0.00 H new ATOM 0 HA VAL A 62 11.183 5.100 -2.659 1.00 0.00 H new ATOM 0 HB VAL A 62 9.873 2.376 -2.450 1.00 0.00 H new ATOM 0 HG11 VAL A 62 10.032 2.748 -0.020 1.00 0.00 H new ATOM 0 HG12 VAL A 62 11.638 2.695 -0.785 1.00 0.00 H new ATOM 0 HG13 VAL A 62 10.929 4.257 -0.312 1.00 0.00 H new ATOM 0 HG21 VAL A 62 8.088 3.614 -1.268 1.00 0.00 H new ATOM 0 HG22 VAL A 62 8.927 5.144 -1.618 1.00 0.00 H new ATOM 0 HG23 VAL A 62 8.266 4.167 -2.951 1.00 0.00 H new ATOM 665 N ILE A 63 13.370 4.059 -3.023 1.00 0.00 N ATOM 666 CA ILE A 63 14.674 3.520 -3.248 1.00 0.00 C ATOM 667 C ILE A 63 15.517 3.629 -1.988 1.00 0.00 C ATOM 668 O ILE A 63 15.584 4.694 -1.352 1.00 0.00 O ATOM 669 CB ILE A 63 15.398 4.286 -4.407 1.00 0.00 C ATOM 670 CG1 ILE A 63 14.571 4.269 -5.705 1.00 0.00 C ATOM 671 CG2 ILE A 63 16.789 3.722 -4.668 1.00 0.00 C ATOM 672 CD1 ILE A 63 14.300 2.890 -6.260 1.00 0.00 C ATOM 0 H ILE A 63 13.366 5.024 -2.692 1.00 0.00 H new ATOM 0 HA ILE A 63 14.558 2.472 -3.524 1.00 0.00 H new ATOM 0 HB ILE A 63 15.501 5.321 -4.080 1.00 0.00 H new ATOM 0 HG12 ILE A 63 13.618 4.766 -5.520 1.00 0.00 H new ATOM 0 HG13 ILE A 63 15.094 4.854 -6.461 1.00 0.00 H new ATOM 0 HG21 ILE A 63 17.261 4.278 -5.478 1.00 0.00 H new ATOM 0 HG22 ILE A 63 17.394 3.813 -3.766 1.00 0.00 H new ATOM 0 HG23 ILE A 63 16.709 2.671 -4.947 1.00 0.00 H new ATOM 0 HD11 ILE A 63 13.712 2.975 -7.174 1.00 0.00 H new ATOM 0 HD12 ILE A 63 15.245 2.395 -6.481 1.00 0.00 H new ATOM 0 HD13 ILE A 63 13.747 2.304 -5.526 1.00 0.00 H new ATOM 684 N MET A 64 16.129 2.541 -1.617 1.00 0.00 N ATOM 685 CA MET A 64 17.111 2.557 -0.540 1.00 0.00 C ATOM 686 C MET A 64 18.450 2.302 -1.140 1.00 0.00 C ATOM 687 O MET A 64 18.531 2.063 -2.325 1.00 0.00 O ATOM 688 CB MET A 64 16.831 1.552 0.577 1.00 0.00 C ATOM 689 CG MET A 64 15.646 1.911 1.448 1.00 0.00 C ATOM 690 SD MET A 64 15.391 0.749 2.809 1.00 0.00 S ATOM 691 CE MET A 64 16.864 1.038 3.798 1.00 0.00 C ATOM 0 H MET A 64 15.974 1.625 -2.037 1.00 0.00 H new ATOM 0 HA MET A 64 17.062 3.535 -0.061 1.00 0.00 H new ATOM 0 HB2 MET A 64 16.659 0.571 0.134 1.00 0.00 H new ATOM 0 HB3 MET A 64 17.718 1.467 1.205 1.00 0.00 H new ATOM 0 HG2 MET A 64 15.791 2.912 1.855 1.00 0.00 H new ATOM 0 HG3 MET A 64 14.747 1.944 0.833 1.00 0.00 H new ATOM 0 HE1 MET A 64 17.261 0.085 4.147 1.00 0.00 H new ATOM 0 HE2 MET A 64 17.616 1.544 3.192 1.00 0.00 H new ATOM 0 HE3 MET A 64 16.610 1.661 4.655 1.00 0.00 H new ATOM 701 N VAL A 65 19.485 2.368 -0.372 1.00 0.00 N ATOM 702 CA VAL A 65 20.806 2.118 -0.906 1.00 0.00 C ATOM 703 C VAL A 65 21.779 1.709 0.194 1.00 0.00 C ATOM 704 O VAL A 65 21.663 2.135 1.340 1.00 0.00 O ATOM 705 CB VAL A 65 21.350 3.333 -1.756 1.00 0.00 C ATOM 706 CG1 VAL A 65 21.601 4.526 -0.935 1.00 0.00 C ATOM 707 CG2 VAL A 65 22.599 3.007 -2.527 1.00 0.00 C ATOM 0 H VAL A 65 19.456 2.591 0.623 1.00 0.00 H new ATOM 0 HA VAL A 65 20.719 1.278 -1.595 1.00 0.00 H new ATOM 0 HB VAL A 65 20.551 3.545 -2.466 1.00 0.00 H new ATOM 0 HG11 VAL A 65 21.974 5.331 -1.568 1.00 0.00 H new ATOM 0 HG12 VAL A 65 20.673 4.840 -0.456 1.00 0.00 H new ATOM 0 HG13 VAL A 65 22.342 4.292 -0.171 1.00 0.00 H new ATOM 0 HG21 VAL A 65 22.919 3.884 -3.089 1.00 0.00 H new ATOM 0 HG22 VAL A 65 23.387 2.712 -1.835 1.00 0.00 H new ATOM 0 HG23 VAL A 65 22.397 2.188 -3.217 1.00 0.00 H new ATOM 717 N CYS A 66 22.650 0.822 -0.160 1.00 0.00 N ATOM 718 CA CYS A 66 23.692 0.322 0.695 1.00 0.00 C ATOM 719 C CYS A 66 24.780 1.360 0.822 1.00 0.00 C ATOM 720 O CYS A 66 25.308 1.811 -0.195 1.00 0.00 O ATOM 721 CB CYS A 66 24.282 -0.926 0.040 1.00 0.00 C ATOM 722 SG CYS A 66 25.679 -1.668 0.920 1.00 0.00 S ATOM 0 H CYS A 66 22.661 0.404 -1.091 1.00 0.00 H new ATOM 0 HA CYS A 66 23.290 0.092 1.682 1.00 0.00 H new ATOM 0 HB2 CYS A 66 23.495 -1.674 -0.056 1.00 0.00 H new ATOM 0 HB3 CYS A 66 24.603 -0.670 -0.970 1.00 0.00 H new ATOM 727 N ARG A 67 25.104 1.760 2.026 1.00 0.00 N ATOM 728 CA ARG A 67 26.180 2.689 2.232 1.00 0.00 C ATOM 729 C ARG A 67 26.740 2.533 3.636 1.00 0.00 C ATOM 730 O ARG A 67 25.983 2.399 4.589 1.00 0.00 O ATOM 731 CB ARG A 67 25.740 4.138 1.964 1.00 0.00 C ATOM 732 CG ARG A 67 26.902 5.103 1.974 1.00 0.00 C ATOM 733 CD ARG A 67 26.513 6.498 1.569 1.00 0.00 C ATOM 734 NE ARG A 67 27.692 7.373 1.548 1.00 0.00 N ATOM 735 CZ ARG A 67 27.745 8.590 1.007 1.00 0.00 C ATOM 736 NH1 ARG A 67 26.653 9.140 0.450 1.00 0.00 N ATOM 737 NH2 ARG A 67 28.890 9.265 1.030 1.00 0.00 N ATOM 0 H ARG A 67 24.635 1.454 2.879 1.00 0.00 H new ATOM 0 HA ARG A 67 26.969 2.461 1.515 1.00 0.00 H new ATOM 0 HB2 ARG A 67 25.237 4.189 0.999 1.00 0.00 H new ATOM 0 HB3 ARG A 67 25.014 4.440 2.719 1.00 0.00 H new ATOM 0 HG2 ARG A 67 27.337 5.129 2.973 1.00 0.00 H new ATOM 0 HG3 ARG A 67 27.676 4.738 1.299 1.00 0.00 H new ATOM 0 HD2 ARG A 67 26.048 6.481 0.584 1.00 0.00 H new ATOM 0 HD3 ARG A 67 25.772 6.892 2.265 1.00 0.00 H new ATOM 0 HE ARG A 67 28.543 7.019 1.985 1.00 0.00 H new ATOM 0 HH11 ARG A 67 25.772 8.626 0.438 1.00 0.00 H new ATOM 0 HH12 ARG A 67 26.705 10.072 0.039 1.00 0.00 H new ATOM 0 HH21 ARG A 67 29.718 8.851 1.459 1.00 0.00 H new ATOM 0 HH22 ARG A 67 28.941 10.197 0.619 1.00 0.00 H new ATOM 751 N LYS A 68 28.077 2.494 3.748 1.00 0.00 N ATOM 752 CA LYS A 68 28.791 2.354 5.039 1.00 0.00 C ATOM 753 C LYS A 68 28.478 1.043 5.732 1.00 0.00 C ATOM 754 O LYS A 68 28.668 0.902 6.941 1.00 0.00 O ATOM 755 CB LYS A 68 28.494 3.531 5.962 1.00 0.00 C ATOM 756 CG LYS A 68 28.940 4.861 5.394 1.00 0.00 C ATOM 757 CD LYS A 68 30.451 4.921 5.240 1.00 0.00 C ATOM 758 CE LYS A 68 31.162 5.001 6.577 1.00 0.00 C ATOM 759 NZ LYS A 68 32.611 5.229 6.411 1.00 0.00 N ATOM 0 H LYS A 68 28.702 2.559 2.944 1.00 0.00 H new ATOM 0 HA LYS A 68 29.856 2.352 4.808 1.00 0.00 H new ATOM 0 HB2 LYS A 68 27.423 3.568 6.159 1.00 0.00 H new ATOM 0 HB3 LYS A 68 28.989 3.368 6.919 1.00 0.00 H new ATOM 0 HG2 LYS A 68 28.468 5.021 4.425 1.00 0.00 H new ATOM 0 HG3 LYS A 68 28.607 5.667 6.048 1.00 0.00 H new ATOM 0 HD2 LYS A 68 30.794 4.038 4.700 1.00 0.00 H new ATOM 0 HD3 LYS A 68 30.718 5.788 4.636 1.00 0.00 H new ATOM 0 HE2 LYS A 68 30.732 5.808 7.170 1.00 0.00 H new ATOM 0 HE3 LYS A 68 31.000 4.077 7.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 33.064 5.278 7.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 33.025 4.446 5.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 32.766 6.124 5.904 1.00 0.00 H new ATOM 773 N GLY A 69 28.022 0.091 4.975 1.00 0.00 N ATOM 774 CA GLY A 69 27.733 -1.204 5.511 1.00 0.00 C ATOM 775 C GLY A 69 26.293 -1.366 5.883 1.00 0.00 C ATOM 776 O GLY A 69 25.850 -2.480 6.161 1.00 0.00 O ATOM 0 H GLY A 69 27.841 0.189 3.976 1.00 0.00 H new ATOM 0 HA2 GLY A 69 28.003 -1.965 4.778 1.00 0.00 H new ATOM 0 HA3 GLY A 69 28.353 -1.375 6.391 1.00 0.00 H new ATOM 780 N GLU A 70 25.546 -0.287 5.885 1.00 0.00 N ATOM 781 CA GLU A 70 24.164 -0.374 6.267 1.00 0.00 C ATOM 782 C GLU A 70 23.247 0.106 5.157 1.00 0.00 C ATOM 783 O GLU A 70 23.673 0.811 4.240 1.00 0.00 O ATOM 784 CB GLU A 70 23.929 0.397 7.563 1.00 0.00 C ATOM 785 CG GLU A 70 24.291 1.864 7.492 1.00 0.00 C ATOM 786 CD GLU A 70 24.209 2.522 8.829 1.00 0.00 C ATOM 787 OE1 GLU A 70 23.099 2.935 9.251 1.00 0.00 O ATOM 788 OE2 GLU A 70 25.255 2.640 9.505 1.00 0.00 O ATOM 0 H GLU A 70 25.869 0.646 5.630 1.00 0.00 H new ATOM 0 HA GLU A 70 23.922 -1.422 6.443 1.00 0.00 H new ATOM 0 HB2 GLU A 70 22.878 0.308 7.839 1.00 0.00 H new ATOM 0 HB3 GLU A 70 24.509 -0.070 8.359 1.00 0.00 H new ATOM 0 HG2 GLU A 70 25.301 1.970 7.096 1.00 0.00 H new ATOM 0 HG3 GLU A 70 23.621 2.370 6.796 1.00 0.00 H new ATOM 795 N TRP A 71 22.011 -0.294 5.220 1.00 0.00 N ATOM 796 CA TRP A 71 21.043 0.131 4.252 1.00 0.00 C ATOM 797 C TRP A 71 20.370 1.391 4.706 1.00 0.00 C ATOM 798 O TRP A 71 19.718 1.438 5.760 1.00 0.00 O ATOM 799 CB TRP A 71 20.046 -0.983 3.916 1.00 0.00 C ATOM 800 CG TRP A 71 20.680 -2.088 3.133 1.00 0.00 C ATOM 801 CD1 TRP A 71 21.332 -3.173 3.622 1.00 0.00 C ATOM 802 CD2 TRP A 71 20.736 -2.197 1.707 1.00 0.00 C ATOM 803 NE1 TRP A 71 21.795 -3.943 2.589 1.00 0.00 N ATOM 804 CE2 TRP A 71 21.449 -3.368 1.406 1.00 0.00 C ATOM 805 CE3 TRP A 71 20.255 -1.415 0.661 1.00 0.00 C ATOM 806 CZ2 TRP A 71 21.697 -3.776 0.092 1.00 0.00 C ATOM 807 CZ3 TRP A 71 20.496 -1.822 -0.633 1.00 0.00 C ATOM 808 CH2 TRP A 71 21.213 -2.988 -0.906 1.00 0.00 C ATOM 0 H TRP A 71 21.647 -0.920 5.939 1.00 0.00 H new ATOM 0 HA TRP A 71 21.564 0.355 3.321 1.00 0.00 H new ATOM 0 HB2 TRP A 71 19.629 -1.386 4.839 1.00 0.00 H new ATOM 0 HB3 TRP A 71 19.215 -0.566 3.346 1.00 0.00 H new ATOM 0 HD1 TRP A 71 21.466 -3.396 4.670 1.00 0.00 H new ATOM 0 HE1 TRP A 71 22.318 -4.813 2.691 1.00 0.00 H new ATOM 0 HE3 TRP A 71 19.704 -0.508 0.860 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 22.250 -4.679 -0.122 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 20.122 -1.227 -1.453 1.00 0.00 H new ATOM 0 HH2 TRP A 71 21.388 -3.271 -1.933 1.00 0.00 H new ATOM 819 N VAL A 72 20.557 2.413 3.932 1.00 0.00 N ATOM 820 CA VAL A 72 20.022 3.705 4.214 1.00 0.00 C ATOM 821 C VAL A 72 19.030 4.070 3.142 1.00 0.00 C ATOM 822 O VAL A 72 18.930 3.381 2.120 1.00 0.00 O ATOM 823 CB VAL A 72 21.127 4.799 4.320 1.00 0.00 C ATOM 824 CG1 VAL A 72 22.098 4.490 5.450 1.00 0.00 C ATOM 825 CG2 VAL A 72 21.878 4.969 3.007 1.00 0.00 C ATOM 0 H VAL A 72 21.098 2.370 3.068 1.00 0.00 H new ATOM 0 HA VAL A 72 19.531 3.660 5.186 1.00 0.00 H new ATOM 0 HB VAL A 72 20.625 5.741 4.543 1.00 0.00 H new ATOM 0 HG11 VAL A 72 22.858 5.270 5.500 1.00 0.00 H new ATOM 0 HG12 VAL A 72 21.556 4.450 6.395 1.00 0.00 H new ATOM 0 HG13 VAL A 72 22.577 3.528 5.266 1.00 0.00 H new ATOM 0 HG21 VAL A 72 22.640 5.740 3.121 1.00 0.00 H new ATOM 0 HG22 VAL A 72 22.353 4.027 2.735 1.00 0.00 H new ATOM 0 HG23 VAL A 72 21.179 5.262 2.223 1.00 0.00 H new ATOM 835 N ALA A 73 18.296 5.106 3.358 1.00 0.00 N ATOM 836 CA ALA A 73 17.332 5.533 2.399 1.00 0.00 C ATOM 837 C ALA A 73 17.972 6.484 1.417 1.00 0.00 C ATOM 838 O ALA A 73 18.627 7.454 1.815 1.00 0.00 O ATOM 839 CB ALA A 73 16.131 6.179 3.080 1.00 0.00 C ATOM 0 H ALA A 73 18.345 5.680 4.200 1.00 0.00 H new ATOM 0 HA ALA A 73 16.970 4.660 1.856 1.00 0.00 H new ATOM 0 HB1 ALA A 73 15.411 6.495 2.325 1.00 0.00 H new ATOM 0 HB2 ALA A 73 15.661 5.458 3.750 1.00 0.00 H new ATOM 0 HB3 ALA A 73 16.460 7.046 3.653 1.00 0.00 H new ATOM 845 N LEU A 74 17.844 6.165 0.146 1.00 0.00 N ATOM 846 CA LEU A 74 18.293 7.030 -0.907 1.00 0.00 C ATOM 847 C LEU A 74 17.381 8.218 -0.887 1.00 0.00 C ATOM 848 O LEU A 74 17.813 9.358 -0.737 1.00 0.00 O ATOM 849 CB LEU A 74 18.160 6.297 -2.260 1.00 0.00 C ATOM 850 CG LEU A 74 18.753 6.950 -3.543 1.00 0.00 C ATOM 851 CD1 LEU A 74 18.173 8.304 -3.903 1.00 0.00 C ATOM 852 CD2 LEU A 74 20.269 6.952 -3.542 1.00 0.00 C ATOM 0 H LEU A 74 17.424 5.294 -0.179 1.00 0.00 H new ATOM 0 HA LEU A 74 19.334 7.324 -0.774 1.00 0.00 H new ATOM 0 HB2 LEU A 74 18.623 5.316 -2.148 1.00 0.00 H new ATOM 0 HB3 LEU A 74 17.098 6.130 -2.439 1.00 0.00 H new ATOM 0 HG LEU A 74 18.427 6.296 -4.352 1.00 0.00 H new ATOM 0 HD11 LEU A 74 18.650 8.675 -4.810 1.00 0.00 H new ATOM 0 HD12 LEU A 74 17.100 8.207 -4.071 1.00 0.00 H new ATOM 0 HD13 LEU A 74 18.351 9.005 -3.087 1.00 0.00 H new ATOM 0 HD21 LEU A 74 20.633 7.418 -4.458 1.00 0.00 H new ATOM 0 HD22 LEU A 74 20.632 7.513 -2.681 1.00 0.00 H new ATOM 0 HD23 LEU A 74 20.634 5.926 -3.487 1.00 0.00 H new ATOM 864 N ASN A 75 16.106 7.947 -1.016 1.00 0.00 N ATOM 865 CA ASN A 75 15.159 8.995 -1.055 1.00 0.00 C ATOM 866 C ASN A 75 14.171 8.819 0.081 1.00 0.00 C ATOM 867 O ASN A 75 13.275 7.990 -0.004 1.00 0.00 O ATOM 868 CB ASN A 75 14.419 9.025 -2.382 1.00 0.00 C ATOM 869 CG ASN A 75 13.763 10.355 -2.610 1.00 0.00 C ATOM 870 OD1 ASN A 75 12.633 10.590 -2.202 1.00 0.00 O ATOM 871 ND2 ASN A 75 14.477 11.232 -3.252 1.00 0.00 N ATOM 0 H ASN A 75 15.716 7.008 -1.094 1.00 0.00 H new ATOM 0 HA ASN A 75 15.688 9.942 -0.946 1.00 0.00 H new ATOM 0 HB2 ASN A 75 15.116 8.817 -3.194 1.00 0.00 H new ATOM 0 HB3 ASN A 75 13.665 8.238 -2.399 1.00 0.00 H new ATOM 0 HD21 ASN A 75 14.100 12.162 -3.435 1.00 0.00 H new ATOM 0 HD22 ASN A 75 15.415 10.990 -3.573 1.00 0.00 H new ATOM 878 N PRO A 76 14.340 9.569 1.177 1.00 0.00 N ATOM 879 CA PRO A 76 13.469 9.456 2.374 1.00 0.00 C ATOM 880 C PRO A 76 12.088 10.088 2.165 1.00 0.00 C ATOM 881 O PRO A 76 11.204 9.999 3.025 1.00 0.00 O ATOM 882 CB PRO A 76 14.248 10.252 3.427 1.00 0.00 C ATOM 883 CG PRO A 76 14.994 11.275 2.632 1.00 0.00 C ATOM 884 CD PRO A 76 15.412 10.575 1.375 1.00 0.00 C ATOM 0 HA PRO A 76 13.269 8.417 2.637 1.00 0.00 H new ATOM 0 HB2 PRO A 76 13.579 10.719 4.150 1.00 0.00 H new ATOM 0 HB3 PRO A 76 14.927 9.611 3.989 1.00 0.00 H new ATOM 0 HG2 PRO A 76 14.364 12.137 2.411 1.00 0.00 H new ATOM 0 HG3 PRO A 76 15.859 11.645 3.182 1.00 0.00 H new ATOM 0 HD2 PRO A 76 15.479 11.264 0.533 1.00 0.00 H new ATOM 0 HD3 PRO A 76 16.390 10.106 1.481 1.00 0.00 H new ATOM 892 N LEU A 77 11.918 10.726 1.030 1.00 0.00 N ATOM 893 CA LEU A 77 10.703 11.430 0.711 1.00 0.00 C ATOM 894 C LEU A 77 9.725 10.524 0.044 1.00 0.00 C ATOM 895 O LEU A 77 8.519 10.781 -0.005 1.00 0.00 O ATOM 896 CB LEU A 77 11.040 12.562 -0.186 1.00 0.00 C ATOM 897 CG LEU A 77 12.106 13.469 0.368 1.00 0.00 C ATOM 898 CD1 LEU A 77 12.251 14.620 -0.516 1.00 0.00 C ATOM 899 CD2 LEU A 77 11.777 13.897 1.787 1.00 0.00 C ATOM 0 H LEU A 77 12.627 10.770 0.298 1.00 0.00 H new ATOM 0 HA LEU A 77 10.245 11.798 1.629 1.00 0.00 H new ATOM 0 HB2 LEU A 77 11.372 12.168 -1.146 1.00 0.00 H new ATOM 0 HB3 LEU A 77 10.139 13.146 -0.375 1.00 0.00 H new ATOM 0 HG LEU A 77 13.053 12.931 0.413 1.00 0.00 H new ATOM 0 HD11 LEU A 77 13.021 15.285 -0.125 1.00 0.00 H new ATOM 0 HD12 LEU A 77 12.537 14.280 -1.512 1.00 0.00 H new ATOM 0 HD13 LEU A 77 11.304 15.156 -0.573 1.00 0.00 H new ATOM 0 HD21 LEU A 77 12.564 14.551 2.161 1.00 0.00 H new ATOM 0 HD22 LEU A 77 10.827 14.431 1.795 1.00 0.00 H new ATOM 0 HD23 LEU A 77 11.703 13.016 2.425 1.00 0.00 H new ATOM 911 N ARG A 78 10.240 9.473 -0.488 1.00 0.00 N ATOM 912 CA ARG A 78 9.413 8.489 -1.100 1.00 0.00 C ATOM 913 C ARG A 78 9.040 7.454 -0.088 1.00 0.00 C ATOM 914 O ARG A 78 9.880 6.959 0.655 1.00 0.00 O ATOM 915 CB ARG A 78 10.059 7.824 -2.308 1.00 0.00 C ATOM 916 CG ARG A 78 10.422 8.760 -3.439 1.00 0.00 C ATOM 917 CD ARG A 78 9.268 9.642 -3.865 1.00 0.00 C ATOM 918 NE ARG A 78 9.611 10.416 -5.059 1.00 0.00 N ATOM 919 CZ ARG A 78 8.809 11.296 -5.669 1.00 0.00 C ATOM 920 NH1 ARG A 78 7.709 11.746 -5.050 1.00 0.00 N ATOM 921 NH2 ARG A 78 9.145 11.778 -6.865 1.00 0.00 N ATOM 0 H ARG A 78 11.239 9.269 -0.513 1.00 0.00 H new ATOM 0 HA ARG A 78 8.525 9.003 -1.468 1.00 0.00 H new ATOM 0 HB2 ARG A 78 10.962 7.309 -1.980 1.00 0.00 H new ATOM 0 HB3 ARG A 78 9.379 7.063 -2.691 1.00 0.00 H new ATOM 0 HG2 ARG A 78 11.258 9.388 -3.131 1.00 0.00 H new ATOM 0 HG3 ARG A 78 10.761 8.175 -4.294 1.00 0.00 H new ATOM 0 HD2 ARG A 78 8.391 9.027 -4.066 1.00 0.00 H new ATOM 0 HD3 ARG A 78 9.004 10.319 -3.052 1.00 0.00 H new ATOM 0 HE ARG A 78 10.538 10.273 -5.459 1.00 0.00 H new ATOM 0 HH11 ARG A 78 7.482 11.418 -4.111 1.00 0.00 H new ATOM 0 HH12 ARG A 78 7.099 12.417 -5.517 1.00 0.00 H new ATOM 0 HH21 ARG A 78 10.011 11.476 -7.312 1.00 0.00 H new ATOM 0 HH22 ARG A 78 8.536 12.449 -7.334 1.00 0.00 H new ATOM 935 N LYS A 79 7.793 7.154 -0.052 1.00 0.00 N ATOM 936 CA LYS A 79 7.257 6.181 0.853 1.00 0.00 C ATOM 937 C LYS A 79 6.068 5.549 0.174 1.00 0.00 C ATOM 938 O LYS A 79 5.504 6.140 -0.766 1.00 0.00 O ATOM 939 CB LYS A 79 6.810 6.849 2.168 1.00 0.00 C ATOM 940 CG LYS A 79 5.628 7.799 2.004 1.00 0.00 C ATOM 941 CD LYS A 79 5.187 8.415 3.320 1.00 0.00 C ATOM 942 CE LYS A 79 6.209 9.390 3.871 1.00 0.00 C ATOM 943 NZ LYS A 79 5.764 9.982 5.143 1.00 0.00 N ATOM 0 H LYS A 79 7.095 7.582 -0.660 1.00 0.00 H new ATOM 0 HA LYS A 79 8.014 5.436 1.099 1.00 0.00 H new ATOM 0 HB2 LYS A 79 6.544 6.074 2.887 1.00 0.00 H new ATOM 0 HB3 LYS A 79 7.651 7.400 2.589 1.00 0.00 H new ATOM 0 HG2 LYS A 79 5.899 8.593 1.308 1.00 0.00 H new ATOM 0 HG3 LYS A 79 4.791 7.259 1.561 1.00 0.00 H new ATOM 0 HD2 LYS A 79 4.237 8.930 3.177 1.00 0.00 H new ATOM 0 HD3 LYS A 79 5.014 7.623 4.049 1.00 0.00 H new ATOM 0 HE2 LYS A 79 7.159 8.876 4.021 1.00 0.00 H new ATOM 0 HE3 LYS A 79 6.386 10.182 3.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 6.488 10.643 5.490 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 4.871 10.493 4.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 5.619 9.228 5.845 1.00 0.00 H new ATOM 957 N CYS A 80 5.699 4.395 0.607 1.00 0.00 N ATOM 958 CA CYS A 80 4.566 3.717 0.062 1.00 0.00 C ATOM 959 C CYS A 80 3.345 3.947 0.935 1.00 0.00 C ATOM 960 O CYS A 80 3.237 3.442 2.059 1.00 0.00 O ATOM 961 CB CYS A 80 4.858 2.237 -0.150 1.00 0.00 C ATOM 962 SG CYS A 80 6.249 1.941 -1.304 1.00 0.00 S ATOM 0 H CYS A 80 6.175 3.888 1.354 1.00 0.00 H new ATOM 0 HA CYS A 80 4.348 4.133 -0.922 1.00 0.00 H new ATOM 0 HB2 CYS A 80 5.086 1.776 0.811 1.00 0.00 H new ATOM 0 HB3 CYS A 80 3.963 1.747 -0.535 1.00 0.00 H new ATOM 967 N GLN A 81 2.461 4.751 0.422 1.00 0.00 N ATOM 968 CA GLN A 81 1.238 5.130 1.088 1.00 0.00 C ATOM 969 C GLN A 81 0.120 4.302 0.512 1.00 0.00 C ATOM 970 O GLN A 81 0.302 3.642 -0.516 1.00 0.00 O ATOM 971 CB GLN A 81 0.929 6.595 0.800 1.00 0.00 C ATOM 972 CG GLN A 81 2.021 7.566 1.176 1.00 0.00 C ATOM 973 CD GLN A 81 1.675 8.982 0.773 1.00 0.00 C ATOM 974 OE1 GLN A 81 0.950 9.201 -0.201 1.00 0.00 O ATOM 975 NE2 GLN A 81 2.178 9.945 1.497 1.00 0.00 N ATOM 0 H GLN A 81 2.569 5.177 -0.499 1.00 0.00 H new ATOM 0 HA GLN A 81 1.340 4.976 2.162 1.00 0.00 H new ATOM 0 HB2 GLN A 81 0.719 6.703 -0.264 1.00 0.00 H new ATOM 0 HB3 GLN A 81 0.020 6.870 1.334 1.00 0.00 H new ATOM 0 HG2 GLN A 81 2.189 7.525 2.252 1.00 0.00 H new ATOM 0 HG3 GLN A 81 2.953 7.269 0.696 1.00 0.00 H new ATOM 0 HE21 GLN A 81 2.774 9.725 2.295 1.00 0.00 H new ATOM 0 HE22 GLN A 81 1.975 10.917 1.264 1.00 0.00 H new ATOM 984 N LYS A 82 -1.023 4.337 1.136 1.00 0.00 N ATOM 985 CA LYS A 82 -2.180 3.640 0.625 1.00 0.00 C ATOM 986 C LYS A 82 -2.610 4.282 -0.667 1.00 0.00 C ATOM 987 O LYS A 82 -2.470 5.501 -0.836 1.00 0.00 O ATOM 988 CB LYS A 82 -3.340 3.721 1.596 1.00 0.00 C ATOM 989 CG LYS A 82 -3.125 3.046 2.927 1.00 0.00 C ATOM 990 CD LYS A 82 -4.388 3.145 3.739 1.00 0.00 C ATOM 991 CE LYS A 82 -4.270 2.481 5.083 1.00 0.00 C ATOM 992 NZ LYS A 82 -5.554 2.539 5.812 1.00 0.00 N ATOM 0 H LYS A 82 -1.184 4.844 2.007 1.00 0.00 H new ATOM 0 HA LYS A 82 -1.908 2.595 0.477 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -3.568 4.772 1.775 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -4.218 3.280 1.123 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -2.854 2.001 2.779 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -2.298 3.517 3.459 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -4.643 4.195 3.879 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -5.208 2.689 3.184 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -3.966 1.442 4.955 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -3.492 2.971 5.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -5.392 2.329 6.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -5.964 3.490 5.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -6.211 1.838 5.414 1.00 0.00 H new ATOM 1006 N ARG A 83 -3.091 3.498 -1.590 1.00 0.00 N ATOM 1007 CA ARG A 83 -3.597 4.076 -2.792 1.00 0.00 C ATOM 1008 C ARG A 83 -5.034 4.464 -2.545 1.00 0.00 C ATOM 1009 O ARG A 83 -5.752 3.759 -1.819 1.00 0.00 O ATOM 1010 CB ARG A 83 -3.492 3.120 -4.003 1.00 0.00 C ATOM 1011 CG ARG A 83 -4.470 1.944 -3.993 1.00 0.00 C ATOM 1012 CD ARG A 83 -4.239 1.007 -5.165 1.00 0.00 C ATOM 1013 NE ARG A 83 -4.304 1.699 -6.465 1.00 0.00 N ATOM 1014 CZ ARG A 83 -4.246 1.091 -7.659 1.00 0.00 C ATOM 1015 NH1 ARG A 83 -4.367 -0.229 -7.744 1.00 0.00 N ATOM 1016 NH2 ARG A 83 -4.140 1.817 -8.766 1.00 0.00 N ATOM 0 H ARG A 83 -3.141 2.481 -1.533 1.00 0.00 H new ATOM 0 HA ARG A 83 -2.994 4.948 -3.046 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -3.651 3.696 -4.915 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -2.476 2.727 -4.048 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -4.364 1.391 -3.060 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -5.492 2.321 -4.026 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -3.264 0.532 -5.059 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -4.985 0.212 -5.143 1.00 0.00 H new ATOM 0 HE ARG A 83 -4.400 2.714 -6.456 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -4.505 -0.784 -6.899 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -4.322 -0.688 -8.654 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -4.103 2.835 -8.707 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -4.096 1.357 -9.675 1.00 0.00 H new ATOM 1030 N PRO A 84 -5.455 5.611 -3.043 1.00 0.00 N ATOM 1031 CA PRO A 84 -6.836 6.002 -2.957 1.00 0.00 C ATOM 1032 C PRO A 84 -7.663 5.090 -3.857 1.00 0.00 C ATOM 1033 O PRO A 84 -7.220 4.717 -4.946 1.00 0.00 O ATOM 1034 CB PRO A 84 -6.859 7.445 -3.470 1.00 0.00 C ATOM 1035 CG PRO A 84 -5.606 7.609 -4.254 1.00 0.00 C ATOM 1036 CD PRO A 84 -4.617 6.622 -3.704 1.00 0.00 C ATOM 0 HA PRO A 84 -7.248 5.928 -1.951 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -7.737 7.627 -4.090 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -6.900 8.155 -2.644 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -5.786 7.426 -5.313 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -5.226 8.627 -4.166 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -4.010 6.182 -4.495 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -3.931 7.094 -3.001 1.00 0.00 H new ATOM 1044 N CYS A 85 -8.817 4.711 -3.407 1.00 0.00 N ATOM 1045 CA CYS A 85 -9.641 3.779 -4.162 1.00 0.00 C ATOM 1046 C CYS A 85 -10.273 4.475 -5.358 1.00 0.00 C ATOM 1047 O CYS A 85 -10.382 3.903 -6.452 1.00 0.00 O ATOM 1048 CB CYS A 85 -10.744 3.216 -3.285 1.00 0.00 C ATOM 1049 SG CYS A 85 -10.200 2.615 -1.671 1.00 0.00 S ATOM 0 H CYS A 85 -9.222 5.023 -2.525 1.00 0.00 H new ATOM 0 HA CYS A 85 -8.999 2.969 -4.508 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -11.498 3.989 -3.134 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -11.229 2.397 -3.817 1.00 0.00 H new ATOM 1054 N GLY A 86 -10.670 5.704 -5.149 1.00 0.00 N ATOM 1055 CA GLY A 86 -11.348 6.452 -6.154 1.00 0.00 C ATOM 1056 C GLY A 86 -12.677 6.911 -5.628 1.00 0.00 C ATOM 1057 O GLY A 86 -12.786 7.998 -5.069 1.00 0.00 O ATOM 0 H GLY A 86 -10.528 6.207 -4.273 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -10.746 7.311 -6.450 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -11.490 5.839 -7.044 1.00 0.00 H new ATOM 1061 N HIS A 87 -13.677 6.060 -5.753 1.00 0.00 N ATOM 1062 CA HIS A 87 -15.026 6.338 -5.286 1.00 0.00 C ATOM 1063 C HIS A 87 -15.893 5.090 -5.470 1.00 0.00 C ATOM 1064 O HIS A 87 -16.015 4.586 -6.584 1.00 0.00 O ATOM 1065 CB HIS A 87 -15.641 7.534 -6.067 1.00 0.00 C ATOM 1066 CG HIS A 87 -17.044 7.920 -5.668 1.00 0.00 C ATOM 1067 ND1 HIS A 87 -17.573 8.251 -4.463 1.00 0.00 N flip ATOM 1068 CD2 HIS A 87 -18.069 8.042 -6.568 1.00 0.00 C flip ATOM 1069 CE1 HIS A 87 -18.888 8.555 -4.671 1.00 0.00 C flip ATOM 1070 NE2 HIS A 87 -19.158 8.422 -5.951 1.00 0.00 N flip ATOM 0 H HIS A 87 -13.576 5.143 -6.188 1.00 0.00 H new ATOM 0 HA HIS A 87 -14.988 6.604 -4.230 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -14.994 8.401 -5.937 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -15.638 7.291 -7.130 1.00 0.00 H new ATOM 0 HD1 HIS A 87 -17.081 8.269 -3.570 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -17.990 7.853 -7.628 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -19.591 8.856 -3.909 1.00 0.00 H new ATOM 1079 N PRO A 88 -16.461 4.555 -4.379 1.00 0.00 N ATOM 1080 CA PRO A 88 -17.414 3.433 -4.450 1.00 0.00 C ATOM 1081 C PRO A 88 -18.693 3.915 -5.082 1.00 0.00 C ATOM 1082 O PRO A 88 -18.950 5.132 -5.092 1.00 0.00 O ATOM 1083 CB PRO A 88 -17.656 3.087 -2.973 1.00 0.00 C ATOM 1084 CG PRO A 88 -17.343 4.330 -2.228 1.00 0.00 C ATOM 1085 CD PRO A 88 -16.247 5.003 -2.995 1.00 0.00 C ATOM 0 HA PRO A 88 -17.057 2.585 -5.034 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -18.687 2.776 -2.805 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -17.018 2.264 -2.651 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -18.220 4.973 -2.155 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -17.026 4.106 -1.209 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -16.309 6.088 -2.912 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -15.263 4.710 -2.627 1.00 0.00 H new ATOM 1093 N GLY A 89 -19.455 2.998 -5.640 1.00 0.00 N ATOM 1094 CA GLY A 89 -20.713 3.332 -6.251 1.00 0.00 C ATOM 1095 C GLY A 89 -21.591 4.148 -5.338 1.00 0.00 C ATOM 1096 O GLY A 89 -21.708 3.857 -4.128 1.00 0.00 O ATOM 0 H GLY A 89 -19.217 2.007 -5.680 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -20.532 3.888 -7.171 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -21.234 2.416 -6.530 1.00 0.00 H new ATOM 1100 N ASP A 90 -22.216 5.117 -5.897 1.00 0.00 N ATOM 1101 CA ASP A 90 -22.951 6.086 -5.134 1.00 0.00 C ATOM 1102 C ASP A 90 -24.401 5.742 -5.139 1.00 0.00 C ATOM 1103 O ASP A 90 -24.960 5.343 -6.169 1.00 0.00 O ATOM 1104 CB ASP A 90 -22.716 7.488 -5.686 1.00 0.00 C ATOM 1105 CG ASP A 90 -23.463 8.556 -4.932 1.00 0.00 C ATOM 1106 OD1 ASP A 90 -23.017 8.956 -3.827 1.00 0.00 O ATOM 1107 OD2 ASP A 90 -24.493 9.018 -5.418 1.00 0.00 O ATOM 0 H ASP A 90 -22.239 5.271 -6.905 1.00 0.00 H new ATOM 0 HA ASP A 90 -22.598 6.070 -4.103 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -21.649 7.709 -5.655 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -23.017 7.514 -6.733 1.00 0.00 H new ATOM 1112 N THR A 91 -25.007 5.866 -4.014 1.00 0.00 N ATOM 1113 CA THR A 91 -26.356 5.504 -3.868 1.00 0.00 C ATOM 1114 C THR A 91 -27.151 6.681 -3.287 1.00 0.00 C ATOM 1115 O THR A 91 -26.627 7.449 -2.468 1.00 0.00 O ATOM 1116 CB THR A 91 -26.468 4.262 -2.953 1.00 0.00 C ATOM 1117 OG1 THR A 91 -27.827 3.848 -2.839 1.00 0.00 O ATOM 1118 CG2 THR A 91 -25.885 4.536 -1.564 1.00 0.00 C ATOM 0 H THR A 91 -24.570 6.226 -3.165 1.00 0.00 H new ATOM 0 HA THR A 91 -26.773 5.254 -4.844 1.00 0.00 H new ATOM 0 HB THR A 91 -25.888 3.461 -3.411 1.00 0.00 H new ATOM 0 HG1 THR A 91 -27.863 2.943 -2.464 1.00 0.00 H new ATOM 0 HG21 THR A 91 -25.980 3.643 -0.947 1.00 0.00 H new ATOM 0 HG22 THR A 91 -24.832 4.802 -1.657 1.00 0.00 H new ATOM 0 HG23 THR A 91 -26.427 5.358 -1.098 1.00 0.00 H new ATOM 1126 N PRO A 92 -28.388 6.907 -3.754 1.00 0.00 N ATOM 1127 CA PRO A 92 -29.262 7.931 -3.181 1.00 0.00 C ATOM 1128 C PRO A 92 -29.809 7.482 -1.830 1.00 0.00 C ATOM 1129 O PRO A 92 -30.061 8.290 -0.946 1.00 0.00 O ATOM 1130 CB PRO A 92 -30.411 8.049 -4.194 1.00 0.00 C ATOM 1131 CG PRO A 92 -29.976 7.277 -5.394 1.00 0.00 C ATOM 1132 CD PRO A 92 -29.014 6.242 -4.905 1.00 0.00 C ATOM 0 HA PRO A 92 -28.739 8.872 -3.012 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -31.337 7.645 -3.784 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -30.603 9.091 -4.448 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -30.830 6.812 -5.887 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -29.503 7.931 -6.126 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -29.521 5.322 -4.615 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -28.282 5.976 -5.667 1.00 0.00 H new ATOM 1140 N PHE A 93 -29.963 6.184 -1.675 1.00 0.00 N ATOM 1141 CA PHE A 93 -30.510 5.615 -0.464 1.00 0.00 C ATOM 1142 C PHE A 93 -29.472 4.735 0.179 1.00 0.00 C ATOM 1143 O PHE A 93 -29.115 3.693 -0.359 1.00 0.00 O ATOM 1144 CB PHE A 93 -31.777 4.802 -0.767 1.00 0.00 C ATOM 1145 CG PHE A 93 -32.863 5.597 -1.433 1.00 0.00 C ATOM 1146 CD1 PHE A 93 -33.752 6.349 -0.684 1.00 0.00 C ATOM 1147 CD2 PHE A 93 -32.985 5.600 -2.811 1.00 0.00 C ATOM 1148 CE1 PHE A 93 -34.741 7.086 -1.299 1.00 0.00 C ATOM 1149 CE2 PHE A 93 -33.967 6.335 -3.431 1.00 0.00 C ATOM 1150 CZ PHE A 93 -34.849 7.080 -2.674 1.00 0.00 C ATOM 0 H PHE A 93 -29.713 5.495 -2.385 1.00 0.00 H new ATOM 0 HA PHE A 93 -30.782 6.422 0.217 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -31.513 3.959 -1.406 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -32.162 4.387 0.164 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -33.670 6.358 0.393 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -32.299 5.017 -3.408 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -35.431 7.667 -0.705 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -34.048 6.330 -4.508 1.00 0.00 H new ATOM 0 HZ PHE A 93 -35.623 7.657 -3.158 1.00 0.00 H new ATOM 1160 N GLY A 94 -28.957 5.166 1.274 1.00 0.00 N ATOM 1161 CA GLY A 94 -27.972 4.399 1.953 1.00 0.00 C ATOM 1162 C GLY A 94 -26.733 5.189 2.178 1.00 0.00 C ATOM 1163 O GLY A 94 -26.481 6.174 1.486 1.00 0.00 O ATOM 0 H GLY A 94 -29.201 6.049 1.722 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -28.368 4.060 2.910 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -27.737 3.508 1.371 1.00 0.00 H new ATOM 1167 N THR A 95 -25.980 4.799 3.138 1.00 0.00 N ATOM 1168 CA THR A 95 -24.760 5.453 3.471 1.00 0.00 C ATOM 1169 C THR A 95 -23.746 4.356 3.757 1.00 0.00 C ATOM 1170 O THR A 95 -24.130 3.187 3.927 1.00 0.00 O ATOM 1171 CB THR A 95 -24.952 6.298 4.745 1.00 0.00 C ATOM 1172 OG1 THR A 95 -26.245 6.944 4.715 1.00 0.00 O ATOM 1173 CG2 THR A 95 -23.888 7.377 4.837 1.00 0.00 C ATOM 0 H THR A 95 -26.195 3.998 3.731 1.00 0.00 H new ATOM 0 HA THR A 95 -24.434 6.107 2.663 1.00 0.00 H new ATOM 0 HB THR A 95 -24.877 5.632 5.605 1.00 0.00 H new ATOM 0 HG1 THR A 95 -26.363 7.479 5.528 1.00 0.00 H new ATOM 0 HG21 THR A 95 -24.041 7.963 5.743 1.00 0.00 H new ATOM 0 HG22 THR A 95 -22.902 6.914 4.866 1.00 0.00 H new ATOM 0 HG23 THR A 95 -23.956 8.030 3.967 1.00 0.00 H new ATOM 1181 N PHE A 96 -22.494 4.684 3.783 1.00 0.00 N ATOM 1182 CA PHE A 96 -21.508 3.706 4.091 1.00 0.00 C ATOM 1183 C PHE A 96 -20.578 4.197 5.171 1.00 0.00 C ATOM 1184 O PHE A 96 -20.440 5.416 5.384 1.00 0.00 O ATOM 1185 CB PHE A 96 -20.742 3.256 2.845 1.00 0.00 C ATOM 1186 CG PHE A 96 -20.046 4.351 2.121 1.00 0.00 C ATOM 1187 CD1 PHE A 96 -18.791 4.764 2.516 1.00 0.00 C ATOM 1188 CD2 PHE A 96 -20.643 4.957 1.035 1.00 0.00 C ATOM 1189 CE1 PHE A 96 -18.138 5.762 1.838 1.00 0.00 C ATOM 1190 CE2 PHE A 96 -20.001 5.962 0.347 1.00 0.00 C ATOM 1191 CZ PHE A 96 -18.744 6.366 0.745 1.00 0.00 C ATOM 0 H PHE A 96 -22.134 5.619 3.595 1.00 0.00 H new ATOM 0 HA PHE A 96 -22.026 2.827 4.475 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -20.007 2.506 3.137 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -21.438 2.771 2.161 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -18.318 4.297 3.367 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -21.626 4.639 0.721 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -17.154 6.077 2.154 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -20.479 6.431 -0.500 1.00 0.00 H new ATOM 0 HZ PHE A 96 -18.232 7.151 0.207 1.00 0.00 H new ATOM 1201 N THR A 97 -19.988 3.275 5.854 1.00 0.00 N ATOM 1202 CA THR A 97 -19.050 3.552 6.904 1.00 0.00 C ATOM 1203 C THR A 97 -17.652 3.369 6.372 1.00 0.00 C ATOM 1204 O THR A 97 -17.481 2.794 5.311 1.00 0.00 O ATOM 1205 CB THR A 97 -19.259 2.501 7.969 1.00 0.00 C ATOM 1206 OG1 THR A 97 -19.143 1.268 7.340 1.00 0.00 O ATOM 1207 CG2 THR A 97 -20.613 2.615 8.646 1.00 0.00 C ATOM 0 H THR A 97 -20.145 2.279 5.698 1.00 0.00 H new ATOM 0 HA THR A 97 -19.186 4.564 7.285 1.00 0.00 H new ATOM 0 HB THR A 97 -18.517 2.630 8.757 1.00 0.00 H new ATOM 0 HG1 THR A 97 -18.196 1.027 7.266 1.00 0.00 H new ATOM 0 HG21 THR A 97 -20.709 1.835 9.402 1.00 0.00 H new ATOM 0 HG22 THR A 97 -20.702 3.593 9.120 1.00 0.00 H new ATOM 0 HG23 THR A 97 -21.402 2.499 7.903 1.00 0.00 H new ATOM 1215 N LEU A 98 -16.674 3.867 7.086 1.00 0.00 N ATOM 1216 CA LEU A 98 -15.305 3.606 6.764 1.00 0.00 C ATOM 1217 C LEU A 98 -14.603 3.168 8.015 1.00 0.00 C ATOM 1218 O LEU A 98 -14.612 3.871 9.024 1.00 0.00 O ATOM 1219 CB LEU A 98 -14.627 4.814 6.153 1.00 0.00 C ATOM 1220 CG LEU A 98 -15.232 5.319 4.844 1.00 0.00 C ATOM 1221 CD1 LEU A 98 -14.487 6.538 4.390 1.00 0.00 C ATOM 1222 CD2 LEU A 98 -15.165 4.247 3.760 1.00 0.00 C ATOM 0 H LEU A 98 -16.810 4.462 7.903 1.00 0.00 H new ATOM 0 HA LEU A 98 -15.258 2.817 6.013 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -14.648 5.626 6.879 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -13.579 4.570 5.978 1.00 0.00 H new ATOM 0 HG LEU A 98 -16.279 5.565 5.019 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -14.917 6.900 3.456 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -14.563 7.315 5.150 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -13.438 6.286 4.233 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -15.602 4.633 2.839 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -14.125 3.975 3.581 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -15.720 3.367 4.084 1.00 0.00 H new ATOM 1234 N THR A 99 -14.015 2.017 7.957 1.00 0.00 N ATOM 1235 CA THR A 99 -13.417 1.418 9.146 1.00 0.00 C ATOM 1236 C THR A 99 -11.969 0.947 8.909 1.00 0.00 C ATOM 1237 O THR A 99 -11.421 0.134 9.667 1.00 0.00 O ATOM 1238 CB THR A 99 -14.319 0.261 9.683 1.00 0.00 C ATOM 1239 OG1 THR A 99 -13.808 -0.302 10.891 1.00 0.00 O ATOM 1240 CG2 THR A 99 -14.491 -0.825 8.666 1.00 0.00 C ATOM 0 H THR A 99 -13.927 1.459 7.108 1.00 0.00 H new ATOM 0 HA THR A 99 -13.359 2.194 9.909 1.00 0.00 H new ATOM 0 HB THR A 99 -15.290 0.710 9.892 1.00 0.00 H new ATOM 0 HG1 THR A 99 -12.836 -0.405 10.819 1.00 0.00 H new ATOM 0 HG21 THR A 99 -15.124 -1.611 9.077 1.00 0.00 H new ATOM 0 HG22 THR A 99 -14.957 -0.414 7.770 1.00 0.00 H new ATOM 0 HG23 THR A 99 -13.517 -1.241 8.409 1.00 0.00 H new ATOM 1248 N GLY A 100 -11.343 1.490 7.906 1.00 0.00 N ATOM 1249 CA GLY A 100 -9.957 1.157 7.618 1.00 0.00 C ATOM 1250 C GLY A 100 -9.255 2.378 7.142 1.00 0.00 C ATOM 1251 O GLY A 100 -8.368 2.329 6.291 1.00 0.00 O ATOM 0 H GLY A 100 -11.760 2.167 7.267 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -9.470 0.767 8.512 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.907 0.375 6.861 1.00 0.00 H new ATOM 1255 N GLY A 101 -9.686 3.477 7.687 1.00 0.00 N ATOM 1256 CA GLY A 101 -9.214 4.753 7.306 1.00 0.00 C ATOM 1257 C GLY A 101 -10.324 5.738 7.453 1.00 0.00 C ATOM 1258 O GLY A 101 -11.231 5.515 8.261 1.00 0.00 O ATOM 0 H GLY A 101 -10.391 3.500 8.424 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -8.367 5.043 7.927 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -8.861 4.733 6.275 1.00 0.00 H new ATOM 1262 N ASN A 102 -10.310 6.779 6.669 1.00 0.00 N ATOM 1263 CA ASN A 102 -11.370 7.808 6.776 1.00 0.00 C ATOM 1264 C ASN A 102 -11.738 8.370 5.419 1.00 0.00 C ATOM 1265 O ASN A 102 -12.581 9.258 5.309 1.00 0.00 O ATOM 1266 CB ASN A 102 -10.991 8.963 7.741 1.00 0.00 C ATOM 1267 CG ASN A 102 -9.911 9.932 7.227 1.00 0.00 C ATOM 1268 OD1 ASN A 102 -8.969 9.456 6.455 1.00 0.00 O flip ATOM 1269 ND2 ASN A 102 -9.926 11.124 7.564 1.00 0.00 N flip ATOM 0 H ASN A 102 -9.604 6.959 5.956 1.00 0.00 H new ATOM 0 HA ASN A 102 -12.238 7.299 7.196 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -11.891 9.536 7.964 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -10.648 8.530 8.680 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -10.670 11.474 8.167 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -9.194 11.755 7.238 1.00 0.00 H new ATOM 1276 N VAL A 103 -11.132 7.829 4.398 1.00 0.00 N ATOM 1277 CA VAL A 103 -11.345 8.249 3.033 1.00 0.00 C ATOM 1278 C VAL A 103 -11.343 7.001 2.194 1.00 0.00 C ATOM 1279 O VAL A 103 -11.311 5.895 2.745 1.00 0.00 O ATOM 1280 CB VAL A 103 -10.221 9.214 2.515 1.00 0.00 C ATOM 1281 CG1 VAL A 103 -10.220 10.541 3.264 1.00 0.00 C ATOM 1282 CG2 VAL A 103 -8.855 8.546 2.610 1.00 0.00 C ATOM 0 H VAL A 103 -10.461 7.067 4.490 1.00 0.00 H new ATOM 0 HA VAL A 103 -12.284 8.798 2.971 1.00 0.00 H new ATOM 0 HB VAL A 103 -10.435 9.430 1.468 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -9.427 11.178 2.874 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -11.182 11.035 3.129 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -10.051 10.360 4.325 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -8.089 9.231 2.246 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -8.648 8.288 3.649 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -8.850 7.640 2.003 1.00 0.00 H new ATOM 1292 N PHE A 104 -11.360 7.145 0.900 1.00 0.00 N ATOM 1293 CA PHE A 104 -11.308 5.996 0.045 1.00 0.00 C ATOM 1294 C PHE A 104 -9.853 5.629 -0.143 1.00 0.00 C ATOM 1295 O PHE A 104 -9.157 6.205 -0.978 1.00 0.00 O ATOM 1296 CB PHE A 104 -11.983 6.270 -1.295 1.00 0.00 C ATOM 1297 CG PHE A 104 -13.338 6.886 -1.161 1.00 0.00 C ATOM 1298 CD1 PHE A 104 -14.267 6.356 -0.290 1.00 0.00 C ATOM 1299 CD2 PHE A 104 -13.670 8.015 -1.883 1.00 0.00 C ATOM 1300 CE1 PHE A 104 -15.497 6.934 -0.148 1.00 0.00 C ATOM 1301 CE2 PHE A 104 -14.909 8.602 -1.744 1.00 0.00 C ATOM 1302 CZ PHE A 104 -15.825 8.060 -0.874 1.00 0.00 C ATOM 0 H PHE A 104 -11.409 8.042 0.417 1.00 0.00 H new ATOM 0 HA PHE A 104 -11.850 5.167 0.501 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -11.348 6.931 -1.885 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -12.070 5.335 -1.848 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -14.020 5.476 0.285 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -12.950 8.443 -2.565 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -16.216 6.507 0.536 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -15.159 9.483 -2.316 1.00 0.00 H new ATOM 0 HZ PHE A 104 -16.798 8.514 -0.759 1.00 0.00 H new ATOM 1312 N GLU A 105 -9.403 4.719 0.648 1.00 0.00 N ATOM 1313 CA GLU A 105 -8.021 4.336 0.702 1.00 0.00 C ATOM 1314 C GLU A 105 -7.921 2.815 0.800 1.00 0.00 C ATOM 1315 O GLU A 105 -8.801 2.178 1.368 1.00 0.00 O ATOM 1316 CB GLU A 105 -7.379 5.015 1.928 1.00 0.00 C ATOM 1317 CG GLU A 105 -8.069 4.651 3.264 1.00 0.00 C ATOM 1318 CD GLU A 105 -7.567 5.423 4.469 1.00 0.00 C ATOM 1319 OE1 GLU A 105 -6.526 5.040 5.053 1.00 0.00 O ATOM 1320 OE2 GLU A 105 -8.220 6.426 4.885 1.00 0.00 O ATOM 0 H GLU A 105 -9.996 4.201 1.296 1.00 0.00 H new ATOM 0 HA GLU A 105 -7.494 4.652 -0.198 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -6.328 4.732 1.982 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -7.412 6.096 1.794 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -9.141 4.821 3.162 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -7.932 3.586 3.449 1.00 0.00 H new ATOM 1327 N TYR A 106 -6.901 2.241 0.199 1.00 0.00 N ATOM 1328 CA TYR A 106 -6.659 0.801 0.268 1.00 0.00 C ATOM 1329 C TYR A 106 -6.720 0.285 1.703 1.00 0.00 C ATOM 1330 O TYR A 106 -6.011 0.770 2.591 1.00 0.00 O ATOM 1331 CB TYR A 106 -5.314 0.440 -0.389 1.00 0.00 C ATOM 1332 CG TYR A 106 -4.808 -0.961 -0.082 1.00 0.00 C ATOM 1333 CD1 TYR A 106 -5.291 -2.067 -0.758 1.00 0.00 C ATOM 1334 CD2 TYR A 106 -3.840 -1.164 0.895 1.00 0.00 C ATOM 1335 CE1 TYR A 106 -4.824 -3.338 -0.472 1.00 0.00 C ATOM 1336 CE2 TYR A 106 -3.372 -2.424 1.183 1.00 0.00 C ATOM 1337 CZ TYR A 106 -3.862 -3.506 0.503 1.00 0.00 C ATOM 1338 OH TYR A 106 -3.379 -4.763 0.788 1.00 0.00 O ATOM 0 H TYR A 106 -6.212 2.752 -0.353 1.00 0.00 H new ATOM 0 HA TYR A 106 -7.456 0.309 -0.289 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -5.414 0.546 -1.469 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -4.563 1.161 -0.066 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -6.044 -1.937 -1.521 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -3.449 -0.316 1.438 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -5.210 -4.192 -1.008 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -2.619 -2.560 1.945 1.00 0.00 H new ATOM 0 HH TYR A 106 -2.743 -5.034 0.094 1.00 0.00 H new ATOM 1348 N GLY A 107 -7.574 -0.680 1.922 1.00 0.00 N ATOM 1349 CA GLY A 107 -7.712 -1.239 3.227 1.00 0.00 C ATOM 1350 C GLY A 107 -8.878 -0.659 3.994 1.00 0.00 C ATOM 1351 O GLY A 107 -9.083 -1.008 5.166 1.00 0.00 O ATOM 0 H GLY A 107 -8.180 -1.090 1.211 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -7.839 -2.318 3.143 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -6.793 -1.069 3.789 1.00 0.00 H new ATOM 1355 N VAL A 108 -9.626 0.244 3.374 1.00 0.00 N ATOM 1356 CA VAL A 108 -10.793 0.791 4.022 1.00 0.00 C ATOM 1357 C VAL A 108 -12.011 -0.039 3.654 1.00 0.00 C ATOM 1358 O VAL A 108 -12.161 -0.484 2.505 1.00 0.00 O ATOM 1359 CB VAL A 108 -11.035 2.320 3.703 1.00 0.00 C ATOM 1360 CG1 VAL A 108 -11.588 2.580 2.313 1.00 0.00 C ATOM 1361 CG2 VAL A 108 -11.894 2.987 4.749 1.00 0.00 C ATOM 0 H VAL A 108 -9.443 0.604 2.437 1.00 0.00 H new ATOM 0 HA VAL A 108 -10.617 0.741 5.097 1.00 0.00 H new ATOM 0 HB VAL A 108 -10.043 2.770 3.729 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -11.726 3.652 2.171 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -10.889 2.202 1.567 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -12.546 2.073 2.202 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -12.034 4.036 4.490 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -12.864 2.491 4.793 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -11.405 2.916 5.721 1.00 0.00 H new ATOM 1371 N LYS A 109 -12.813 -0.320 4.627 1.00 0.00 N ATOM 1372 CA LYS A 109 -14.037 -1.034 4.401 1.00 0.00 C ATOM 1373 C LYS A 109 -15.162 -0.033 4.408 1.00 0.00 C ATOM 1374 O LYS A 109 -15.217 0.808 5.307 1.00 0.00 O ATOM 1375 CB LYS A 109 -14.295 -2.052 5.510 1.00 0.00 C ATOM 1376 CG LYS A 109 -15.513 -2.942 5.269 1.00 0.00 C ATOM 1377 CD LYS A 109 -15.834 -3.819 6.478 1.00 0.00 C ATOM 1378 CE LYS A 109 -14.806 -4.916 6.694 1.00 0.00 C ATOM 1379 NZ LYS A 109 -15.048 -5.660 7.945 1.00 0.00 N ATOM 0 H LYS A 109 -12.644 -0.065 5.600 1.00 0.00 H new ATOM 0 HA LYS A 109 -13.970 -1.564 3.451 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -13.413 -2.683 5.621 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -14.427 -1.521 6.452 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -16.376 -2.319 5.035 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -15.332 -3.575 4.400 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -15.887 -3.195 7.370 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -16.818 -4.269 6.345 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -14.830 -5.606 5.851 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -13.808 -4.478 6.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -14.325 -6.399 8.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -15.000 -5.006 8.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -15.990 -6.100 7.911 1.00 0.00 H new ATOM 1393 N ALA A 110 -16.014 -0.117 3.429 1.00 0.00 N ATOM 1394 CA ALA A 110 -17.183 0.713 3.331 1.00 0.00 C ATOM 1395 C ALA A 110 -18.401 -0.154 3.597 1.00 0.00 C ATOM 1396 O ALA A 110 -18.789 -0.943 2.730 1.00 0.00 O ATOM 1397 CB ALA A 110 -17.277 1.356 1.936 1.00 0.00 C ATOM 0 H ALA A 110 -15.915 -0.778 2.659 1.00 0.00 H new ATOM 0 HA ALA A 110 -17.128 1.519 4.063 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -18.169 1.980 1.882 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -16.394 1.969 1.758 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -17.335 0.575 1.178 1.00 0.00 H new ATOM 1403 N VAL A 111 -18.968 -0.080 4.792 1.00 0.00 N ATOM 1404 CA VAL A 111 -20.129 -0.916 5.088 1.00 0.00 C ATOM 1405 C VAL A 111 -21.382 -0.175 4.676 1.00 0.00 C ATOM 1406 O VAL A 111 -21.537 0.991 4.983 1.00 0.00 O ATOM 1407 CB VAL A 111 -20.221 -1.434 6.577 1.00 0.00 C ATOM 1408 CG1 VAL A 111 -18.903 -1.764 7.245 1.00 0.00 C ATOM 1409 CG2 VAL A 111 -21.245 -0.755 7.485 1.00 0.00 C ATOM 0 H VAL A 111 -18.659 0.527 5.551 1.00 0.00 H new ATOM 0 HA VAL A 111 -20.015 -1.830 4.505 1.00 0.00 H new ATOM 0 HB VAL A 111 -20.676 -2.411 6.414 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -19.087 -2.109 8.262 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -18.396 -2.548 6.682 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -18.276 -0.873 7.272 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -21.205 -1.204 8.477 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -21.018 0.308 7.558 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -22.244 -0.884 7.068 1.00 0.00 H new ATOM 1419 N TYR A 112 -22.243 -0.834 3.977 1.00 0.00 N ATOM 1420 CA TYR A 112 -23.412 -0.213 3.416 1.00 0.00 C ATOM 1421 C TYR A 112 -24.593 -0.476 4.308 1.00 0.00 C ATOM 1422 O TYR A 112 -24.894 -1.616 4.658 1.00 0.00 O ATOM 1423 CB TYR A 112 -23.624 -0.758 1.992 1.00 0.00 C ATOM 1424 CG TYR A 112 -24.696 -0.086 1.140 1.00 0.00 C ATOM 1425 CD1 TYR A 112 -26.046 -0.165 1.464 1.00 0.00 C ATOM 1426 CD2 TYR A 112 -24.346 0.604 -0.010 1.00 0.00 C ATOM 1427 CE1 TYR A 112 -27.005 0.422 0.681 1.00 0.00 C ATOM 1428 CE2 TYR A 112 -25.307 1.191 -0.801 1.00 0.00 C ATOM 1429 CZ TYR A 112 -26.635 1.096 -0.450 1.00 0.00 C ATOM 1430 OH TYR A 112 -27.598 1.689 -1.234 1.00 0.00 O ATOM 0 H TYR A 112 -22.161 -1.830 3.772 1.00 0.00 H new ATOM 0 HA TYR A 112 -23.288 0.868 3.350 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -22.676 -0.688 1.459 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -23.869 -1.817 2.069 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -26.345 -0.701 2.353 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -23.306 0.682 -0.289 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -28.047 0.353 0.955 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -25.020 1.725 -1.695 1.00 0.00 H new ATOM 0 HH TYR A 112 -27.997 2.441 -0.749 1.00 0.00 H new ATOM 1440 N THR A 113 -25.216 0.577 4.724 1.00 0.00 N ATOM 1441 CA THR A 113 -26.365 0.500 5.554 1.00 0.00 C ATOM 1442 C THR A 113 -27.302 1.635 5.147 1.00 0.00 C ATOM 1443 O THR A 113 -26.863 2.611 4.542 1.00 0.00 O ATOM 1444 CB THR A 113 -25.961 0.662 7.028 1.00 0.00 C ATOM 1445 OG1 THR A 113 -24.756 -0.088 7.278 1.00 0.00 O ATOM 1446 CG2 THR A 113 -27.030 0.095 7.910 1.00 0.00 C ATOM 0 H THR A 113 -24.934 1.529 4.491 1.00 0.00 H new ATOM 0 HA THR A 113 -26.856 -0.466 5.439 1.00 0.00 H new ATOM 0 HB THR A 113 -25.813 1.722 7.235 1.00 0.00 H new ATOM 0 HG1 THR A 113 -24.495 0.015 8.217 1.00 0.00 H new ATOM 0 HG21 THR A 113 -26.740 0.212 8.954 1.00 0.00 H new ATOM 0 HG22 THR A 113 -27.967 0.623 7.732 1.00 0.00 H new ATOM 0 HG23 THR A 113 -27.163 -0.964 7.686 1.00 0.00 H new ATOM 1454 N CYS A 114 -28.552 1.516 5.447 1.00 0.00 N ATOM 1455 CA CYS A 114 -29.500 2.537 5.070 1.00 0.00 C ATOM 1456 C CYS A 114 -30.270 3.035 6.258 1.00 0.00 C ATOM 1457 O CYS A 114 -30.182 4.206 6.619 1.00 0.00 O ATOM 1458 CB CYS A 114 -30.479 2.026 4.032 1.00 0.00 C ATOM 1459 SG CYS A 114 -29.765 1.521 2.457 1.00 0.00 S ATOM 0 H CYS A 114 -28.951 0.725 5.952 1.00 0.00 H new ATOM 0 HA CYS A 114 -28.922 3.358 4.646 1.00 0.00 H new ATOM 0 HB2 CYS A 114 -31.016 1.177 4.454 1.00 0.00 H new ATOM 0 HB3 CYS A 114 -31.216 2.806 3.841 1.00 0.00 H new ATOM 1464 N ASN A 115 -31.001 2.152 6.880 1.00 0.00 N ATOM 1465 CA ASN A 115 -31.870 2.528 7.957 1.00 0.00 C ATOM 1466 C ASN A 115 -31.989 1.314 8.852 1.00 0.00 C ATOM 1467 O ASN A 115 -31.216 0.367 8.690 1.00 0.00 O ATOM 1468 CB ASN A 115 -33.248 2.924 7.371 1.00 0.00 C ATOM 1469 CG ASN A 115 -34.130 3.723 8.318 1.00 0.00 C ATOM 1470 OD1 ASN A 115 -34.906 3.159 9.084 1.00 0.00 O ATOM 1471 ND2 ASN A 115 -34.025 5.023 8.267 1.00 0.00 N ATOM 0 H ASN A 115 -31.011 1.157 6.655 1.00 0.00 H new ATOM 0 HA ASN A 115 -31.489 3.378 8.522 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -33.089 3.507 6.464 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -33.778 2.018 7.078 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -34.599 5.605 8.877 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -33.369 5.457 7.617 1.00 0.00 H new ATOM 1478 N GLU A 116 -32.939 1.314 9.745 1.00 0.00 N ATOM 1479 CA GLU A 116 -33.142 0.226 10.666 1.00 0.00 C ATOM 1480 C GLU A 116 -33.606 -1.034 9.934 1.00 0.00 C ATOM 1481 O GLU A 116 -32.967 -2.084 10.011 1.00 0.00 O ATOM 1482 CB GLU A 116 -34.133 0.671 11.732 1.00 0.00 C ATOM 1483 CG GLU A 116 -34.420 -0.351 12.804 1.00 0.00 C ATOM 1484 CD GLU A 116 -35.237 0.221 13.927 1.00 0.00 C ATOM 1485 OE1 GLU A 116 -36.425 0.545 13.712 1.00 0.00 O ATOM 1486 OE2 GLU A 116 -34.698 0.393 15.039 1.00 0.00 O ATOM 0 H GLU A 116 -33.604 2.079 9.857 1.00 0.00 H new ATOM 0 HA GLU A 116 -32.200 -0.033 11.150 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -33.751 1.575 12.206 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -35.071 0.938 11.245 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -34.950 -1.197 12.365 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -33.479 -0.734 13.200 1.00 0.00 H new ATOM 1493 N GLY A 117 -34.684 -0.911 9.215 1.00 0.00 N ATOM 1494 CA GLY A 117 -35.204 -2.032 8.460 1.00 0.00 C ATOM 1495 C GLY A 117 -34.619 -2.111 7.069 1.00 0.00 C ATOM 1496 O GLY A 117 -34.753 -3.134 6.381 1.00 0.00 O ATOM 0 H GLY A 117 -35.225 -0.050 9.131 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -34.989 -2.957 8.995 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -36.289 -1.948 8.391 1.00 0.00 H new ATOM 1500 N TYR A 118 -33.973 -1.043 6.651 1.00 0.00 N ATOM 1501 CA TYR A 118 -33.374 -0.996 5.337 1.00 0.00 C ATOM 1502 C TYR A 118 -31.937 -1.404 5.374 1.00 0.00 C ATOM 1503 O TYR A 118 -31.081 -0.710 5.964 1.00 0.00 O ATOM 1504 CB TYR A 118 -33.469 0.372 4.679 1.00 0.00 C ATOM 1505 CG TYR A 118 -34.832 0.780 4.194 1.00 0.00 C ATOM 1506 CD1 TYR A 118 -35.760 1.358 5.045 1.00 0.00 C ATOM 1507 CD2 TYR A 118 -35.184 0.603 2.858 1.00 0.00 C ATOM 1508 CE1 TYR A 118 -36.998 1.745 4.586 1.00 0.00 C ATOM 1509 CE2 TYR A 118 -36.423 0.988 2.395 1.00 0.00 C ATOM 1510 CZ TYR A 118 -37.325 1.558 3.265 1.00 0.00 C ATOM 1511 OH TYR A 118 -38.567 1.943 2.816 1.00 0.00 O ATOM 0 H TYR A 118 -33.850 -0.195 7.204 1.00 0.00 H new ATOM 0 HA TYR A 118 -33.951 -1.703 4.740 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -33.120 1.120 5.391 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -32.783 0.394 3.832 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -35.508 1.507 6.085 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -34.475 0.158 2.175 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -37.710 2.194 5.262 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -36.685 0.844 1.357 1.00 0.00 H new ATOM 0 HH TYR A 118 -38.645 1.746 1.859 1.00 0.00 H new ATOM 1521 N GLN A 119 -31.672 -2.487 4.734 1.00 0.00 N ATOM 1522 CA GLN A 119 -30.358 -2.957 4.555 1.00 0.00 C ATOM 1523 C GLN A 119 -30.085 -2.849 3.104 1.00 0.00 C ATOM 1524 O GLN A 119 -30.172 -1.752 2.544 1.00 0.00 O ATOM 1525 CB GLN A 119 -30.138 -4.397 5.015 1.00 0.00 C ATOM 1526 CG GLN A 119 -30.295 -4.645 6.496 1.00 0.00 C ATOM 1527 CD GLN A 119 -29.957 -6.071 6.844 1.00 0.00 C ATOM 1528 OE1 GLN A 119 -30.824 -6.952 6.830 1.00 0.00 O ATOM 1529 NE2 GLN A 119 -28.706 -6.324 7.129 1.00 0.00 N ATOM 0 H GLN A 119 -32.386 -3.081 4.312 1.00 0.00 H new ATOM 0 HA GLN A 119 -29.684 -2.360 5.169 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -30.839 -5.040 4.482 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -29.135 -4.704 4.719 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -29.647 -3.968 7.052 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -31.319 -4.426 6.798 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -28.020 -5.569 7.130 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -28.416 -7.277 7.350 1.00 0.00 H new ATOM 1538 N LEU A 120 -29.832 -3.961 2.448 1.00 0.00 N ATOM 1539 CA LEU A 120 -29.504 -3.929 1.135 1.00 0.00 C ATOM 1540 C LEU A 120 -29.618 -5.352 0.555 1.00 0.00 C ATOM 1541 O LEU A 120 -29.604 -6.337 1.306 1.00 0.00 O ATOM 1542 CB LEU A 120 -28.085 -3.397 1.104 1.00 0.00 C ATOM 1543 CG LEU A 120 -26.951 -4.318 1.516 1.00 0.00 C ATOM 1544 CD1 LEU A 120 -25.695 -3.562 1.681 1.00 0.00 C ATOM 1545 CD2 LEU A 120 -27.118 -5.118 2.752 1.00 0.00 C ATOM 0 H LEU A 120 -29.862 -4.894 2.860 1.00 0.00 H new ATOM 0 HA LEU A 120 -30.158 -3.300 0.531 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -27.882 -3.057 0.089 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -28.048 -2.518 1.748 1.00 0.00 H new ATOM 0 HG LEU A 120 -26.941 -5.028 0.689 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -24.897 -4.243 1.976 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -25.432 -3.082 0.738 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -25.827 -2.801 2.451 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -26.228 -5.725 2.915 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -27.262 -4.450 3.601 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -27.987 -5.768 2.650 1.00 0.00 H new ATOM 1557 N LEU A 121 -29.801 -5.444 -0.729 1.00 0.00 N ATOM 1558 CA LEU A 121 -29.806 -6.698 -1.420 1.00 0.00 C ATOM 1559 C LEU A 121 -28.398 -7.120 -1.626 1.00 0.00 C ATOM 1560 O LEU A 121 -27.569 -6.352 -2.151 1.00 0.00 O ATOM 1561 CB LEU A 121 -30.541 -6.614 -2.752 1.00 0.00 C ATOM 1562 CG LEU A 121 -32.025 -6.278 -2.662 1.00 0.00 C ATOM 1563 CD1 LEU A 121 -32.619 -6.073 -4.044 1.00 0.00 C ATOM 1564 CD2 LEU A 121 -32.785 -7.371 -1.919 1.00 0.00 C ATOM 0 H LEU A 121 -29.953 -4.637 -1.334 1.00 0.00 H new ATOM 0 HA LEU A 121 -30.340 -7.433 -0.817 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -30.052 -5.861 -3.370 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -30.433 -7.568 -3.268 1.00 0.00 H new ATOM 0 HG LEU A 121 -32.122 -5.347 -2.103 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -33.679 -5.834 -3.953 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -32.104 -5.252 -4.543 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -32.501 -6.985 -4.629 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -33.842 -7.109 -1.868 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -32.671 -8.317 -2.448 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -32.386 -7.470 -0.909 1.00 0.00 H new ATOM 1576 N GLY A 122 -28.131 -8.284 -1.185 1.00 0.00 N ATOM 1577 CA GLY A 122 -26.829 -8.826 -1.208 1.00 0.00 C ATOM 1578 C GLY A 122 -26.532 -9.394 0.139 1.00 0.00 C ATOM 1579 O GLY A 122 -27.100 -8.946 1.144 1.00 0.00 O ATOM 0 H GLY A 122 -28.832 -8.908 -0.785 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -26.754 -9.601 -1.971 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -26.102 -8.055 -1.463 1.00 0.00 H new ATOM 1583 N GLU A 123 -25.683 -10.368 0.193 1.00 0.00 N ATOM 1584 CA GLU A 123 -25.354 -11.003 1.439 1.00 0.00 C ATOM 1585 C GLU A 123 -24.124 -10.394 2.039 1.00 0.00 C ATOM 1586 O GLU A 123 -23.785 -10.652 3.191 1.00 0.00 O ATOM 1587 CB GLU A 123 -25.197 -12.499 1.258 1.00 0.00 C ATOM 1588 CG GLU A 123 -26.514 -13.193 0.965 1.00 0.00 C ATOM 1589 CD GLU A 123 -26.401 -14.685 0.943 1.00 0.00 C ATOM 1590 OE1 GLU A 123 -26.475 -15.316 2.026 1.00 0.00 O ATOM 1591 OE2 GLU A 123 -26.242 -15.258 -0.152 1.00 0.00 O ATOM 0 H GLU A 123 -25.197 -10.749 -0.619 1.00 0.00 H new ATOM 0 HA GLU A 123 -26.178 -10.839 2.133 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -24.500 -12.691 0.442 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -24.758 -12.926 2.160 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -27.246 -12.901 1.718 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -26.892 -12.849 0.002 1.00 0.00 H new ATOM 1598 N ILE A 124 -23.468 -9.583 1.268 1.00 0.00 N ATOM 1599 CA ILE A 124 -22.302 -8.906 1.711 1.00 0.00 C ATOM 1600 C ILE A 124 -22.645 -7.437 1.812 1.00 0.00 C ATOM 1601 O ILE A 124 -22.805 -6.752 0.804 1.00 0.00 O ATOM 1602 CB ILE A 124 -21.120 -9.141 0.737 1.00 0.00 C ATOM 1603 CG1 ILE A 124 -20.884 -10.660 0.542 1.00 0.00 C ATOM 1604 CG2 ILE A 124 -19.855 -8.463 1.256 1.00 0.00 C ATOM 1605 CD1 ILE A 124 -20.480 -11.407 1.800 1.00 0.00 C ATOM 0 H ILE A 124 -23.734 -9.374 0.306 1.00 0.00 H new ATOM 0 HA ILE A 124 -21.985 -9.287 2.682 1.00 0.00 H new ATOM 0 HB ILE A 124 -21.370 -8.701 -0.228 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -21.796 -11.108 0.147 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -20.109 -10.799 -0.211 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -19.036 -8.639 0.559 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -20.029 -7.391 1.349 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -19.596 -8.874 2.232 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -20.337 -12.462 1.567 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -19.550 -10.992 2.187 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -21.263 -11.305 2.551 1.00 0.00 H new ATOM 1617 N ASN A 125 -22.782 -6.954 3.020 1.00 0.00 N ATOM 1618 CA ASN A 125 -23.259 -5.591 3.244 1.00 0.00 C ATOM 1619 C ASN A 125 -22.127 -4.594 3.309 1.00 0.00 C ATOM 1620 O ASN A 125 -22.225 -3.566 3.981 1.00 0.00 O ATOM 1621 CB ASN A 125 -24.115 -5.484 4.519 1.00 0.00 C ATOM 1622 CG ASN A 125 -23.348 -5.718 5.822 1.00 0.00 C ATOM 1623 OD1 ASN A 125 -22.417 -6.528 5.891 1.00 0.00 O ATOM 1624 ND2 ASN A 125 -23.700 -4.977 6.845 1.00 0.00 N ATOM 0 H ASN A 125 -22.573 -7.475 3.871 1.00 0.00 H new ATOM 0 HA ASN A 125 -23.882 -5.348 2.384 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -24.570 -4.494 4.553 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -24.928 -6.207 4.457 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -23.201 -5.060 7.731 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -24.473 -4.318 6.755 1.00 0.00 H new ATOM 1631 N TYR A 126 -21.113 -4.815 2.542 1.00 0.00 N ATOM 1632 CA TYR A 126 -19.942 -3.983 2.641 1.00 0.00 C ATOM 1633 C TYR A 126 -19.057 -4.133 1.434 1.00 0.00 C ATOM 1634 O TYR A 126 -19.248 -5.014 0.608 1.00 0.00 O ATOM 1635 CB TYR A 126 -19.143 -4.268 3.949 1.00 0.00 C ATOM 1636 CG TYR A 126 -18.415 -5.608 4.009 1.00 0.00 C ATOM 1637 CD1 TYR A 126 -19.034 -6.755 4.480 1.00 0.00 C ATOM 1638 CD2 TYR A 126 -17.094 -5.703 3.608 1.00 0.00 C ATOM 1639 CE1 TYR A 126 -18.347 -7.959 4.544 1.00 0.00 C ATOM 1640 CE2 TYR A 126 -16.404 -6.893 3.666 1.00 0.00 C ATOM 1641 CZ TYR A 126 -17.033 -8.019 4.137 1.00 0.00 C ATOM 1642 OH TYR A 126 -16.349 -9.214 4.197 1.00 0.00 O ATOM 0 H TYR A 126 -21.062 -5.556 1.843 1.00 0.00 H new ATOM 0 HA TYR A 126 -20.287 -2.950 2.680 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -18.410 -3.472 4.084 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -19.832 -4.213 4.792 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -20.064 -6.711 4.801 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -16.591 -4.821 3.240 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -18.841 -8.846 4.912 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -15.375 -6.941 3.343 1.00 0.00 H new ATOM 0 HH TYR A 126 -15.434 -9.084 3.872 1.00 0.00 H new ATOM 1652 N ARG A 127 -18.108 -3.261 1.354 1.00 0.00 N ATOM 1653 CA ARG A 127 -17.127 -3.225 0.318 1.00 0.00 C ATOM 1654 C ARG A 127 -15.805 -3.070 0.995 1.00 0.00 C ATOM 1655 O ARG A 127 -15.686 -2.270 1.902 1.00 0.00 O ATOM 1656 CB ARG A 127 -17.309 -1.977 -0.523 1.00 0.00 C ATOM 1657 CG ARG A 127 -18.650 -1.767 -1.163 1.00 0.00 C ATOM 1658 CD ARG A 127 -18.725 -0.341 -1.667 1.00 0.00 C ATOM 1659 NE ARG A 127 -19.926 -0.077 -2.434 1.00 0.00 N ATOM 1660 CZ ARG A 127 -20.631 1.057 -2.428 1.00 0.00 C ATOM 1661 NH1 ARG A 127 -20.410 1.998 -1.503 1.00 0.00 N ATOM 1662 NH2 ARG A 127 -21.584 1.224 -3.318 1.00 0.00 N ATOM 0 H ARG A 127 -17.989 -2.518 2.042 1.00 0.00 H new ATOM 0 HA ARG A 127 -17.204 -4.119 -0.301 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -17.097 -1.113 0.106 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -16.557 -1.990 -1.312 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -18.790 -2.467 -1.986 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -19.447 -1.957 -0.444 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -18.684 0.342 -0.818 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -17.852 -0.133 -2.285 1.00 0.00 H new ATOM 0 HE ARG A 127 -20.265 -0.828 -3.035 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -19.695 1.854 -0.790 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -20.956 2.859 -1.511 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -21.777 0.492 -4.002 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -22.130 2.085 -3.325 1.00 0.00 H new ATOM 1676 N GLU A 128 -14.847 -3.806 0.600 1.00 0.00 N ATOM 1677 CA GLU A 128 -13.526 -3.621 1.105 1.00 0.00 C ATOM 1678 C GLU A 128 -12.649 -3.163 -0.015 1.00 0.00 C ATOM 1679 O GLU A 128 -12.713 -3.715 -1.116 1.00 0.00 O ATOM 1680 CB GLU A 128 -13.008 -4.893 1.759 1.00 0.00 C ATOM 1681 CG GLU A 128 -13.562 -5.138 3.129 1.00 0.00 C ATOM 1682 CD GLU A 128 -12.955 -6.347 3.804 1.00 0.00 C ATOM 1683 OE1 GLU A 128 -13.141 -7.484 3.316 1.00 0.00 O ATOM 1684 OE2 GLU A 128 -12.292 -6.182 4.855 1.00 0.00 O ATOM 0 H GLU A 128 -14.942 -4.558 -0.083 1.00 0.00 H new ATOM 0 HA GLU A 128 -13.527 -2.858 1.884 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -13.251 -5.743 1.122 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -11.921 -4.842 1.821 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -13.388 -4.258 3.748 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -14.642 -5.271 3.060 1.00 0.00 H new ATOM 1691 N CYS A 129 -11.909 -2.117 0.214 1.00 0.00 N ATOM 1692 CA CYS A 129 -11.032 -1.611 -0.799 1.00 0.00 C ATOM 1693 C CYS A 129 -9.797 -2.465 -0.823 1.00 0.00 C ATOM 1694 O CYS A 129 -9.039 -2.529 0.161 1.00 0.00 O ATOM 1695 CB CYS A 129 -10.676 -0.154 -0.554 1.00 0.00 C ATOM 1696 SG CYS A 129 -9.856 0.642 -1.971 1.00 0.00 S ATOM 0 H CYS A 129 -11.896 -1.599 1.093 1.00 0.00 H new ATOM 0 HA CYS A 129 -11.535 -1.653 -1.765 1.00 0.00 H new ATOM 0 HB2 CYS A 129 -11.584 0.398 -0.313 1.00 0.00 H new ATOM 0 HB3 CYS A 129 -10.023 -0.089 0.317 1.00 0.00 H new ATOM 1701 N ASP A 130 -9.619 -3.154 -1.899 1.00 0.00 N ATOM 1702 CA ASP A 130 -8.536 -4.065 -2.044 1.00 0.00 C ATOM 1703 C ASP A 130 -7.497 -3.447 -2.970 1.00 0.00 C ATOM 1704 O ASP A 130 -7.534 -2.243 -3.207 1.00 0.00 O ATOM 1705 CB ASP A 130 -9.066 -5.394 -2.579 1.00 0.00 C ATOM 1706 CG ASP A 130 -8.141 -6.538 -2.284 1.00 0.00 C ATOM 1707 OD1 ASP A 130 -8.209 -7.081 -1.169 1.00 0.00 O ATOM 1708 OD2 ASP A 130 -7.357 -6.922 -3.162 1.00 0.00 O ATOM 0 H ASP A 130 -10.230 -3.099 -2.714 1.00 0.00 H new ATOM 0 HA ASP A 130 -8.059 -4.262 -1.084 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -10.042 -5.597 -2.139 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -9.212 -5.317 -3.656 1.00 0.00 H new ATOM 1713 N THR A 131 -6.613 -4.250 -3.506 1.00 0.00 N ATOM 1714 CA THR A 131 -5.475 -3.778 -4.260 1.00 0.00 C ATOM 1715 C THR A 131 -5.879 -3.016 -5.523 1.00 0.00 C ATOM 1716 O THR A 131 -5.303 -1.976 -5.853 1.00 0.00 O ATOM 1717 CB THR A 131 -4.585 -4.979 -4.653 1.00 0.00 C ATOM 1718 OG1 THR A 131 -5.331 -5.891 -5.491 1.00 0.00 O ATOM 1719 CG2 THR A 131 -4.142 -5.725 -3.411 1.00 0.00 C ATOM 0 H THR A 131 -6.663 -5.266 -3.431 1.00 0.00 H new ATOM 0 HA THR A 131 -4.929 -3.084 -3.621 1.00 0.00 H new ATOM 0 HB THR A 131 -3.715 -4.602 -5.191 1.00 0.00 H new ATOM 0 HG1 THR A 131 -5.159 -5.684 -6.433 1.00 0.00 H new ATOM 0 HG21 THR A 131 -3.515 -6.570 -3.698 1.00 0.00 H new ATOM 0 HG22 THR A 131 -3.574 -5.054 -2.767 1.00 0.00 H new ATOM 0 HG23 THR A 131 -5.018 -6.089 -2.873 1.00 0.00 H new ATOM 1727 N ASP A 132 -6.857 -3.548 -6.214 1.00 0.00 N ATOM 1728 CA ASP A 132 -7.271 -3.047 -7.475 1.00 0.00 C ATOM 1729 C ASP A 132 -8.594 -2.322 -7.429 1.00 0.00 C ATOM 1730 O ASP A 132 -8.969 -1.658 -8.391 1.00 0.00 O ATOM 1731 CB ASP A 132 -7.339 -4.211 -8.435 1.00 0.00 C ATOM 1732 CG ASP A 132 -5.983 -4.640 -8.929 1.00 0.00 C ATOM 1733 OD1 ASP A 132 -5.223 -5.292 -8.156 1.00 0.00 O ATOM 1734 OD2 ASP A 132 -5.616 -4.286 -10.082 1.00 0.00 O ATOM 0 H ASP A 132 -7.390 -4.358 -5.898 1.00 0.00 H new ATOM 0 HA ASP A 132 -6.544 -2.304 -7.803 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -7.825 -5.054 -7.943 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -7.961 -3.937 -9.287 1.00 0.00 H new ATOM 1739 N GLY A 133 -9.295 -2.422 -6.334 1.00 0.00 N ATOM 1740 CA GLY A 133 -10.584 -1.789 -6.243 1.00 0.00 C ATOM 1741 C GLY A 133 -11.390 -2.384 -5.140 1.00 0.00 C ATOM 1742 O GLY A 133 -10.842 -3.072 -4.289 1.00 0.00 O ATOM 0 H GLY A 133 -9.001 -2.930 -5.500 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -10.458 -0.720 -6.071 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -11.116 -1.899 -7.188 1.00 0.00 H new ATOM 1746 N TRP A 134 -12.675 -2.155 -5.151 1.00 0.00 N ATOM 1747 CA TRP A 134 -13.538 -2.649 -4.098 1.00 0.00 C ATOM 1748 C TRP A 134 -13.920 -4.099 -4.366 1.00 0.00 C ATOM 1749 O TRP A 134 -14.093 -4.500 -5.520 1.00 0.00 O ATOM 1750 CB TRP A 134 -14.794 -1.772 -3.966 1.00 0.00 C ATOM 1751 CG TRP A 134 -14.495 -0.323 -3.685 1.00 0.00 C ATOM 1752 CD1 TRP A 134 -14.292 0.656 -4.609 1.00 0.00 C ATOM 1753 CD2 TRP A 134 -14.370 0.308 -2.400 1.00 0.00 C ATOM 1754 NE1 TRP A 134 -14.039 1.850 -3.987 1.00 0.00 N ATOM 1755 CE2 TRP A 134 -14.085 1.667 -2.632 1.00 0.00 C ATOM 1756 CE3 TRP A 134 -14.469 -0.139 -1.083 1.00 0.00 C ATOM 1757 CZ2 TRP A 134 -13.897 2.576 -1.596 1.00 0.00 C ATOM 1758 CZ3 TRP A 134 -14.284 0.765 -0.057 1.00 0.00 C ATOM 1759 CH2 TRP A 134 -14.004 2.108 -0.320 1.00 0.00 C ATOM 0 H TRP A 134 -13.155 -1.627 -5.880 1.00 0.00 H new ATOM 0 HA TRP A 134 -12.993 -2.602 -3.155 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -15.373 -1.842 -4.887 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -15.419 -2.167 -3.165 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -14.326 0.512 -5.679 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -13.847 2.734 -4.459 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -14.687 -1.175 -0.870 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -13.675 3.614 -1.795 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -14.357 0.428 0.967 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -13.869 2.791 0.506 1.00 0.00 H new ATOM 1770 N THR A 135 -14.029 -4.875 -3.314 1.00 0.00 N ATOM 1771 CA THR A 135 -14.382 -6.286 -3.402 1.00 0.00 C ATOM 1772 C THR A 135 -15.848 -6.499 -3.809 1.00 0.00 C ATOM 1773 O THR A 135 -16.227 -7.567 -4.311 1.00 0.00 O ATOM 1774 CB THR A 135 -14.121 -6.958 -2.049 1.00 0.00 C ATOM 1775 OG1 THR A 135 -14.714 -6.156 -0.997 1.00 0.00 O ATOM 1776 CG2 THR A 135 -12.625 -7.109 -1.798 1.00 0.00 C ATOM 0 H THR A 135 -13.875 -4.549 -2.360 1.00 0.00 H new ATOM 0 HA THR A 135 -13.762 -6.734 -4.178 1.00 0.00 H new ATOM 0 HB THR A 135 -14.569 -7.952 -2.058 1.00 0.00 H new ATOM 0 HG1 THR A 135 -15.663 -6.384 -0.907 1.00 0.00 H new ATOM 0 HG21 THR A 135 -12.465 -7.588 -0.832 1.00 0.00 H new ATOM 0 HG22 THR A 135 -12.184 -7.721 -2.585 1.00 0.00 H new ATOM 0 HG23 THR A 135 -12.155 -6.126 -1.798 1.00 0.00 H new ATOM 1784 N ASN A 136 -16.653 -5.483 -3.606 1.00 0.00 N ATOM 1785 CA ASN A 136 -18.070 -5.530 -3.889 1.00 0.00 C ATOM 1786 C ASN A 136 -18.452 -4.240 -4.537 1.00 0.00 C ATOM 1787 O ASN A 136 -17.845 -3.202 -4.240 1.00 0.00 O ATOM 1788 CB ASN A 136 -18.896 -5.739 -2.601 1.00 0.00 C ATOM 1789 CG ASN A 136 -18.713 -7.114 -1.970 1.00 0.00 C ATOM 1790 OD1 ASN A 136 -17.740 -7.257 -1.094 1.00 0.00 O flip ATOM 1791 ND2 ASN A 136 -19.440 -8.049 -2.282 1.00 0.00 N flip ATOM 0 H ASN A 136 -16.338 -4.587 -3.234 1.00 0.00 H new ATOM 0 HA ASN A 136 -18.280 -6.372 -4.548 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -18.618 -4.976 -1.874 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -19.952 -5.592 -2.829 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -20.186 -7.910 -2.963 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -19.299 -8.967 -1.860 1.00 0.00 H new ATOM 1798 N ASP A 137 -19.436 -4.285 -5.409 1.00 0.00 N ATOM 1799 CA ASP A 137 -19.845 -3.103 -6.144 1.00 0.00 C ATOM 1800 C ASP A 137 -20.925 -2.330 -5.394 1.00 0.00 C ATOM 1801 O ASP A 137 -20.628 -1.661 -4.414 1.00 0.00 O ATOM 1802 CB ASP A 137 -20.244 -3.439 -7.594 1.00 0.00 C ATOM 1803 CG ASP A 137 -20.683 -2.230 -8.402 1.00 0.00 C ATOM 1804 OD1 ASP A 137 -19.853 -1.358 -8.703 1.00 0.00 O ATOM 1805 OD2 ASP A 137 -21.880 -2.137 -8.728 1.00 0.00 O ATOM 0 H ASP A 137 -19.969 -5.127 -5.628 1.00 0.00 H new ATOM 0 HA ASP A 137 -18.982 -2.441 -6.216 1.00 0.00 H new ATOM 0 HB2 ASP A 137 -19.399 -3.912 -8.094 1.00 0.00 H new ATOM 0 HB3 ASP A 137 -21.054 -4.168 -7.579 1.00 0.00 H new ATOM 1810 N ILE A 138 -22.170 -2.424 -5.789 1.00 0.00 N ATOM 1811 CA ILE A 138 -23.201 -1.698 -5.088 1.00 0.00 C ATOM 1812 C ILE A 138 -24.352 -2.618 -4.657 1.00 0.00 C ATOM 1813 O ILE A 138 -25.192 -2.996 -5.490 1.00 0.00 O ATOM 1814 CB ILE A 138 -23.761 -0.533 -5.959 1.00 0.00 C ATOM 1815 CG1 ILE A 138 -22.626 0.367 -6.467 1.00 0.00 C ATOM 1816 CG2 ILE A 138 -24.745 0.328 -5.141 1.00 0.00 C ATOM 1817 CD1 ILE A 138 -23.042 1.188 -7.652 1.00 0.00 C ATOM 0 H ILE A 138 -22.491 -2.985 -6.578 1.00 0.00 H new ATOM 0 HA ILE A 138 -22.739 -1.282 -4.193 1.00 0.00 H new ATOM 0 HB ILE A 138 -24.278 -0.978 -6.809 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -22.302 1.029 -5.664 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -21.769 -0.250 -6.737 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -25.126 1.137 -5.765 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -25.575 -0.291 -4.802 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -24.230 0.748 -4.277 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -22.207 1.809 -7.976 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -23.340 0.527 -8.466 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -23.882 1.826 -7.376 1.00 0.00 H new ATOM 1829 N PRO A 139 -24.329 -3.099 -3.393 1.00 0.00 N ATOM 1830 CA PRO A 139 -25.493 -3.751 -2.776 1.00 0.00 C ATOM 1831 C PRO A 139 -26.690 -2.769 -2.821 1.00 0.00 C ATOM 1832 O PRO A 139 -26.538 -1.578 -2.531 1.00 0.00 O ATOM 1833 CB PRO A 139 -25.049 -3.976 -1.323 1.00 0.00 C ATOM 1834 CG PRO A 139 -23.762 -3.243 -1.159 1.00 0.00 C ATOM 1835 CD PRO A 139 -23.159 -3.119 -2.505 1.00 0.00 C ATOM 0 HA PRO A 139 -25.798 -4.674 -3.269 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -25.799 -3.604 -0.625 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -24.920 -5.038 -1.116 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -23.932 -2.260 -0.721 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -23.095 -3.781 -0.486 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -22.566 -2.209 -2.599 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -22.497 -3.956 -2.729 1.00 0.00 H new ATOM 1843 N ILE A 140 -27.839 -3.264 -3.177 1.00 0.00 N ATOM 1844 CA ILE A 140 -29.018 -2.423 -3.446 1.00 0.00 C ATOM 1845 C ILE A 140 -29.793 -2.154 -2.167 1.00 0.00 C ATOM 1846 O ILE A 140 -30.314 -3.066 -1.604 1.00 0.00 O ATOM 1847 CB ILE A 140 -29.992 -3.115 -4.465 1.00 0.00 C ATOM 1848 CG1 ILE A 140 -29.342 -3.402 -5.841 1.00 0.00 C ATOM 1849 CG2 ILE A 140 -31.294 -2.335 -4.639 1.00 0.00 C ATOM 1850 CD1 ILE A 140 -28.371 -4.572 -5.858 1.00 0.00 C ATOM 0 H ILE A 140 -28.008 -4.263 -3.295 1.00 0.00 H new ATOM 0 HA ILE A 140 -28.648 -1.488 -3.867 1.00 0.00 H new ATOM 0 HB ILE A 140 -30.229 -4.081 -4.019 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -30.132 -3.594 -6.567 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -28.816 -2.507 -6.172 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -31.935 -2.852 -5.353 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -31.805 -2.261 -3.679 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -31.072 -1.334 -5.010 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -27.967 -4.695 -6.863 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -27.556 -4.378 -5.161 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -28.893 -5.482 -5.562 1.00 0.00 H new ATOM 1862 N CYS A 141 -29.870 -0.907 -1.740 1.00 0.00 N ATOM 1863 CA CYS A 141 -30.590 -0.526 -0.499 1.00 0.00 C ATOM 1864 C CYS A 141 -32.023 -1.069 -0.468 1.00 0.00 C ATOM 1865 O CYS A 141 -32.866 -0.635 -1.252 1.00 0.00 O ATOM 1866 CB CYS A 141 -30.656 0.980 -0.380 1.00 0.00 C ATOM 1867 SG CYS A 141 -31.344 1.581 1.185 1.00 0.00 S ATOM 0 H CYS A 141 -29.443 -0.119 -2.228 1.00 0.00 H new ATOM 0 HA CYS A 141 -30.034 -0.960 0.332 1.00 0.00 H new ATOM 0 HB2 CYS A 141 -29.651 1.386 -0.500 1.00 0.00 H new ATOM 0 HB3 CYS A 141 -31.258 1.371 -1.201 1.00 0.00 H new ATOM 1872 N GLU A 142 -32.274 -1.995 0.445 1.00 0.00 N ATOM 1873 CA GLU A 142 -33.558 -2.664 0.637 1.00 0.00 C ATOM 1874 C GLU A 142 -33.546 -3.416 1.962 1.00 0.00 C ATOM 1875 O GLU A 142 -33.246 -4.626 1.989 1.00 0.00 O ATOM 1876 CB GLU A 142 -33.897 -3.641 -0.517 1.00 0.00 C ATOM 1877 CG GLU A 142 -34.650 -3.037 -1.697 1.00 0.00 C ATOM 1878 CD GLU A 142 -35.976 -2.428 -1.287 1.00 0.00 C ATOM 1879 OE1 GLU A 142 -36.771 -3.100 -0.591 1.00 0.00 O ATOM 1880 OE2 GLU A 142 -36.262 -1.270 -1.659 1.00 0.00 O ATOM 1881 OXT GLU A 142 -33.807 -2.805 2.995 1.00 0.00 O ATOM 0 H GLU A 142 -31.562 -2.316 1.101 1.00 0.00 H new ATOM 0 HA GLU A 142 -34.330 -1.895 0.645 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -32.967 -4.074 -0.886 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -34.491 -4.460 -0.112 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -34.031 -2.272 -2.166 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -34.824 -3.809 -2.447 1.00 0.00 H new TER 1888 GLU A 142