USER MOD reduce.3.24.130724 H: found=0, std=0, add=1239, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1239 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 143 ASN : amide:sc= -0.36 K(o=2.6,f=-5!) USER MOD Set 1.2: A 147 SER OG : rot 110:sc= 0.959 USER MOD Set 1.3: A 150 THR OG1 : rot 163:sc= 2.03 USER MOD Set 2.1: A 96 HIS : no HE2:sc= 1.03 K(o=0.84,f=-5.1!) USER MOD Set 2.2: A 98 CYS SG : rot 180:sc= -0.187 USER MOD Set 3.1: A 92 SER OG : rot -135:sc= 0.316 USER MOD Set 3.2: A 93 ASN :FLIP amide:sc= -0.0134 F(o=-1.2!,f=0.28) USER MOD Set 3.3: A 132 ASN :FLIP amide:sc= -0.0269 F(o=-1.2,f=0.28) USER MOD Set 4.1: A 13 GLN : amide:sc= -0.247 X(o=-2,f=-1.8) USER MOD Set 4.2: A 73 HIS : no HE2:sc= -0.575 X(o=-2,f=-1.6) USER MOD Set 4.3: A 74 SER OG : rot -157:sc= -1.17 USER MOD Set 5.1: A 33 SER OG : rot -103:sc= 0.278 USER MOD Set 5.2: A 34 HIS :FLIP no HD1:sc= 0.261 F(o=0,f=0.54) USER MOD Single : A 1 SER N :NH3+ 151:sc= 0.0347 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0.0293 USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 27:sc= 0.0487 USER MOD Single : A 7 SER OG : rot 180:sc= 0.0397 USER MOD Single : A 8 GLN : amide:sc= -0.27 X(o=-0.27,f=-0.13) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 27 CYS SG : rot 110:sc= -5.75! USER MOD Single : A 29 ASN : amide:sc= -2.8 K(o=-2.8,f=-4.5!) USER MOD Single : A 30 GLN :FLIP amide:sc= -0.857 F(o=-1.5,f=-0.86) USER MOD Single : A 31 SER OG : rot 129:sc= 2.46 USER MOD Single : A 32 SER OG : rot -32:sc= 0.0744 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 38 ASN : amide:sc= -4! C(o=-4!,f=-9.8!) USER MOD Single : A 41 LYS NZ :NH3+ 170:sc=-0.00803 (180deg=-0.134) USER MOD Single : A 42 GLN : amide:sc= -0.969 K(o=-0.97,f=-7.9!) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 ASN : amide:sc= 1.1 K(o=1.1,f=-0.14) USER MOD Single : A 54 SER OG : rot 147:sc= 0.364 USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -3.68! C(o=-3.7!,f=-7.1!) USER MOD Single : A 68 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 71 LYS NZ :NH3+ -168:sc= -0.0307 (180deg=-0.215) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ -176:sc= 0.676 (180deg=0.661) USER MOD Single : A 87 THR OG1 : rot -170:sc= -0.108 USER MOD Single : A 89 LYS NZ :NH3+ 173:sc= -1.11! (180deg=-1.57!) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 MET CE :methyl -109:sc= -0.774 (180deg=-2.49) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 103 ASN : amide:sc= -0.0962 X(o=-0.096,f=0.28) USER MOD Single : A 108 SER OG : rot 180:sc= -0.0404 USER MOD Single : A 110 THR OG1 : rot 33:sc= 1.25 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 ASN : amide:sc= -2.55! C(o=-2.5!,f=-5.3!) USER MOD Single : A 119 LYS NZ :NH3+ 132:sc= 0.205 (180deg=-0.348) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 LYS NZ :NH3+ 170:sc=-0.00182 (180deg=-0.123) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 135 SER OG : rot 152:sc= 0.667 USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 144 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 145 SER OG : rot -31:sc= 0.133 USER MOD Single : A 151 LYS NZ :NH3+ -120:sc= -0.527 (180deg=-1.67!) USER MOD Single : A 153 GLN : amide:sc= -0.154 X(o=-0.15,f=-0.65) USER MOD Single : A 154 LYS NZ :NH3+ -113:sc= -0.612 (180deg=-3.53!) USER MOD Single : A 158 TYR OH : rot 43:sc= 1.16 USER MOD Single : A 160 SER OG : rot 180:sc=-0.00962 USER MOD Single : A 161 THR OG1 : rot 43:sc= 0.616 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -19.610 4.956 -15.505 1.00 0.00 N ATOM 2 CA SER A 1 -19.742 4.525 -14.126 1.00 0.00 C ATOM 3 C SER A 1 -18.404 3.982 -13.645 1.00 0.00 C ATOM 4 O SER A 1 -17.951 2.931 -14.110 1.00 0.00 O ATOM 5 CB SER A 1 -20.816 3.447 -14.050 1.00 0.00 C ATOM 6 OG SER A 1 -22.048 3.923 -14.588 1.00 0.00 O ATOM 0 H1 SER A 1 -20.526 4.860 -15.988 1.00 0.00 H new ATOM 0 H2 SER A 1 -19.308 5.951 -15.530 1.00 0.00 H new ATOM 0 H3 SER A 1 -18.901 4.366 -15.987 1.00 0.00 H new ATOM 0 HA SER A 1 -20.031 5.361 -13.489 1.00 0.00 H new ATOM 0 HB2 SER A 1 -20.491 2.564 -14.599 1.00 0.00 H new ATOM 0 HB3 SER A 1 -20.960 3.143 -13.013 1.00 0.00 H new ATOM 0 HG SER A 1 -22.724 3.216 -14.532 1.00 0.00 H new ATOM 14 N SER A 2 -17.765 4.681 -12.735 1.00 0.00 N ATOM 15 CA SER A 2 -16.451 4.293 -12.293 1.00 0.00 C ATOM 16 C SER A 2 -16.436 3.108 -11.335 1.00 0.00 C ATOM 17 O SER A 2 -16.543 3.248 -10.120 1.00 0.00 O ATOM 18 CB SER A 2 -15.659 5.472 -11.753 1.00 0.00 C ATOM 19 OG SER A 2 -15.456 6.449 -12.773 1.00 0.00 O ATOM 0 H SER A 2 -18.136 5.520 -12.289 1.00 0.00 H new ATOM 0 HA SER A 2 -15.945 3.938 -13.191 1.00 0.00 H new ATOM 0 HB2 SER A 2 -16.190 5.920 -10.913 1.00 0.00 H new ATOM 0 HB3 SER A 2 -14.696 5.128 -11.374 1.00 0.00 H new ATOM 0 HG SER A 2 -14.946 7.202 -12.408 1.00 0.00 H new ATOM 25 N ALA A 3 -16.382 1.958 -11.920 1.00 0.00 N ATOM 26 CA ALA A 3 -16.183 0.712 -11.248 1.00 0.00 C ATOM 27 C ALA A 3 -15.476 -0.164 -12.234 1.00 0.00 C ATOM 28 O ALA A 3 -16.091 -0.973 -12.940 1.00 0.00 O ATOM 29 CB ALA A 3 -17.489 0.091 -10.774 1.00 0.00 C ATOM 0 H ALA A 3 -16.480 1.854 -12.930 1.00 0.00 H new ATOM 0 HA ALA A 3 -15.599 0.848 -10.338 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -17.281 -0.853 -10.270 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -17.985 0.771 -10.081 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -18.138 -0.090 -11.631 1.00 0.00 H new ATOM 35 N GLU A 4 -14.199 0.067 -12.339 1.00 0.00 N ATOM 36 CA GLU A 4 -13.388 -0.507 -13.373 1.00 0.00 C ATOM 37 C GLU A 4 -11.934 -0.496 -12.949 1.00 0.00 C ATOM 38 O GLU A 4 -11.571 0.130 -11.936 1.00 0.00 O ATOM 39 CB GLU A 4 -13.539 0.353 -14.634 1.00 0.00 C ATOM 40 CG GLU A 4 -13.159 1.822 -14.407 1.00 0.00 C ATOM 41 CD GLU A 4 -13.288 2.661 -15.640 1.00 0.00 C ATOM 42 OE1 GLU A 4 -12.347 2.674 -16.451 1.00 0.00 O ATOM 43 OE2 GLU A 4 -14.343 3.318 -15.827 1.00 0.00 O ATOM 0 H GLU A 4 -13.684 0.670 -11.697 1.00 0.00 H new ATOM 0 HA GLU A 4 -13.702 -1.533 -13.563 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -12.914 -0.060 -15.426 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -14.571 0.300 -14.982 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -13.793 2.238 -13.624 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -12.132 1.873 -14.046 1.00 0.00 H new ATOM 50 N SER A 5 -11.110 -1.144 -13.713 1.00 0.00 N ATOM 51 CA SER A 5 -9.717 -1.170 -13.447 1.00 0.00 C ATOM 52 C SER A 5 -9.020 -0.056 -14.222 1.00 0.00 C ATOM 53 O SER A 5 -9.210 0.094 -15.431 1.00 0.00 O ATOM 54 CB SER A 5 -9.155 -2.541 -13.805 1.00 0.00 C ATOM 55 OG SER A 5 -9.503 -2.902 -15.140 1.00 0.00 O ATOM 0 H SER A 5 -11.392 -1.670 -14.540 1.00 0.00 H new ATOM 0 HA SER A 5 -9.538 -0.998 -12.386 1.00 0.00 H new ATOM 0 HB2 SER A 5 -8.070 -2.533 -13.697 1.00 0.00 H new ATOM 0 HB3 SER A 5 -9.539 -3.288 -13.110 1.00 0.00 H new ATOM 0 HG SER A 5 -9.629 -2.091 -15.676 1.00 0.00 H new ATOM 61 N ALA A 6 -8.253 0.729 -13.527 1.00 0.00 N ATOM 62 CA ALA A 6 -7.515 1.805 -14.113 1.00 0.00 C ATOM 63 C ALA A 6 -6.136 1.863 -13.497 1.00 0.00 C ATOM 64 O ALA A 6 -5.889 2.596 -12.522 1.00 0.00 O ATOM 65 CB ALA A 6 -8.243 3.141 -13.968 1.00 0.00 C ATOM 0 H ALA A 6 -8.121 0.637 -12.520 1.00 0.00 H new ATOM 0 HA ALA A 6 -7.421 1.617 -15.183 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -7.648 3.931 -14.426 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -9.212 3.083 -14.463 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -8.388 3.363 -12.911 1.00 0.00 H new ATOM 71 N SER A 7 -5.270 1.040 -14.007 1.00 0.00 N ATOM 72 CA SER A 7 -3.923 0.981 -13.551 1.00 0.00 C ATOM 73 C SER A 7 -3.092 1.943 -14.354 1.00 0.00 C ATOM 74 O SER A 7 -3.482 2.336 -15.469 1.00 0.00 O ATOM 75 CB SER A 7 -3.406 -0.448 -13.675 1.00 0.00 C ATOM 76 OG SER A 7 -3.713 -0.989 -14.952 1.00 0.00 O ATOM 0 H SER A 7 -5.486 0.386 -14.759 1.00 0.00 H new ATOM 0 HA SER A 7 -3.862 1.268 -12.501 1.00 0.00 H new ATOM 0 HB2 SER A 7 -2.327 -0.464 -13.519 1.00 0.00 H new ATOM 0 HB3 SER A 7 -3.850 -1.068 -12.896 1.00 0.00 H new ATOM 0 HG SER A 7 -3.371 -1.905 -15.010 1.00 0.00 H new ATOM 82 N GLN A 8 -1.977 2.343 -13.835 1.00 0.00 N ATOM 83 CA GLN A 8 -1.167 3.275 -14.545 1.00 0.00 C ATOM 84 C GLN A 8 0.206 2.751 -14.613 1.00 0.00 C ATOM 85 O GLN A 8 1.013 2.993 -13.727 1.00 0.00 O ATOM 86 CB GLN A 8 -1.174 4.638 -13.881 1.00 0.00 C ATOM 87 CG GLN A 8 -0.551 5.764 -14.713 1.00 0.00 C ATOM 88 CD GLN A 8 -1.318 6.038 -15.992 1.00 0.00 C ATOM 89 OE1 GLN A 8 -2.246 6.857 -16.009 1.00 0.00 O ATOM 90 NE2 GLN A 8 -0.940 5.389 -17.068 1.00 0.00 N ATOM 0 H GLN A 8 -1.610 2.043 -12.932 1.00 0.00 H new ATOM 0 HA GLN A 8 -1.573 3.401 -15.549 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -2.204 4.906 -13.646 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -0.639 4.567 -12.934 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -0.513 6.674 -14.115 1.00 0.00 H new ATOM 0 HG3 GLN A 8 0.478 5.502 -14.960 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -0.171 4.721 -17.017 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -1.415 5.553 -17.956 1.00 0.00 H new ATOM 99 N ILE A 9 0.455 1.962 -15.599 1.00 0.00 N ATOM 100 CA ILE A 9 1.758 1.408 -15.760 1.00 0.00 C ATOM 101 C ILE A 9 2.681 2.406 -16.477 1.00 0.00 C ATOM 102 O ILE A 9 2.436 2.760 -17.630 1.00 0.00 O ATOM 103 CB ILE A 9 1.785 0.033 -16.540 1.00 0.00 C ATOM 104 CG1 ILE A 9 0.983 -1.089 -15.843 1.00 0.00 C ATOM 105 CG2 ILE A 9 3.216 -0.437 -16.783 1.00 0.00 C ATOM 106 CD1 ILE A 9 -0.515 -0.905 -15.825 1.00 0.00 C ATOM 0 H ILE A 9 -0.224 1.684 -16.307 1.00 0.00 H new ATOM 0 HA ILE A 9 2.112 1.207 -14.749 1.00 0.00 H new ATOM 0 HB ILE A 9 1.297 0.233 -17.494 1.00 0.00 H new ATOM 0 HG12 ILE A 9 1.209 -2.034 -16.337 1.00 0.00 H new ATOM 0 HG13 ILE A 9 1.333 -1.176 -14.814 1.00 0.00 H new ATOM 0 HG21 ILE A 9 3.201 -1.385 -17.321 1.00 0.00 H new ATOM 0 HG22 ILE A 9 3.748 0.308 -17.375 1.00 0.00 H new ATOM 0 HG23 ILE A 9 3.722 -0.570 -15.827 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -0.979 -1.748 -15.313 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -0.762 0.019 -15.301 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -0.887 -0.853 -16.848 1.00 0.00 H new ATOM 118 N PRO A 10 3.720 2.896 -15.805 1.00 0.00 N ATOM 119 CA PRO A 10 4.719 3.711 -16.442 1.00 0.00 C ATOM 120 C PRO A 10 5.819 2.807 -16.986 1.00 0.00 C ATOM 121 O PRO A 10 6.147 1.791 -16.366 1.00 0.00 O ATOM 122 CB PRO A 10 5.244 4.576 -15.297 1.00 0.00 C ATOM 123 CG PRO A 10 5.066 3.745 -14.060 1.00 0.00 C ATOM 124 CD PRO A 10 4.001 2.708 -14.364 1.00 0.00 C ATOM 0 HA PRO A 10 4.348 4.305 -17.278 1.00 0.00 H new ATOM 0 HB2 PRO A 10 6.292 4.836 -15.449 1.00 0.00 H new ATOM 0 HB3 PRO A 10 4.690 5.512 -15.225 1.00 0.00 H new ATOM 0 HG2 PRO A 10 6.003 3.263 -13.782 1.00 0.00 H new ATOM 0 HG3 PRO A 10 4.766 4.369 -13.218 1.00 0.00 H new ATOM 0 HD2 PRO A 10 4.355 1.699 -14.155 1.00 0.00 H new ATOM 0 HD3 PRO A 10 3.108 2.864 -13.759 1.00 0.00 H new ATOM 132 N LYS A 11 6.374 3.133 -18.127 1.00 0.00 N ATOM 133 CA LYS A 11 7.416 2.292 -18.683 1.00 0.00 C ATOM 134 C LYS A 11 8.685 2.381 -17.864 1.00 0.00 C ATOM 135 O LYS A 11 9.460 3.341 -17.969 1.00 0.00 O ATOM 136 CB LYS A 11 7.666 2.533 -20.174 1.00 0.00 C ATOM 137 CG LYS A 11 6.498 2.152 -21.089 1.00 0.00 C ATOM 138 CD LYS A 11 6.089 0.674 -20.924 1.00 0.00 C ATOM 139 CE LYS A 11 7.248 -0.301 -21.186 1.00 0.00 C ATOM 140 NZ LYS A 11 7.767 -0.217 -22.569 1.00 0.00 N ATOM 0 H LYS A 11 6.132 3.954 -18.682 1.00 0.00 H new ATOM 0 HA LYS A 11 7.051 1.267 -18.620 1.00 0.00 H new ATOM 0 HB2 LYS A 11 7.898 3.587 -20.324 1.00 0.00 H new ATOM 0 HB3 LYS A 11 8.547 1.967 -20.477 1.00 0.00 H new ATOM 0 HG2 LYS A 11 5.643 2.791 -20.869 1.00 0.00 H new ATOM 0 HG3 LYS A 11 6.776 2.337 -22.127 1.00 0.00 H new ATOM 0 HD2 LYS A 11 5.711 0.518 -19.914 1.00 0.00 H new ATOM 0 HD3 LYS A 11 5.271 0.450 -21.609 1.00 0.00 H new ATOM 0 HE2 LYS A 11 8.057 -0.093 -20.486 1.00 0.00 H new ATOM 0 HE3 LYS A 11 6.911 -1.319 -20.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 8.546 -0.895 -22.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 7.005 -0.442 -23.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 8.115 0.746 -22.751 1.00 0.00 H new ATOM 154 N GLY A 12 8.851 1.394 -17.029 1.00 0.00 N ATOM 155 CA GLY A 12 9.943 1.311 -16.121 1.00 0.00 C ATOM 156 C GLY A 12 9.616 0.313 -15.055 1.00 0.00 C ATOM 157 O GLY A 12 10.413 -0.573 -14.747 1.00 0.00 O ATOM 0 H GLY A 12 8.207 0.605 -16.965 1.00 0.00 H new ATOM 0 HA2 GLY A 12 10.850 1.015 -16.649 1.00 0.00 H new ATOM 0 HA3 GLY A 12 10.138 2.287 -15.676 1.00 0.00 H new ATOM 161 N GLN A 13 8.425 0.447 -14.495 1.00 0.00 N ATOM 162 CA GLN A 13 7.931 -0.490 -13.513 1.00 0.00 C ATOM 163 C GLN A 13 6.667 -1.109 -14.064 1.00 0.00 C ATOM 164 O GLN A 13 6.230 -0.778 -15.161 1.00 0.00 O ATOM 165 CB GLN A 13 7.548 0.155 -12.143 1.00 0.00 C ATOM 166 CG GLN A 13 8.611 0.943 -11.357 1.00 0.00 C ATOM 167 CD GLN A 13 9.000 2.293 -11.949 1.00 0.00 C ATOM 168 OE1 GLN A 13 8.370 3.311 -11.654 1.00 0.00 O ATOM 169 NE2 GLN A 13 10.065 2.332 -12.700 1.00 0.00 N ATOM 0 H GLN A 13 7.780 1.207 -14.711 1.00 0.00 H new ATOM 0 HA GLN A 13 8.737 -1.201 -13.331 1.00 0.00 H new ATOM 0 HB2 GLN A 13 6.708 0.826 -12.321 1.00 0.00 H new ATOM 0 HB3 GLN A 13 7.187 -0.643 -11.495 1.00 0.00 H new ATOM 0 HG2 GLN A 13 8.243 1.103 -10.343 1.00 0.00 H new ATOM 0 HG3 GLN A 13 9.508 0.329 -11.278 1.00 0.00 H new ATOM 0 HE21 GLN A 13 10.562 1.470 -12.925 1.00 0.00 H new ATOM 0 HE22 GLN A 13 10.401 3.224 -13.063 1.00 0.00 H new ATOM 178 N VAL A 14 6.099 -1.991 -13.327 1.00 0.00 N ATOM 179 CA VAL A 14 4.819 -2.537 -13.655 1.00 0.00 C ATOM 180 C VAL A 14 3.881 -2.305 -12.464 1.00 0.00 C ATOM 181 O VAL A 14 4.332 -2.351 -11.303 1.00 0.00 O ATOM 182 CB VAL A 14 4.918 -4.047 -14.040 1.00 0.00 C ATOM 183 CG1 VAL A 14 5.478 -4.889 -12.902 1.00 0.00 C ATOM 184 CG2 VAL A 14 3.578 -4.584 -14.524 1.00 0.00 C ATOM 0 H VAL A 14 6.507 -2.363 -12.469 1.00 0.00 H new ATOM 0 HA VAL A 14 4.417 -2.034 -14.535 1.00 0.00 H new ATOM 0 HB VAL A 14 5.623 -4.122 -14.868 1.00 0.00 H new ATOM 0 HG11 VAL A 14 5.530 -5.932 -13.213 1.00 0.00 H new ATOM 0 HG12 VAL A 14 6.477 -4.537 -12.646 1.00 0.00 H new ATOM 0 HG13 VAL A 14 4.829 -4.802 -12.031 1.00 0.00 H new ATOM 0 HG21 VAL A 14 3.681 -5.638 -14.784 1.00 0.00 H new ATOM 0 HG22 VAL A 14 2.836 -4.476 -13.733 1.00 0.00 H new ATOM 0 HG23 VAL A 14 3.257 -4.023 -15.402 1.00 0.00 H new ATOM 194 N ASP A 15 2.612 -2.005 -12.740 1.00 0.00 N ATOM 195 CA ASP A 15 1.633 -1.733 -11.681 1.00 0.00 C ATOM 196 C ASP A 15 1.306 -3.056 -11.012 1.00 0.00 C ATOM 197 O ASP A 15 0.773 -3.972 -11.649 1.00 0.00 O ATOM 198 CB ASP A 15 0.348 -1.074 -12.262 1.00 0.00 C ATOM 199 CG ASP A 15 -0.571 -0.463 -11.196 1.00 0.00 C ATOM 200 OD1 ASP A 15 -0.971 -1.180 -10.281 1.00 0.00 O ATOM 201 OD2 ASP A 15 -0.914 0.783 -11.305 1.00 0.00 O ATOM 0 H ASP A 15 2.236 -1.944 -13.686 1.00 0.00 H new ATOM 0 HA ASP A 15 2.047 -1.032 -10.957 1.00 0.00 H new ATOM 0 HB2 ASP A 15 0.638 -0.296 -12.968 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -0.211 -1.822 -12.824 1.00 0.00 H new ATOM 206 N LEU A 16 1.625 -3.165 -9.744 1.00 0.00 N ATOM 207 CA LEU A 16 1.518 -4.425 -9.036 1.00 0.00 C ATOM 208 C LEU A 16 0.097 -4.742 -8.606 1.00 0.00 C ATOM 209 O LEU A 16 -0.126 -5.738 -7.928 1.00 0.00 O ATOM 210 CB LEU A 16 2.461 -4.472 -7.831 1.00 0.00 C ATOM 211 CG LEU A 16 3.942 -4.193 -8.110 1.00 0.00 C ATOM 212 CD1 LEU A 16 4.766 -4.377 -6.854 1.00 0.00 C ATOM 213 CD2 LEU A 16 4.479 -5.048 -9.247 1.00 0.00 C ATOM 0 H LEU A 16 1.964 -2.390 -9.174 1.00 0.00 H new ATOM 0 HA LEU A 16 1.819 -5.195 -9.747 1.00 0.00 H new ATOM 0 HB2 LEU A 16 2.110 -3.748 -7.095 1.00 0.00 H new ATOM 0 HB3 LEU A 16 2.380 -5.458 -7.373 1.00 0.00 H new ATOM 0 HG LEU A 16 4.024 -3.153 -8.427 1.00 0.00 H new ATOM 0 HD11 LEU A 16 5.814 -4.174 -7.074 1.00 0.00 H new ATOM 0 HD12 LEU A 16 4.416 -3.688 -6.085 1.00 0.00 H new ATOM 0 HD13 LEU A 16 4.662 -5.402 -6.497 1.00 0.00 H new ATOM 0 HD21 LEU A 16 5.532 -4.817 -9.410 1.00 0.00 H new ATOM 0 HD22 LEU A 16 4.374 -6.102 -8.990 1.00 0.00 H new ATOM 0 HD23 LEU A 16 3.916 -4.838 -10.157 1.00 0.00 H new ATOM 225 N LEU A 17 -0.860 -3.912 -9.019 1.00 0.00 N ATOM 226 CA LEU A 17 -2.301 -4.144 -8.730 1.00 0.00 C ATOM 227 C LEU A 17 -2.689 -5.543 -9.240 1.00 0.00 C ATOM 228 O LEU A 17 -3.444 -6.288 -8.599 1.00 0.00 O ATOM 229 CB LEU A 17 -3.118 -3.056 -9.477 1.00 0.00 C ATOM 230 CG LEU A 17 -4.643 -2.895 -9.230 1.00 0.00 C ATOM 231 CD1 LEU A 17 -5.116 -1.685 -9.984 1.00 0.00 C ATOM 232 CD2 LEU A 17 -5.467 -4.092 -9.684 1.00 0.00 C ATOM 0 H LEU A 17 -0.677 -3.066 -9.558 1.00 0.00 H new ATOM 0 HA LEU A 17 -2.503 -4.088 -7.660 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -2.654 -2.096 -9.251 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -2.984 -3.231 -10.544 1.00 0.00 H new ATOM 0 HG LEU A 17 -4.784 -2.800 -8.153 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -6.186 -1.552 -9.825 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -4.584 -0.803 -9.627 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -4.922 -1.820 -11.048 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -6.521 -3.907 -9.479 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -5.327 -4.246 -10.754 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -5.144 -4.982 -9.144 1.00 0.00 H new ATOM 244 N ASP A 18 -2.125 -5.890 -10.375 1.00 0.00 N ATOM 245 CA ASP A 18 -2.397 -7.148 -11.056 1.00 0.00 C ATOM 246 C ASP A 18 -1.613 -8.317 -10.427 1.00 0.00 C ATOM 247 O ASP A 18 -1.960 -9.485 -10.600 1.00 0.00 O ATOM 248 CB ASP A 18 -2.048 -6.982 -12.540 1.00 0.00 C ATOM 249 CG ASP A 18 -2.274 -8.224 -13.362 1.00 0.00 C ATOM 250 OD1 ASP A 18 -3.444 -8.570 -13.626 1.00 0.00 O ATOM 251 OD2 ASP A 18 -1.288 -8.864 -13.764 1.00 0.00 O ATOM 0 H ASP A 18 -1.452 -5.300 -10.864 1.00 0.00 H new ATOM 0 HA ASP A 18 -3.454 -7.393 -10.951 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -2.645 -6.170 -12.955 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -1.003 -6.686 -12.627 1.00 0.00 H new ATOM 256 N PHE A 19 -0.598 -7.983 -9.655 1.00 0.00 N ATOM 257 CA PHE A 19 0.276 -8.978 -9.022 1.00 0.00 C ATOM 258 C PHE A 19 -0.230 -9.373 -7.656 1.00 0.00 C ATOM 259 O PHE A 19 0.324 -10.256 -7.005 1.00 0.00 O ATOM 260 CB PHE A 19 1.702 -8.454 -8.885 1.00 0.00 C ATOM 261 CG PHE A 19 2.461 -8.312 -10.171 1.00 0.00 C ATOM 262 CD1 PHE A 19 2.034 -7.455 -11.169 1.00 0.00 C ATOM 263 CD2 PHE A 19 3.621 -9.030 -10.364 1.00 0.00 C ATOM 264 CE1 PHE A 19 2.749 -7.327 -12.336 1.00 0.00 C ATOM 265 CE2 PHE A 19 4.340 -8.907 -11.524 1.00 0.00 C ATOM 266 CZ PHE A 19 3.906 -8.055 -12.514 1.00 0.00 C ATOM 0 H PHE A 19 -0.347 -7.017 -9.443 1.00 0.00 H new ATOM 0 HA PHE A 19 0.271 -9.853 -9.671 1.00 0.00 H new ATOM 0 HB2 PHE A 19 1.668 -7.482 -8.393 1.00 0.00 H new ATOM 0 HB3 PHE A 19 2.256 -9.124 -8.228 1.00 0.00 H new ATOM 0 HD1 PHE A 19 1.130 -6.881 -11.030 1.00 0.00 H new ATOM 0 HD2 PHE A 19 3.968 -9.699 -9.590 1.00 0.00 H new ATOM 0 HE1 PHE A 19 2.405 -6.658 -13.111 1.00 0.00 H new ATOM 0 HE2 PHE A 19 5.246 -9.478 -11.661 1.00 0.00 H new ATOM 0 HZ PHE A 19 4.471 -7.957 -13.429 1.00 0.00 H new ATOM 276 N ILE A 20 -1.259 -8.729 -7.223 1.00 0.00 N ATOM 277 CA ILE A 20 -1.811 -8.986 -5.927 1.00 0.00 C ATOM 278 C ILE A 20 -2.809 -10.121 -5.979 1.00 0.00 C ATOM 279 O ILE A 20 -3.585 -10.243 -6.935 1.00 0.00 O ATOM 280 CB ILE A 20 -2.479 -7.707 -5.363 1.00 0.00 C ATOM 281 CG1 ILE A 20 -1.418 -6.626 -5.198 1.00 0.00 C ATOM 282 CG2 ILE A 20 -3.180 -7.988 -4.034 1.00 0.00 C ATOM 283 CD1 ILE A 20 -1.944 -5.267 -4.784 1.00 0.00 C ATOM 0 H ILE A 20 -1.746 -8.007 -7.754 1.00 0.00 H new ATOM 0 HA ILE A 20 -0.997 -9.279 -5.264 1.00 0.00 H new ATOM 0 HB ILE A 20 -3.242 -7.365 -6.063 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -0.694 -6.960 -4.455 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -0.881 -6.519 -6.141 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -3.639 -7.071 -3.664 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -3.950 -8.745 -4.182 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -2.452 -8.348 -3.307 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -1.113 -4.567 -4.693 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -2.644 -4.903 -5.536 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -2.454 -5.351 -3.824 1.00 0.00 H new ATOM 295 N ASP A 21 -2.750 -10.983 -4.990 1.00 0.00 N ATOM 296 CA ASP A 21 -3.734 -12.015 -4.837 1.00 0.00 C ATOM 297 C ASP A 21 -4.813 -11.457 -3.953 1.00 0.00 C ATOM 298 O ASP A 21 -4.651 -11.358 -2.732 1.00 0.00 O ATOM 299 CB ASP A 21 -3.148 -13.281 -4.212 1.00 0.00 C ATOM 300 CG ASP A 21 -4.174 -14.391 -4.091 1.00 0.00 C ATOM 301 OD1 ASP A 21 -4.971 -14.390 -3.136 1.00 0.00 O ATOM 302 OD2 ASP A 21 -4.184 -15.297 -4.957 1.00 0.00 O ATOM 0 H ASP A 21 -2.021 -10.984 -4.276 1.00 0.00 H new ATOM 0 HA ASP A 21 -4.120 -12.304 -5.815 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -2.310 -13.628 -4.817 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -2.752 -13.046 -3.224 1.00 0.00 H new ATOM 307 N TRP A 22 -5.892 -11.059 -4.558 1.00 0.00 N ATOM 308 CA TRP A 22 -6.967 -10.390 -3.860 1.00 0.00 C ATOM 309 C TRP A 22 -7.832 -11.329 -3.035 1.00 0.00 C ATOM 310 O TRP A 22 -8.785 -10.901 -2.388 1.00 0.00 O ATOM 311 CB TRP A 22 -7.797 -9.560 -4.829 1.00 0.00 C ATOM 312 CG TRP A 22 -7.023 -8.425 -5.422 1.00 0.00 C ATOM 313 CD1 TRP A 22 -6.450 -8.356 -6.663 1.00 0.00 C ATOM 314 CD2 TRP A 22 -6.724 -7.198 -4.775 1.00 0.00 C ATOM 315 NE1 TRP A 22 -5.806 -7.150 -6.812 1.00 0.00 N ATOM 316 CE2 TRP A 22 -5.970 -6.420 -5.671 1.00 0.00 C ATOM 317 CE3 TRP A 22 -7.028 -6.678 -3.518 1.00 0.00 C ATOM 318 CZ2 TRP A 22 -5.518 -5.154 -5.346 1.00 0.00 C ATOM 319 CZ3 TRP A 22 -6.579 -5.425 -3.200 1.00 0.00 C ATOM 320 CH2 TRP A 22 -5.835 -4.676 -4.110 1.00 0.00 C ATOM 0 H TRP A 22 -6.059 -11.187 -5.556 1.00 0.00 H new ATOM 0 HA TRP A 22 -6.502 -9.719 -3.137 1.00 0.00 H new ATOM 0 HB2 TRP A 22 -8.164 -10.202 -5.630 1.00 0.00 H new ATOM 0 HB3 TRP A 22 -8.671 -9.167 -4.309 1.00 0.00 H new ATOM 0 HD1 TRP A 22 -6.497 -9.132 -7.413 1.00 0.00 H new ATOM 0 HE1 TRP A 22 -5.290 -6.850 -7.640 1.00 0.00 H new ATOM 0 HE3 TRP A 22 -7.606 -7.252 -2.809 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 -4.938 -4.568 -6.043 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 -6.805 -5.010 -2.229 1.00 0.00 H new ATOM 0 HH2 TRP A 22 -5.500 -3.689 -3.827 1.00 0.00 H new ATOM 331 N SER A 23 -7.492 -12.584 -3.030 1.00 0.00 N ATOM 332 CA SER A 23 -8.220 -13.545 -2.267 1.00 0.00 C ATOM 333 C SER A 23 -7.578 -13.694 -0.880 1.00 0.00 C ATOM 334 O SER A 23 -8.254 -14.003 0.103 1.00 0.00 O ATOM 335 CB SER A 23 -8.196 -14.875 -2.997 1.00 0.00 C ATOM 336 OG SER A 23 -8.627 -14.718 -4.342 1.00 0.00 O ATOM 0 H SER A 23 -6.705 -12.966 -3.554 1.00 0.00 H new ATOM 0 HA SER A 23 -9.252 -13.217 -2.144 1.00 0.00 H new ATOM 0 HB2 SER A 23 -7.187 -15.287 -2.979 1.00 0.00 H new ATOM 0 HB3 SER A 23 -8.841 -15.589 -2.484 1.00 0.00 H new ATOM 0 HG SER A 23 -8.603 -15.586 -4.797 1.00 0.00 H new ATOM 342 N GLY A 24 -6.274 -13.447 -0.810 1.00 0.00 N ATOM 343 CA GLY A 24 -5.550 -13.623 0.430 1.00 0.00 C ATOM 344 C GLY A 24 -5.282 -12.337 1.182 1.00 0.00 C ATOM 345 O GLY A 24 -4.570 -12.350 2.189 1.00 0.00 O ATOM 0 H GLY A 24 -5.706 -13.127 -1.595 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -6.115 -14.296 1.075 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -4.599 -14.110 0.216 1.00 0.00 H new ATOM 349 N VAL A 25 -5.808 -11.229 0.689 1.00 0.00 N ATOM 350 CA VAL A 25 -5.644 -9.945 1.365 1.00 0.00 C ATOM 351 C VAL A 25 -6.263 -9.959 2.776 1.00 0.00 C ATOM 352 O VAL A 25 -7.367 -10.488 2.989 1.00 0.00 O ATOM 353 CB VAL A 25 -6.208 -8.755 0.532 1.00 0.00 C ATOM 354 CG1 VAL A 25 -5.444 -8.620 -0.772 1.00 0.00 C ATOM 355 CG2 VAL A 25 -7.700 -8.922 0.256 1.00 0.00 C ATOM 0 H VAL A 25 -6.351 -11.188 -0.173 1.00 0.00 H new ATOM 0 HA VAL A 25 -4.569 -9.792 1.465 1.00 0.00 H new ATOM 0 HB VAL A 25 -6.078 -7.845 1.118 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -5.847 -7.785 -1.345 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -4.390 -8.439 -0.559 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -5.545 -9.539 -1.350 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -8.059 -8.074 -0.327 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -7.866 -9.843 -0.303 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -8.242 -8.969 1.201 1.00 0.00 H new ATOM 365 N GLU A 26 -5.540 -9.406 3.720 1.00 0.00 N ATOM 366 CA GLU A 26 -5.975 -9.340 5.102 1.00 0.00 C ATOM 367 C GLU A 26 -5.715 -7.932 5.635 1.00 0.00 C ATOM 368 O GLU A 26 -4.751 -7.288 5.243 1.00 0.00 O ATOM 369 CB GLU A 26 -5.252 -10.418 5.950 1.00 0.00 C ATOM 370 CG GLU A 26 -5.592 -10.404 7.435 1.00 0.00 C ATOM 371 CD GLU A 26 -7.066 -10.585 7.700 1.00 0.00 C ATOM 372 OE1 GLU A 26 -7.804 -9.594 7.662 1.00 0.00 O ATOM 373 OE2 GLU A 26 -7.507 -11.730 7.953 1.00 0.00 O ATOM 0 H GLU A 26 -4.626 -8.985 3.554 1.00 0.00 H new ATOM 0 HA GLU A 26 -7.043 -9.546 5.167 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -5.496 -11.400 5.546 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -4.176 -10.286 5.838 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -5.037 -11.197 7.937 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -5.263 -9.460 7.869 1.00 0.00 H new ATOM 380 N CYS A 27 -6.585 -7.446 6.474 1.00 0.00 N ATOM 381 CA CYS A 27 -6.480 -6.100 6.991 1.00 0.00 C ATOM 382 C CYS A 27 -6.776 -6.068 8.462 1.00 0.00 C ATOM 383 O CYS A 27 -7.692 -6.740 8.945 1.00 0.00 O ATOM 384 CB CYS A 27 -7.416 -5.189 6.226 1.00 0.00 C ATOM 385 SG CYS A 27 -7.130 -5.179 4.449 1.00 0.00 S ATOM 0 H CYS A 27 -7.389 -7.967 6.823 1.00 0.00 H new ATOM 0 HA CYS A 27 -5.458 -5.746 6.856 1.00 0.00 H new ATOM 0 HB2 CYS A 27 -8.444 -5.497 6.417 1.00 0.00 H new ATOM 0 HB3 CYS A 27 -7.311 -4.173 6.607 1.00 0.00 H new ATOM 0 HG CYS A 27 -8.117 -5.773 3.847 1.00 0.00 H new ATOM 391 N LEU A 28 -5.991 -5.304 9.174 1.00 0.00 N ATOM 392 CA LEU A 28 -6.150 -5.155 10.594 1.00 0.00 C ATOM 393 C LEU A 28 -7.407 -4.309 10.903 1.00 0.00 C ATOM 394 O LEU A 28 -8.233 -4.687 11.730 1.00 0.00 O ATOM 395 CB LEU A 28 -4.834 -4.552 11.164 1.00 0.00 C ATOM 396 CG LEU A 28 -4.693 -4.318 12.679 1.00 0.00 C ATOM 397 CD1 LEU A 28 -5.572 -3.184 13.149 1.00 0.00 C ATOM 398 CD2 LEU A 28 -4.989 -5.594 13.452 1.00 0.00 C ATOM 0 H LEU A 28 -5.219 -4.765 8.782 1.00 0.00 H new ATOM 0 HA LEU A 28 -6.316 -6.115 11.082 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -4.018 -5.206 10.859 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -4.675 -3.593 10.671 1.00 0.00 H new ATOM 0 HG LEU A 28 -3.659 -4.033 12.875 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -5.447 -3.047 14.223 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -5.291 -2.267 12.631 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -6.614 -3.418 12.932 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -4.883 -5.405 14.520 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -6.007 -5.920 13.240 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -4.289 -6.373 13.150 1.00 0.00 H new ATOM 410 N ASN A 29 -7.541 -3.170 10.243 1.00 0.00 N ATOM 411 CA ASN A 29 -8.714 -2.322 10.463 1.00 0.00 C ATOM 412 C ASN A 29 -9.673 -2.474 9.289 1.00 0.00 C ATOM 413 O ASN A 29 -10.792 -2.951 9.453 1.00 0.00 O ATOM 414 CB ASN A 29 -8.323 -0.822 10.597 1.00 0.00 C ATOM 415 CG ASN A 29 -9.495 0.101 11.004 1.00 0.00 C ATOM 416 OD1 ASN A 29 -10.642 -0.205 10.783 1.00 0.00 O ATOM 417 ND2 ASN A 29 -9.196 1.272 11.516 1.00 0.00 N ATOM 0 H ASN A 29 -6.871 -2.812 9.563 1.00 0.00 H new ATOM 0 HA ASN A 29 -9.185 -2.640 11.393 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -7.528 -0.729 11.337 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -7.916 -0.477 9.646 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -9.937 1.938 11.733 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -8.222 1.516 11.697 1.00 0.00 H new ATOM 424 N GLN A 30 -9.196 -2.040 8.085 1.00 0.00 N ATOM 425 CA GLN A 30 -9.973 -1.997 6.809 1.00 0.00 C ATOM 426 C GLN A 30 -11.260 -1.214 6.959 1.00 0.00 C ATOM 427 O GLN A 30 -12.183 -1.359 6.169 1.00 0.00 O ATOM 428 CB GLN A 30 -10.185 -3.385 6.145 1.00 0.00 C ATOM 429 CG GLN A 30 -11.020 -4.411 6.892 1.00 0.00 C ATOM 430 CD GLN A 30 -10.992 -5.794 6.245 1.00 0.00 C ATOM 431 OE1 GLN A 30 -10.749 -5.853 4.953 1.00 0.00 O flip ATOM 432 NE2 GLN A 30 -11.139 -6.807 6.927 1.00 0.00 N flip ATOM 0 H GLN A 30 -8.240 -1.703 7.973 1.00 0.00 H new ATOM 0 HA GLN A 30 -9.346 -1.452 6.103 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -10.647 -3.223 5.171 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -9.203 -3.822 5.963 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -10.657 -4.489 7.917 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -12.051 -4.062 6.945 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -11.326 -6.726 7.926 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -11.074 -7.728 6.493 1.00 0.00 H new ATOM 441 N SER A 31 -11.241 -0.342 7.965 1.00 0.00 N ATOM 442 CA SER A 31 -12.303 0.551 8.336 1.00 0.00 C ATOM 443 C SER A 31 -13.437 -0.157 9.008 1.00 0.00 C ATOM 444 O SER A 31 -13.946 -1.169 8.527 1.00 0.00 O ATOM 445 CB SER A 31 -12.792 1.412 7.184 1.00 0.00 C ATOM 446 OG SER A 31 -13.826 2.309 7.597 1.00 0.00 O ATOM 0 H SER A 31 -10.427 -0.245 8.572 1.00 0.00 H new ATOM 0 HA SER A 31 -11.865 1.231 9.067 1.00 0.00 H new ATOM 0 HB2 SER A 31 -11.957 1.982 6.776 1.00 0.00 H new ATOM 0 HB3 SER A 31 -13.163 0.772 6.383 1.00 0.00 H new ATOM 0 HG SER A 31 -13.603 3.219 7.311 1.00 0.00 H new ATOM 452 N SER A 32 -13.823 0.370 10.129 1.00 0.00 N ATOM 453 CA SER A 32 -14.971 -0.120 10.845 1.00 0.00 C ATOM 454 C SER A 32 -16.270 0.305 10.087 1.00 0.00 C ATOM 455 O SER A 32 -17.385 -0.108 10.432 1.00 0.00 O ATOM 456 CB SER A 32 -14.952 0.428 12.290 1.00 0.00 C ATOM 457 OG SER A 32 -15.968 -0.151 13.096 1.00 0.00 O ATOM 0 H SER A 32 -13.352 1.155 10.579 1.00 0.00 H new ATOM 0 HA SER A 32 -14.947 -1.208 10.899 1.00 0.00 H new ATOM 0 HB2 SER A 32 -13.978 0.231 12.739 1.00 0.00 H new ATOM 0 HB3 SER A 32 -15.080 1.510 12.268 1.00 0.00 H new ATOM 0 HG SER A 32 -16.752 -0.350 12.542 1.00 0.00 H new ATOM 463 N SER A 33 -16.102 1.093 9.027 1.00 0.00 N ATOM 464 CA SER A 33 -17.204 1.580 8.250 1.00 0.00 C ATOM 465 C SER A 33 -17.088 1.145 6.769 1.00 0.00 C ATOM 466 O SER A 33 -17.843 0.287 6.301 1.00 0.00 O ATOM 467 CB SER A 33 -17.265 3.115 8.366 1.00 0.00 C ATOM 468 OG SER A 33 -18.337 3.661 7.625 1.00 0.00 O ATOM 0 H SER A 33 -15.189 1.404 8.694 1.00 0.00 H new ATOM 0 HA SER A 33 -18.126 1.149 8.639 1.00 0.00 H new ATOM 0 HB2 SER A 33 -17.369 3.395 9.414 1.00 0.00 H new ATOM 0 HB3 SER A 33 -16.326 3.543 8.014 1.00 0.00 H new ATOM 0 HG SER A 33 -17.994 4.056 6.796 1.00 0.00 H new ATOM 474 N HIS A 34 -16.111 1.699 6.066 1.00 0.00 N ATOM 475 CA HIS A 34 -15.968 1.493 4.622 1.00 0.00 C ATOM 476 C HIS A 34 -14.909 0.442 4.339 1.00 0.00 C ATOM 477 O HIS A 34 -13.739 0.687 4.538 1.00 0.00 O ATOM 478 CB HIS A 34 -15.598 2.812 3.926 1.00 0.00 C ATOM 479 CG HIS A 34 -16.618 3.916 4.046 1.00 0.00 C ATOM 480 ND1 HIS A 34 -16.824 4.835 5.020 1.00 0.00 N flip ATOM 481 CD2 HIS A 34 -17.549 4.192 3.073 1.00 0.00 C flip ATOM 482 CE1 HIS A 34 -17.855 5.634 4.614 1.00 0.00 C flip ATOM 483 NE2 HIS A 34 -18.272 5.225 3.438 1.00 0.00 N flip ATOM 0 H HIS A 34 -15.396 2.302 6.473 1.00 0.00 H new ATOM 0 HA HIS A 34 -16.923 1.144 4.229 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -14.653 3.167 4.337 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -15.429 2.610 2.868 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -17.667 3.643 2.150 1.00 0.00 H new ATOM 0 HE1 HIS A 34 -18.261 6.466 5.170 1.00 0.00 H new ATOM 0 HE2 HIS A 34 -19.031 5.641 2.898 1.00 0.00 H new ATOM 492 N SER A 35 -15.323 -0.686 3.829 1.00 0.00 N ATOM 493 CA SER A 35 -14.445 -1.846 3.688 1.00 0.00 C ATOM 494 C SER A 35 -13.310 -1.610 2.668 1.00 0.00 C ATOM 495 O SER A 35 -13.559 -1.237 1.552 1.00 0.00 O ATOM 496 CB SER A 35 -15.290 -3.038 3.275 1.00 0.00 C ATOM 497 OG SER A 35 -16.360 -3.239 4.197 1.00 0.00 O ATOM 0 H SER A 35 -16.275 -0.840 3.496 1.00 0.00 H new ATOM 0 HA SER A 35 -13.961 -2.031 4.647 1.00 0.00 H new ATOM 0 HB2 SER A 35 -15.691 -2.877 2.274 1.00 0.00 H new ATOM 0 HB3 SER A 35 -14.669 -3.933 3.230 1.00 0.00 H new ATOM 0 HG SER A 35 -16.895 -4.010 3.914 1.00 0.00 H new ATOM 503 N LEU A 36 -12.072 -1.909 3.076 1.00 0.00 N ATOM 504 CA LEU A 36 -10.856 -1.691 2.254 1.00 0.00 C ATOM 505 C LEU A 36 -10.882 -2.120 0.746 1.00 0.00 C ATOM 506 O LEU A 36 -10.300 -1.401 -0.087 1.00 0.00 O ATOM 507 CB LEU A 36 -9.598 -2.168 2.995 1.00 0.00 C ATOM 508 CG LEU A 36 -8.297 -2.209 2.206 1.00 0.00 C ATOM 509 CD1 LEU A 36 -7.139 -2.048 3.148 1.00 0.00 C ATOM 510 CD2 LEU A 36 -8.170 -3.563 1.497 1.00 0.00 C ATOM 0 H LEU A 36 -11.874 -2.313 3.992 1.00 0.00 H new ATOM 0 HA LEU A 36 -10.831 -0.607 2.143 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -9.449 -1.520 3.858 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -9.792 -3.170 3.378 1.00 0.00 H new ATOM 0 HG LEU A 36 -8.296 -1.404 1.471 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -6.206 -2.077 2.586 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -7.221 -1.092 3.666 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -7.148 -2.858 3.878 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -7.238 -3.592 0.932 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -8.170 -4.363 2.237 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -9.011 -3.698 0.817 1.00 0.00 H new ATOM 522 N PRO A 37 -11.501 -3.286 0.354 1.00 0.00 N ATOM 523 CA PRO A 37 -11.597 -3.711 -1.075 1.00 0.00 C ATOM 524 C PRO A 37 -12.222 -2.650 -2.036 1.00 0.00 C ATOM 525 O PRO A 37 -12.381 -2.907 -3.222 1.00 0.00 O ATOM 526 CB PRO A 37 -12.465 -4.969 -1.018 1.00 0.00 C ATOM 527 CG PRO A 37 -12.231 -5.511 0.344 1.00 0.00 C ATOM 528 CD PRO A 37 -12.101 -4.314 1.242 1.00 0.00 C ATOM 0 HA PRO A 37 -10.602 -3.867 -1.492 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -13.517 -4.734 -1.178 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -12.178 -5.686 -1.787 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -13.057 -6.149 0.659 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -11.328 -6.122 0.373 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -13.068 -3.995 1.630 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -11.465 -4.523 2.102 1.00 0.00 H new ATOM 536 N ASN A 38 -12.623 -1.519 -1.514 1.00 0.00 N ATOM 537 CA ASN A 38 -13.119 -0.449 -2.345 1.00 0.00 C ATOM 538 C ASN A 38 -11.988 0.467 -2.884 1.00 0.00 C ATOM 539 O ASN A 38 -11.934 0.733 -4.081 1.00 0.00 O ATOM 540 CB ASN A 38 -14.244 0.365 -1.647 1.00 0.00 C ATOM 541 CG ASN A 38 -13.886 0.959 -0.276 1.00 0.00 C ATOM 542 OD1 ASN A 38 -12.743 1.270 0.017 1.00 0.00 O ATOM 543 ND2 ASN A 38 -14.873 1.106 0.579 1.00 0.00 N ATOM 0 H ASN A 38 -12.616 -1.314 -0.515 1.00 0.00 H new ATOM 0 HA ASN A 38 -13.567 -0.927 -3.216 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -14.542 1.179 -2.308 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -15.113 -0.282 -1.526 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -14.691 1.486 1.508 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -15.821 0.840 0.314 1.00 0.00 H new ATOM 550 N ALA A 39 -11.081 0.906 -2.010 1.00 0.00 N ATOM 551 CA ALA A 39 -10.031 1.859 -2.391 1.00 0.00 C ATOM 552 C ALA A 39 -8.661 1.226 -2.535 1.00 0.00 C ATOM 553 O ALA A 39 -7.746 1.838 -3.100 1.00 0.00 O ATOM 554 CB ALA A 39 -9.972 3.005 -1.416 1.00 0.00 C ATOM 0 H ALA A 39 -11.050 0.618 -1.032 1.00 0.00 H new ATOM 0 HA ALA A 39 -10.308 2.230 -3.378 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -9.187 3.699 -1.717 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -10.931 3.524 -1.406 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -9.755 2.623 -0.418 1.00 0.00 H new ATOM 560 N LEU A 40 -8.497 0.021 -2.045 1.00 0.00 N ATOM 561 CA LEU A 40 -7.222 -0.639 -2.227 1.00 0.00 C ATOM 562 C LEU A 40 -7.372 -1.631 -3.323 1.00 0.00 C ATOM 563 O LEU A 40 -6.496 -1.758 -4.173 1.00 0.00 O ATOM 564 CB LEU A 40 -6.678 -1.292 -0.940 1.00 0.00 C ATOM 565 CG LEU A 40 -5.312 -2.020 -1.081 1.00 0.00 C ATOM 566 CD1 LEU A 40 -4.256 -1.091 -1.627 1.00 0.00 C ATOM 567 CD2 LEU A 40 -4.841 -2.574 0.247 1.00 0.00 C ATOM 0 H LEU A 40 -9.202 -0.510 -1.534 1.00 0.00 H new ATOM 0 HA LEU A 40 -6.477 0.112 -2.490 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -6.581 -0.521 -0.176 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -7.415 -2.008 -0.578 1.00 0.00 H new ATOM 0 HG LEU A 40 -5.464 -2.845 -1.777 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -3.311 -1.626 -1.715 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -4.562 -0.730 -2.609 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -4.132 -0.244 -0.952 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -3.883 -3.077 0.112 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -4.726 -1.759 0.961 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -5.575 -3.286 0.625 1.00 0.00 H new ATOM 579 N LYS A 41 -8.503 -2.327 -3.349 1.00 0.00 N ATOM 580 CA LYS A 41 -8.785 -3.134 -4.492 1.00 0.00 C ATOM 581 C LYS A 41 -9.304 -2.136 -5.487 1.00 0.00 C ATOM 582 O LYS A 41 -10.458 -1.708 -5.426 1.00 0.00 O ATOM 583 CB LYS A 41 -9.834 -4.242 -4.183 1.00 0.00 C ATOM 584 CG LYS A 41 -9.958 -5.381 -5.226 1.00 0.00 C ATOM 585 CD LYS A 41 -10.396 -4.916 -6.608 1.00 0.00 C ATOM 586 CE LYS A 41 -10.432 -6.078 -7.594 1.00 0.00 C ATOM 587 NZ LYS A 41 -11.415 -7.113 -7.212 1.00 0.00 N ATOM 0 H LYS A 41 -9.207 -2.340 -2.611 1.00 0.00 H new ATOM 0 HA LYS A 41 -7.914 -3.683 -4.849 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -9.588 -4.687 -3.219 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -10.810 -3.769 -4.076 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -8.996 -5.886 -5.313 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -10.672 -6.118 -4.859 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -11.383 -4.458 -6.545 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -9.712 -4.149 -6.970 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -10.674 -5.700 -8.587 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -9.441 -6.528 -7.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -11.525 -7.792 -7.992 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -11.082 -7.612 -6.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -12.332 -6.664 -7.012 1.00 0.00 H new ATOM 601 N GLN A 42 -8.431 -1.721 -6.341 1.00 0.00 N ATOM 602 CA GLN A 42 -8.698 -0.672 -7.253 1.00 0.00 C ATOM 603 C GLN A 42 -9.690 -1.128 -8.303 1.00 0.00 C ATOM 604 O GLN A 42 -9.365 -1.893 -9.211 1.00 0.00 O ATOM 605 CB GLN A 42 -7.357 -0.170 -7.824 1.00 0.00 C ATOM 606 CG GLN A 42 -7.363 1.079 -8.722 1.00 0.00 C ATOM 607 CD GLN A 42 -8.096 0.918 -10.030 1.00 0.00 C ATOM 608 OE1 GLN A 42 -7.525 0.496 -10.999 1.00 0.00 O ATOM 609 NE2 GLN A 42 -9.352 1.299 -10.067 1.00 0.00 N ATOM 0 H GLN A 42 -7.493 -2.113 -6.423 1.00 0.00 H new ATOM 0 HA GLN A 42 -9.175 0.174 -6.758 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -6.693 0.029 -6.983 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -6.913 -0.986 -8.394 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -7.813 1.904 -8.169 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -6.332 1.362 -8.933 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -9.803 1.652 -9.223 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -9.877 1.242 -10.940 1.00 0.00 H new ATOM 618 N GLY A 43 -10.906 -0.695 -8.115 1.00 0.00 N ATOM 619 CA GLY A 43 -11.962 -0.968 -9.036 1.00 0.00 C ATOM 620 C GLY A 43 -13.138 -0.068 -8.773 1.00 0.00 C ATOM 621 O GLY A 43 -13.561 0.688 -9.633 1.00 0.00 O ATOM 0 H GLY A 43 -11.189 -0.138 -7.309 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -11.608 -0.824 -10.057 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -12.268 -2.011 -8.949 1.00 0.00 H new ATOM 625 N TYR A 44 -13.621 -0.113 -7.554 1.00 0.00 N ATOM 626 CA TYR A 44 -14.801 0.643 -7.130 1.00 0.00 C ATOM 627 C TYR A 44 -14.390 2.013 -6.628 1.00 0.00 C ATOM 628 O TYR A 44 -15.227 2.873 -6.371 1.00 0.00 O ATOM 629 CB TYR A 44 -15.473 -0.090 -5.976 1.00 0.00 C ATOM 630 CG TYR A 44 -15.797 -1.534 -6.250 1.00 0.00 C ATOM 631 CD1 TYR A 44 -14.877 -2.536 -5.956 1.00 0.00 C ATOM 632 CD2 TYR A 44 -17.013 -1.901 -6.788 1.00 0.00 C ATOM 633 CE1 TYR A 44 -15.163 -3.852 -6.195 1.00 0.00 C ATOM 634 CE2 TYR A 44 -17.309 -3.224 -7.028 1.00 0.00 C ATOM 635 CZ TYR A 44 -16.381 -4.194 -6.731 1.00 0.00 C ATOM 636 OH TYR A 44 -16.677 -5.515 -6.964 1.00 0.00 O ATOM 0 H TYR A 44 -13.209 -0.679 -6.812 1.00 0.00 H new ATOM 0 HA TYR A 44 -15.477 0.743 -7.979 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -14.823 -0.037 -5.103 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -16.395 0.432 -5.719 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -13.920 -2.270 -5.532 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -17.743 -1.140 -7.024 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -14.436 -4.617 -5.964 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -18.266 -3.499 -7.448 1.00 0.00 H new ATOM 0 HH TYR A 44 -17.578 -5.586 -7.344 1.00 0.00 H new ATOM 646 N ARG A 45 -13.101 2.173 -6.478 1.00 0.00 N ATOM 647 CA ARG A 45 -12.489 3.334 -5.865 1.00 0.00 C ATOM 648 C ARG A 45 -12.939 4.666 -6.463 1.00 0.00 C ATOM 649 O ARG A 45 -12.967 4.840 -7.697 1.00 0.00 O ATOM 650 CB ARG A 45 -10.938 3.175 -5.858 1.00 0.00 C ATOM 651 CG ARG A 45 -10.214 3.202 -7.220 1.00 0.00 C ATOM 652 CD ARG A 45 -10.042 4.625 -7.764 1.00 0.00 C ATOM 653 NE ARG A 45 -9.432 4.657 -9.098 1.00 0.00 N ATOM 654 CZ ARG A 45 -8.778 5.706 -9.613 1.00 0.00 C ATOM 655 NH1 ARG A 45 -8.659 6.833 -8.917 1.00 0.00 N ATOM 656 NH2 ARG A 45 -8.274 5.630 -10.841 1.00 0.00 N ATOM 0 H ARG A 45 -12.422 1.478 -6.788 1.00 0.00 H new ATOM 0 HA ARG A 45 -12.842 3.374 -4.835 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -10.521 3.970 -5.239 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -10.699 2.231 -5.368 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -9.235 2.735 -7.117 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -10.777 2.607 -7.939 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -11.016 5.113 -7.804 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -9.425 5.200 -7.074 1.00 0.00 H new ATOM 0 HE ARG A 45 -9.512 3.820 -9.675 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -9.067 6.902 -7.985 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -8.160 7.628 -9.315 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -8.386 4.775 -11.386 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -7.775 6.426 -11.238 1.00 0.00 H new ATOM 670 N GLU A 46 -13.327 5.560 -5.569 1.00 0.00 N ATOM 671 CA GLU A 46 -13.673 6.939 -5.855 1.00 0.00 C ATOM 672 C GLU A 46 -14.188 7.480 -4.526 1.00 0.00 C ATOM 673 O GLU A 46 -14.896 6.768 -3.808 1.00 0.00 O ATOM 674 CB GLU A 46 -14.784 7.021 -6.935 1.00 0.00 C ATOM 675 CG GLU A 46 -14.817 8.316 -7.764 1.00 0.00 C ATOM 676 CD GLU A 46 -15.036 9.577 -6.974 1.00 0.00 C ATOM 677 OE1 GLU A 46 -14.044 10.180 -6.506 1.00 0.00 O ATOM 678 OE2 GLU A 46 -16.200 10.003 -6.847 1.00 0.00 O ATOM 0 H GLU A 46 -13.413 5.332 -4.579 1.00 0.00 H new ATOM 0 HA GLU A 46 -12.825 7.504 -6.243 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -14.665 6.179 -7.616 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -15.750 6.901 -6.445 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -13.876 8.405 -8.307 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -15.608 8.231 -8.509 1.00 0.00 H new ATOM 685 N ASP A 47 -13.836 8.682 -4.176 1.00 0.00 N ATOM 686 CA ASP A 47 -14.275 9.227 -2.904 1.00 0.00 C ATOM 687 C ASP A 47 -15.677 9.783 -3.066 1.00 0.00 C ATOM 688 O ASP A 47 -15.869 10.938 -3.439 1.00 0.00 O ATOM 689 CB ASP A 47 -13.308 10.295 -2.372 1.00 0.00 C ATOM 690 CG ASP A 47 -13.690 10.811 -0.996 1.00 0.00 C ATOM 691 OD1 ASP A 47 -14.572 11.688 -0.889 1.00 0.00 O ATOM 692 OD2 ASP A 47 -13.108 10.340 -0.004 1.00 0.00 O ATOM 0 H ASP A 47 -13.255 9.304 -4.737 1.00 0.00 H new ATOM 0 HA ASP A 47 -14.284 8.428 -2.163 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -12.302 9.878 -2.331 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -13.278 11.130 -3.071 1.00 0.00 H new ATOM 697 N GLU A 48 -16.643 8.931 -2.864 1.00 0.00 N ATOM 698 CA GLU A 48 -18.028 9.285 -3.045 1.00 0.00 C ATOM 699 C GLU A 48 -18.861 8.420 -2.112 1.00 0.00 C ATOM 700 O GLU A 48 -19.408 8.903 -1.128 1.00 0.00 O ATOM 701 CB GLU A 48 -18.403 9.057 -4.539 1.00 0.00 C ATOM 702 CG GLU A 48 -19.774 9.565 -5.011 1.00 0.00 C ATOM 703 CD GLU A 48 -20.960 8.857 -4.410 1.00 0.00 C ATOM 704 OE1 GLU A 48 -21.218 7.687 -4.776 1.00 0.00 O ATOM 705 OE2 GLU A 48 -21.669 9.467 -3.605 1.00 0.00 O ATOM 0 H GLU A 48 -16.494 7.966 -2.568 1.00 0.00 H new ATOM 0 HA GLU A 48 -18.216 10.332 -2.805 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -17.638 9.532 -5.154 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -18.354 7.987 -4.739 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -19.850 10.628 -4.780 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -19.825 9.470 -6.096 1.00 0.00 H new ATOM 712 N GLY A 49 -18.923 7.143 -2.410 1.00 0.00 N ATOM 713 CA GLY A 49 -19.659 6.233 -1.582 1.00 0.00 C ATOM 714 C GLY A 49 -18.751 5.247 -0.910 1.00 0.00 C ATOM 715 O GLY A 49 -18.845 5.021 0.297 1.00 0.00 O ATOM 0 H GLY A 49 -18.472 6.717 -3.219 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -20.213 6.792 -0.828 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -20.393 5.700 -2.187 1.00 0.00 H new ATOM 719 N LEU A 50 -17.852 4.661 -1.669 1.00 0.00 N ATOM 720 CA LEU A 50 -16.949 3.707 -1.102 1.00 0.00 C ATOM 721 C LEU A 50 -15.491 4.050 -1.373 1.00 0.00 C ATOM 722 O LEU A 50 -15.017 4.032 -2.507 1.00 0.00 O ATOM 723 CB LEU A 50 -17.299 2.217 -1.467 1.00 0.00 C ATOM 724 CG LEU A 50 -17.276 1.739 -2.954 1.00 0.00 C ATOM 725 CD1 LEU A 50 -17.658 0.271 -3.032 1.00 0.00 C ATOM 726 CD2 LEU A 50 -18.193 2.547 -3.859 1.00 0.00 C ATOM 0 H LEU A 50 -17.733 4.831 -2.668 1.00 0.00 H new ATOM 0 HA LEU A 50 -17.089 3.780 -0.023 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -16.609 1.580 -0.913 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -18.298 2.017 -1.080 1.00 0.00 H new ATOM 0 HG LEU A 50 -16.258 1.890 -3.312 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -17.640 -0.055 -4.072 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -16.948 -0.321 -2.454 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -18.660 0.134 -2.626 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -18.130 2.163 -4.877 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -19.220 2.464 -3.503 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -17.888 3.593 -3.846 1.00 0.00 H new ATOM 738 N ASN A 51 -14.808 4.360 -0.303 1.00 0.00 N ATOM 739 CA ASN A 51 -13.391 4.664 -0.271 1.00 0.00 C ATOM 740 C ASN A 51 -12.904 4.207 1.074 1.00 0.00 C ATOM 741 O ASN A 51 -13.715 4.053 1.983 1.00 0.00 O ATOM 742 CB ASN A 51 -13.117 6.182 -0.434 1.00 0.00 C ATOM 743 CG ASN A 51 -13.767 7.037 0.651 1.00 0.00 C ATOM 744 OD1 ASN A 51 -14.903 7.486 0.507 1.00 0.00 O ATOM 745 ND2 ASN A 51 -13.057 7.265 1.736 1.00 0.00 N ATOM 0 H ASN A 51 -15.241 4.411 0.619 1.00 0.00 H new ATOM 0 HA ASN A 51 -12.880 4.166 -1.095 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -12.040 6.352 -0.424 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -13.482 6.507 -1.409 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -13.446 7.830 2.491 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -12.118 6.877 1.822 1.00 0.00 H new ATOM 752 N LEU A 52 -11.635 4.001 1.232 1.00 0.00 N ATOM 753 CA LEU A 52 -11.145 3.507 2.488 1.00 0.00 C ATOM 754 C LEU A 52 -10.793 4.657 3.404 1.00 0.00 C ATOM 755 O LEU A 52 -9.991 5.527 3.057 1.00 0.00 O ATOM 756 CB LEU A 52 -9.964 2.495 2.280 1.00 0.00 C ATOM 757 CG LEU A 52 -9.371 1.759 3.533 1.00 0.00 C ATOM 758 CD1 LEU A 52 -8.510 2.663 4.398 1.00 0.00 C ATOM 759 CD2 LEU A 52 -10.485 1.176 4.377 1.00 0.00 C ATOM 0 H LEU A 52 -10.924 4.163 0.519 1.00 0.00 H new ATOM 0 HA LEU A 52 -11.936 2.942 2.981 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -10.302 1.732 1.578 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -9.149 3.034 1.797 1.00 0.00 H new ATOM 0 HG LEU A 52 -8.732 0.964 3.149 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -8.129 2.098 5.248 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -7.674 3.041 3.810 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -9.108 3.500 4.758 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -10.058 0.669 5.242 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -11.143 1.977 4.714 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -11.056 0.462 3.783 1.00 0.00 H new ATOM 771 N GLU A 53 -11.453 4.684 4.533 1.00 0.00 N ATOM 772 CA GLU A 53 -11.187 5.626 5.576 1.00 0.00 C ATOM 773 C GLU A 53 -11.298 4.962 6.921 1.00 0.00 C ATOM 774 O GLU A 53 -12.348 4.451 7.276 1.00 0.00 O ATOM 775 CB GLU A 53 -12.001 6.909 5.431 1.00 0.00 C ATOM 776 CG GLU A 53 -13.488 6.756 5.284 1.00 0.00 C ATOM 777 CD GLU A 53 -14.120 8.090 5.018 1.00 0.00 C ATOM 778 OE1 GLU A 53 -14.081 8.549 3.862 1.00 0.00 O ATOM 779 OE2 GLU A 53 -14.635 8.711 5.954 1.00 0.00 O ATOM 0 H GLU A 53 -12.207 4.034 4.753 1.00 0.00 H new ATOM 0 HA GLU A 53 -10.155 5.964 5.485 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -11.809 7.534 6.303 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -11.628 7.451 4.562 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -13.712 6.070 4.467 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -13.908 6.320 6.191 1.00 0.00 H new ATOM 786 N SER A 54 -10.185 4.983 7.641 1.00 0.00 N ATOM 787 CA SER A 54 -9.953 4.256 8.900 1.00 0.00 C ATOM 788 C SER A 54 -11.185 4.120 9.830 1.00 0.00 C ATOM 789 O SER A 54 -11.642 2.996 10.081 1.00 0.00 O ATOM 790 CB SER A 54 -8.759 4.870 9.614 1.00 0.00 C ATOM 791 OG SER A 54 -8.921 6.265 9.803 1.00 0.00 O ATOM 0 H SER A 54 -9.374 5.532 7.356 1.00 0.00 H new ATOM 0 HA SER A 54 -9.739 3.223 8.626 1.00 0.00 H new ATOM 0 HB2 SER A 54 -8.625 4.385 10.581 1.00 0.00 H new ATOM 0 HB3 SER A 54 -7.854 4.684 9.036 1.00 0.00 H new ATOM 0 HG SER A 54 -8.487 6.534 10.639 1.00 0.00 H new ATOM 797 N ASP A 55 -11.671 5.239 10.359 1.00 0.00 N ATOM 798 CA ASP A 55 -12.930 5.290 11.171 1.00 0.00 C ATOM 799 C ASP A 55 -12.784 4.542 12.527 1.00 0.00 C ATOM 800 O ASP A 55 -13.752 4.246 13.201 1.00 0.00 O ATOM 801 CB ASP A 55 -14.126 4.736 10.327 1.00 0.00 C ATOM 802 CG ASP A 55 -15.493 4.890 10.983 1.00 0.00 C ATOM 803 OD1 ASP A 55 -15.986 6.035 11.069 1.00 0.00 O ATOM 804 OD2 ASP A 55 -16.098 3.881 11.391 1.00 0.00 O ATOM 0 H ASP A 55 -11.220 6.147 10.250 1.00 0.00 H new ATOM 0 HA ASP A 55 -13.133 6.331 11.422 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -14.141 5.246 9.364 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -13.952 3.679 10.125 1.00 0.00 H new ATOM 809 N ALA A 56 -11.551 4.301 12.935 1.00 0.00 N ATOM 810 CA ALA A 56 -11.272 3.598 14.189 1.00 0.00 C ATOM 811 C ALA A 56 -9.847 3.875 14.618 1.00 0.00 C ATOM 812 O ALA A 56 -9.600 4.461 15.667 1.00 0.00 O ATOM 813 CB ALA A 56 -11.499 2.096 14.036 1.00 0.00 C ATOM 0 H ALA A 56 -10.718 4.581 12.418 1.00 0.00 H new ATOM 0 HA ALA A 56 -11.957 3.963 14.955 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -11.285 1.597 14.981 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -12.536 1.911 13.755 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -10.839 1.705 13.262 1.00 0.00 H new ATOM 819 N ASP A 57 -8.923 3.443 13.792 1.00 0.00 N ATOM 820 CA ASP A 57 -7.504 3.683 13.983 1.00 0.00 C ATOM 821 C ASP A 57 -6.951 4.186 12.706 1.00 0.00 C ATOM 822 O ASP A 57 -7.156 3.559 11.669 1.00 0.00 O ATOM 823 CB ASP A 57 -6.727 2.411 14.373 1.00 0.00 C ATOM 824 CG ASP A 57 -7.058 1.876 15.730 1.00 0.00 C ATOM 825 OD1 ASP A 57 -6.581 2.452 16.733 1.00 0.00 O ATOM 826 OD2 ASP A 57 -7.765 0.849 15.823 1.00 0.00 O ATOM 0 H ASP A 57 -9.136 2.905 12.952 1.00 0.00 H new ATOM 0 HA ASP A 57 -7.395 4.399 14.798 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -6.926 1.637 13.632 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -5.659 2.625 14.331 1.00 0.00 H new ATOM 831 N GLU A 58 -6.263 5.297 12.767 1.00 0.00 N ATOM 832 CA GLU A 58 -5.650 5.917 11.599 1.00 0.00 C ATOM 833 C GLU A 58 -4.440 5.131 11.163 1.00 0.00 C ATOM 834 O GLU A 58 -4.095 5.087 9.976 1.00 0.00 O ATOM 835 CB GLU A 58 -5.287 7.409 11.842 1.00 0.00 C ATOM 836 CG GLU A 58 -4.397 7.711 13.056 1.00 0.00 C ATOM 837 CD GLU A 58 -5.063 7.418 14.381 1.00 0.00 C ATOM 838 OE1 GLU A 58 -5.755 8.297 14.920 1.00 0.00 O ATOM 839 OE2 GLU A 58 -4.896 6.297 14.901 1.00 0.00 O ATOM 0 H GLU A 58 -6.105 5.810 13.634 1.00 0.00 H new ATOM 0 HA GLU A 58 -6.388 5.902 10.797 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -4.787 7.788 10.950 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -6.214 7.972 11.951 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -3.482 7.123 12.981 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -4.105 8.761 13.030 1.00 0.00 H new ATOM 846 N GLN A 59 -3.812 4.513 12.124 1.00 0.00 N ATOM 847 CA GLN A 59 -2.704 3.653 11.889 1.00 0.00 C ATOM 848 C GLN A 59 -3.240 2.350 11.297 1.00 0.00 C ATOM 849 O GLN A 59 -4.021 1.620 11.925 1.00 0.00 O ATOM 850 CB GLN A 59 -1.935 3.470 13.195 1.00 0.00 C ATOM 851 CG GLN A 59 -2.778 2.961 14.352 1.00 0.00 C ATOM 852 CD GLN A 59 -2.057 3.050 15.655 1.00 0.00 C ATOM 853 OE1 GLN A 59 -2.158 4.050 16.363 1.00 0.00 O ATOM 854 NE2 GLN A 59 -1.308 2.055 15.969 1.00 0.00 N ATOM 0 H GLN A 59 -4.067 4.600 13.108 1.00 0.00 H new ATOM 0 HA GLN A 59 -1.996 4.069 11.172 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -1.114 2.773 13.025 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -1.490 4.424 13.477 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -3.701 3.538 14.409 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -3.061 1.925 14.165 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -1.253 1.244 15.353 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -0.769 2.076 16.834 1.00 0.00 H new ATOM 863 N LEU A 60 -2.863 2.091 10.088 1.00 0.00 N ATOM 864 CA LEU A 60 -3.446 1.020 9.335 1.00 0.00 C ATOM 865 C LEU A 60 -2.440 -0.033 8.928 1.00 0.00 C ATOM 866 O LEU A 60 -1.420 0.261 8.321 1.00 0.00 O ATOM 867 CB LEU A 60 -4.169 1.598 8.121 1.00 0.00 C ATOM 868 CG LEU A 60 -5.412 2.445 8.402 1.00 0.00 C ATOM 869 CD1 LEU A 60 -5.947 3.042 7.126 1.00 0.00 C ATOM 870 CD2 LEU A 60 -6.484 1.617 9.064 1.00 0.00 C ATOM 0 H LEU A 60 -2.142 2.614 9.591 1.00 0.00 H new ATOM 0 HA LEU A 60 -4.161 0.507 9.979 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -3.460 2.209 7.561 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -4.460 0.772 7.472 1.00 0.00 H new ATOM 0 HG LEU A 60 -5.123 3.251 9.076 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -6.831 3.641 7.347 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -5.184 3.675 6.673 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -6.214 2.243 6.434 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -7.358 2.239 9.255 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -6.762 0.791 8.409 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -6.108 1.221 10.007 1.00 0.00 H new ATOM 882 N LEU A 61 -2.756 -1.257 9.260 1.00 0.00 N ATOM 883 CA LEU A 61 -1.922 -2.391 8.948 1.00 0.00 C ATOM 884 C LEU A 61 -2.681 -3.257 7.923 1.00 0.00 C ATOM 885 O LEU A 61 -3.828 -3.689 8.183 1.00 0.00 O ATOM 886 CB LEU A 61 -1.657 -3.184 10.263 1.00 0.00 C ATOM 887 CG LEU A 61 -0.571 -4.291 10.271 1.00 0.00 C ATOM 888 CD1 LEU A 61 -0.827 -5.376 9.255 1.00 0.00 C ATOM 889 CD2 LEU A 61 0.794 -3.700 10.075 1.00 0.00 C ATOM 0 H LEU A 61 -3.611 -1.499 9.761 1.00 0.00 H new ATOM 0 HA LEU A 61 -0.963 -2.089 8.527 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -1.395 -2.461 11.035 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -2.598 -3.645 10.564 1.00 0.00 H new ATOM 0 HG LEU A 61 -0.619 -4.762 11.253 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -0.033 -6.121 9.310 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -1.785 -5.852 9.464 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -0.848 -4.941 8.256 1.00 0.00 H new ATOM 0 HD21 LEU A 61 1.539 -4.495 10.084 1.00 0.00 H new ATOM 0 HD22 LEU A 61 0.831 -3.179 9.118 1.00 0.00 H new ATOM 0 HD23 LEU A 61 1.005 -2.996 10.880 1.00 0.00 H new ATOM 901 N ILE A 62 -2.080 -3.475 6.769 1.00 0.00 N ATOM 902 CA ILE A 62 -2.684 -4.287 5.717 1.00 0.00 C ATOM 903 C ILE A 62 -1.687 -5.376 5.258 1.00 0.00 C ATOM 904 O ILE A 62 -0.485 -5.145 5.210 1.00 0.00 O ATOM 905 CB ILE A 62 -3.152 -3.436 4.452 1.00 0.00 C ATOM 906 CG1 ILE A 62 -4.207 -2.354 4.794 1.00 0.00 C ATOM 907 CG2 ILE A 62 -3.729 -4.340 3.368 1.00 0.00 C ATOM 908 CD1 ILE A 62 -3.724 -1.166 5.588 1.00 0.00 C ATOM 0 H ILE A 62 -1.163 -3.098 6.530 1.00 0.00 H new ATOM 0 HA ILE A 62 -3.578 -4.737 6.149 1.00 0.00 H new ATOM 0 HB ILE A 62 -2.253 -2.933 4.096 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -4.635 -1.988 3.860 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -5.015 -2.830 5.350 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -4.040 -3.734 2.517 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -2.970 -5.054 3.047 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -4.590 -4.879 3.764 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -4.555 -0.482 5.762 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -3.327 -1.505 6.545 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -2.941 -0.651 5.032 1.00 0.00 H new ATOM 920 N TYR A 63 -2.200 -6.544 4.961 1.00 0.00 N ATOM 921 CA TYR A 63 -1.424 -7.664 4.473 1.00 0.00 C ATOM 922 C TYR A 63 -1.764 -7.929 3.022 1.00 0.00 C ATOM 923 O TYR A 63 -2.932 -8.192 2.686 1.00 0.00 O ATOM 924 CB TYR A 63 -1.737 -8.912 5.307 1.00 0.00 C ATOM 925 CG TYR A 63 -1.122 -10.212 4.783 1.00 0.00 C ATOM 926 CD1 TYR A 63 -1.813 -11.007 3.867 1.00 0.00 C ATOM 927 CD2 TYR A 63 0.127 -10.637 5.198 1.00 0.00 C ATOM 928 CE1 TYR A 63 -1.278 -12.177 3.384 1.00 0.00 C ATOM 929 CE2 TYR A 63 0.672 -11.815 4.719 1.00 0.00 C ATOM 930 CZ TYR A 63 -0.037 -12.581 3.808 1.00 0.00 C ATOM 931 OH TYR A 63 0.503 -13.762 3.330 1.00 0.00 O ATOM 0 H TYR A 63 -3.195 -6.751 5.053 1.00 0.00 H new ATOM 0 HA TYR A 63 -0.363 -7.428 4.558 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -1.386 -8.747 6.326 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -2.819 -9.034 5.358 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -2.791 -10.695 3.530 1.00 0.00 H new ATOM 0 HD2 TYR A 63 0.684 -10.041 5.906 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -1.831 -12.775 2.675 1.00 0.00 H new ATOM 0 HE2 TYR A 63 1.647 -12.136 5.054 1.00 0.00 H new ATOM 0 HH TYR A 63 1.387 -13.902 3.728 1.00 0.00 H new ATOM 941 N ILE A 64 -0.773 -7.876 2.175 1.00 0.00 N ATOM 942 CA ILE A 64 -0.968 -8.145 0.777 1.00 0.00 C ATOM 943 C ILE A 64 -0.095 -9.320 0.322 1.00 0.00 C ATOM 944 O ILE A 64 1.116 -9.290 0.481 1.00 0.00 O ATOM 945 CB ILE A 64 -0.630 -6.914 -0.100 1.00 0.00 C ATOM 946 CG1 ILE A 64 -1.520 -5.703 0.259 1.00 0.00 C ATOM 947 CG2 ILE A 64 -0.789 -7.275 -1.562 1.00 0.00 C ATOM 948 CD1 ILE A 64 -3.009 -5.931 0.047 1.00 0.00 C ATOM 0 H ILE A 64 0.187 -7.647 2.432 1.00 0.00 H new ATOM 0 HA ILE A 64 -2.022 -8.391 0.652 1.00 0.00 H new ATOM 0 HB ILE A 64 0.404 -6.627 0.092 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -1.350 -5.440 1.303 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -1.207 -4.848 -0.340 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -0.551 -6.408 -2.179 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -0.113 -8.094 -1.810 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -1.817 -7.583 -1.751 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -3.558 -5.031 0.324 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -3.196 -6.162 -1.002 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.341 -6.764 0.667 1.00 0.00 H new ATOM 960 N PRO A 65 -0.698 -10.379 -0.206 1.00 0.00 N ATOM 961 CA PRO A 65 0.035 -11.479 -0.787 1.00 0.00 C ATOM 962 C PRO A 65 0.212 -11.291 -2.308 1.00 0.00 C ATOM 963 O PRO A 65 -0.770 -11.095 -3.046 1.00 0.00 O ATOM 964 CB PRO A 65 -0.869 -12.675 -0.499 1.00 0.00 C ATOM 965 CG PRO A 65 -2.261 -12.116 -0.401 1.00 0.00 C ATOM 966 CD PRO A 65 -2.145 -10.612 -0.251 1.00 0.00 C ATOM 0 HA PRO A 65 1.042 -11.582 -0.383 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -0.800 -13.418 -1.293 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -0.580 -13.171 0.428 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -2.838 -12.368 -1.291 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -2.786 -12.546 0.452 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -2.609 -10.089 -1.087 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -2.636 -10.261 0.657 1.00 0.00 H new ATOM 974 N PHE A 66 1.438 -11.328 -2.773 1.00 0.00 N ATOM 975 CA PHE A 66 1.696 -11.185 -4.191 1.00 0.00 C ATOM 976 C PHE A 66 1.827 -12.514 -4.852 1.00 0.00 C ATOM 977 O PHE A 66 2.137 -13.525 -4.206 1.00 0.00 O ATOM 978 CB PHE A 66 2.928 -10.346 -4.491 1.00 0.00 C ATOM 979 CG PHE A 66 2.801 -8.901 -4.104 1.00 0.00 C ATOM 980 CD1 PHE A 66 3.170 -8.468 -2.842 1.00 0.00 C ATOM 981 CD2 PHE A 66 2.307 -7.974 -5.006 1.00 0.00 C ATOM 982 CE1 PHE A 66 3.051 -7.140 -2.490 1.00 0.00 C ATOM 983 CE2 PHE A 66 2.186 -6.646 -4.658 1.00 0.00 C ATOM 984 CZ PHE A 66 2.558 -6.227 -3.398 1.00 0.00 C ATOM 0 H PHE A 66 2.270 -11.455 -2.197 1.00 0.00 H new ATOM 0 HA PHE A 66 0.832 -10.659 -4.597 1.00 0.00 H new ATOM 0 HB2 PHE A 66 3.782 -10.776 -3.968 1.00 0.00 H new ATOM 0 HB3 PHE A 66 3.144 -10.407 -5.558 1.00 0.00 H new ATOM 0 HD1 PHE A 66 3.555 -9.178 -2.125 1.00 0.00 H new ATOM 0 HD2 PHE A 66 2.013 -8.295 -5.994 1.00 0.00 H new ATOM 0 HE1 PHE A 66 3.344 -6.815 -1.503 1.00 0.00 H new ATOM 0 HE2 PHE A 66 1.800 -5.934 -5.372 1.00 0.00 H new ATOM 0 HZ PHE A 66 2.463 -5.187 -3.123 1.00 0.00 H new ATOM 994 N ASN A 67 1.601 -12.517 -6.129 1.00 0.00 N ATOM 995 CA ASN A 67 1.652 -13.732 -6.908 1.00 0.00 C ATOM 996 C ASN A 67 3.079 -14.190 -7.249 1.00 0.00 C ATOM 997 O ASN A 67 3.308 -15.382 -7.504 1.00 0.00 O ATOM 998 CB ASN A 67 0.767 -13.641 -8.166 1.00 0.00 C ATOM 999 CG ASN A 67 1.143 -12.550 -9.181 1.00 0.00 C ATOM 1000 OD1 ASN A 67 2.297 -12.183 -9.340 1.00 0.00 O ATOM 1001 ND2 ASN A 67 0.157 -12.025 -9.866 1.00 0.00 N ATOM 0 H ASN A 67 1.375 -11.681 -6.668 1.00 0.00 H new ATOM 0 HA ASN A 67 1.241 -14.509 -6.264 1.00 0.00 H new ATOM 0 HB2 ASN A 67 0.793 -14.605 -8.674 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -0.263 -13.475 -7.850 1.00 0.00 H new ATOM 0 HD21 ASN A 67 0.345 -11.292 -10.550 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -0.798 -12.349 -9.715 1.00 0.00 H new ATOM 1008 N GLN A 68 4.031 -13.267 -7.245 1.00 0.00 N ATOM 1009 CA GLN A 68 5.425 -13.591 -7.560 1.00 0.00 C ATOM 1010 C GLN A 68 6.357 -12.787 -6.696 1.00 0.00 C ATOM 1011 O GLN A 68 5.963 -11.757 -6.142 1.00 0.00 O ATOM 1012 CB GLN A 68 5.771 -13.263 -9.024 1.00 0.00 C ATOM 1013 CG GLN A 68 4.973 -13.993 -10.087 1.00 0.00 C ATOM 1014 CD GLN A 68 5.468 -13.665 -11.486 1.00 0.00 C ATOM 1015 OE1 GLN A 68 5.989 -12.576 -11.741 1.00 0.00 O ATOM 1016 NE2 GLN A 68 5.322 -14.587 -12.391 1.00 0.00 N ATOM 0 H GLN A 68 3.868 -12.284 -7.027 1.00 0.00 H new ATOM 0 HA GLN A 68 5.543 -14.660 -7.382 1.00 0.00 H new ATOM 0 HB2 GLN A 68 5.639 -12.191 -9.174 1.00 0.00 H new ATOM 0 HB3 GLN A 68 6.828 -13.479 -9.182 1.00 0.00 H new ATOM 0 HG2 GLN A 68 5.042 -15.068 -9.919 1.00 0.00 H new ATOM 0 HG3 GLN A 68 3.920 -13.724 -10.001 1.00 0.00 H new ATOM 0 HE21 GLN A 68 4.887 -15.477 -12.147 1.00 0.00 H new ATOM 0 HE22 GLN A 68 5.643 -14.421 -13.345 1.00 0.00 H new ATOM 1025 N VAL A 69 7.595 -13.247 -6.587 1.00 0.00 N ATOM 1026 CA VAL A 69 8.611 -12.483 -5.920 1.00 0.00 C ATOM 1027 C VAL A 69 9.193 -11.497 -6.932 1.00 0.00 C ATOM 1028 O VAL A 69 9.856 -11.886 -7.898 1.00 0.00 O ATOM 1029 CB VAL A 69 9.738 -13.380 -5.256 1.00 0.00 C ATOM 1030 CG1 VAL A 69 10.422 -14.311 -6.238 1.00 0.00 C ATOM 1031 CG2 VAL A 69 10.768 -12.520 -4.577 1.00 0.00 C ATOM 0 H VAL A 69 7.909 -14.145 -6.955 1.00 0.00 H new ATOM 0 HA VAL A 69 8.158 -11.949 -5.084 1.00 0.00 H new ATOM 0 HB VAL A 69 9.230 -14.005 -4.522 1.00 0.00 H new ATOM 0 HG11 VAL A 69 11.181 -14.895 -5.718 1.00 0.00 H new ATOM 0 HG12 VAL A 69 9.684 -14.983 -6.676 1.00 0.00 H new ATOM 0 HG13 VAL A 69 10.893 -13.725 -7.027 1.00 0.00 H new ATOM 0 HG21 VAL A 69 11.532 -13.154 -4.128 1.00 0.00 H new ATOM 0 HG22 VAL A 69 11.230 -11.858 -5.310 1.00 0.00 H new ATOM 0 HG23 VAL A 69 10.289 -11.923 -3.801 1.00 0.00 H new ATOM 1041 N ILE A 70 8.890 -10.239 -6.762 1.00 0.00 N ATOM 1042 CA ILE A 70 9.356 -9.243 -7.698 1.00 0.00 C ATOM 1043 C ILE A 70 10.111 -8.172 -6.954 1.00 0.00 C ATOM 1044 O ILE A 70 10.136 -8.161 -5.715 1.00 0.00 O ATOM 1045 CB ILE A 70 8.195 -8.586 -8.551 1.00 0.00 C ATOM 1046 CG1 ILE A 70 7.415 -7.474 -7.790 1.00 0.00 C ATOM 1047 CG2 ILE A 70 7.229 -9.647 -9.072 1.00 0.00 C ATOM 1048 CD1 ILE A 70 6.794 -7.866 -6.466 1.00 0.00 C ATOM 0 H ILE A 70 8.327 -9.878 -5.992 1.00 0.00 H new ATOM 0 HA ILE A 70 10.008 -9.755 -8.406 1.00 0.00 H new ATOM 0 HB ILE A 70 8.687 -8.100 -9.394 1.00 0.00 H new ATOM 0 HG12 ILE A 70 8.095 -6.641 -7.614 1.00 0.00 H new ATOM 0 HG13 ILE A 70 6.623 -7.106 -8.442 1.00 0.00 H new ATOM 0 HG21 ILE A 70 6.442 -9.168 -9.654 1.00 0.00 H new ATOM 0 HG22 ILE A 70 7.769 -10.352 -9.703 1.00 0.00 H new ATOM 0 HG23 ILE A 70 6.785 -10.179 -8.231 1.00 0.00 H new ATOM 0 HD11 ILE A 70 6.280 -7.006 -6.036 1.00 0.00 H new ATOM 0 HD12 ILE A 70 6.079 -8.674 -6.624 1.00 0.00 H new ATOM 0 HD13 ILE A 70 7.575 -8.201 -5.783 1.00 0.00 H new ATOM 1060 N LYS A 71 10.714 -7.292 -7.683 1.00 0.00 N ATOM 1061 CA LYS A 71 11.458 -6.225 -7.099 1.00 0.00 C ATOM 1062 C LYS A 71 10.578 -5.012 -6.885 1.00 0.00 C ATOM 1063 O LYS A 71 10.093 -4.431 -7.846 1.00 0.00 O ATOM 1064 CB LYS A 71 12.619 -5.865 -8.010 1.00 0.00 C ATOM 1065 CG LYS A 71 13.586 -7.000 -8.217 1.00 0.00 C ATOM 1066 CD LYS A 71 14.672 -6.614 -9.193 1.00 0.00 C ATOM 1067 CE LYS A 71 15.661 -7.743 -9.409 1.00 0.00 C ATOM 1068 NZ LYS A 71 16.370 -8.114 -8.161 1.00 0.00 N ATOM 0 H LYS A 71 10.705 -7.292 -8.703 1.00 0.00 H new ATOM 0 HA LYS A 71 11.836 -6.549 -6.129 1.00 0.00 H new ATOM 0 HB2 LYS A 71 12.229 -5.548 -8.977 1.00 0.00 H new ATOM 0 HB3 LYS A 71 13.153 -5.014 -7.588 1.00 0.00 H new ATOM 0 HG2 LYS A 71 14.032 -7.281 -7.263 1.00 0.00 H new ATOM 0 HG3 LYS A 71 13.052 -7.874 -8.589 1.00 0.00 H new ATOM 0 HD2 LYS A 71 14.222 -6.337 -10.147 1.00 0.00 H new ATOM 0 HD3 LYS A 71 15.199 -5.735 -8.822 1.00 0.00 H new ATOM 0 HE2 LYS A 71 15.135 -8.615 -9.799 1.00 0.00 H new ATOM 0 HE3 LYS A 71 16.389 -7.446 -10.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 17.170 -8.738 -8.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 16.723 -7.255 -7.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 15.715 -8.610 -7.524 1.00 0.00 H new ATOM 1082 N LEU A 72 10.342 -4.661 -5.633 1.00 0.00 N ATOM 1083 CA LEU A 72 9.616 -3.449 -5.311 1.00 0.00 C ATOM 1084 C LEU A 72 10.473 -2.265 -5.667 1.00 0.00 C ATOM 1085 O LEU A 72 11.637 -2.188 -5.287 1.00 0.00 O ATOM 1086 CB LEU A 72 9.254 -3.376 -3.823 1.00 0.00 C ATOM 1087 CG LEU A 72 8.330 -4.457 -3.283 1.00 0.00 C ATOM 1088 CD1 LEU A 72 8.115 -4.266 -1.790 1.00 0.00 C ATOM 1089 CD2 LEU A 72 6.994 -4.442 -4.008 1.00 0.00 C ATOM 0 H LEU A 72 10.644 -5.201 -4.822 1.00 0.00 H new ATOM 0 HA LEU A 72 8.687 -3.447 -5.881 1.00 0.00 H new ATOM 0 HB2 LEU A 72 10.179 -3.403 -3.248 1.00 0.00 H new ATOM 0 HB3 LEU A 72 8.789 -2.408 -3.635 1.00 0.00 H new ATOM 0 HG LEU A 72 8.802 -5.424 -3.455 1.00 0.00 H new ATOM 0 HD11 LEU A 72 7.452 -5.046 -1.415 1.00 0.00 H new ATOM 0 HD12 LEU A 72 9.073 -4.325 -1.274 1.00 0.00 H new ATOM 0 HD13 LEU A 72 7.665 -3.290 -1.609 1.00 0.00 H new ATOM 0 HD21 LEU A 72 6.352 -5.224 -3.603 1.00 0.00 H new ATOM 0 HD22 LEU A 72 6.516 -3.472 -3.870 1.00 0.00 H new ATOM 0 HD23 LEU A 72 7.155 -4.619 -5.071 1.00 0.00 H new ATOM 1101 N HIS A 73 9.921 -1.371 -6.405 1.00 0.00 N ATOM 1102 CA HIS A 73 10.653 -0.206 -6.817 1.00 0.00 C ATOM 1103 C HIS A 73 9.986 1.047 -6.278 1.00 0.00 C ATOM 1104 O HIS A 73 10.629 1.877 -5.664 1.00 0.00 O ATOM 1105 CB HIS A 73 10.737 -0.154 -8.360 1.00 0.00 C ATOM 1106 CG HIS A 73 11.530 1.012 -8.894 1.00 0.00 C ATOM 1107 ND1 HIS A 73 12.867 0.945 -9.210 1.00 0.00 N ATOM 1108 CD2 HIS A 73 11.155 2.287 -9.148 1.00 0.00 C ATOM 1109 CE1 HIS A 73 13.270 2.128 -9.621 1.00 0.00 C ATOM 1110 NE2 HIS A 73 12.251 2.951 -9.595 1.00 0.00 N ATOM 0 H HIS A 73 8.960 -1.415 -6.743 1.00 0.00 H new ATOM 0 HA HIS A 73 11.664 -0.260 -6.414 1.00 0.00 H new ATOM 0 HB2 HIS A 73 11.185 -1.080 -8.720 1.00 0.00 H new ATOM 0 HB3 HIS A 73 9.727 -0.109 -8.767 1.00 0.00 H new ATOM 0 HD1 HIS A 73 13.452 0.112 -9.137 1.00 0.00 H new ATOM 0 HD2 HIS A 73 10.166 2.700 -9.019 1.00 0.00 H new ATOM 0 HE1 HIS A 73 14.274 2.379 -9.929 1.00 0.00 H new ATOM 1119 N SER A 74 8.702 1.167 -6.495 1.00 0.00 N ATOM 1120 CA SER A 74 7.983 2.359 -6.130 1.00 0.00 C ATOM 1121 C SER A 74 6.538 2.057 -5.708 1.00 0.00 C ATOM 1122 O SER A 74 6.107 0.920 -5.755 1.00 0.00 O ATOM 1123 CB SER A 74 8.056 3.338 -7.303 1.00 0.00 C ATOM 1124 OG SER A 74 7.727 2.694 -8.527 1.00 0.00 O ATOM 0 H SER A 74 8.127 0.444 -6.928 1.00 0.00 H new ATOM 0 HA SER A 74 8.446 2.812 -5.253 1.00 0.00 H new ATOM 0 HB2 SER A 74 7.372 4.169 -7.130 1.00 0.00 H new ATOM 0 HB3 SER A 74 9.059 3.759 -7.368 1.00 0.00 H new ATOM 0 HG SER A 74 8.112 3.197 -9.275 1.00 0.00 H new ATOM 1130 N PHE A 75 5.827 3.063 -5.240 1.00 0.00 N ATOM 1131 CA PHE A 75 4.421 2.913 -4.867 1.00 0.00 C ATOM 1132 C PHE A 75 3.687 4.225 -5.111 1.00 0.00 C ATOM 1133 O PHE A 75 4.323 5.278 -5.218 1.00 0.00 O ATOM 1134 CB PHE A 75 4.267 2.481 -3.387 1.00 0.00 C ATOM 1135 CG PHE A 75 4.722 3.516 -2.385 1.00 0.00 C ATOM 1136 CD1 PHE A 75 6.063 3.715 -2.133 1.00 0.00 C ATOM 1137 CD2 PHE A 75 3.798 4.285 -1.700 1.00 0.00 C ATOM 1138 CE1 PHE A 75 6.478 4.659 -1.225 1.00 0.00 C ATOM 1139 CE2 PHE A 75 4.206 5.233 -0.787 1.00 0.00 C ATOM 1140 CZ PHE A 75 5.548 5.421 -0.549 1.00 0.00 C ATOM 0 H PHE A 75 6.197 4.004 -5.105 1.00 0.00 H new ATOM 0 HA PHE A 75 3.986 2.128 -5.485 1.00 0.00 H new ATOM 0 HB2 PHE A 75 3.220 2.245 -3.197 1.00 0.00 H new ATOM 0 HB3 PHE A 75 4.835 1.564 -3.228 1.00 0.00 H new ATOM 0 HD1 PHE A 75 6.797 3.121 -2.657 1.00 0.00 H new ATOM 0 HD2 PHE A 75 2.744 4.140 -1.883 1.00 0.00 H new ATOM 0 HE1 PHE A 75 7.532 4.804 -1.041 1.00 0.00 H new ATOM 0 HE2 PHE A 75 3.474 5.827 -0.260 1.00 0.00 H new ATOM 0 HZ PHE A 75 5.872 6.163 0.165 1.00 0.00 H new ATOM 1150 N ALA A 76 2.375 4.159 -5.224 1.00 0.00 N ATOM 1151 CA ALA A 76 1.550 5.338 -5.424 1.00 0.00 C ATOM 1152 C ALA A 76 0.298 5.255 -4.568 1.00 0.00 C ATOM 1153 O ALA A 76 -0.321 4.185 -4.456 1.00 0.00 O ATOM 1154 CB ALA A 76 1.176 5.489 -6.883 1.00 0.00 C ATOM 0 H ALA A 76 1.849 3.286 -5.180 1.00 0.00 H new ATOM 0 HA ALA A 76 2.125 6.214 -5.124 1.00 0.00 H new ATOM 0 HB1 ALA A 76 0.558 6.378 -7.010 1.00 0.00 H new ATOM 0 HB2 ALA A 76 2.081 5.587 -7.482 1.00 0.00 H new ATOM 0 HB3 ALA A 76 0.619 4.611 -7.209 1.00 0.00 H new ATOM 1160 N ILE A 77 -0.078 6.372 -3.993 1.00 0.00 N ATOM 1161 CA ILE A 77 -1.213 6.467 -3.095 1.00 0.00 C ATOM 1162 C ILE A 77 -1.922 7.764 -3.380 1.00 0.00 C ATOM 1163 O ILE A 77 -1.344 8.835 -3.231 1.00 0.00 O ATOM 1164 CB ILE A 77 -0.774 6.480 -1.580 1.00 0.00 C ATOM 1165 CG1 ILE A 77 -0.009 5.200 -1.204 1.00 0.00 C ATOM 1166 CG2 ILE A 77 -1.978 6.681 -0.660 1.00 0.00 C ATOM 1167 CD1 ILE A 77 0.494 5.171 0.229 1.00 0.00 C ATOM 0 H ILE A 77 0.403 7.260 -4.136 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.850 5.598 -3.259 1.00 0.00 H new ATOM 0 HB ILE A 77 -0.097 7.324 -1.444 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -0.660 4.341 -1.366 1.00 0.00 H new ATOM 0 HG13 ILE A 77 0.841 5.087 -1.877 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -1.646 6.686 0.378 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -2.458 7.632 -0.892 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -2.690 5.869 -0.809 1.00 0.00 H new ATOM 0 HD11 ILE A 77 1.022 4.235 0.411 1.00 0.00 H new ATOM 0 HD12 ILE A 77 1.173 6.008 0.393 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -0.351 5.250 0.913 1.00 0.00 H new ATOM 1179 N LYS A 78 -3.148 7.681 -3.803 1.00 0.00 N ATOM 1180 CA LYS A 78 -3.904 8.858 -4.034 1.00 0.00 C ATOM 1181 C LYS A 78 -4.937 9.023 -2.979 1.00 0.00 C ATOM 1182 O LYS A 78 -5.743 8.124 -2.709 1.00 0.00 O ATOM 1183 CB LYS A 78 -4.523 8.921 -5.421 1.00 0.00 C ATOM 1184 CG LYS A 78 -3.512 8.822 -6.540 1.00 0.00 C ATOM 1185 CD LYS A 78 -4.149 9.141 -7.870 1.00 0.00 C ATOM 1186 CE LYS A 78 -3.199 8.915 -9.030 1.00 0.00 C ATOM 1187 NZ LYS A 78 -3.820 9.245 -10.333 1.00 0.00 N ATOM 0 H LYS A 78 -3.639 6.807 -3.993 1.00 0.00 H new ATOM 0 HA LYS A 78 -3.204 9.692 -3.986 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -5.247 8.112 -5.524 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -5.074 9.856 -5.522 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -2.688 9.510 -6.353 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -3.089 7.818 -6.566 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -5.036 8.522 -8.004 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -4.481 10.179 -7.872 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -2.306 9.524 -8.890 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -2.877 7.874 -9.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -3.135 9.076 -11.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -4.658 8.646 -10.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -4.104 10.245 -10.339 1.00 0.00 H new ATOM 1201 N GLY A 79 -4.890 10.141 -2.398 1.00 0.00 N ATOM 1202 CA GLY A 79 -5.751 10.530 -1.335 1.00 0.00 C ATOM 1203 C GLY A 79 -5.868 12.007 -1.358 1.00 0.00 C ATOM 1204 O GLY A 79 -5.362 12.633 -2.294 1.00 0.00 O ATOM 0 H GLY A 79 -4.217 10.864 -2.653 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -6.732 10.068 -1.450 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -5.351 10.194 -0.378 1.00 0.00 H new ATOM 1208 N PRO A 80 -6.516 12.617 -0.404 1.00 0.00 N ATOM 1209 CA PRO A 80 -6.509 14.038 -0.316 1.00 0.00 C ATOM 1210 C PRO A 80 -5.312 14.467 0.516 1.00 0.00 C ATOM 1211 O PRO A 80 -5.046 13.877 1.556 1.00 0.00 O ATOM 1212 CB PRO A 80 -7.821 14.352 0.400 1.00 0.00 C ATOM 1213 CG PRO A 80 -8.123 13.139 1.232 1.00 0.00 C ATOM 1214 CD PRO A 80 -7.328 11.988 0.667 1.00 0.00 C ATOM 0 HA PRO A 80 -6.432 14.551 -1.275 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -7.725 15.241 1.023 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -8.621 14.547 -0.314 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -7.856 13.314 2.274 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -9.190 12.915 1.209 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -6.699 11.524 1.427 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -7.978 11.208 0.271 1.00 0.00 H new ATOM 1222 N GLU A 81 -4.593 15.479 0.067 1.00 0.00 N ATOM 1223 CA GLU A 81 -3.414 15.992 0.795 1.00 0.00 C ATOM 1224 C GLU A 81 -3.796 16.441 2.186 1.00 0.00 C ATOM 1225 O GLU A 81 -2.977 16.466 3.105 1.00 0.00 O ATOM 1226 CB GLU A 81 -2.646 17.106 0.019 1.00 0.00 C ATOM 1227 CG GLU A 81 -3.494 18.245 -0.564 1.00 0.00 C ATOM 1228 CD GLU A 81 -4.338 17.798 -1.738 1.00 0.00 C ATOM 1229 OE1 GLU A 81 -3.820 17.770 -2.873 1.00 0.00 O ATOM 1230 OE2 GLU A 81 -5.507 17.440 -1.538 1.00 0.00 O ATOM 0 H GLU A 81 -4.795 15.974 -0.802 1.00 0.00 H new ATOM 0 HA GLU A 81 -2.715 15.160 0.882 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -1.906 17.541 0.691 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -2.098 16.637 -0.798 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -4.143 18.645 0.215 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -2.838 19.056 -0.880 1.00 0.00 H new ATOM 1237 N GLU A 82 -5.048 16.799 2.300 1.00 0.00 N ATOM 1238 CA GLU A 82 -5.680 17.177 3.521 1.00 0.00 C ATOM 1239 C GLU A 82 -5.441 16.174 4.645 1.00 0.00 C ATOM 1240 O GLU A 82 -5.014 16.552 5.728 1.00 0.00 O ATOM 1241 CB GLU A 82 -7.145 17.301 3.264 1.00 0.00 C ATOM 1242 CG GLU A 82 -7.506 18.430 2.315 1.00 0.00 C ATOM 1243 CD GLU A 82 -6.946 19.770 2.762 1.00 0.00 C ATOM 1244 OE1 GLU A 82 -7.622 20.486 3.511 1.00 0.00 O ATOM 1245 OE2 GLU A 82 -5.810 20.124 2.359 1.00 0.00 O ATOM 0 H GLU A 82 -5.679 16.834 1.500 1.00 0.00 H new ATOM 0 HA GLU A 82 -5.250 18.123 3.850 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -7.513 16.361 2.853 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -7.659 17.457 4.212 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -7.129 18.197 1.319 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -8.591 18.501 2.237 1.00 0.00 H new ATOM 1252 N GLU A 83 -5.736 14.920 4.392 1.00 0.00 N ATOM 1253 CA GLU A 83 -5.516 13.882 5.381 1.00 0.00 C ATOM 1254 C GLU A 83 -4.280 13.095 5.003 1.00 0.00 C ATOM 1255 O GLU A 83 -3.294 13.094 5.736 1.00 0.00 O ATOM 1256 CB GLU A 83 -6.723 12.905 5.442 1.00 0.00 C ATOM 1257 CG GLU A 83 -8.049 13.473 5.975 1.00 0.00 C ATOM 1258 CD GLU A 83 -8.610 14.616 5.172 1.00 0.00 C ATOM 1259 OE1 GLU A 83 -9.047 14.394 4.041 1.00 0.00 O ATOM 1260 OE2 GLU A 83 -8.646 15.739 5.685 1.00 0.00 O ATOM 0 H GLU A 83 -6.129 14.591 3.510 1.00 0.00 H new ATOM 0 HA GLU A 83 -5.394 14.355 6.355 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -6.898 12.519 4.438 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -6.442 12.056 6.066 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -8.787 12.671 6.005 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -7.899 13.807 7.002 1.00 0.00 H new ATOM 1267 N GLY A 84 -4.377 12.509 3.801 1.00 0.00 N ATOM 1268 CA GLY A 84 -3.369 11.614 3.119 1.00 0.00 C ATOM 1269 C GLY A 84 -2.381 10.781 4.014 1.00 0.00 C ATOM 1270 O GLY A 84 -1.656 11.340 4.844 1.00 0.00 O ATOM 0 H GLY A 84 -5.207 12.642 3.223 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -3.919 10.913 2.491 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -2.770 12.236 2.454 1.00 0.00 H new ATOM 1274 N PRO A 85 -2.261 9.440 3.799 1.00 0.00 N ATOM 1275 CA PRO A 85 -1.389 8.586 4.629 1.00 0.00 C ATOM 1276 C PRO A 85 0.077 8.799 4.254 1.00 0.00 C ATOM 1277 O PRO A 85 0.485 8.468 3.151 1.00 0.00 O ATOM 1278 CB PRO A 85 -1.827 7.149 4.270 1.00 0.00 C ATOM 1279 CG PRO A 85 -2.982 7.296 3.318 1.00 0.00 C ATOM 1280 CD PRO A 85 -2.867 8.664 2.715 1.00 0.00 C ATOM 0 HA PRO A 85 -1.476 8.803 5.694 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -1.009 6.595 3.809 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -2.124 6.597 5.162 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -2.948 6.528 2.546 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -3.932 7.181 3.840 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -2.244 8.662 1.821 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -3.839 9.063 2.425 1.00 0.00 H new ATOM 1288 N LYS A 86 0.867 9.337 5.167 1.00 0.00 N ATOM 1289 CA LYS A 86 2.216 9.736 4.818 1.00 0.00 C ATOM 1290 C LYS A 86 3.283 8.738 5.229 1.00 0.00 C ATOM 1291 O LYS A 86 3.935 8.167 4.379 1.00 0.00 O ATOM 1292 CB LYS A 86 2.553 11.097 5.369 1.00 0.00 C ATOM 1293 CG LYS A 86 3.930 11.557 4.980 1.00 0.00 C ATOM 1294 CD LYS A 86 4.324 12.768 5.749 1.00 0.00 C ATOM 1295 CE LYS A 86 5.712 13.227 5.391 1.00 0.00 C ATOM 1296 NZ LYS A 86 5.787 13.812 4.023 1.00 0.00 N ATOM 0 H LYS A 86 0.603 9.505 6.138 1.00 0.00 H new ATOM 0 HA LYS A 86 2.221 9.773 3.729 1.00 0.00 H new ATOM 0 HB2 LYS A 86 1.819 11.820 5.013 1.00 0.00 H new ATOM 0 HB3 LYS A 86 2.476 11.073 6.456 1.00 0.00 H new ATOM 0 HG2 LYS A 86 4.649 10.758 5.160 1.00 0.00 H new ATOM 0 HG3 LYS A 86 3.956 11.775 3.912 1.00 0.00 H new ATOM 0 HD2 LYS A 86 3.613 13.571 5.553 1.00 0.00 H new ATOM 0 HD3 LYS A 86 4.276 12.553 6.816 1.00 0.00 H new ATOM 0 HE2 LYS A 86 6.044 13.968 6.118 1.00 0.00 H new ATOM 0 HE3 LYS A 86 6.399 12.383 5.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 6.775 14.049 3.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 5.432 13.122 3.330 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 5.206 14.674 3.982 1.00 0.00 H new ATOM 1310 N THR A 87 3.517 8.615 6.525 1.00 0.00 N ATOM 1311 CA THR A 87 4.500 7.671 7.053 1.00 0.00 C ATOM 1312 C THR A 87 4.187 6.221 6.603 1.00 0.00 C ATOM 1313 O THR A 87 3.226 5.593 7.096 1.00 0.00 O ATOM 1314 CB THR A 87 4.513 7.713 8.585 1.00 0.00 C ATOM 1315 OG1 THR A 87 4.656 9.076 9.033 1.00 0.00 O ATOM 1316 CG2 THR A 87 5.673 6.897 9.112 1.00 0.00 C ATOM 0 H THR A 87 3.037 9.161 7.240 1.00 0.00 H new ATOM 0 HA THR A 87 5.474 7.966 6.662 1.00 0.00 H new ATOM 0 HB THR A 87 3.576 7.299 8.957 1.00 0.00 H new ATOM 0 HG1 THR A 87 4.822 9.087 9.999 1.00 0.00 H new ATOM 0 HG21 THR A 87 5.677 6.931 10.201 1.00 0.00 H new ATOM 0 HG22 THR A 87 5.571 5.863 8.782 1.00 0.00 H new ATOM 0 HG23 THR A 87 6.609 7.308 8.733 1.00 0.00 H new ATOM 1324 N VAL A 88 4.986 5.712 5.683 1.00 0.00 N ATOM 1325 CA VAL A 88 4.800 4.388 5.127 1.00 0.00 C ATOM 1326 C VAL A 88 5.903 3.425 5.615 1.00 0.00 C ATOM 1327 O VAL A 88 7.097 3.614 5.319 1.00 0.00 O ATOM 1328 CB VAL A 88 4.812 4.458 3.567 1.00 0.00 C ATOM 1329 CG1 VAL A 88 4.665 3.111 2.944 1.00 0.00 C ATOM 1330 CG2 VAL A 88 3.723 5.366 3.053 1.00 0.00 C ATOM 0 H VAL A 88 5.788 6.211 5.299 1.00 0.00 H new ATOM 0 HA VAL A 88 3.836 4.008 5.466 1.00 0.00 H new ATOM 0 HB VAL A 88 5.784 4.864 3.285 1.00 0.00 H new ATOM 0 HG11 VAL A 88 4.679 3.209 1.858 1.00 0.00 H new ATOM 0 HG12 VAL A 88 5.489 2.472 3.261 1.00 0.00 H new ATOM 0 HG13 VAL A 88 3.720 2.667 3.256 1.00 0.00 H new ATOM 0 HG21 VAL A 88 3.757 5.394 1.964 1.00 0.00 H new ATOM 0 HG22 VAL A 88 2.753 4.989 3.376 1.00 0.00 H new ATOM 0 HG23 VAL A 88 3.872 6.371 3.447 1.00 0.00 H new ATOM 1340 N LYS A 89 5.497 2.409 6.353 1.00 0.00 N ATOM 1341 CA LYS A 89 6.398 1.387 6.874 1.00 0.00 C ATOM 1342 C LYS A 89 5.996 0.016 6.311 1.00 0.00 C ATOM 1343 O LYS A 89 4.823 -0.302 6.235 1.00 0.00 O ATOM 1344 CB LYS A 89 6.350 1.384 8.424 1.00 0.00 C ATOM 1345 CG LYS A 89 7.168 0.273 9.090 1.00 0.00 C ATOM 1346 CD LYS A 89 7.138 0.333 10.638 1.00 0.00 C ATOM 1347 CE LYS A 89 8.058 1.420 11.251 1.00 0.00 C ATOM 1348 NZ LYS A 89 7.713 2.823 10.894 1.00 0.00 N ATOM 0 H LYS A 89 4.521 2.265 6.613 1.00 0.00 H new ATOM 0 HA LYS A 89 7.420 1.605 6.564 1.00 0.00 H new ATOM 0 HB2 LYS A 89 6.709 2.347 8.786 1.00 0.00 H new ATOM 0 HB3 LYS A 89 5.311 1.291 8.741 1.00 0.00 H new ATOM 0 HG2 LYS A 89 6.787 -0.695 8.763 1.00 0.00 H new ATOM 0 HG3 LYS A 89 8.202 0.339 8.751 1.00 0.00 H new ATOM 0 HD2 LYS A 89 6.114 0.515 10.963 1.00 0.00 H new ATOM 0 HD3 LYS A 89 7.430 -0.640 11.034 1.00 0.00 H new ATOM 0 HE2 LYS A 89 8.034 1.323 12.336 1.00 0.00 H new ATOM 0 HE3 LYS A 89 9.083 1.224 10.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 8.307 3.477 11.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 7.879 2.974 9.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 6.711 3.000 11.111 1.00 0.00 H new ATOM 1362 N PHE A 90 6.960 -0.772 5.893 1.00 0.00 N ATOM 1363 CA PHE A 90 6.664 -2.092 5.338 1.00 0.00 C ATOM 1364 C PHE A 90 7.351 -3.189 6.102 1.00 0.00 C ATOM 1365 O PHE A 90 8.244 -2.943 6.867 1.00 0.00 O ATOM 1366 CB PHE A 90 7.179 -2.206 3.924 1.00 0.00 C ATOM 1367 CG PHE A 90 6.577 -1.328 2.921 1.00 0.00 C ATOM 1368 CD1 PHE A 90 7.105 -0.090 2.665 1.00 0.00 C ATOM 1369 CD2 PHE A 90 5.502 -1.757 2.199 1.00 0.00 C ATOM 1370 CE1 PHE A 90 6.568 0.704 1.707 1.00 0.00 C ATOM 1371 CE2 PHE A 90 4.948 -0.975 1.240 1.00 0.00 C ATOM 1372 CZ PHE A 90 5.475 0.268 0.980 1.00 0.00 C ATOM 0 H PHE A 90 7.951 -0.533 5.922 1.00 0.00 H new ATOM 0 HA PHE A 90 5.580 -2.197 5.391 1.00 0.00 H new ATOM 0 HB2 PHE A 90 8.252 -2.016 3.939 1.00 0.00 H new ATOM 0 HB3 PHE A 90 7.042 -3.237 3.597 1.00 0.00 H new ATOM 0 HD1 PHE A 90 7.957 0.256 3.232 1.00 0.00 H new ATOM 0 HD2 PHE A 90 5.086 -2.734 2.394 1.00 0.00 H new ATOM 0 HE1 PHE A 90 6.993 1.677 1.511 1.00 0.00 H new ATOM 0 HE2 PHE A 90 4.094 -1.328 0.681 1.00 0.00 H new ATOM 0 HZ PHE A 90 5.041 0.897 0.217 1.00 0.00 H new ATOM 1382 N PHE A 91 6.928 -4.393 5.850 1.00 0.00 N ATOM 1383 CA PHE A 91 7.596 -5.595 6.300 1.00 0.00 C ATOM 1384 C PHE A 91 7.280 -6.683 5.288 1.00 0.00 C ATOM 1385 O PHE A 91 6.116 -6.963 5.033 1.00 0.00 O ATOM 1386 CB PHE A 91 7.155 -6.012 7.715 1.00 0.00 C ATOM 1387 CG PHE A 91 7.858 -7.250 8.218 1.00 0.00 C ATOM 1388 CD1 PHE A 91 9.106 -7.160 8.806 1.00 0.00 C ATOM 1389 CD2 PHE A 91 7.271 -8.502 8.092 1.00 0.00 C ATOM 1390 CE1 PHE A 91 9.758 -8.289 9.257 1.00 0.00 C ATOM 1391 CE2 PHE A 91 7.920 -9.634 8.543 1.00 0.00 C ATOM 1392 CZ PHE A 91 9.166 -9.527 9.126 1.00 0.00 C ATOM 0 H PHE A 91 6.083 -4.579 5.310 1.00 0.00 H new ATOM 0 HA PHE A 91 8.670 -5.419 6.365 1.00 0.00 H new ATOM 0 HB2 PHE A 91 7.344 -5.189 8.405 1.00 0.00 H new ATOM 0 HB3 PHE A 91 6.079 -6.187 7.716 1.00 0.00 H new ATOM 0 HD1 PHE A 91 9.576 -6.194 8.914 1.00 0.00 H new ATOM 0 HD2 PHE A 91 6.296 -8.591 7.636 1.00 0.00 H new ATOM 0 HE1 PHE A 91 10.733 -8.203 9.713 1.00 0.00 H new ATOM 0 HE2 PHE A 91 7.453 -10.602 8.440 1.00 0.00 H new ATOM 0 HZ PHE A 91 9.676 -10.411 9.479 1.00 0.00 H new ATOM 1402 N SER A 92 8.284 -7.260 4.688 1.00 0.00 N ATOM 1403 CA SER A 92 8.050 -8.246 3.667 1.00 0.00 C ATOM 1404 C SER A 92 8.157 -9.649 4.238 1.00 0.00 C ATOM 1405 O SER A 92 8.978 -9.909 5.127 1.00 0.00 O ATOM 1406 CB SER A 92 9.009 -8.046 2.473 1.00 0.00 C ATOM 1407 OG SER A 92 8.777 -9.000 1.443 1.00 0.00 O ATOM 0 H SER A 92 9.266 -7.067 4.885 1.00 0.00 H new ATOM 0 HA SER A 92 7.034 -8.116 3.295 1.00 0.00 H new ATOM 0 HB2 SER A 92 8.885 -7.040 2.072 1.00 0.00 H new ATOM 0 HB3 SER A 92 10.040 -8.127 2.817 1.00 0.00 H new ATOM 0 HG SER A 92 9.634 -9.355 1.127 1.00 0.00 H new ATOM 1413 N ASN A 93 7.309 -10.526 3.727 1.00 0.00 N ATOM 1414 CA ASN A 93 7.234 -11.940 4.100 1.00 0.00 C ATOM 1415 C ASN A 93 6.526 -12.159 5.411 1.00 0.00 C ATOM 1416 O ASN A 93 6.171 -11.200 6.111 1.00 0.00 O ATOM 1417 CB ASN A 93 8.585 -12.697 4.048 1.00 0.00 C ATOM 1418 CG ASN A 93 9.166 -12.867 2.642 1.00 0.00 C ATOM 1419 OD1 ASN A 93 8.966 -11.903 1.774 1.00 0.00 O flip ATOM 1420 ND2 ASN A 93 9.819 -13.863 2.359 1.00 0.00 N flip ATOM 0 H ASN A 93 6.626 -10.269 3.014 1.00 0.00 H new ATOM 0 HA ASN A 93 6.624 -12.387 3.315 1.00 0.00 H new ATOM 0 HB2 ASN A 93 9.309 -12.164 4.664 1.00 0.00 H new ATOM 0 HB3 ASN A 93 8.452 -13.683 4.494 1.00 0.00 H new ATOM 0 HD21 ASN A 93 9.958 -14.596 3.054 1.00 0.00 H new ATOM 0 HD22 ASN A 93 10.224 -13.960 1.428 1.00 0.00 H new ATOM 1427 N LYS A 94 6.293 -13.435 5.712 1.00 0.00 N ATOM 1428 CA LYS A 94 5.592 -13.884 6.902 1.00 0.00 C ATOM 1429 C LYS A 94 4.108 -13.581 6.853 1.00 0.00 C ATOM 1430 O LYS A 94 3.591 -13.006 5.876 1.00 0.00 O ATOM 1431 CB LYS A 94 6.204 -13.363 8.212 1.00 0.00 C ATOM 1432 CG LYS A 94 7.567 -13.923 8.549 1.00 0.00 C ATOM 1433 CD LYS A 94 7.967 -13.517 9.954 1.00 0.00 C ATOM 1434 CE LYS A 94 9.254 -14.180 10.373 1.00 0.00 C ATOM 1435 NZ LYS A 94 9.583 -13.913 11.788 1.00 0.00 N ATOM 0 H LYS A 94 6.598 -14.203 5.114 1.00 0.00 H new ATOM 0 HA LYS A 94 5.718 -14.967 6.901 1.00 0.00 H new ATOM 0 HB2 LYS A 94 6.279 -12.277 8.154 1.00 0.00 H new ATOM 0 HB3 LYS A 94 5.521 -13.592 9.030 1.00 0.00 H new ATOM 0 HG2 LYS A 94 7.552 -15.010 8.467 1.00 0.00 H new ATOM 0 HG3 LYS A 94 8.305 -13.559 7.834 1.00 0.00 H new ATOM 0 HD2 LYS A 94 8.081 -12.434 10.003 1.00 0.00 H new ATOM 0 HD3 LYS A 94 7.174 -13.786 10.652 1.00 0.00 H new ATOM 0 HE2 LYS A 94 9.174 -15.256 10.217 1.00 0.00 H new ATOM 0 HE3 LYS A 94 10.067 -13.825 9.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 10.475 -14.388 12.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 9.685 -12.888 11.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 8.821 -14.274 12.396 1.00 0.00 H new ATOM 1449 N GLU A 95 3.426 -14.005 7.885 1.00 0.00 N ATOM 1450 CA GLU A 95 2.026 -13.753 8.039 1.00 0.00 C ATOM 1451 C GLU A 95 1.947 -12.352 8.694 1.00 0.00 C ATOM 1452 O GLU A 95 2.914 -11.941 9.361 1.00 0.00 O ATOM 1453 CB GLU A 95 1.430 -14.874 8.930 1.00 0.00 C ATOM 1454 CG GLU A 95 -0.063 -15.181 8.731 1.00 0.00 C ATOM 1455 CD GLU A 95 -0.975 -14.058 9.076 1.00 0.00 C ATOM 1456 OE1 GLU A 95 -1.398 -13.974 10.242 1.00 0.00 O ATOM 1457 OE2 GLU A 95 -1.282 -13.224 8.189 1.00 0.00 O ATOM 0 H GLU A 95 3.837 -14.541 8.649 1.00 0.00 H new ATOM 0 HA GLU A 95 1.458 -13.759 7.109 1.00 0.00 H new ATOM 0 HB2 GLU A 95 1.994 -15.789 8.751 1.00 0.00 H new ATOM 0 HB3 GLU A 95 1.587 -14.601 9.974 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -0.228 -15.460 7.690 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -0.327 -16.047 9.339 1.00 0.00 H new ATOM 1464 N HIS A 96 0.833 -11.647 8.516 1.00 0.00 N ATOM 1465 CA HIS A 96 0.706 -10.226 8.904 1.00 0.00 C ATOM 1466 C HIS A 96 1.137 -9.956 10.341 1.00 0.00 C ATOM 1467 O HIS A 96 0.647 -10.579 11.285 1.00 0.00 O ATOM 1468 CB HIS A 96 -0.731 -9.675 8.658 1.00 0.00 C ATOM 1469 CG HIS A 96 -1.814 -10.122 9.627 1.00 0.00 C ATOM 1470 ND1 HIS A 96 -2.485 -11.310 9.526 1.00 0.00 N ATOM 1471 CD2 HIS A 96 -2.342 -9.498 10.709 1.00 0.00 C ATOM 1472 CE1 HIS A 96 -3.374 -11.401 10.485 1.00 0.00 C ATOM 1473 NE2 HIS A 96 -3.304 -10.315 11.216 1.00 0.00 N ATOM 0 H HIS A 96 -0.013 -12.036 8.099 1.00 0.00 H new ATOM 0 HA HIS A 96 1.396 -9.689 8.253 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -0.685 -8.586 8.679 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -1.037 -9.962 7.652 1.00 0.00 H new ATOM 0 HD1 HIS A 96 -2.318 -12.019 8.812 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -2.053 -8.532 11.096 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -4.049 -12.229 10.645 1.00 0.00 H new ATOM 1482 N MET A 97 2.056 -9.053 10.494 1.00 0.00 N ATOM 1483 CA MET A 97 2.493 -8.648 11.796 1.00 0.00 C ATOM 1484 C MET A 97 1.804 -7.374 12.177 1.00 0.00 C ATOM 1485 O MET A 97 1.968 -6.361 11.512 1.00 0.00 O ATOM 1486 CB MET A 97 4.004 -8.454 11.847 1.00 0.00 C ATOM 1487 CG MET A 97 4.804 -9.718 11.620 1.00 0.00 C ATOM 1488 SD MET A 97 6.582 -9.439 11.738 1.00 0.00 S ATOM 1489 CE MET A 97 6.708 -8.779 13.394 1.00 0.00 C ATOM 0 H MET A 97 2.524 -8.577 9.723 1.00 0.00 H new ATOM 0 HA MET A 97 2.236 -9.438 12.502 1.00 0.00 H new ATOM 0 HB2 MET A 97 4.289 -7.718 11.095 1.00 0.00 H new ATOM 0 HB3 MET A 97 4.272 -8.038 12.818 1.00 0.00 H new ATOM 0 HG2 MET A 97 4.508 -10.468 12.353 1.00 0.00 H new ATOM 0 HG3 MET A 97 4.567 -10.122 10.636 1.00 0.00 H new ATOM 0 HE1 MET A 97 6.947 -7.717 13.345 1.00 0.00 H new ATOM 0 HE2 MET A 97 5.759 -8.914 13.913 1.00 0.00 H new ATOM 0 HE3 MET A 97 7.495 -9.303 13.936 1.00 0.00 H new ATOM 1499 N CYS A 98 1.018 -7.427 13.219 1.00 0.00 N ATOM 1500 CA CYS A 98 0.309 -6.260 13.695 1.00 0.00 C ATOM 1501 C CYS A 98 1.292 -5.288 14.353 1.00 0.00 C ATOM 1502 O CYS A 98 2.368 -5.701 14.787 1.00 0.00 O ATOM 1503 CB CYS A 98 -0.791 -6.679 14.661 1.00 0.00 C ATOM 1504 SG CYS A 98 -1.988 -7.831 13.937 1.00 0.00 S ATOM 0 H CYS A 98 0.849 -8.274 13.762 1.00 0.00 H new ATOM 0 HA CYS A 98 -0.160 -5.748 12.854 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -0.337 -7.142 15.537 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -1.318 -5.790 15.007 1.00 0.00 H new ATOM 0 HG CYS A 98 -2.887 -8.138 14.825 1.00 0.00 H new ATOM 1510 N PHE A 99 0.912 -4.017 14.433 1.00 0.00 N ATOM 1511 CA PHE A 99 1.764 -2.937 14.962 1.00 0.00 C ATOM 1512 C PHE A 99 2.418 -3.255 16.303 1.00 0.00 C ATOM 1513 O PHE A 99 3.577 -2.904 16.520 1.00 0.00 O ATOM 1514 CB PHE A 99 1.001 -1.608 15.002 1.00 0.00 C ATOM 1515 CG PHE A 99 1.677 -0.474 15.758 1.00 0.00 C ATOM 1516 CD1 PHE A 99 2.685 0.271 15.181 1.00 0.00 C ATOM 1517 CD2 PHE A 99 1.287 -0.162 17.051 1.00 0.00 C ATOM 1518 CE1 PHE A 99 3.291 1.302 15.873 1.00 0.00 C ATOM 1519 CE2 PHE A 99 1.889 0.864 17.749 1.00 0.00 C ATOM 1520 CZ PHE A 99 2.892 1.598 17.157 1.00 0.00 C ATOM 0 H PHE A 99 -0.007 -3.695 14.130 1.00 0.00 H new ATOM 0 HA PHE A 99 2.594 -2.842 14.262 1.00 0.00 H new ATOM 0 HB2 PHE A 99 0.826 -1.281 13.977 1.00 0.00 H new ATOM 0 HB3 PHE A 99 0.024 -1.786 15.451 1.00 0.00 H new ATOM 0 HD1 PHE A 99 3.005 0.045 14.174 1.00 0.00 H new ATOM 0 HD2 PHE A 99 0.498 -0.732 17.520 1.00 0.00 H new ATOM 0 HE1 PHE A 99 4.078 1.876 15.406 1.00 0.00 H new ATOM 0 HE2 PHE A 99 1.574 1.091 18.757 1.00 0.00 H new ATOM 0 HZ PHE A 99 3.365 2.404 17.698 1.00 0.00 H new ATOM 1530 N SER A 100 1.710 -3.937 17.175 1.00 0.00 N ATOM 1531 CA SER A 100 2.248 -4.298 18.480 1.00 0.00 C ATOM 1532 C SER A 100 3.524 -5.168 18.350 1.00 0.00 C ATOM 1533 O SER A 100 4.353 -5.209 19.255 1.00 0.00 O ATOM 1534 CB SER A 100 1.182 -5.028 19.280 1.00 0.00 C ATOM 1535 OG SER A 100 0.002 -4.238 19.363 1.00 0.00 O ATOM 0 H SER A 100 0.756 -4.257 17.009 1.00 0.00 H new ATOM 0 HA SER A 100 2.533 -3.384 19.002 1.00 0.00 H new ATOM 0 HB2 SER A 100 0.955 -5.985 18.809 1.00 0.00 H new ATOM 0 HB3 SER A 100 1.554 -5.246 20.281 1.00 0.00 H new ATOM 0 HG SER A 100 -0.678 -4.719 19.879 1.00 0.00 H new ATOM 1541 N ASN A 101 3.676 -5.827 17.211 1.00 0.00 N ATOM 1542 CA ASN A 101 4.826 -6.685 16.960 1.00 0.00 C ATOM 1543 C ASN A 101 5.674 -6.144 15.820 1.00 0.00 C ATOM 1544 O ASN A 101 6.803 -6.582 15.628 1.00 0.00 O ATOM 1545 CB ASN A 101 4.370 -8.110 16.577 1.00 0.00 C ATOM 1546 CG ASN A 101 3.575 -8.812 17.656 1.00 0.00 C ATOM 1547 OD1 ASN A 101 3.779 -8.587 18.844 1.00 0.00 O ATOM 1548 ND2 ASN A 101 2.676 -9.670 17.258 1.00 0.00 N ATOM 0 H ASN A 101 3.011 -5.783 16.439 1.00 0.00 H new ATOM 0 HA ASN A 101 5.412 -6.710 17.879 1.00 0.00 H new ATOM 0 HB2 ASN A 101 3.766 -8.056 15.672 1.00 0.00 H new ATOM 0 HB3 ASN A 101 5.248 -8.710 16.339 1.00 0.00 H new ATOM 0 HD21 ASN A 101 2.117 -10.178 17.944 1.00 0.00 H new ATOM 0 HD22 ASN A 101 2.532 -9.833 16.261 1.00 0.00 H new ATOM 1555 N VAL A 102 5.130 -5.182 15.074 1.00 0.00 N ATOM 1556 CA VAL A 102 5.762 -4.695 13.840 1.00 0.00 C ATOM 1557 C VAL A 102 7.075 -3.950 14.143 1.00 0.00 C ATOM 1558 O VAL A 102 8.035 -4.028 13.377 1.00 0.00 O ATOM 1559 CB VAL A 102 4.779 -3.781 13.008 1.00 0.00 C ATOM 1560 CG1 VAL A 102 4.706 -2.353 13.507 1.00 0.00 C ATOM 1561 CG2 VAL A 102 5.057 -3.816 11.532 1.00 0.00 C ATOM 0 H VAL A 102 4.249 -4.721 15.301 1.00 0.00 H new ATOM 0 HA VAL A 102 6.000 -5.568 13.232 1.00 0.00 H new ATOM 0 HB VAL A 102 3.796 -4.222 13.171 1.00 0.00 H new ATOM 0 HG11 VAL A 102 4.012 -1.786 12.887 1.00 0.00 H new ATOM 0 HG12 VAL A 102 4.359 -2.346 14.540 1.00 0.00 H new ATOM 0 HG13 VAL A 102 5.695 -1.898 13.454 1.00 0.00 H new ATOM 0 HG21 VAL A 102 4.350 -3.169 11.013 1.00 0.00 H new ATOM 0 HG22 VAL A 102 6.073 -3.467 11.345 1.00 0.00 H new ATOM 0 HG23 VAL A 102 4.951 -4.837 11.166 1.00 0.00 H new ATOM 1571 N ASN A 103 7.119 -3.260 15.274 1.00 0.00 N ATOM 1572 CA ASN A 103 8.303 -2.515 15.636 1.00 0.00 C ATOM 1573 C ASN A 103 9.232 -3.384 16.423 1.00 0.00 C ATOM 1574 O ASN A 103 9.073 -3.546 17.640 1.00 0.00 O ATOM 1575 CB ASN A 103 7.990 -1.237 16.427 1.00 0.00 C ATOM 1576 CG ASN A 103 7.138 -0.241 15.669 1.00 0.00 C ATOM 1577 OD1 ASN A 103 5.922 -0.268 15.759 1.00 0.00 O ATOM 1578 ND2 ASN A 103 7.760 0.633 14.917 1.00 0.00 N ATOM 0 H ASN A 103 6.354 -3.204 15.946 1.00 0.00 H new ATOM 0 HA ASN A 103 8.777 -2.204 14.705 1.00 0.00 H new ATOM 0 HB2 ASN A 103 7.479 -1.509 17.351 1.00 0.00 H new ATOM 0 HB3 ASN A 103 8.927 -0.758 16.710 1.00 0.00 H new ATOM 0 HD21 ASN A 103 7.226 1.319 14.384 1.00 0.00 H new ATOM 0 HD22 ASN A 103 8.779 0.628 14.865 1.00 0.00 H new ATOM 1585 N ASP A 104 10.160 -3.971 15.722 1.00 0.00 N ATOM 1586 CA ASP A 104 11.180 -4.848 16.291 1.00 0.00 C ATOM 1587 C ASP A 104 12.079 -5.303 15.180 1.00 0.00 C ATOM 1588 O ASP A 104 13.306 -5.275 15.294 1.00 0.00 O ATOM 1589 CB ASP A 104 10.561 -6.097 16.952 1.00 0.00 C ATOM 1590 CG ASP A 104 11.595 -6.974 17.649 1.00 0.00 C ATOM 1591 OD1 ASP A 104 12.329 -7.732 16.976 1.00 0.00 O ATOM 1592 OD2 ASP A 104 11.679 -6.927 18.896 1.00 0.00 O ATOM 0 H ASP A 104 10.242 -3.859 14.712 1.00 0.00 H new ATOM 0 HA ASP A 104 11.724 -4.291 17.054 1.00 0.00 H new ATOM 0 HB2 ASP A 104 9.810 -5.783 17.677 1.00 0.00 H new ATOM 0 HB3 ASP A 104 10.045 -6.685 16.193 1.00 0.00 H new ATOM 1597 N PHE A 105 11.456 -5.695 14.093 1.00 0.00 N ATOM 1598 CA PHE A 105 12.153 -6.237 12.944 1.00 0.00 C ATOM 1599 C PHE A 105 12.358 -5.161 11.890 1.00 0.00 C ATOM 1600 O PHE A 105 11.563 -4.229 11.805 1.00 0.00 O ATOM 1601 CB PHE A 105 11.364 -7.417 12.357 1.00 0.00 C ATOM 1602 CG PHE A 105 11.216 -8.581 13.297 1.00 0.00 C ATOM 1603 CD1 PHE A 105 10.214 -8.600 14.251 1.00 0.00 C ATOM 1604 CD2 PHE A 105 12.085 -9.654 13.225 1.00 0.00 C ATOM 1605 CE1 PHE A 105 10.083 -9.666 15.118 1.00 0.00 C ATOM 1606 CE2 PHE A 105 11.960 -10.720 14.086 1.00 0.00 C ATOM 1607 CZ PHE A 105 10.957 -10.728 15.035 1.00 0.00 C ATOM 0 H PHE A 105 10.444 -5.647 13.978 1.00 0.00 H new ATOM 0 HA PHE A 105 13.131 -6.594 13.266 1.00 0.00 H new ATOM 0 HB2 PHE A 105 10.373 -7.069 12.066 1.00 0.00 H new ATOM 0 HB3 PHE A 105 11.861 -7.757 11.449 1.00 0.00 H new ATOM 0 HD1 PHE A 105 9.526 -7.770 14.318 1.00 0.00 H new ATOM 0 HD2 PHE A 105 12.871 -9.655 12.484 1.00 0.00 H new ATOM 0 HE1 PHE A 105 9.298 -9.668 15.859 1.00 0.00 H new ATOM 0 HE2 PHE A 105 12.647 -11.551 14.020 1.00 0.00 H new ATOM 0 HZ PHE A 105 10.858 -11.565 15.711 1.00 0.00 H new ATOM 1617 N PRO A 106 13.442 -5.249 11.094 1.00 0.00 N ATOM 1618 CA PRO A 106 13.718 -4.280 10.033 1.00 0.00 C ATOM 1619 C PRO A 106 12.623 -4.278 8.964 1.00 0.00 C ATOM 1620 O PRO A 106 12.269 -5.345 8.427 1.00 0.00 O ATOM 1621 CB PRO A 106 15.036 -4.774 9.416 1.00 0.00 C ATOM 1622 CG PRO A 106 15.638 -5.652 10.447 1.00 0.00 C ATOM 1623 CD PRO A 106 14.489 -6.280 11.176 1.00 0.00 C ATOM 0 HA PRO A 106 13.766 -3.263 10.421 1.00 0.00 H new ATOM 0 HB2 PRO A 106 14.858 -5.319 8.489 1.00 0.00 H new ATOM 0 HB3 PRO A 106 15.695 -3.940 9.174 1.00 0.00 H new ATOM 0 HG2 PRO A 106 16.273 -6.412 9.991 1.00 0.00 H new ATOM 0 HG3 PRO A 106 16.267 -5.079 11.129 1.00 0.00 H new ATOM 0 HD2 PRO A 106 14.175 -7.213 10.707 1.00 0.00 H new ATOM 0 HD3 PRO A 106 14.746 -6.513 12.209 1.00 0.00 H new ATOM 1631 N PRO A 107 12.055 -3.093 8.664 1.00 0.00 N ATOM 1632 CA PRO A 107 11.032 -2.929 7.618 1.00 0.00 C ATOM 1633 C PRO A 107 11.523 -3.404 6.237 1.00 0.00 C ATOM 1634 O PRO A 107 12.737 -3.569 6.033 1.00 0.00 O ATOM 1635 CB PRO A 107 10.810 -1.406 7.587 1.00 0.00 C ATOM 1636 CG PRO A 107 11.201 -0.944 8.941 1.00 0.00 C ATOM 1637 CD PRO A 107 12.343 -1.817 9.354 1.00 0.00 C ATOM 0 HA PRO A 107 10.138 -3.515 7.830 1.00 0.00 H new ATOM 0 HB2 PRO A 107 11.417 -0.932 6.816 1.00 0.00 H new ATOM 0 HB3 PRO A 107 9.770 -1.161 7.369 1.00 0.00 H new ATOM 0 HG2 PRO A 107 11.496 0.105 8.926 1.00 0.00 H new ATOM 0 HG3 PRO A 107 10.369 -1.032 9.640 1.00 0.00 H new ATOM 0 HD2 PRO A 107 13.302 -1.399 9.046 1.00 0.00 H new ATOM 0 HD3 PRO A 107 12.383 -1.944 10.436 1.00 0.00 H new ATOM 1645 N SER A 108 10.577 -3.623 5.286 1.00 0.00 N ATOM 1646 CA SER A 108 10.954 -4.033 3.920 1.00 0.00 C ATOM 1647 C SER A 108 11.798 -2.916 3.358 1.00 0.00 C ATOM 1648 O SER A 108 12.868 -3.132 2.879 1.00 0.00 O ATOM 1649 CB SER A 108 9.700 -4.156 3.009 1.00 0.00 C ATOM 1650 OG SER A 108 9.998 -4.815 1.791 1.00 0.00 O ATOM 0 H SER A 108 9.574 -3.524 5.440 1.00 0.00 H new ATOM 0 HA SER A 108 11.468 -4.994 3.953 1.00 0.00 H new ATOM 0 HB2 SER A 108 8.919 -4.703 3.537 1.00 0.00 H new ATOM 0 HB3 SER A 108 9.305 -3.162 2.798 1.00 0.00 H new ATOM 0 HG SER A 108 9.187 -4.876 1.245 1.00 0.00 H new ATOM 1656 N ASP A 109 11.271 -1.720 3.539 1.00 0.00 N ATOM 1657 CA ASP A 109 11.830 -0.437 3.187 1.00 0.00 C ATOM 1658 C ASP A 109 10.855 0.556 3.761 1.00 0.00 C ATOM 1659 O ASP A 109 9.879 0.131 4.414 1.00 0.00 O ATOM 1660 CB ASP A 109 12.022 -0.202 1.642 1.00 0.00 C ATOM 1661 CG ASP A 109 13.192 -0.984 0.995 1.00 0.00 C ATOM 1662 OD1 ASP A 109 14.379 -0.637 1.253 1.00 0.00 O ATOM 1663 OD2 ASP A 109 12.946 -1.925 0.245 1.00 0.00 O ATOM 0 H ASP A 109 10.356 -1.617 3.977 1.00 0.00 H new ATOM 0 HA ASP A 109 12.842 -0.348 3.582 1.00 0.00 H new ATOM 0 HB2 ASP A 109 11.098 -0.475 1.132 1.00 0.00 H new ATOM 0 HB3 ASP A 109 12.179 0.863 1.470 1.00 0.00 H new ATOM 1668 N THR A 110 11.064 1.821 3.564 1.00 0.00 N ATOM 1669 CA THR A 110 10.178 2.811 4.131 1.00 0.00 C ATOM 1670 C THR A 110 10.269 4.116 3.343 1.00 0.00 C ATOM 1671 O THR A 110 11.337 4.462 2.827 1.00 0.00 O ATOM 1672 CB THR A 110 10.508 3.036 5.644 1.00 0.00 C ATOM 1673 OG1 THR A 110 9.612 3.991 6.241 1.00 0.00 O ATOM 1674 CG2 THR A 110 11.956 3.487 5.836 1.00 0.00 C ATOM 0 H THR A 110 11.837 2.200 3.017 1.00 0.00 H new ATOM 0 HA THR A 110 9.152 2.448 4.063 1.00 0.00 H new ATOM 0 HB THR A 110 10.374 2.078 6.146 1.00 0.00 H new ATOM 0 HG1 THR A 110 8.731 3.921 5.818 1.00 0.00 H new ATOM 0 HG21 THR A 110 12.153 3.635 6.898 1.00 0.00 H new ATOM 0 HG22 THR A 110 12.629 2.725 5.444 1.00 0.00 H new ATOM 0 HG23 THR A 110 12.119 4.424 5.303 1.00 0.00 H new ATOM 1682 N ALA A 111 9.149 4.808 3.237 1.00 0.00 N ATOM 1683 CA ALA A 111 9.063 6.053 2.516 1.00 0.00 C ATOM 1684 C ALA A 111 7.925 6.868 3.071 1.00 0.00 C ATOM 1685 O ALA A 111 7.157 6.387 3.907 1.00 0.00 O ATOM 1686 CB ALA A 111 8.850 5.803 1.034 1.00 0.00 C ATOM 0 H ALA A 111 8.267 4.513 3.656 1.00 0.00 H new ATOM 0 HA ALA A 111 9.999 6.598 2.636 1.00 0.00 H new ATOM 0 HB1 ALA A 111 8.788 6.756 0.509 1.00 0.00 H new ATOM 0 HB2 ALA A 111 9.685 5.225 0.639 1.00 0.00 H new ATOM 0 HB3 ALA A 111 7.923 5.248 0.888 1.00 0.00 H new ATOM 1692 N GLU A 112 7.825 8.082 2.626 1.00 0.00 N ATOM 1693 CA GLU A 112 6.795 8.982 3.069 1.00 0.00 C ATOM 1694 C GLU A 112 6.029 9.528 1.875 1.00 0.00 C ATOM 1695 O GLU A 112 6.626 9.855 0.843 1.00 0.00 O ATOM 1696 CB GLU A 112 7.353 10.168 3.889 1.00 0.00 C ATOM 1697 CG GLU A 112 8.025 9.848 5.237 1.00 0.00 C ATOM 1698 CD GLU A 112 9.342 9.107 5.133 1.00 0.00 C ATOM 1699 OE1 GLU A 112 10.322 9.695 4.627 1.00 0.00 O ATOM 1700 OE2 GLU A 112 9.423 7.950 5.560 1.00 0.00 O ATOM 0 H GLU A 112 8.461 8.484 1.937 1.00 0.00 H new ATOM 0 HA GLU A 112 6.135 8.406 3.717 1.00 0.00 H new ATOM 0 HB2 GLU A 112 8.078 10.694 3.268 1.00 0.00 H new ATOM 0 HB3 GLU A 112 6.533 10.861 4.078 1.00 0.00 H new ATOM 0 HG2 GLU A 112 8.192 10.782 5.774 1.00 0.00 H new ATOM 0 HG3 GLU A 112 7.337 9.253 5.837 1.00 0.00 H new ATOM 1707 N LEU A 113 4.723 9.606 2.005 1.00 0.00 N ATOM 1708 CA LEU A 113 3.864 10.201 0.982 1.00 0.00 C ATOM 1709 C LEU A 113 4.239 11.667 0.799 1.00 0.00 C ATOM 1710 O LEU A 113 4.586 12.369 1.773 1.00 0.00 O ATOM 1711 CB LEU A 113 2.417 10.192 1.445 1.00 0.00 C ATOM 1712 CG LEU A 113 1.335 10.634 0.446 1.00 0.00 C ATOM 1713 CD1 LEU A 113 1.108 9.581 -0.607 1.00 0.00 C ATOM 1714 CD2 LEU A 113 0.037 10.981 1.166 1.00 0.00 C ATOM 0 H LEU A 113 4.217 9.261 2.821 1.00 0.00 H new ATOM 0 HA LEU A 113 3.988 9.630 0.062 1.00 0.00 H new ATOM 0 HB2 LEU A 113 2.177 9.180 1.770 1.00 0.00 H new ATOM 0 HB3 LEU A 113 2.343 10.835 2.322 1.00 0.00 H new ATOM 0 HG LEU A 113 1.689 11.534 -0.056 1.00 0.00 H new ATOM 0 HD11 LEU A 113 0.338 9.920 -1.300 1.00 0.00 H new ATOM 0 HD12 LEU A 113 2.035 9.406 -1.152 1.00 0.00 H new ATOM 0 HD13 LEU A 113 0.786 8.654 -0.132 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -0.712 11.291 0.437 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -0.324 10.107 1.708 1.00 0.00 H new ATOM 0 HD23 LEU A 113 0.217 11.794 1.869 1.00 0.00 H new ATOM 1726 N THR A 114 4.163 12.106 -0.402 1.00 0.00 N ATOM 1727 CA THR A 114 4.376 13.467 -0.759 1.00 0.00 C ATOM 1728 C THR A 114 3.241 13.830 -1.717 1.00 0.00 C ATOM 1729 O THR A 114 2.563 12.918 -2.207 1.00 0.00 O ATOM 1730 CB THR A 114 5.789 13.661 -1.415 1.00 0.00 C ATOM 1731 OG1 THR A 114 6.003 15.022 -1.790 1.00 0.00 O ATOM 1732 CG2 THR A 114 5.977 12.765 -2.628 1.00 0.00 C ATOM 0 H THR A 114 3.942 11.507 -1.198 1.00 0.00 H new ATOM 0 HA THR A 114 4.367 14.121 0.113 1.00 0.00 H new ATOM 0 HB THR A 114 6.524 13.379 -0.661 1.00 0.00 H new ATOM 0 HG1 THR A 114 6.891 15.114 -2.194 1.00 0.00 H new ATOM 0 HG21 THR A 114 6.967 12.930 -3.052 1.00 0.00 H new ATOM 0 HG22 THR A 114 5.880 11.722 -2.328 1.00 0.00 H new ATOM 0 HG23 THR A 114 5.219 13.000 -3.375 1.00 0.00 H new ATOM 1740 N GLU A 115 3.010 15.109 -1.989 1.00 0.00 N ATOM 1741 CA GLU A 115 1.911 15.492 -2.886 1.00 0.00 C ATOM 1742 C GLU A 115 2.123 14.950 -4.279 1.00 0.00 C ATOM 1743 O GLU A 115 1.176 14.677 -4.996 1.00 0.00 O ATOM 1744 CB GLU A 115 1.689 16.991 -2.932 1.00 0.00 C ATOM 1745 CG GLU A 115 1.189 17.583 -1.644 1.00 0.00 C ATOM 1746 CD GLU A 115 0.982 19.058 -1.766 1.00 0.00 C ATOM 1747 OE1 GLU A 115 0.000 19.478 -2.397 1.00 0.00 O ATOM 1748 OE2 GLU A 115 1.803 19.824 -1.242 1.00 0.00 O ATOM 0 H GLU A 115 3.552 15.888 -1.614 1.00 0.00 H new ATOM 0 HA GLU A 115 1.009 15.043 -2.470 1.00 0.00 H new ATOM 0 HB2 GLU A 115 2.627 17.477 -3.202 1.00 0.00 H new ATOM 0 HB3 GLU A 115 0.974 17.216 -3.723 1.00 0.00 H new ATOM 0 HG2 GLU A 115 0.251 17.105 -1.362 1.00 0.00 H new ATOM 0 HG3 GLU A 115 1.903 17.379 -0.846 1.00 0.00 H new ATOM 1755 N GLU A 116 3.363 14.774 -4.637 1.00 0.00 N ATOM 1756 CA GLU A 116 3.711 14.213 -5.909 1.00 0.00 C ATOM 1757 C GLU A 116 3.253 12.740 -5.973 1.00 0.00 C ATOM 1758 O GLU A 116 2.679 12.291 -6.967 1.00 0.00 O ATOM 1759 CB GLU A 116 5.213 14.359 -6.113 1.00 0.00 C ATOM 1760 CG GLU A 116 5.717 13.840 -7.422 1.00 0.00 C ATOM 1761 CD GLU A 116 7.173 14.114 -7.606 1.00 0.00 C ATOM 1762 OE1 GLU A 116 8.004 13.304 -7.166 1.00 0.00 O ATOM 1763 OE2 GLU A 116 7.510 15.158 -8.189 1.00 0.00 O ATOM 0 H GLU A 116 4.163 15.017 -4.052 1.00 0.00 H new ATOM 0 HA GLU A 116 3.204 14.742 -6.716 1.00 0.00 H new ATOM 0 HB2 GLU A 116 5.477 15.413 -6.029 1.00 0.00 H new ATOM 0 HB3 GLU A 116 5.728 13.836 -5.307 1.00 0.00 H new ATOM 0 HG2 GLU A 116 5.540 12.766 -7.479 1.00 0.00 H new ATOM 0 HG3 GLU A 116 5.155 14.300 -8.235 1.00 0.00 H new ATOM 1770 N ASN A 117 3.439 12.030 -4.865 1.00 0.00 N ATOM 1771 CA ASN A 117 3.058 10.608 -4.752 1.00 0.00 C ATOM 1772 C ASN A 117 1.542 10.523 -4.805 1.00 0.00 C ATOM 1773 O ASN A 117 0.961 9.603 -5.370 1.00 0.00 O ATOM 1774 CB ASN A 117 3.512 10.044 -3.383 1.00 0.00 C ATOM 1775 CG ASN A 117 3.423 8.518 -3.272 1.00 0.00 C ATOM 1776 OD1 ASN A 117 3.208 7.988 -2.208 1.00 0.00 O ATOM 1777 ND2 ASN A 117 3.619 7.821 -4.357 1.00 0.00 N ATOM 0 H ASN A 117 3.856 12.414 -4.017 1.00 0.00 H new ATOM 0 HA ASN A 117 3.524 10.041 -5.558 1.00 0.00 H new ATOM 0 HB2 ASN A 117 4.542 10.351 -3.199 1.00 0.00 H new ATOM 0 HB3 ASN A 117 2.902 10.490 -2.598 1.00 0.00 H new ATOM 0 HD21 ASN A 117 3.593 6.802 -4.320 1.00 0.00 H new ATOM 0 HD22 ASN A 117 3.798 8.295 -5.242 1.00 0.00 H new ATOM 1784 N LEU A 118 0.942 11.545 -4.240 1.00 0.00 N ATOM 1785 CA LEU A 118 -0.486 11.692 -4.084 1.00 0.00 C ATOM 1786 C LEU A 118 -1.193 11.872 -5.442 1.00 0.00 C ATOM 1787 O LEU A 118 -2.363 11.546 -5.592 1.00 0.00 O ATOM 1788 CB LEU A 118 -0.722 12.917 -3.261 1.00 0.00 C ATOM 1789 CG LEU A 118 -2.105 13.128 -2.766 1.00 0.00 C ATOM 1790 CD1 LEU A 118 -2.377 12.230 -1.577 1.00 0.00 C ATOM 1791 CD2 LEU A 118 -2.300 14.565 -2.443 1.00 0.00 C ATOM 0 H LEU A 118 1.462 12.335 -3.858 1.00 0.00 H new ATOM 0 HA LEU A 118 -0.886 10.794 -3.613 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -0.054 12.884 -2.401 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -0.436 13.786 -3.853 1.00 0.00 H new ATOM 0 HG LEU A 118 -2.824 12.859 -3.540 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -3.395 12.394 -1.223 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -2.259 11.188 -1.874 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -1.673 12.461 -0.778 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -3.316 14.722 -2.079 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -1.589 14.865 -1.673 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -2.139 15.164 -3.339 1.00 0.00 H new ATOM 1803 N LYS A 119 -0.479 12.433 -6.405 1.00 0.00 N ATOM 1804 CA LYS A 119 -0.982 12.605 -7.768 1.00 0.00 C ATOM 1805 C LYS A 119 -0.691 11.376 -8.599 1.00 0.00 C ATOM 1806 O LYS A 119 -1.025 11.303 -9.785 1.00 0.00 O ATOM 1807 CB LYS A 119 -0.418 13.867 -8.448 1.00 0.00 C ATOM 1808 CG LYS A 119 -1.166 15.183 -8.164 1.00 0.00 C ATOM 1809 CD LYS A 119 -1.217 15.576 -6.699 1.00 0.00 C ATOM 1810 CE LYS A 119 -1.961 16.894 -6.541 1.00 0.00 C ATOM 1811 NZ LYS A 119 -2.049 17.351 -5.137 1.00 0.00 N ATOM 0 H LYS A 119 0.469 12.784 -6.268 1.00 0.00 H new ATOM 0 HA LYS A 119 -2.062 12.738 -7.697 1.00 0.00 H new ATOM 0 HB2 LYS A 119 0.620 13.989 -8.138 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -0.411 13.702 -9.525 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -0.688 15.986 -8.726 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -2.186 15.094 -8.539 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -1.714 14.796 -6.122 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -0.206 15.670 -6.303 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -1.460 17.659 -7.134 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -2.968 16.786 -6.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -1.775 18.353 -5.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -3.025 17.239 -4.796 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -1.408 16.783 -4.546 1.00 0.00 H new ATOM 1825 N GLY A 120 -0.085 10.407 -7.973 1.00 0.00 N ATOM 1826 CA GLY A 120 0.169 9.156 -8.642 1.00 0.00 C ATOM 1827 C GLY A 120 1.583 8.957 -9.108 1.00 0.00 C ATOM 1828 O GLY A 120 1.830 8.092 -9.938 1.00 0.00 O ATOM 0 H GLY A 120 0.241 10.455 -7.008 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -0.092 8.341 -7.967 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -0.495 9.081 -9.503 1.00 0.00 H new ATOM 1832 N LYS A 121 2.505 9.741 -8.617 1.00 0.00 N ATOM 1833 CA LYS A 121 3.904 9.512 -8.932 1.00 0.00 C ATOM 1834 C LYS A 121 4.395 8.322 -8.143 1.00 0.00 C ATOM 1835 O LYS A 121 4.336 8.339 -6.911 1.00 0.00 O ATOM 1836 CB LYS A 121 4.756 10.736 -8.573 1.00 0.00 C ATOM 1837 CG LYS A 121 6.284 10.512 -8.609 1.00 0.00 C ATOM 1838 CD LYS A 121 6.839 10.208 -9.992 1.00 0.00 C ATOM 1839 CE LYS A 121 6.716 11.391 -10.935 1.00 0.00 C ATOM 1840 NZ LYS A 121 7.376 11.119 -12.231 1.00 0.00 N ATOM 0 H LYS A 121 2.324 10.536 -8.004 1.00 0.00 H new ATOM 0 HA LYS A 121 3.995 9.328 -10.002 1.00 0.00 H new ATOM 0 HB2 LYS A 121 4.508 11.545 -9.260 1.00 0.00 H new ATOM 0 HB3 LYS A 121 4.478 11.071 -7.574 1.00 0.00 H new ATOM 0 HG2 LYS A 121 6.779 11.401 -8.219 1.00 0.00 H new ATOM 0 HG3 LYS A 121 6.535 9.688 -7.940 1.00 0.00 H new ATOM 0 HD2 LYS A 121 7.887 9.923 -9.906 1.00 0.00 H new ATOM 0 HD3 LYS A 121 6.310 9.354 -10.414 1.00 0.00 H new ATOM 0 HE2 LYS A 121 5.663 11.617 -11.102 1.00 0.00 H new ATOM 0 HE3 LYS A 121 7.163 12.273 -10.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 7.274 11.946 -12.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 8.386 10.927 -12.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 6.933 10.292 -12.680 1.00 0.00 H new ATOM 1854 N PRO A 122 4.845 7.258 -8.823 1.00 0.00 N ATOM 1855 CA PRO A 122 5.430 6.118 -8.156 1.00 0.00 C ATOM 1856 C PRO A 122 6.720 6.534 -7.469 1.00 0.00 C ATOM 1857 O PRO A 122 7.746 6.719 -8.117 1.00 0.00 O ATOM 1858 CB PRO A 122 5.738 5.137 -9.303 1.00 0.00 C ATOM 1859 CG PRO A 122 4.904 5.597 -10.442 1.00 0.00 C ATOM 1860 CD PRO A 122 4.796 7.077 -10.291 1.00 0.00 C ATOM 0 HA PRO A 122 4.780 5.688 -7.394 1.00 0.00 H new ATOM 0 HB2 PRO A 122 6.797 5.151 -9.560 1.00 0.00 H new ATOM 0 HB3 PRO A 122 5.491 4.113 -9.022 1.00 0.00 H new ATOM 0 HG2 PRO A 122 5.363 5.333 -11.395 1.00 0.00 H new ATOM 0 HG3 PRO A 122 3.920 5.128 -10.421 1.00 0.00 H new ATOM 0 HD2 PRO A 122 5.614 7.596 -10.791 1.00 0.00 H new ATOM 0 HD3 PRO A 122 3.868 7.461 -10.716 1.00 0.00 H new ATOM 1868 N VAL A 123 6.649 6.738 -6.191 1.00 0.00 N ATOM 1869 CA VAL A 123 7.809 7.134 -5.425 1.00 0.00 C ATOM 1870 C VAL A 123 8.500 5.899 -4.959 1.00 0.00 C ATOM 1871 O VAL A 123 7.840 4.963 -4.501 1.00 0.00 O ATOM 1872 CB VAL A 123 7.430 8.013 -4.193 1.00 0.00 C ATOM 1873 CG1 VAL A 123 8.659 8.357 -3.359 1.00 0.00 C ATOM 1874 CG2 VAL A 123 6.755 9.286 -4.639 1.00 0.00 C ATOM 0 H VAL A 123 5.794 6.638 -5.643 1.00 0.00 H new ATOM 0 HA VAL A 123 8.457 7.735 -6.063 1.00 0.00 H new ATOM 0 HB VAL A 123 6.742 7.434 -3.577 1.00 0.00 H new ATOM 0 HG11 VAL A 123 8.361 8.970 -2.508 1.00 0.00 H new ATOM 0 HG12 VAL A 123 9.124 7.439 -3.000 1.00 0.00 H new ATOM 0 HG13 VAL A 123 9.372 8.909 -3.972 1.00 0.00 H new ATOM 0 HG21 VAL A 123 6.498 9.886 -3.766 1.00 0.00 H new ATOM 0 HG22 VAL A 123 7.431 9.850 -5.281 1.00 0.00 H new ATOM 0 HG23 VAL A 123 5.848 9.042 -5.192 1.00 0.00 H new ATOM 1884 N VAL A 124 9.802 5.854 -5.118 1.00 0.00 N ATOM 1885 CA VAL A 124 10.553 4.724 -4.656 1.00 0.00 C ATOM 1886 C VAL A 124 10.478 4.619 -3.147 1.00 0.00 C ATOM 1887 O VAL A 124 10.564 5.632 -2.444 1.00 0.00 O ATOM 1888 CB VAL A 124 12.039 4.716 -5.148 1.00 0.00 C ATOM 1889 CG1 VAL A 124 12.098 4.608 -6.651 1.00 0.00 C ATOM 1890 CG2 VAL A 124 12.806 5.943 -4.696 1.00 0.00 C ATOM 0 H VAL A 124 10.356 6.586 -5.562 1.00 0.00 H new ATOM 0 HA VAL A 124 10.089 3.843 -5.100 1.00 0.00 H new ATOM 0 HB VAL A 124 12.513 3.844 -4.697 1.00 0.00 H new ATOM 0 HG11 VAL A 124 13.139 4.604 -6.975 1.00 0.00 H new ATOM 0 HG12 VAL A 124 11.615 3.684 -6.969 1.00 0.00 H new ATOM 0 HG13 VAL A 124 11.582 5.458 -7.097 1.00 0.00 H new ATOM 0 HG21 VAL A 124 13.831 5.888 -5.064 1.00 0.00 H new ATOM 0 HG22 VAL A 124 12.326 6.838 -5.092 1.00 0.00 H new ATOM 0 HG23 VAL A 124 12.813 5.987 -3.607 1.00 0.00 H new ATOM 1900 N LEU A 125 10.257 3.410 -2.661 1.00 0.00 N ATOM 1901 CA LEU A 125 10.217 3.150 -1.228 1.00 0.00 C ATOM 1902 C LEU A 125 11.614 3.434 -0.743 1.00 0.00 C ATOM 1903 O LEU A 125 11.888 4.408 -0.055 1.00 0.00 O ATOM 1904 CB LEU A 125 9.881 1.639 -0.923 1.00 0.00 C ATOM 1905 CG LEU A 125 8.541 1.025 -1.426 1.00 0.00 C ATOM 1906 CD1 LEU A 125 8.439 1.026 -2.933 1.00 0.00 C ATOM 1907 CD2 LEU A 125 8.405 -0.397 -0.929 1.00 0.00 C ATOM 0 H LEU A 125 10.101 2.585 -3.241 1.00 0.00 H new ATOM 0 HA LEU A 125 9.452 3.759 -0.746 1.00 0.00 H new ATOM 0 HB2 LEU A 125 10.690 1.037 -1.337 1.00 0.00 H new ATOM 0 HB3 LEU A 125 9.910 1.512 0.159 1.00 0.00 H new ATOM 0 HG LEU A 125 7.738 1.648 -1.031 1.00 0.00 H new ATOM 0 HD11 LEU A 125 7.487 0.588 -3.234 1.00 0.00 H new ATOM 0 HD12 LEU A 125 8.499 2.050 -3.301 1.00 0.00 H new ATOM 0 HD13 LEU A 125 9.257 0.441 -3.353 1.00 0.00 H new ATOM 0 HD21 LEU A 125 7.465 -0.819 -1.285 1.00 0.00 H new ATOM 0 HD22 LEU A 125 9.236 -0.994 -1.304 1.00 0.00 H new ATOM 0 HD23 LEU A 125 8.416 -0.404 0.161 1.00 0.00 H new ATOM 1919 N LYS A 126 12.455 2.580 -1.211 1.00 0.00 N ATOM 1920 CA LYS A 126 13.873 2.536 -1.135 1.00 0.00 C ATOM 1921 C LYS A 126 14.151 1.401 -2.074 1.00 0.00 C ATOM 1922 O LYS A 126 13.200 0.910 -2.706 1.00 0.00 O ATOM 1923 CB LYS A 126 14.448 2.204 0.277 1.00 0.00 C ATOM 1924 CG LYS A 126 14.201 3.224 1.388 1.00 0.00 C ATOM 1925 CD LYS A 126 14.808 4.579 1.050 1.00 0.00 C ATOM 1926 CE LYS A 126 14.558 5.596 2.153 1.00 0.00 C ATOM 1927 NZ LYS A 126 15.223 5.225 3.420 1.00 0.00 N ATOM 0 H LYS A 126 12.108 1.776 -1.734 1.00 0.00 H new ATOM 0 HA LYS A 126 14.328 3.499 -1.366 1.00 0.00 H new ATOM 0 HB2 LYS A 126 14.031 1.249 0.596 1.00 0.00 H new ATOM 0 HB3 LYS A 126 15.525 2.065 0.179 1.00 0.00 H new ATOM 0 HG2 LYS A 126 13.129 3.335 1.549 1.00 0.00 H new ATOM 0 HG3 LYS A 126 14.627 2.856 2.322 1.00 0.00 H new ATOM 0 HD2 LYS A 126 15.881 4.469 0.893 1.00 0.00 H new ATOM 0 HD3 LYS A 126 14.385 4.945 0.114 1.00 0.00 H new ATOM 0 HE2 LYS A 126 14.916 6.574 1.830 1.00 0.00 H new ATOM 0 HE3 LYS A 126 13.485 5.689 2.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 15.168 6.021 4.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 14.749 4.396 3.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 16.221 4.997 3.235 1.00 0.00 H new ATOM 1941 N TYR A 127 15.346 0.972 -2.204 1.00 0.00 N ATOM 1942 CA TYR A 127 15.593 -0.118 -3.104 1.00 0.00 C ATOM 1943 C TYR A 127 16.737 -0.967 -2.523 1.00 0.00 C ATOM 1944 O TYR A 127 17.458 -1.702 -3.217 1.00 0.00 O ATOM 1945 CB TYR A 127 15.897 0.477 -4.499 1.00 0.00 C ATOM 1946 CG TYR A 127 15.858 -0.487 -5.644 1.00 0.00 C ATOM 1947 CD1 TYR A 127 14.665 -0.746 -6.286 1.00 0.00 C ATOM 1948 CD2 TYR A 127 16.999 -1.116 -6.093 1.00 0.00 C ATOM 1949 CE1 TYR A 127 14.603 -1.610 -7.350 1.00 0.00 C ATOM 1950 CE2 TYR A 127 16.955 -1.991 -7.160 1.00 0.00 C ATOM 1951 CZ TYR A 127 15.748 -2.233 -7.787 1.00 0.00 C ATOM 1952 OH TYR A 127 15.684 -3.092 -8.866 1.00 0.00 O ATOM 0 H TYR A 127 16.163 1.340 -1.717 1.00 0.00 H new ATOM 0 HA TYR A 127 14.735 -0.780 -3.219 1.00 0.00 H new ATOM 0 HB2 TYR A 127 15.181 1.275 -4.696 1.00 0.00 H new ATOM 0 HB3 TYR A 127 16.885 0.936 -4.469 1.00 0.00 H new ATOM 0 HD1 TYR A 127 13.763 -0.260 -5.945 1.00 0.00 H new ATOM 0 HD2 TYR A 127 17.942 -0.922 -5.603 1.00 0.00 H new ATOM 0 HE1 TYR A 127 13.660 -1.800 -7.841 1.00 0.00 H new ATOM 0 HE2 TYR A 127 17.855 -2.481 -7.501 1.00 0.00 H new ATOM 0 HH TYR A 127 16.577 -3.451 -9.052 1.00 0.00 H new ATOM 1962 N VAL A 128 16.871 -0.864 -1.234 1.00 0.00 N ATOM 1963 CA VAL A 128 17.910 -1.540 -0.505 1.00 0.00 C ATOM 1964 C VAL A 128 17.514 -2.886 0.165 1.00 0.00 C ATOM 1965 O VAL A 128 18.301 -3.837 0.135 1.00 0.00 O ATOM 1966 CB VAL A 128 18.608 -0.598 0.500 1.00 0.00 C ATOM 1967 CG1 VAL A 128 19.356 0.490 -0.251 1.00 0.00 C ATOM 1968 CG2 VAL A 128 17.582 0.037 1.400 1.00 0.00 C ATOM 0 H VAL A 128 16.254 -0.301 -0.648 1.00 0.00 H new ATOM 0 HA VAL A 128 18.619 -1.829 -1.281 1.00 0.00 H new ATOM 0 HB VAL A 128 19.311 -1.177 1.100 1.00 0.00 H new ATOM 0 HG11 VAL A 128 19.847 1.152 0.462 1.00 0.00 H new ATOM 0 HG12 VAL A 128 20.105 0.035 -0.899 1.00 0.00 H new ATOM 0 HG13 VAL A 128 18.653 1.064 -0.855 1.00 0.00 H new ATOM 0 HG21 VAL A 128 18.079 0.701 2.107 1.00 0.00 H new ATOM 0 HG22 VAL A 128 16.876 0.610 0.799 1.00 0.00 H new ATOM 0 HG23 VAL A 128 17.047 -0.740 1.946 1.00 0.00 H new ATOM 1978 N LYS A 129 16.317 -2.987 0.757 1.00 0.00 N ATOM 1979 CA LYS A 129 16.048 -4.153 1.616 1.00 0.00 C ATOM 1980 C LYS A 129 14.890 -5.085 1.090 1.00 0.00 C ATOM 1981 O LYS A 129 14.833 -6.255 1.449 1.00 0.00 O ATOM 1982 CB LYS A 129 15.834 -3.621 3.078 1.00 0.00 C ATOM 1983 CG LYS A 129 15.910 -4.631 4.241 1.00 0.00 C ATOM 1984 CD LYS A 129 14.760 -5.607 4.288 1.00 0.00 C ATOM 1985 CE LYS A 129 14.926 -6.585 5.420 1.00 0.00 C ATOM 1986 NZ LYS A 129 13.856 -7.586 5.427 1.00 0.00 N ATOM 0 H LYS A 129 15.554 -2.316 0.667 1.00 0.00 H new ATOM 0 HA LYS A 129 16.906 -4.825 1.598 1.00 0.00 H new ATOM 0 HB2 LYS A 129 16.577 -2.845 3.262 1.00 0.00 H new ATOM 0 HB3 LYS A 129 14.856 -3.141 3.118 1.00 0.00 H new ATOM 0 HG2 LYS A 129 16.843 -5.189 4.162 1.00 0.00 H new ATOM 0 HG3 LYS A 129 15.945 -4.082 5.182 1.00 0.00 H new ATOM 0 HD2 LYS A 129 13.822 -5.064 4.407 1.00 0.00 H new ATOM 0 HD3 LYS A 129 14.698 -6.147 3.343 1.00 0.00 H new ATOM 0 HE2 LYS A 129 15.891 -7.084 5.333 1.00 0.00 H new ATOM 0 HE3 LYS A 129 14.929 -6.048 6.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 14.001 -8.244 6.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 12.937 -7.111 5.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 13.869 -8.115 4.531 1.00 0.00 H new ATOM 2000 N PHE A 130 14.018 -4.571 0.229 1.00 0.00 N ATOM 2001 CA PHE A 130 12.830 -5.319 -0.374 1.00 0.00 C ATOM 2002 C PHE A 130 13.218 -6.620 -1.176 1.00 0.00 C ATOM 2003 O PHE A 130 12.378 -7.151 -1.905 1.00 0.00 O ATOM 2004 CB PHE A 130 12.162 -4.395 -1.416 1.00 0.00 C ATOM 2005 CG PHE A 130 13.036 -4.214 -2.650 1.00 0.00 C ATOM 2006 CD1 PHE A 130 14.077 -3.334 -2.658 1.00 0.00 C ATOM 2007 CD2 PHE A 130 12.829 -4.987 -3.780 1.00 0.00 C ATOM 2008 CE1 PHE A 130 14.881 -3.228 -3.762 1.00 0.00 C ATOM 2009 CE2 PHE A 130 13.639 -4.880 -4.869 1.00 0.00 C ATOM 2010 CZ PHE A 130 14.661 -4.002 -4.862 1.00 0.00 C ATOM 0 H PHE A 130 14.085 -3.608 -0.100 1.00 0.00 H new ATOM 0 HA PHE A 130 12.198 -5.600 0.469 1.00 0.00 H new ATOM 0 HB2 PHE A 130 11.200 -4.814 -1.710 1.00 0.00 H new ATOM 0 HB3 PHE A 130 11.962 -3.423 -0.965 1.00 0.00 H new ATOM 0 HD1 PHE A 130 14.268 -2.719 -1.791 1.00 0.00 H new ATOM 0 HD2 PHE A 130 12.008 -5.689 -3.798 1.00 0.00 H new ATOM 0 HE1 PHE A 130 15.699 -2.523 -3.761 1.00 0.00 H new ATOM 0 HE2 PHE A 130 13.463 -5.498 -5.737 1.00 0.00 H new ATOM 0 HZ PHE A 130 15.304 -3.912 -5.725 1.00 0.00 H new ATOM 2020 N GLN A 131 14.405 -7.152 -0.971 1.00 0.00 N ATOM 2021 CA GLN A 131 15.036 -8.135 -1.869 1.00 0.00 C ATOM 2022 C GLN A 131 14.321 -9.488 -2.087 1.00 0.00 C ATOM 2023 O GLN A 131 14.835 -10.344 -2.810 1.00 0.00 O ATOM 2024 CB GLN A 131 16.470 -8.322 -1.487 1.00 0.00 C ATOM 2025 CG GLN A 131 17.254 -7.052 -1.687 1.00 0.00 C ATOM 2026 CD GLN A 131 18.677 -7.200 -1.325 1.00 0.00 C ATOM 2027 OE1 GLN A 131 19.520 -7.559 -2.160 1.00 0.00 O ATOM 2028 NE2 GLN A 131 18.975 -6.949 -0.107 1.00 0.00 N ATOM 0 H GLN A 131 14.981 -6.917 -0.163 1.00 0.00 H new ATOM 0 HA GLN A 131 14.943 -7.681 -2.856 1.00 0.00 H new ATOM 0 HB2 GLN A 131 16.534 -8.632 -0.444 1.00 0.00 H new ATOM 0 HB3 GLN A 131 16.908 -9.121 -2.085 1.00 0.00 H new ATOM 0 HG2 GLN A 131 17.178 -6.743 -2.730 1.00 0.00 H new ATOM 0 HG3 GLN A 131 16.811 -6.258 -1.086 1.00 0.00 H new ATOM 0 HE21 GLN A 131 18.248 -6.656 0.546 1.00 0.00 H new ATOM 0 HE22 GLN A 131 19.940 -7.042 0.212 1.00 0.00 H new ATOM 2037 N ASN A 132 13.165 -9.663 -1.498 1.00 0.00 N ATOM 2038 CA ASN A 132 12.314 -10.823 -1.735 1.00 0.00 C ATOM 2039 C ASN A 132 10.937 -10.555 -1.168 1.00 0.00 C ATOM 2040 O ASN A 132 10.773 -10.349 0.041 1.00 0.00 O ATOM 2041 CB ASN A 132 12.919 -12.154 -1.196 1.00 0.00 C ATOM 2042 CG ASN A 132 13.148 -12.205 0.317 1.00 0.00 C ATOM 2043 OD1 ASN A 132 12.236 -12.816 1.036 1.00 0.00 O flip ATOM 2044 ND2 ASN A 132 14.175 -11.755 0.820 1.00 0.00 N flip ATOM 0 H ASN A 132 12.775 -8.999 -0.829 1.00 0.00 H new ATOM 0 HA ASN A 132 12.239 -10.968 -2.813 1.00 0.00 H new ATOM 0 HB2 ASN A 132 12.256 -12.974 -1.474 1.00 0.00 H new ATOM 0 HB3 ASN A 132 13.871 -12.330 -1.697 1.00 0.00 H new ATOM 0 HD21 ASN A 132 14.866 -11.285 0.235 1.00 0.00 H new ATOM 0 HD22 ASN A 132 14.337 -11.852 1.822 1.00 0.00 H new ATOM 2051 N VAL A 133 9.953 -10.499 -2.041 1.00 0.00 N ATOM 2052 CA VAL A 133 8.590 -10.228 -1.642 1.00 0.00 C ATOM 2053 C VAL A 133 7.656 -11.368 -2.016 1.00 0.00 C ATOM 2054 O VAL A 133 7.606 -11.791 -3.156 1.00 0.00 O ATOM 2055 CB VAL A 133 8.061 -8.897 -2.266 1.00 0.00 C ATOM 2056 CG1 VAL A 133 6.635 -8.612 -1.814 1.00 0.00 C ATOM 2057 CG2 VAL A 133 8.963 -7.755 -1.868 1.00 0.00 C ATOM 0 H VAL A 133 10.076 -10.640 -3.044 1.00 0.00 H new ATOM 0 HA VAL A 133 8.602 -10.128 -0.557 1.00 0.00 H new ATOM 0 HB VAL A 133 8.061 -9.001 -3.351 1.00 0.00 H new ATOM 0 HG11 VAL A 133 6.291 -7.680 -2.262 1.00 0.00 H new ATOM 0 HG12 VAL A 133 5.984 -9.428 -2.128 1.00 0.00 H new ATOM 0 HG13 VAL A 133 6.608 -8.524 -0.728 1.00 0.00 H new ATOM 0 HG21 VAL A 133 8.591 -6.828 -2.305 1.00 0.00 H new ATOM 0 HG22 VAL A 133 8.977 -7.664 -0.782 1.00 0.00 H new ATOM 0 HG23 VAL A 133 9.973 -7.947 -2.229 1.00 0.00 H new ATOM 2067 N ARG A 134 6.954 -11.864 -1.031 1.00 0.00 N ATOM 2068 CA ARG A 134 5.910 -12.864 -1.213 1.00 0.00 C ATOM 2069 C ARG A 134 4.647 -12.268 -0.679 1.00 0.00 C ATOM 2070 O ARG A 134 3.671 -12.064 -1.388 1.00 0.00 O ATOM 2071 CB ARG A 134 6.228 -14.157 -0.444 1.00 0.00 C ATOM 2072 CG ARG A 134 7.408 -14.937 -0.970 1.00 0.00 C ATOM 2073 CD ARG A 134 7.138 -15.427 -2.375 1.00 0.00 C ATOM 2074 NE ARG A 134 8.235 -16.229 -2.916 1.00 0.00 N ATOM 2075 CZ ARG A 134 8.289 -16.650 -4.183 1.00 0.00 C ATOM 2076 NH1 ARG A 134 7.286 -16.364 -5.015 1.00 0.00 N ATOM 2077 NH2 ARG A 134 9.321 -17.377 -4.610 1.00 0.00 N ATOM 0 H ARG A 134 7.087 -11.586 -0.059 1.00 0.00 H new ATOM 0 HA ARG A 134 5.826 -13.126 -2.268 1.00 0.00 H new ATOM 0 HB2 ARG A 134 6.414 -13.905 0.600 1.00 0.00 H new ATOM 0 HB3 ARG A 134 5.348 -14.800 -0.464 1.00 0.00 H new ATOM 0 HG2 ARG A 134 8.299 -14.309 -0.963 1.00 0.00 H new ATOM 0 HG3 ARG A 134 7.611 -15.785 -0.316 1.00 0.00 H new ATOM 0 HD2 ARG A 134 6.224 -16.021 -2.378 1.00 0.00 H new ATOM 0 HD3 ARG A 134 6.964 -14.571 -3.027 1.00 0.00 H new ATOM 0 HE ARG A 134 9.001 -16.481 -2.292 1.00 0.00 H new ATOM 0 HH11 ARG A 134 6.485 -15.827 -4.683 1.00 0.00 H new ATOM 0 HH12 ARG A 134 7.320 -16.682 -5.984 1.00 0.00 H new ATOM 0 HH21 ARG A 134 10.077 -17.616 -3.968 1.00 0.00 H new ATOM 0 HH22 ARG A 134 9.355 -17.695 -5.579 1.00 0.00 H new ATOM 2091 N SER A 135 4.691 -11.976 0.569 1.00 0.00 N ATOM 2092 CA SER A 135 3.662 -11.305 1.235 1.00 0.00 C ATOM 2093 C SER A 135 4.233 -9.992 1.702 1.00 0.00 C ATOM 2094 O SER A 135 5.454 -9.881 1.886 1.00 0.00 O ATOM 2095 CB SER A 135 3.189 -12.164 2.398 1.00 0.00 C ATOM 2096 OG SER A 135 4.282 -12.560 3.208 1.00 0.00 O ATOM 0 H SER A 135 5.481 -12.212 1.169 1.00 0.00 H new ATOM 0 HA SER A 135 2.800 -11.120 0.594 1.00 0.00 H new ATOM 0 HB2 SER A 135 2.469 -11.607 2.998 1.00 0.00 H new ATOM 0 HB3 SER A 135 2.673 -13.046 2.018 1.00 0.00 H new ATOM 0 HG SER A 135 3.974 -12.698 4.128 1.00 0.00 H new ATOM 2102 N LEU A 136 3.421 -9.012 1.840 1.00 0.00 N ATOM 2103 CA LEU A 136 3.887 -7.745 2.262 1.00 0.00 C ATOM 2104 C LEU A 136 2.956 -7.172 3.292 1.00 0.00 C ATOM 2105 O LEU A 136 1.749 -7.044 3.060 1.00 0.00 O ATOM 2106 CB LEU A 136 4.016 -6.810 1.058 1.00 0.00 C ATOM 2107 CG LEU A 136 4.604 -5.423 1.321 1.00 0.00 C ATOM 2108 CD1 LEU A 136 6.025 -5.529 1.854 1.00 0.00 C ATOM 2109 CD2 LEU A 136 4.580 -4.601 0.050 1.00 0.00 C ATOM 0 H LEU A 136 2.418 -9.064 1.664 1.00 0.00 H new ATOM 0 HA LEU A 136 4.871 -7.855 2.717 1.00 0.00 H new ATOM 0 HB2 LEU A 136 4.634 -7.304 0.309 1.00 0.00 H new ATOM 0 HB3 LEU A 136 3.026 -6.682 0.620 1.00 0.00 H new ATOM 0 HG LEU A 136 3.994 -4.928 2.077 1.00 0.00 H new ATOM 0 HD11 LEU A 136 6.422 -4.530 2.033 1.00 0.00 H new ATOM 0 HD12 LEU A 136 6.022 -6.091 2.788 1.00 0.00 H new ATOM 0 HD13 LEU A 136 6.650 -6.042 1.123 1.00 0.00 H new ATOM 0 HD21 LEU A 136 5.001 -3.615 0.247 1.00 0.00 H new ATOM 0 HD22 LEU A 136 5.171 -5.101 -0.718 1.00 0.00 H new ATOM 0 HD23 LEU A 136 3.552 -4.495 -0.295 1.00 0.00 H new ATOM 2121 N THR A 137 3.502 -6.877 4.419 1.00 0.00 N ATOM 2122 CA THR A 137 2.797 -6.246 5.467 1.00 0.00 C ATOM 2123 C THR A 137 3.025 -4.741 5.325 1.00 0.00 C ATOM 2124 O THR A 137 4.158 -4.257 5.445 1.00 0.00 O ATOM 2125 CB THR A 137 3.314 -6.744 6.841 1.00 0.00 C ATOM 2126 OG1 THR A 137 3.150 -8.177 6.938 1.00 0.00 O ATOM 2127 CG2 THR A 137 2.567 -6.080 7.980 1.00 0.00 C ATOM 0 H THR A 137 4.478 -7.075 4.639 1.00 0.00 H new ATOM 0 HA THR A 137 1.734 -6.480 5.412 1.00 0.00 H new ATOM 0 HB THR A 137 4.370 -6.484 6.917 1.00 0.00 H new ATOM 0 HG1 THR A 137 3.480 -8.486 7.808 1.00 0.00 H new ATOM 0 HG21 THR A 137 2.951 -6.449 8.931 1.00 0.00 H new ATOM 0 HG22 THR A 137 2.707 -5.000 7.926 1.00 0.00 H new ATOM 0 HG23 THR A 137 1.505 -6.313 7.903 1.00 0.00 H new ATOM 2135 N ILE A 138 1.981 -4.033 5.021 1.00 0.00 N ATOM 2136 CA ILE A 138 2.050 -2.612 4.817 1.00 0.00 C ATOM 2137 C ILE A 138 1.462 -1.915 6.025 1.00 0.00 C ATOM 2138 O ILE A 138 0.275 -2.077 6.331 1.00 0.00 O ATOM 2139 CB ILE A 138 1.248 -2.191 3.549 1.00 0.00 C ATOM 2140 CG1 ILE A 138 1.769 -2.943 2.311 1.00 0.00 C ATOM 2141 CG2 ILE A 138 1.341 -0.673 3.335 1.00 0.00 C ATOM 2142 CD1 ILE A 138 1.004 -2.645 1.033 1.00 0.00 C ATOM 0 H ILE A 138 1.047 -4.425 4.906 1.00 0.00 H new ATOM 0 HA ILE A 138 3.093 -2.329 4.678 1.00 0.00 H new ATOM 0 HB ILE A 138 0.201 -2.454 3.698 1.00 0.00 H new ATOM 0 HG12 ILE A 138 2.818 -2.689 2.161 1.00 0.00 H new ATOM 0 HG13 ILE A 138 1.725 -4.015 2.506 1.00 0.00 H new ATOM 0 HG21 ILE A 138 0.776 -0.396 2.445 1.00 0.00 H new ATOM 0 HG22 ILE A 138 0.929 -0.157 4.202 1.00 0.00 H new ATOM 0 HG23 ILE A 138 2.385 -0.387 3.205 1.00 0.00 H new ATOM 0 HD11 ILE A 138 1.435 -3.215 0.210 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -0.041 -2.926 1.161 1.00 0.00 H new ATOM 0 HD13 ILE A 138 1.069 -1.580 0.810 1.00 0.00 H new ATOM 2154 N PHE A 139 2.274 -1.170 6.712 1.00 0.00 N ATOM 2155 CA PHE A 139 1.826 -0.453 7.852 1.00 0.00 C ATOM 2156 C PHE A 139 1.924 1.033 7.628 1.00 0.00 C ATOM 2157 O PHE A 139 3.022 1.604 7.570 1.00 0.00 O ATOM 2158 CB PHE A 139 2.593 -0.845 9.123 1.00 0.00 C ATOM 2159 CG PHE A 139 2.132 -0.068 10.330 1.00 0.00 C ATOM 2160 CD1 PHE A 139 0.846 -0.233 10.823 1.00 0.00 C ATOM 2161 CD2 PHE A 139 2.963 0.849 10.943 1.00 0.00 C ATOM 2162 CE1 PHE A 139 0.403 0.493 11.905 1.00 0.00 C ATOM 2163 CE2 PHE A 139 2.523 1.580 12.024 1.00 0.00 C ATOM 2164 CZ PHE A 139 1.241 1.403 12.504 1.00 0.00 C ATOM 0 H PHE A 139 3.263 -1.046 6.493 1.00 0.00 H new ATOM 0 HA PHE A 139 0.780 -0.722 8.000 1.00 0.00 H new ATOM 0 HB2 PHE A 139 2.464 -1.911 9.309 1.00 0.00 H new ATOM 0 HB3 PHE A 139 3.659 -0.675 8.969 1.00 0.00 H new ATOM 0 HD1 PHE A 139 0.182 -0.942 10.351 1.00 0.00 H new ATOM 0 HD2 PHE A 139 3.967 0.994 10.571 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -0.599 0.348 12.282 1.00 0.00 H new ATOM 0 HE2 PHE A 139 3.182 2.293 12.497 1.00 0.00 H new ATOM 0 HZ PHE A 139 0.897 1.979 13.350 1.00 0.00 H new ATOM 2174 N ILE A 140 0.807 1.655 7.481 1.00 0.00 N ATOM 2175 CA ILE A 140 0.792 3.086 7.415 1.00 0.00 C ATOM 2176 C ILE A 140 0.649 3.638 8.813 1.00 0.00 C ATOM 2177 O ILE A 140 -0.366 3.445 9.489 1.00 0.00 O ATOM 2178 CB ILE A 140 -0.217 3.675 6.399 1.00 0.00 C ATOM 2179 CG1 ILE A 140 -1.575 3.016 6.512 1.00 0.00 C ATOM 2180 CG2 ILE A 140 0.330 3.597 4.983 1.00 0.00 C ATOM 2181 CD1 ILE A 140 -2.602 3.547 5.526 1.00 0.00 C ATOM 0 H ILE A 140 -0.105 1.206 7.404 1.00 0.00 H new ATOM 0 HA ILE A 140 1.747 3.414 7.005 1.00 0.00 H new ATOM 0 HB ILE A 140 -0.356 4.728 6.643 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -1.461 1.943 6.360 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -1.952 3.156 7.525 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -0.397 4.017 4.288 1.00 0.00 H new ATOM 0 HG22 ILE A 140 1.260 4.162 4.920 1.00 0.00 H new ATOM 0 HG23 ILE A 140 0.520 2.556 4.723 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -3.548 3.025 5.670 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -2.747 4.614 5.692 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -2.248 3.383 4.508 1.00 0.00 H new ATOM 2193 N GLU A 141 1.689 4.300 9.233 1.00 0.00 N ATOM 2194 CA GLU A 141 1.879 4.705 10.605 1.00 0.00 C ATOM 2195 C GLU A 141 1.206 6.026 10.933 1.00 0.00 C ATOM 2196 O GLU A 141 0.614 6.168 12.007 1.00 0.00 O ATOM 2197 CB GLU A 141 3.388 4.791 10.855 1.00 0.00 C ATOM 2198 CG GLU A 141 3.820 5.148 12.262 1.00 0.00 C ATOM 2199 CD GLU A 141 5.323 5.221 12.364 1.00 0.00 C ATOM 2200 OE1 GLU A 141 5.978 4.157 12.424 1.00 0.00 O ATOM 2201 OE2 GLU A 141 5.877 6.344 12.372 1.00 0.00 O ATOM 0 H GLU A 141 2.451 4.583 8.617 1.00 0.00 H new ATOM 0 HA GLU A 141 1.411 3.968 11.258 1.00 0.00 H new ATOM 0 HB2 GLU A 141 3.832 3.830 10.595 1.00 0.00 H new ATOM 0 HB3 GLU A 141 3.806 5.531 10.172 1.00 0.00 H new ATOM 0 HG2 GLU A 141 3.386 6.106 12.547 1.00 0.00 H new ATOM 0 HG3 GLU A 141 3.440 4.404 12.963 1.00 0.00 H new ATOM 2208 N ALA A 142 1.278 6.984 10.024 1.00 0.00 N ATOM 2209 CA ALA A 142 0.754 8.307 10.311 1.00 0.00 C ATOM 2210 C ALA A 142 0.372 9.040 9.051 1.00 0.00 C ATOM 2211 O ALA A 142 0.962 8.821 7.984 1.00 0.00 O ATOM 2212 CB ALA A 142 1.778 9.120 11.097 1.00 0.00 C ATOM 0 H ALA A 142 1.687 6.873 9.096 1.00 0.00 H new ATOM 0 HA ALA A 142 -0.147 8.182 10.911 1.00 0.00 H new ATOM 0 HB1 ALA A 142 1.373 10.110 11.306 1.00 0.00 H new ATOM 0 HB2 ALA A 142 2.001 8.614 12.036 1.00 0.00 H new ATOM 0 HB3 ALA A 142 2.692 9.218 10.511 1.00 0.00 H new ATOM 2218 N ASN A 143 -0.603 9.907 9.173 1.00 0.00 N ATOM 2219 CA ASN A 143 -1.056 10.717 8.068 1.00 0.00 C ATOM 2220 C ASN A 143 -0.305 12.000 8.054 1.00 0.00 C ATOM 2221 O ASN A 143 0.161 12.457 9.095 1.00 0.00 O ATOM 2222 CB ASN A 143 -2.555 10.999 8.140 1.00 0.00 C ATOM 2223 CG ASN A 143 -3.378 9.750 8.051 1.00 0.00 C ATOM 2224 OD1 ASN A 143 -2.977 8.776 7.434 1.00 0.00 O ATOM 2225 ND2 ASN A 143 -4.539 9.770 8.645 1.00 0.00 N ATOM 0 H ASN A 143 -1.107 10.072 10.044 1.00 0.00 H new ATOM 0 HA ASN A 143 -0.870 10.161 7.149 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -2.780 11.513 9.074 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -2.834 11.673 7.330 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -5.147 8.952 8.604 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -4.839 10.603 9.151 1.00 0.00 H new ATOM 2232 N GLN A 144 -0.212 12.590 6.894 1.00 0.00 N ATOM 2233 CA GLN A 144 0.543 13.790 6.670 1.00 0.00 C ATOM 2234 C GLN A 144 0.069 14.948 7.553 1.00 0.00 C ATOM 2235 O GLN A 144 0.879 15.744 8.038 1.00 0.00 O ATOM 2236 CB GLN A 144 0.436 14.125 5.203 1.00 0.00 C ATOM 2237 CG GLN A 144 1.419 15.131 4.708 1.00 0.00 C ATOM 2238 CD GLN A 144 1.489 15.076 3.221 1.00 0.00 C ATOM 2239 OE1 GLN A 144 0.798 15.796 2.510 1.00 0.00 O ATOM 2240 NE2 GLN A 144 2.282 14.164 2.738 1.00 0.00 N ATOM 0 H GLN A 144 -0.673 12.238 6.055 1.00 0.00 H new ATOM 0 HA GLN A 144 1.585 13.627 6.946 1.00 0.00 H new ATOM 0 HB2 GLN A 144 0.558 13.207 4.627 1.00 0.00 H new ATOM 0 HB3 GLN A 144 -0.570 14.495 5.004 1.00 0.00 H new ATOM 0 HG2 GLN A 144 1.126 16.130 5.031 1.00 0.00 H new ATOM 0 HG3 GLN A 144 2.402 14.934 5.135 1.00 0.00 H new ATOM 0 HE21 GLN A 144 2.839 13.587 3.368 1.00 0.00 H new ATOM 0 HE22 GLN A 144 2.346 14.026 1.729 1.00 0.00 H new ATOM 2249 N SER A 145 -1.217 15.024 7.780 1.00 0.00 N ATOM 2250 CA SER A 145 -1.763 16.079 8.605 1.00 0.00 C ATOM 2251 C SER A 145 -2.130 15.566 10.013 1.00 0.00 C ATOM 2252 O SER A 145 -2.436 16.358 10.903 1.00 0.00 O ATOM 2253 CB SER A 145 -2.986 16.686 7.906 1.00 0.00 C ATOM 2254 OG SER A 145 -3.557 17.770 8.631 1.00 0.00 O ATOM 0 H SER A 145 -1.907 14.371 7.408 1.00 0.00 H new ATOM 0 HA SER A 145 -1.003 16.849 8.736 1.00 0.00 H new ATOM 0 HB2 SER A 145 -2.697 17.032 6.914 1.00 0.00 H new ATOM 0 HB3 SER A 145 -3.740 15.911 7.767 1.00 0.00 H new ATOM 0 HG SER A 145 -3.419 17.630 9.591 1.00 0.00 H new ATOM 2260 N GLY A 146 -2.052 14.248 10.221 1.00 0.00 N ATOM 2261 CA GLY A 146 -2.493 13.679 11.492 1.00 0.00 C ATOM 2262 C GLY A 146 -3.972 13.951 11.701 1.00 0.00 C ATOM 2263 O GLY A 146 -4.381 14.527 12.705 1.00 0.00 O ATOM 0 H GLY A 146 -1.697 13.573 9.544 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -2.308 12.605 11.502 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -1.917 14.109 12.311 1.00 0.00 H new ATOM 2267 N SER A 147 -4.751 13.518 10.748 1.00 0.00 N ATOM 2268 CA SER A 147 -6.157 13.827 10.646 1.00 0.00 C ATOM 2269 C SER A 147 -7.073 12.861 11.409 1.00 0.00 C ATOM 2270 O SER A 147 -8.302 13.026 11.380 1.00 0.00 O ATOM 2271 CB SER A 147 -6.489 13.777 9.180 1.00 0.00 C ATOM 2272 OG SER A 147 -6.004 12.543 8.632 1.00 0.00 O ATOM 0 H SER A 147 -4.416 12.919 9.993 1.00 0.00 H new ATOM 0 HA SER A 147 -6.331 14.803 11.099 1.00 0.00 H new ATOM 0 HB2 SER A 147 -7.567 13.855 9.035 1.00 0.00 H new ATOM 0 HB3 SER A 147 -6.036 14.622 8.662 1.00 0.00 H new ATOM 0 HG SER A 147 -6.762 11.961 8.416 1.00 0.00 H new ATOM 2278 N GLU A 148 -6.488 11.843 12.046 1.00 0.00 N ATOM 2279 CA GLU A 148 -7.232 10.777 12.781 1.00 0.00 C ATOM 2280 C GLU A 148 -7.954 9.813 11.826 1.00 0.00 C ATOM 2281 O GLU A 148 -8.047 8.620 12.086 1.00 0.00 O ATOM 2282 CB GLU A 148 -8.205 11.334 13.825 1.00 0.00 C ATOM 2283 CG GLU A 148 -7.547 12.142 14.919 1.00 0.00 C ATOM 2284 CD GLU A 148 -8.540 12.622 15.938 1.00 0.00 C ATOM 2285 OE1 GLU A 148 -8.885 11.847 16.847 1.00 0.00 O ATOM 2286 OE2 GLU A 148 -8.997 13.780 15.848 1.00 0.00 O ATOM 0 H GLU A 148 -5.476 11.721 12.075 1.00 0.00 H new ATOM 0 HA GLU A 148 -6.472 10.213 13.322 1.00 0.00 H new ATOM 0 HB2 GLU A 148 -8.942 11.959 13.321 1.00 0.00 H new ATOM 0 HB3 GLU A 148 -8.747 10.504 14.278 1.00 0.00 H new ATOM 0 HG2 GLU A 148 -6.787 11.535 15.411 1.00 0.00 H new ATOM 0 HG3 GLU A 148 -7.036 12.998 14.480 1.00 0.00 H new ATOM 2293 N VAL A 149 -8.477 10.334 10.751 1.00 0.00 N ATOM 2294 CA VAL A 149 -9.089 9.532 9.732 1.00 0.00 C ATOM 2295 C VAL A 149 -8.186 9.466 8.531 1.00 0.00 C ATOM 2296 O VAL A 149 -7.846 10.494 7.926 1.00 0.00 O ATOM 2297 CB VAL A 149 -10.495 10.048 9.317 1.00 0.00 C ATOM 2298 CG1 VAL A 149 -11.045 9.247 8.136 1.00 0.00 C ATOM 2299 CG2 VAL A 149 -11.446 9.926 10.482 1.00 0.00 C ATOM 0 H VAL A 149 -8.490 11.335 10.557 1.00 0.00 H new ATOM 0 HA VAL A 149 -9.233 8.535 10.149 1.00 0.00 H new ATOM 0 HB VAL A 149 -10.400 11.092 9.019 1.00 0.00 H new ATOM 0 HG11 VAL A 149 -12.030 9.628 7.865 1.00 0.00 H new ATOM 0 HG12 VAL A 149 -10.371 9.345 7.285 1.00 0.00 H new ATOM 0 HG13 VAL A 149 -11.126 8.197 8.415 1.00 0.00 H new ATOM 0 HG21 VAL A 149 -12.431 10.289 10.187 1.00 0.00 H new ATOM 0 HG22 VAL A 149 -11.519 8.881 10.784 1.00 0.00 H new ATOM 0 HG23 VAL A 149 -11.076 10.520 11.318 1.00 0.00 H new ATOM 2309 N THR A 150 -7.772 8.286 8.221 1.00 0.00 N ATOM 2310 CA THR A 150 -6.957 8.040 7.088 1.00 0.00 C ATOM 2311 C THR A 150 -7.867 7.678 5.938 1.00 0.00 C ATOM 2312 O THR A 150 -8.497 6.631 5.963 1.00 0.00 O ATOM 2313 CB THR A 150 -6.031 6.855 7.384 1.00 0.00 C ATOM 2314 OG1 THR A 150 -5.312 7.121 8.590 1.00 0.00 O ATOM 2315 CG2 THR A 150 -5.050 6.629 6.248 1.00 0.00 C ATOM 0 H THR A 150 -7.997 7.450 8.761 1.00 0.00 H new ATOM 0 HA THR A 150 -6.357 8.918 6.846 1.00 0.00 H new ATOM 0 HB THR A 150 -6.637 5.955 7.492 1.00 0.00 H new ATOM 0 HG1 THR A 150 -4.935 6.286 8.937 1.00 0.00 H new ATOM 0 HG21 THR A 150 -4.406 5.782 6.486 1.00 0.00 H new ATOM 0 HG22 THR A 150 -5.599 6.421 5.329 1.00 0.00 H new ATOM 0 HG23 THR A 150 -4.440 7.522 6.111 1.00 0.00 H new ATOM 2323 N LYS A 151 -7.961 8.541 4.960 1.00 0.00 N ATOM 2324 CA LYS A 151 -8.809 8.288 3.824 1.00 0.00 C ATOM 2325 C LYS A 151 -7.994 8.251 2.559 1.00 0.00 C ATOM 2326 O LYS A 151 -7.109 9.084 2.352 1.00 0.00 O ATOM 2327 CB LYS A 151 -9.971 9.295 3.753 1.00 0.00 C ATOM 2328 CG LYS A 151 -9.556 10.749 3.665 1.00 0.00 C ATOM 2329 CD LYS A 151 -10.736 11.730 3.833 1.00 0.00 C ATOM 2330 CE LYS A 151 -11.771 11.733 2.691 1.00 0.00 C ATOM 2331 NZ LYS A 151 -12.578 10.492 2.559 1.00 0.00 N ATOM 0 H LYS A 151 -7.459 9.428 4.927 1.00 0.00 H new ATOM 0 HA LYS A 151 -9.267 7.306 3.943 1.00 0.00 H new ATOM 0 HB2 LYS A 151 -10.586 9.056 2.886 1.00 0.00 H new ATOM 0 HB3 LYS A 151 -10.599 9.165 4.635 1.00 0.00 H new ATOM 0 HG2 LYS A 151 -8.810 10.954 4.432 1.00 0.00 H new ATOM 0 HG3 LYS A 151 -9.079 10.926 2.701 1.00 0.00 H new ATOM 0 HD2 LYS A 151 -11.251 11.494 4.764 1.00 0.00 H new ATOM 0 HD3 LYS A 151 -10.334 12.738 3.937 1.00 0.00 H new ATOM 0 HE2 LYS A 151 -12.449 12.573 2.840 1.00 0.00 H new ATOM 0 HE3 LYS A 151 -11.249 11.908 1.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 -12.423 10.075 1.619 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 -12.291 9.811 3.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 -13.586 10.720 2.675 1.00 0.00 H new ATOM 2345 N VAL A 152 -8.270 7.285 1.736 1.00 0.00 N ATOM 2346 CA VAL A 152 -7.514 7.069 0.540 1.00 0.00 C ATOM 2347 C VAL A 152 -8.440 6.637 -0.593 1.00 0.00 C ATOM 2348 O VAL A 152 -9.493 6.026 -0.347 1.00 0.00 O ATOM 2349 CB VAL A 152 -6.395 6.016 0.784 1.00 0.00 C ATOM 2350 CG1 VAL A 152 -6.968 4.652 1.157 1.00 0.00 C ATOM 2351 CG2 VAL A 152 -5.468 5.918 -0.403 1.00 0.00 C ATOM 0 H VAL A 152 -9.031 6.620 1.876 1.00 0.00 H new ATOM 0 HA VAL A 152 -7.033 8.004 0.251 1.00 0.00 H new ATOM 0 HB VAL A 152 -5.809 6.360 1.636 1.00 0.00 H new ATOM 0 HG11 VAL A 152 -6.153 3.947 1.319 1.00 0.00 H new ATOM 0 HG12 VAL A 152 -7.556 4.742 2.070 1.00 0.00 H new ATOM 0 HG13 VAL A 152 -7.605 4.292 0.349 1.00 0.00 H new ATOM 0 HG21 VAL A 152 -4.697 5.174 -0.202 1.00 0.00 H new ATOM 0 HG22 VAL A 152 -6.036 5.623 -1.285 1.00 0.00 H new ATOM 0 HG23 VAL A 152 -5.000 6.886 -0.580 1.00 0.00 H new ATOM 2361 N GLN A 153 -8.085 7.008 -1.810 1.00 0.00 N ATOM 2362 CA GLN A 153 -8.876 6.689 -2.970 1.00 0.00 C ATOM 2363 C GLN A 153 -8.219 5.630 -3.871 1.00 0.00 C ATOM 2364 O GLN A 153 -8.912 4.860 -4.497 1.00 0.00 O ATOM 2365 CB GLN A 153 -9.128 7.949 -3.778 1.00 0.00 C ATOM 2366 CG GLN A 153 -9.825 9.037 -2.997 1.00 0.00 C ATOM 2367 CD GLN A 153 -10.022 10.302 -3.799 1.00 0.00 C ATOM 2368 OE1 GLN A 153 -10.171 10.269 -5.017 1.00 0.00 O ATOM 2369 NE2 GLN A 153 -10.028 11.409 -3.132 1.00 0.00 N ATOM 0 H GLN A 153 -7.239 7.539 -2.015 1.00 0.00 H new ATOM 0 HA GLN A 153 -9.814 6.269 -2.608 1.00 0.00 H new ATOM 0 HB2 GLN A 153 -8.176 8.331 -4.147 1.00 0.00 H new ATOM 0 HB3 GLN A 153 -9.730 7.697 -4.651 1.00 0.00 H new ATOM 0 HG2 GLN A 153 -10.795 8.671 -2.661 1.00 0.00 H new ATOM 0 HG3 GLN A 153 -9.243 9.266 -2.104 1.00 0.00 H new ATOM 0 HE21 GLN A 153 -9.901 11.395 -2.120 1.00 0.00 H new ATOM 0 HE22 GLN A 153 -10.160 12.296 -3.618 1.00 0.00 H new ATOM 2378 N LYS A 154 -6.889 5.594 -3.946 1.00 0.00 N ATOM 2379 CA LYS A 154 -6.232 4.667 -4.888 1.00 0.00 C ATOM 2380 C LYS A 154 -4.816 4.331 -4.419 1.00 0.00 C ATOM 2381 O LYS A 154 -3.971 5.205 -4.352 1.00 0.00 O ATOM 2382 CB LYS A 154 -6.214 5.355 -6.293 1.00 0.00 C ATOM 2383 CG LYS A 154 -5.783 4.522 -7.524 1.00 0.00 C ATOM 2384 CD LYS A 154 -4.290 4.165 -7.588 1.00 0.00 C ATOM 2385 CE LYS A 154 -3.996 3.451 -8.920 1.00 0.00 C ATOM 2386 NZ LYS A 154 -2.567 3.139 -9.105 1.00 0.00 N ATOM 0 H LYS A 154 -6.257 6.171 -3.390 1.00 0.00 H new ATOM 0 HA LYS A 154 -6.779 3.725 -4.940 1.00 0.00 H new ATOM 0 HB2 LYS A 154 -7.217 5.736 -6.487 1.00 0.00 H new ATOM 0 HB3 LYS A 154 -5.551 6.218 -6.230 1.00 0.00 H new ATOM 0 HG2 LYS A 154 -6.361 3.598 -7.537 1.00 0.00 H new ATOM 0 HG3 LYS A 154 -6.046 5.075 -8.426 1.00 0.00 H new ATOM 0 HD2 LYS A 154 -3.684 5.067 -7.504 1.00 0.00 H new ATOM 0 HD3 LYS A 154 -4.022 3.522 -6.750 1.00 0.00 H new ATOM 0 HE2 LYS A 154 -4.572 2.527 -8.965 1.00 0.00 H new ATOM 0 HE3 LYS A 154 -4.335 4.079 -9.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 -2.187 3.706 -9.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 -2.047 3.362 -8.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 -2.458 2.128 -9.324 1.00 0.00 H new ATOM 2400 N ILE A 155 -4.565 3.073 -4.097 1.00 0.00 N ATOM 2401 CA ILE A 155 -3.221 2.636 -3.699 1.00 0.00 C ATOM 2402 C ILE A 155 -2.743 1.516 -4.616 1.00 0.00 C ATOM 2403 O ILE A 155 -3.455 0.540 -4.827 1.00 0.00 O ATOM 2404 CB ILE A 155 -3.177 2.103 -2.237 1.00 0.00 C ATOM 2405 CG1 ILE A 155 -3.645 3.158 -1.244 1.00 0.00 C ATOM 2406 CG2 ILE A 155 -1.763 1.621 -1.875 1.00 0.00 C ATOM 2407 CD1 ILE A 155 -3.669 2.679 0.200 1.00 0.00 C ATOM 0 H ILE A 155 -5.266 2.332 -4.101 1.00 0.00 H new ATOM 0 HA ILE A 155 -2.577 3.512 -3.774 1.00 0.00 H new ATOM 0 HB ILE A 155 -3.862 1.257 -2.177 1.00 0.00 H new ATOM 0 HG12 ILE A 155 -2.991 4.027 -1.317 1.00 0.00 H new ATOM 0 HG13 ILE A 155 -4.646 3.487 -1.524 1.00 0.00 H new ATOM 0 HG21 ILE A 155 -1.756 1.253 -0.849 1.00 0.00 H new ATOM 0 HG22 ILE A 155 -1.468 0.818 -2.551 1.00 0.00 H new ATOM 0 HG23 ILE A 155 -1.061 2.450 -1.968 1.00 0.00 H new ATOM 0 HD11 ILE A 155 -4.013 3.487 0.846 1.00 0.00 H new ATOM 0 HD12 ILE A 155 -4.346 1.829 0.290 1.00 0.00 H new ATOM 0 HD13 ILE A 155 -2.665 2.377 0.500 1.00 0.00 H new ATOM 2419 N ALA A 156 -1.569 1.684 -5.187 1.00 0.00 N ATOM 2420 CA ALA A 156 -0.944 0.642 -5.979 1.00 0.00 C ATOM 2421 C ALA A 156 0.545 0.683 -5.771 1.00 0.00 C ATOM 2422 O ALA A 156 1.097 1.738 -5.467 1.00 0.00 O ATOM 2423 CB ALA A 156 -1.269 0.784 -7.448 1.00 0.00 C ATOM 0 H ALA A 156 -1.022 2.542 -5.117 1.00 0.00 H new ATOM 0 HA ALA A 156 -1.338 -0.319 -5.650 1.00 0.00 H new ATOM 0 HB1 ALA A 156 -0.782 -0.015 -8.007 1.00 0.00 H new ATOM 0 HB2 ALA A 156 -2.348 0.721 -7.590 1.00 0.00 H new ATOM 0 HB3 ALA A 156 -0.911 1.749 -7.808 1.00 0.00 H new ATOM 2429 N LEU A 157 1.188 -0.427 -5.927 1.00 0.00 N ATOM 2430 CA LEU A 157 2.621 -0.477 -5.814 1.00 0.00 C ATOM 2431 C LEU A 157 3.208 -0.729 -7.169 1.00 0.00 C ATOM 2432 O LEU A 157 2.531 -1.249 -8.047 1.00 0.00 O ATOM 2433 CB LEU A 157 3.118 -1.536 -4.803 1.00 0.00 C ATOM 2434 CG LEU A 157 2.806 -1.307 -3.306 1.00 0.00 C ATOM 2435 CD1 LEU A 157 1.322 -1.414 -2.998 1.00 0.00 C ATOM 2436 CD2 LEU A 157 3.606 -2.259 -2.448 1.00 0.00 C ATOM 0 H LEU A 157 0.746 -1.322 -6.135 1.00 0.00 H new ATOM 0 HA LEU A 157 2.954 0.486 -5.427 1.00 0.00 H new ATOM 0 HB2 LEU A 157 2.693 -2.498 -5.090 1.00 0.00 H new ATOM 0 HB3 LEU A 157 4.199 -1.620 -4.911 1.00 0.00 H new ATOM 0 HG LEU A 157 3.101 -0.285 -3.068 1.00 0.00 H new ATOM 0 HD11 LEU A 157 1.158 -1.245 -1.934 1.00 0.00 H new ATOM 0 HD12 LEU A 157 0.776 -0.666 -3.573 1.00 0.00 H new ATOM 0 HD13 LEU A 157 0.965 -2.408 -3.266 1.00 0.00 H new ATOM 0 HD21 LEU A 157 3.374 -2.084 -1.397 1.00 0.00 H new ATOM 0 HD22 LEU A 157 3.352 -3.286 -2.710 1.00 0.00 H new ATOM 0 HD23 LEU A 157 4.670 -2.095 -2.617 1.00 0.00 H new ATOM 2448 N TYR A 158 4.426 -0.333 -7.358 1.00 0.00 N ATOM 2449 CA TYR A 158 5.098 -0.536 -8.611 1.00 0.00 C ATOM 2450 C TYR A 158 6.397 -1.281 -8.422 1.00 0.00 C ATOM 2451 O TYR A 158 7.223 -0.936 -7.569 1.00 0.00 O ATOM 2452 CB TYR A 158 5.303 0.785 -9.336 1.00 0.00 C ATOM 2453 CG TYR A 158 4.003 1.445 -9.678 1.00 0.00 C ATOM 2454 CD1 TYR A 158 3.308 1.067 -10.800 1.00 0.00 C ATOM 2455 CD2 TYR A 158 3.457 2.431 -8.871 1.00 0.00 C ATOM 2456 CE1 TYR A 158 2.112 1.634 -11.113 1.00 0.00 C ATOM 2457 CE2 TYR A 158 2.252 3.012 -9.187 1.00 0.00 C ATOM 2458 CZ TYR A 158 1.585 2.602 -10.318 1.00 0.00 C ATOM 2459 OH TYR A 158 0.359 3.135 -10.642 1.00 0.00 O ATOM 0 H TYR A 158 4.987 0.141 -6.650 1.00 0.00 H new ATOM 0 HA TYR A 158 4.462 -1.159 -9.239 1.00 0.00 H new ATOM 0 HB2 TYR A 158 5.895 1.453 -8.711 1.00 0.00 H new ATOM 0 HB3 TYR A 158 5.873 0.613 -10.249 1.00 0.00 H new ATOM 0 HD1 TYR A 158 3.719 0.305 -11.446 1.00 0.00 H new ATOM 0 HD2 TYR A 158 3.985 2.747 -7.983 1.00 0.00 H new ATOM 0 HE1 TYR A 158 1.579 1.314 -11.996 1.00 0.00 H new ATOM 0 HE2 TYR A 158 1.834 3.781 -8.555 1.00 0.00 H new ATOM 0 HH TYR A 158 -0.249 2.416 -10.914 1.00 0.00 H new ATOM 2469 N GLY A 159 6.578 -2.289 -9.198 1.00 0.00 N ATOM 2470 CA GLY A 159 7.740 -3.097 -9.081 1.00 0.00 C ATOM 2471 C GLY A 159 8.252 -3.484 -10.418 1.00 0.00 C ATOM 2472 O GLY A 159 7.789 -2.969 -11.426 1.00 0.00 O ATOM 0 H GLY A 159 5.928 -2.577 -9.930 1.00 0.00 H new ATOM 0 HA2 GLY A 159 8.512 -2.555 -8.535 1.00 0.00 H new ATOM 0 HA3 GLY A 159 7.509 -3.992 -8.503 1.00 0.00 H new ATOM 2476 N SER A 160 9.196 -4.359 -10.454 1.00 0.00 N ATOM 2477 CA SER A 160 9.752 -4.789 -11.693 1.00 0.00 C ATOM 2478 C SER A 160 10.082 -6.268 -11.673 1.00 0.00 C ATOM 2479 O SER A 160 10.611 -6.799 -10.684 1.00 0.00 O ATOM 2480 CB SER A 160 10.985 -3.950 -12.030 1.00 0.00 C ATOM 2481 OG SER A 160 10.638 -2.571 -12.121 1.00 0.00 O ATOM 0 H SER A 160 9.605 -4.797 -9.628 1.00 0.00 H new ATOM 0 HA SER A 160 9.005 -4.641 -12.473 1.00 0.00 H new ATOM 0 HB2 SER A 160 11.748 -4.090 -11.264 1.00 0.00 H new ATOM 0 HB3 SER A 160 11.415 -4.286 -12.974 1.00 0.00 H new ATOM 0 HG SER A 160 11.437 -2.046 -12.336 1.00 0.00 H new ATOM 2487 N THR A 161 9.690 -6.918 -12.726 1.00 0.00 N ATOM 2488 CA THR A 161 10.000 -8.286 -12.975 1.00 0.00 C ATOM 2489 C THR A 161 11.259 -8.365 -13.841 1.00 0.00 C ATOM 2490 O THR A 161 11.163 -8.132 -15.076 1.00 0.00 O ATOM 2491 CB THR A 161 8.815 -8.970 -13.683 1.00 0.00 C ATOM 2492 OG1 THR A 161 8.417 -8.172 -14.816 1.00 0.00 O ATOM 2493 CG2 THR A 161 7.643 -9.125 -12.735 1.00 0.00 C ATOM 2494 OXT THR A 161 12.343 -8.630 -13.303 1.00 0.00 O ATOM 0 H THR A 161 9.125 -6.491 -13.460 1.00 0.00 H new ATOM 0 HA THR A 161 10.182 -8.801 -12.032 1.00 0.00 H new ATOM 0 HB THR A 161 9.125 -9.961 -14.014 1.00 0.00 H new ATOM 0 HG1 THR A 161 9.214 -7.862 -15.294 1.00 0.00 H new ATOM 0 HG21 THR A 161 6.817 -9.610 -13.254 1.00 0.00 H new ATOM 0 HG22 THR A 161 7.943 -9.734 -11.882 1.00 0.00 H new ATOM 0 HG23 THR A 161 7.325 -8.143 -12.386 1.00 0.00 H new TER 2502 THR A 161