USER MOD reduce.3.24.130724 H: found=0, std=0, add=1129, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1127 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 22 SER OG : rot 91:sc= 0.228 USER MOD Set 1.2: A 66 GLN : amide:sc= 1.05 K(o=1.3,f=-0.17) USER MOD Set 2.1: A 1 SER N :NH3+ -121:sc= 0.0843 (180deg=-8.01e-05) USER MOD Set 2.2: A 38 MET CE :methyl -168:sc= -0.139 (180deg=-0.515) USER MOD Single : A 1 SER OG : rot -81:sc= 0.677 USER MOD Single : A 3 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 5 THR OG1 : rot -7:sc= 1.4 USER MOD Single : A 6 THR OG1 : rot -16:sc= 0.615 USER MOD Single : A 7 LYS NZ :NH3+ -171:sc=-0.00388 (180deg=-0.0956) USER MOD Single : A 9 ASN : amide:sc= -0.0663 K(o=-0.066,f=-1.8!) USER MOD Single : A 10 THR OG1 : rot -79:sc= 1.18 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 17 SER OG : rot -150:sc= 1.26 USER MOD Single : A 19 SER OG : rot -26:sc= 0.22 USER MOD Single : A 20 SER OG : rot 58:sc= 1.2 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 29 TYR OH : rot 180:sc= 0.109 USER MOD Single : A 34 LYS NZ :NH3+ -179:sc= 0.781 (180deg=0.781) USER MOD Single : A 40 LYS NZ :NH3+ -125:sc= 0.147 (180deg=0) USER MOD Single : A 42 TYR OH : rot 173:sc= 0.615 USER MOD Single : A 43 MET CE :methyl -165:sc= -0.211 (180deg=-0.731) USER MOD Single : A 47 SER OG : rot 180:sc= -0.128 USER MOD Single : A 49 ASN : amide:sc=-0.00603 K(o=-0.006,f=-0.88) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 169:sc= 1.16 (180deg=1.09) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 MET CE :methyl -129:sc= -0.0418 (180deg=-0.343) USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 62 HIS : no HD1:sc= -0.138 K(o=-0.14,f=-1.3) USER MOD Single : A 65 GLN : amide:sc= 0.886 K(o=0.89,f=-7.4!) USER MOD Single : A 68 LYS NZ :NH3+ 176:sc= 1.31 (180deg=1.24) USER MOD Single : A 70 GLN : amide:sc= -0.091 X(o=-0.091,f=-0.15) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 GLN : amide:sc= -0.152 X(o=-0.15,f=-0.26) USER MOD Single : A 76 GLN : amide:sc= 0.75 K(o=0.75,f=0) USER MOD Single : A 78 SER OG : rot 99:sc= 1.26 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 ASN : amide:sc= -0.156 K(o=-0.16,f=-1.4!) USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 SER OG : rot -37:sc= 1.2 USER MOD Single : A 107 ASN : amide:sc= -0.0519 K(o=-0.052,f=-1.5!) USER MOD Single : A 110 LYS NZ :NH3+ -174:sc= 1.19 (180deg=1.12) USER MOD Single : A 113 ASN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 116 SER OG : rot 180:sc= -0.412 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 GLN : amide:sc= 0.0913 X(o=0.091,f=-0.041) USER MOD Single : A 121 ASN : amide:sc= -0.0738 K(o=-0.074,f=-1.6!) USER MOD Single : A 126 SER OG : rot 81:sc= 1.3 USER MOD Single : A 133 HIS : no HD1:sc=-0.00356 X(o=-0.0036,f=-0.0036) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 1.285 -0.064 -0.048 1.00 0.00 N ATOM 2 CA SER A 1 1.900 0.559 1.118 1.00 0.00 C ATOM 3 C SER A 1 2.121 2.049 0.895 1.00 0.00 C ATOM 4 O SER A 1 2.018 2.540 -0.229 1.00 0.00 O ATOM 5 CB SER A 1 3.221 -0.116 1.433 1.00 0.00 C ATOM 6 OG SER A 1 4.175 0.162 0.445 1.00 0.00 O ATOM 0 H1 SER A 1 0.381 -0.498 0.227 1.00 0.00 H new ATOM 0 H2 SER A 1 1.115 0.657 -0.778 1.00 0.00 H new ATOM 0 H3 SER A 1 1.920 -0.796 -0.426 1.00 0.00 H new ATOM 0 HA SER A 1 1.221 0.438 1.962 1.00 0.00 H new ATOM 0 HB2 SER A 1 3.586 0.225 2.402 1.00 0.00 H new ATOM 0 HB3 SER A 1 3.074 -1.193 1.509 1.00 0.00 H new ATOM 0 HG SER A 1 4.036 -0.433 -0.321 1.00 0.00 H new ATOM 14 N GLU A 2 2.425 2.765 1.972 1.00 0.00 N ATOM 15 CA GLU A 2 2.735 4.187 1.885 1.00 0.00 C ATOM 16 C GLU A 2 4.031 4.422 1.119 1.00 0.00 C ATOM 17 O GLU A 2 4.165 5.409 0.395 1.00 0.00 O ATOM 18 CB GLU A 2 2.841 4.797 3.284 1.00 0.00 C ATOM 19 CG GLU A 2 1.520 4.877 4.037 1.00 0.00 C ATOM 20 CD GLU A 2 1.671 5.429 5.427 1.00 0.00 C ATOM 21 OE1 GLU A 2 2.785 5.589 5.864 1.00 0.00 O ATOM 22 OE2 GLU A 2 0.670 5.690 6.052 1.00 0.00 O ATOM 0 H GLU A 2 2.463 2.383 2.917 1.00 0.00 H new ATOM 0 HA GLU A 2 1.923 4.672 1.344 1.00 0.00 H new ATOM 0 HB2 GLU A 2 3.545 4.208 3.872 1.00 0.00 H new ATOM 0 HB3 GLU A 2 3.258 5.800 3.199 1.00 0.00 H new ATOM 0 HG2 GLU A 2 0.826 5.503 3.477 1.00 0.00 H new ATOM 0 HG3 GLU A 2 1.079 3.882 4.093 1.00 0.00 H new ATOM 29 N GLN A 3 4.983 3.511 1.284 1.00 0.00 N ATOM 30 CA GLN A 3 6.238 3.571 0.542 1.00 0.00 C ATOM 31 C GLN A 3 5.995 3.480 -0.959 1.00 0.00 C ATOM 32 O GLN A 3 6.501 4.296 -1.729 1.00 0.00 O ATOM 33 CB GLN A 3 7.178 2.448 0.989 1.00 0.00 C ATOM 34 CG GLN A 3 7.731 2.620 2.393 1.00 0.00 C ATOM 35 CD GLN A 3 8.594 1.449 2.823 1.00 0.00 C ATOM 36 OE1 GLN A 3 8.504 0.355 2.260 1.00 0.00 O ATOM 37 NE2 GLN A 3 9.436 1.672 3.826 1.00 0.00 N ATOM 0 H GLN A 3 4.910 2.721 1.925 1.00 0.00 H new ATOM 0 HA GLN A 3 6.705 4.532 0.755 1.00 0.00 H new ATOM 0 HB2 GLN A 3 6.644 1.499 0.935 1.00 0.00 H new ATOM 0 HB3 GLN A 3 8.010 2.386 0.288 1.00 0.00 H new ATOM 0 HG2 GLN A 3 8.319 3.537 2.439 1.00 0.00 H new ATOM 0 HG3 GLN A 3 6.905 2.735 3.094 1.00 0.00 H new ATOM 0 HE21 GLN A 3 9.477 2.593 4.262 1.00 0.00 H new ATOM 0 HE22 GLN A 3 10.042 0.922 4.160 1.00 0.00 H new ATOM 46 N PHE A 4 5.218 2.483 -1.368 1.00 0.00 N ATOM 47 CA PHE A 4 4.902 2.288 -2.778 1.00 0.00 C ATOM 48 C PHE A 4 4.113 3.467 -3.334 1.00 0.00 C ATOM 49 O PHE A 4 4.281 3.847 -4.493 1.00 0.00 O ATOM 50 CB PHE A 4 4.104 0.998 -2.973 1.00 0.00 C ATOM 51 CG PHE A 4 4.933 -0.250 -2.859 1.00 0.00 C ATOM 52 CD1 PHE A 4 6.293 -0.223 -3.126 1.00 0.00 C ATOM 53 CD2 PHE A 4 4.354 -1.453 -2.485 1.00 0.00 C ATOM 54 CE1 PHE A 4 7.057 -1.371 -3.022 1.00 0.00 C ATOM 55 CE2 PHE A 4 5.114 -2.601 -2.379 1.00 0.00 C ATOM 56 CZ PHE A 4 6.468 -2.559 -2.648 1.00 0.00 C ATOM 0 H PHE A 4 4.795 1.797 -0.743 1.00 0.00 H new ATOM 0 HA PHE A 4 5.844 2.215 -3.321 1.00 0.00 H new ATOM 0 HB2 PHE A 4 3.304 0.961 -2.233 1.00 0.00 H new ATOM 0 HB3 PHE A 4 3.630 1.020 -3.954 1.00 0.00 H new ATOM 0 HD1 PHE A 4 6.761 0.705 -3.419 1.00 0.00 H new ATOM 0 HD2 PHE A 4 3.296 -1.493 -2.274 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.115 -1.336 -3.234 1.00 0.00 H new ATOM 0 HE2 PHE A 4 4.650 -3.531 -2.086 1.00 0.00 H new ATOM 0 HZ PHE A 4 7.064 -3.456 -2.565 1.00 0.00 H new ATOM 66 N THR A 5 3.253 4.043 -2.501 1.00 0.00 N ATOM 67 CA THR A 5 2.487 5.222 -2.885 1.00 0.00 C ATOM 68 C THR A 5 3.404 6.356 -3.324 1.00 0.00 C ATOM 69 O THR A 5 3.212 6.947 -4.386 1.00 0.00 O ATOM 70 CB THR A 5 1.589 5.701 -1.729 1.00 0.00 C ATOM 71 OG1 THR A 5 0.661 4.665 -1.380 1.00 0.00 O ATOM 72 CG2 THR A 5 0.821 6.950 -2.132 1.00 0.00 C ATOM 0 H THR A 5 3.069 3.712 -1.554 1.00 0.00 H new ATOM 0 HA THR A 5 1.856 4.936 -3.726 1.00 0.00 H new ATOM 0 HB THR A 5 2.220 5.936 -0.872 1.00 0.00 H new ATOM 0 HG1 THR A 5 0.729 3.933 -2.028 1.00 0.00 H new ATOM 0 HG21 THR A 5 0.192 7.274 -1.303 1.00 0.00 H new ATOM 0 HG22 THR A 5 1.524 7.743 -2.385 1.00 0.00 H new ATOM 0 HG23 THR A 5 0.196 6.729 -2.997 1.00 0.00 H new ATOM 80 N THR A 6 4.402 6.656 -2.499 1.00 0.00 N ATOM 81 CA THR A 6 5.300 7.775 -2.758 1.00 0.00 C ATOM 82 C THR A 6 6.274 7.451 -3.884 1.00 0.00 C ATOM 83 O THR A 6 6.706 8.339 -4.619 1.00 0.00 O ATOM 84 CB THR A 6 6.084 8.161 -1.491 1.00 0.00 C ATOM 85 OG1 THR A 6 6.869 7.045 -1.052 1.00 0.00 O ATOM 86 CG2 THR A 6 5.132 8.574 -0.379 1.00 0.00 C ATOM 0 H THR A 6 4.609 6.139 -1.645 1.00 0.00 H new ATOM 0 HA THR A 6 4.683 8.620 -3.061 1.00 0.00 H new ATOM 0 HB THR A 6 6.736 9.002 -1.729 1.00 0.00 H new ATOM 0 HG1 THR A 6 6.541 6.226 -1.480 1.00 0.00 H new ATOM 0 HG21 THR A 6 5.704 8.843 0.509 1.00 0.00 H new ATOM 0 HG22 THR A 6 4.542 9.431 -0.704 1.00 0.00 H new ATOM 0 HG23 THR A 6 4.466 7.744 -0.143 1.00 0.00 H new ATOM 94 N LYS A 7 6.616 6.174 -4.014 1.00 0.00 N ATOM 95 CA LYS A 7 7.508 5.724 -5.076 1.00 0.00 C ATOM 96 C LYS A 7 6.848 5.858 -6.443 1.00 0.00 C ATOM 97 O LYS A 7 7.501 6.205 -7.427 1.00 0.00 O ATOM 98 CB LYS A 7 7.936 4.275 -4.839 1.00 0.00 C ATOM 99 CG LYS A 7 8.923 4.090 -3.694 1.00 0.00 C ATOM 100 CD LYS A 7 9.241 2.620 -3.470 1.00 0.00 C ATOM 101 CE LYS A 7 10.125 2.423 -2.247 1.00 0.00 C ATOM 102 NZ LYS A 7 11.438 3.107 -2.394 1.00 0.00 N ATOM 0 H LYS A 7 6.289 5.431 -3.396 1.00 0.00 H new ATOM 0 HA LYS A 7 8.392 6.361 -5.060 1.00 0.00 H new ATOM 0 HB2 LYS A 7 7.048 3.675 -4.638 1.00 0.00 H new ATOM 0 HB3 LYS A 7 8.383 3.887 -5.754 1.00 0.00 H new ATOM 0 HG2 LYS A 7 9.842 4.634 -3.912 1.00 0.00 H new ATOM 0 HG3 LYS A 7 8.508 4.518 -2.781 1.00 0.00 H new ATOM 0 HD2 LYS A 7 8.314 2.061 -3.345 1.00 0.00 H new ATOM 0 HD3 LYS A 7 9.740 2.216 -4.351 1.00 0.00 H new ATOM 0 HE2 LYS A 7 9.613 2.806 -1.364 1.00 0.00 H new ATOM 0 HE3 LYS A 7 10.287 1.357 -2.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 12.065 2.825 -1.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 11.870 2.837 -3.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 11.297 4.137 -2.370 1.00 0.00 H new ATOM 116 N LEU A 8 5.549 5.580 -6.497 1.00 0.00 N ATOM 117 CA LEU A 8 4.769 5.801 -7.708 1.00 0.00 C ATOM 118 C LEU A 8 4.587 7.288 -7.984 1.00 0.00 C ATOM 119 O LEU A 8 4.778 7.748 -9.109 1.00 0.00 O ATOM 120 CB LEU A 8 3.397 5.126 -7.584 1.00 0.00 C ATOM 121 CG LEU A 8 2.460 5.298 -8.787 1.00 0.00 C ATOM 122 CD1 LEU A 8 3.139 4.763 -10.041 1.00 0.00 C ATOM 123 CD2 LEU A 8 1.152 4.568 -8.520 1.00 0.00 C ATOM 0 H LEU A 8 5.015 5.201 -5.715 1.00 0.00 H new ATOM 0 HA LEU A 8 5.316 5.362 -8.543 1.00 0.00 H new ATOM 0 HB2 LEU A 8 3.551 4.060 -7.416 1.00 0.00 H new ATOM 0 HB3 LEU A 8 2.898 5.519 -6.699 1.00 0.00 H new ATOM 0 HG LEU A 8 2.240 6.355 -8.939 1.00 0.00 H new ATOM 0 HD11 LEU A 8 2.473 4.885 -10.895 1.00 0.00 H new ATOM 0 HD12 LEU A 8 4.062 5.315 -10.218 1.00 0.00 H new ATOM 0 HD13 LEU A 8 3.368 3.706 -9.908 1.00 0.00 H new ATOM 0 HD21 LEU A 8 0.486 4.690 -9.374 1.00 0.00 H new ATOM 0 HD22 LEU A 8 1.352 3.508 -8.364 1.00 0.00 H new ATOM 0 HD23 LEU A 8 0.679 4.982 -7.630 1.00 0.00 H new ATOM 135 N ASN A 9 4.217 8.035 -6.950 1.00 0.00 N ATOM 136 CA ASN A 9 3.983 9.468 -7.084 1.00 0.00 C ATOM 137 C ASN A 9 5.227 10.183 -7.596 1.00 0.00 C ATOM 138 O ASN A 9 5.133 11.123 -8.385 1.00 0.00 O ATOM 139 CB ASN A 9 3.531 10.062 -5.763 1.00 0.00 C ATOM 140 CG ASN A 9 2.107 9.713 -5.429 1.00 0.00 C ATOM 141 OD1 ASN A 9 1.340 9.284 -6.299 1.00 0.00 O ATOM 142 ND2 ASN A 9 1.739 9.888 -4.186 1.00 0.00 N ATOM 0 H ASN A 9 4.072 7.671 -6.008 1.00 0.00 H new ATOM 0 HA ASN A 9 3.189 9.611 -7.817 1.00 0.00 H new ATOM 0 HB2 ASN A 9 4.185 9.707 -4.966 1.00 0.00 H new ATOM 0 HB3 ASN A 9 3.636 11.146 -5.802 1.00 0.00 H new ATOM 0 HD21 ASN A 9 0.785 9.668 -3.901 1.00 0.00 H new ATOM 0 HD22 ASN A 9 2.406 10.245 -3.502 1.00 0.00 H new ATOM 149 N THR A 10 6.391 9.732 -7.143 1.00 0.00 N ATOM 150 CA THR A 10 7.657 10.321 -7.563 1.00 0.00 C ATOM 151 C THR A 10 8.470 9.341 -8.400 1.00 0.00 C ATOM 152 O THR A 10 9.696 9.295 -8.302 1.00 0.00 O ATOM 153 CB THR A 10 8.487 10.777 -6.349 1.00 0.00 C ATOM 154 OG1 THR A 10 8.731 9.658 -5.487 1.00 0.00 O ATOM 155 CG2 THR A 10 7.750 11.858 -5.574 1.00 0.00 C ATOM 0 H THR A 10 6.484 8.959 -6.484 1.00 0.00 H new ATOM 0 HA THR A 10 7.420 11.192 -8.174 1.00 0.00 H new ATOM 0 HB THR A 10 9.433 11.183 -6.707 1.00 0.00 H new ATOM 0 HG1 THR A 10 7.932 9.479 -4.949 1.00 0.00 H new ATOM 0 HG21 THR A 10 8.352 12.168 -4.720 1.00 0.00 H new ATOM 0 HG22 THR A 10 7.574 12.715 -6.224 1.00 0.00 H new ATOM 0 HG23 THR A 10 6.795 11.467 -5.222 1.00 0.00 H new ATOM 163 N LEU A 11 7.779 8.558 -9.221 1.00 0.00 N ATOM 164 CA LEU A 11 8.438 7.600 -10.101 1.00 0.00 C ATOM 165 C LEU A 11 9.396 8.298 -11.057 1.00 0.00 C ATOM 166 O LEU A 11 8.996 9.177 -11.820 1.00 0.00 O ATOM 167 CB LEU A 11 7.394 6.809 -10.900 1.00 0.00 C ATOM 168 CG LEU A 11 7.940 5.646 -11.739 1.00 0.00 C ATOM 169 CD1 LEU A 11 8.544 4.595 -10.819 1.00 0.00 C ATOM 170 CD2 LEU A 11 6.817 5.057 -12.580 1.00 0.00 C ATOM 0 H LEU A 11 6.762 8.568 -9.296 1.00 0.00 H new ATOM 0 HA LEU A 11 9.013 6.915 -9.478 1.00 0.00 H new ATOM 0 HB2 LEU A 11 6.653 6.415 -10.204 1.00 0.00 H new ATOM 0 HB3 LEU A 11 6.873 7.498 -11.564 1.00 0.00 H new ATOM 0 HG LEU A 11 8.721 6.004 -12.410 1.00 0.00 H new ATOM 0 HD11 LEU A 11 8.932 3.769 -11.415 1.00 0.00 H new ATOM 0 HD12 LEU A 11 9.356 5.039 -10.243 1.00 0.00 H new ATOM 0 HD13 LEU A 11 7.778 4.223 -10.139 1.00 0.00 H new ATOM 0 HD21 LEU A 11 7.204 4.231 -13.176 1.00 0.00 H new ATOM 0 HD22 LEU A 11 6.025 4.693 -11.926 1.00 0.00 H new ATOM 0 HD23 LEU A 11 6.416 5.825 -13.241 1.00 0.00 H new ATOM 182 N GLU A 12 10.664 7.902 -11.011 1.00 0.00 N ATOM 183 CA GLU A 12 11.704 8.570 -11.784 1.00 0.00 C ATOM 184 C GLU A 12 11.570 8.261 -13.269 1.00 0.00 C ATOM 185 O GLU A 12 11.269 7.131 -13.653 1.00 0.00 O ATOM 186 CB GLU A 12 13.090 8.150 -11.288 1.00 0.00 C ATOM 187 CG GLU A 12 14.245 8.868 -11.969 1.00 0.00 C ATOM 188 CD GLU A 12 15.588 8.456 -11.433 1.00 0.00 C ATOM 189 OE1 GLU A 12 15.645 7.501 -10.697 1.00 0.00 O ATOM 190 OE2 GLU A 12 16.559 9.098 -11.760 1.00 0.00 O ATOM 0 H GLU A 12 10.996 7.121 -10.446 1.00 0.00 H new ATOM 0 HA GLU A 12 11.585 9.644 -11.645 1.00 0.00 H new ATOM 0 HB2 GLU A 12 13.148 8.330 -10.215 1.00 0.00 H new ATOM 0 HB3 GLU A 12 13.206 7.077 -11.438 1.00 0.00 H new ATOM 0 HG2 GLU A 12 14.210 8.668 -13.040 1.00 0.00 H new ATOM 0 HG3 GLU A 12 14.123 9.944 -11.842 1.00 0.00 H new ATOM 197 N ASP A 13 11.797 9.271 -14.101 1.00 0.00 N ATOM 198 CA ASP A 13 11.778 9.092 -15.548 1.00 0.00 C ATOM 199 C ASP A 13 12.985 8.291 -16.020 1.00 0.00 C ATOM 200 O ASP A 13 13.933 8.848 -16.574 1.00 0.00 O ATOM 201 CB ASP A 13 11.749 10.448 -16.257 1.00 0.00 C ATOM 202 CG ASP A 13 11.594 10.324 -17.767 1.00 0.00 C ATOM 203 OD1 ASP A 13 11.530 9.218 -18.249 1.00 0.00 O ATOM 204 OD2 ASP A 13 11.541 11.337 -18.423 1.00 0.00 O ATOM 0 H ASP A 13 11.997 10.224 -13.798 1.00 0.00 H new ATOM 0 HA ASP A 13 10.874 8.537 -15.800 1.00 0.00 H new ATOM 0 HB2 ASP A 13 10.926 11.042 -15.860 1.00 0.00 H new ATOM 0 HB3 ASP A 13 12.669 10.988 -16.034 1.00 0.00 H new ATOM 209 N SER A 14 12.945 6.982 -15.797 1.00 0.00 N ATOM 210 CA SER A 14 14.030 6.101 -16.209 1.00 0.00 C ATOM 211 C SER A 14 13.597 4.641 -16.175 1.00 0.00 C ATOM 212 O SER A 14 13.033 4.173 -15.186 1.00 0.00 O ATOM 213 CB SER A 14 15.235 6.301 -15.311 1.00 0.00 C ATOM 214 OG SER A 14 16.273 5.426 -15.660 1.00 0.00 O ATOM 0 H SER A 14 12.171 6.507 -15.332 1.00 0.00 H new ATOM 0 HA SER A 14 14.298 6.355 -17.235 1.00 0.00 H new ATOM 0 HB2 SER A 14 15.582 7.331 -15.387 1.00 0.00 H new ATOM 0 HB3 SER A 14 14.950 6.136 -14.272 1.00 0.00 H new ATOM 0 HG SER A 14 17.040 5.575 -15.068 1.00 0.00 H new ATOM 220 N GLN A 15 13.865 3.924 -17.262 1.00 0.00 N ATOM 221 CA GLN A 15 13.418 2.543 -17.398 1.00 0.00 C ATOM 222 C GLN A 15 14.019 1.659 -16.313 1.00 0.00 C ATOM 223 O GLN A 15 13.371 0.736 -15.821 1.00 0.00 O ATOM 224 CB GLN A 15 13.783 1.995 -18.780 1.00 0.00 C ATOM 225 CG GLN A 15 12.994 2.612 -19.923 1.00 0.00 C ATOM 226 CD GLN A 15 13.439 2.095 -21.278 1.00 0.00 C ATOM 227 OE1 GLN A 15 14.564 1.615 -21.436 1.00 0.00 O ATOM 228 NE2 GLN A 15 12.556 2.191 -22.265 1.00 0.00 N ATOM 0 H GLN A 15 14.390 4.277 -18.062 1.00 0.00 H new ATOM 0 HA GLN A 15 12.334 2.533 -17.286 1.00 0.00 H new ATOM 0 HB2 GLN A 15 14.846 2.162 -18.955 1.00 0.00 H new ATOM 0 HB3 GLN A 15 13.624 0.917 -18.784 1.00 0.00 H new ATOM 0 HG2 GLN A 15 11.934 2.399 -19.786 1.00 0.00 H new ATOM 0 HG3 GLN A 15 13.107 3.696 -19.896 1.00 0.00 H new ATOM 0 HE21 GLN A 15 11.636 2.595 -22.089 1.00 0.00 H new ATOM 0 HE22 GLN A 15 12.797 1.860 -23.199 1.00 0.00 H new ATOM 237 N GLU A 16 15.262 1.948 -15.943 1.00 0.00 N ATOM 238 CA GLU A 16 15.943 1.199 -14.894 1.00 0.00 C ATOM 239 C GLU A 16 15.267 1.403 -13.544 1.00 0.00 C ATOM 240 O GLU A 16 15.107 0.459 -12.770 1.00 0.00 O ATOM 241 CB GLU A 16 17.413 1.617 -14.808 1.00 0.00 C ATOM 242 CG GLU A 16 18.260 1.186 -15.996 1.00 0.00 C ATOM 243 CD GLU A 16 19.685 1.656 -15.900 1.00 0.00 C ATOM 244 OE1 GLU A 16 19.984 2.405 -15.001 1.00 0.00 O ATOM 245 OE2 GLU A 16 20.475 1.267 -16.727 1.00 0.00 O ATOM 0 H GLU A 16 15.819 2.697 -16.355 1.00 0.00 H new ATOM 0 HA GLU A 16 15.886 0.141 -15.150 1.00 0.00 H new ATOM 0 HB2 GLU A 16 17.465 2.702 -14.715 1.00 0.00 H new ATOM 0 HB3 GLU A 16 17.844 1.198 -13.899 1.00 0.00 H new ATOM 0 HG2 GLU A 16 18.246 0.099 -16.071 1.00 0.00 H new ATOM 0 HG3 GLU A 16 17.816 1.574 -16.912 1.00 0.00 H new ATOM 252 N SER A 17 14.871 2.641 -13.267 1.00 0.00 N ATOM 253 CA SER A 17 14.205 2.969 -12.013 1.00 0.00 C ATOM 254 C SER A 17 12.784 2.423 -11.984 1.00 0.00 C ATOM 255 O SER A 17 12.304 1.967 -10.946 1.00 0.00 O ATOM 256 CB SER A 17 14.183 4.472 -11.812 1.00 0.00 C ATOM 257 OG SER A 17 15.479 4.974 -11.631 1.00 0.00 O ATOM 0 H SER A 17 15.000 3.434 -13.895 1.00 0.00 H new ATOM 0 HA SER A 17 14.766 2.503 -11.203 1.00 0.00 H new ATOM 0 HB2 SER A 17 13.721 4.951 -12.675 1.00 0.00 H new ATOM 0 HB3 SER A 17 13.570 4.718 -10.945 1.00 0.00 H new ATOM 0 HG SER A 17 15.444 5.773 -11.065 1.00 0.00 H new ATOM 263 N ILE A 18 12.113 2.472 -13.130 1.00 0.00 N ATOM 264 CA ILE A 18 10.759 1.945 -13.249 1.00 0.00 C ATOM 265 C ILE A 18 10.737 0.434 -13.057 1.00 0.00 C ATOM 266 O ILE A 18 9.908 -0.095 -12.318 1.00 0.00 O ATOM 267 CB ILE A 18 10.150 2.299 -14.618 1.00 0.00 C ATOM 268 CG1 ILE A 18 9.928 3.809 -14.730 1.00 0.00 C ATOM 269 CG2 ILE A 18 8.844 1.549 -14.829 1.00 0.00 C ATOM 270 CD1 ILE A 18 9.599 4.276 -16.130 1.00 0.00 C ATOM 0 H ILE A 18 12.486 2.872 -13.991 1.00 0.00 H new ATOM 0 HA ILE A 18 10.161 2.407 -12.463 1.00 0.00 H new ATOM 0 HB ILE A 18 10.850 1.996 -15.397 1.00 0.00 H new ATOM 0 HG12 ILE A 18 9.118 4.098 -14.061 1.00 0.00 H new ATOM 0 HG13 ILE A 18 10.825 4.325 -14.386 1.00 0.00 H new ATOM 0 HG21 ILE A 18 8.427 1.811 -15.801 1.00 0.00 H new ATOM 0 HG22 ILE A 18 9.031 0.476 -14.791 1.00 0.00 H new ATOM 0 HG23 ILE A 18 8.137 1.822 -14.046 1.00 0.00 H new ATOM 0 HD11 ILE A 18 9.456 5.357 -16.129 1.00 0.00 H new ATOM 0 HD12 ILE A 18 10.419 4.019 -16.801 1.00 0.00 H new ATOM 0 HD13 ILE A 18 8.685 3.789 -16.471 1.00 0.00 H new ATOM 282 N SER A 19 11.653 -0.256 -13.728 1.00 0.00 N ATOM 283 CA SER A 19 11.744 -1.707 -13.630 1.00 0.00 C ATOM 284 C SER A 19 12.171 -2.139 -12.233 1.00 0.00 C ATOM 285 O SER A 19 11.787 -3.208 -11.758 1.00 0.00 O ATOM 286 CB SER A 19 12.725 -2.240 -14.656 1.00 0.00 C ATOM 287 OG SER A 19 14.027 -1.806 -14.378 1.00 0.00 O ATOM 0 H SER A 19 12.344 0.168 -14.347 1.00 0.00 H new ATOM 0 HA SER A 19 10.755 -2.120 -13.828 1.00 0.00 H new ATOM 0 HB2 SER A 19 12.694 -3.330 -14.662 1.00 0.00 H new ATOM 0 HB3 SER A 19 12.432 -1.908 -15.652 1.00 0.00 H new ATOM 0 HG SER A 19 13.991 -0.968 -13.872 1.00 0.00 H new ATOM 293 N SER A 20 12.969 -1.302 -11.578 1.00 0.00 N ATOM 294 CA SER A 20 13.333 -1.523 -10.184 1.00 0.00 C ATOM 295 C SER A 20 12.116 -1.418 -9.274 1.00 0.00 C ATOM 296 O SER A 20 11.939 -2.225 -8.362 1.00 0.00 O ATOM 297 CB SER A 20 14.385 -0.519 -9.754 1.00 0.00 C ATOM 298 OG SER A 20 15.587 -0.726 -10.444 1.00 0.00 O ATOM 0 H SER A 20 13.376 -0.463 -11.991 1.00 0.00 H new ATOM 0 HA SER A 20 13.738 -2.531 -10.098 1.00 0.00 H new ATOM 0 HB2 SER A 20 14.025 0.493 -9.939 1.00 0.00 H new ATOM 0 HB3 SER A 20 14.558 -0.604 -8.681 1.00 0.00 H new ATOM 0 HG SER A 20 15.427 -0.655 -11.408 1.00 0.00 H new ATOM 304 N ALA A 21 11.279 -0.417 -9.527 1.00 0.00 N ATOM 305 CA ALA A 21 10.038 -0.249 -8.779 1.00 0.00 C ATOM 306 C ALA A 21 9.115 -1.446 -8.968 1.00 0.00 C ATOM 307 O ALA A 21 8.484 -1.911 -8.018 1.00 0.00 O ATOM 308 CB ALA A 21 9.335 1.033 -9.201 1.00 0.00 C ATOM 0 H ALA A 21 11.438 0.290 -10.245 1.00 0.00 H new ATOM 0 HA ALA A 21 10.289 -0.181 -7.721 1.00 0.00 H new ATOM 0 HB1 ALA A 21 8.411 1.145 -8.634 1.00 0.00 H new ATOM 0 HB2 ALA A 21 9.985 1.886 -9.006 1.00 0.00 H new ATOM 0 HB3 ALA A 21 9.105 0.988 -10.265 1.00 0.00 H new ATOM 314 N SER A 22 9.039 -1.940 -10.198 1.00 0.00 N ATOM 315 CA SER A 22 8.193 -3.085 -10.513 1.00 0.00 C ATOM 316 C SER A 22 8.657 -4.333 -9.773 1.00 0.00 C ATOM 317 O SER A 22 7.842 -5.129 -9.307 1.00 0.00 O ATOM 318 CB SER A 22 8.198 -3.342 -12.008 1.00 0.00 C ATOM 319 OG SER A 22 9.461 -3.767 -12.441 1.00 0.00 O ATOM 0 H SER A 22 9.554 -1.565 -10.995 1.00 0.00 H new ATOM 0 HA SER A 22 7.179 -2.853 -10.189 1.00 0.00 H new ATOM 0 HB2 SER A 22 7.452 -4.098 -12.253 1.00 0.00 H new ATOM 0 HB3 SER A 22 7.915 -2.432 -12.538 1.00 0.00 H new ATOM 0 HG SER A 22 9.506 -4.745 -12.409 1.00 0.00 H new ATOM 325 N LYS A 23 9.971 -4.499 -9.668 1.00 0.00 N ATOM 326 CA LYS A 23 10.546 -5.617 -8.930 1.00 0.00 C ATOM 327 C LYS A 23 10.177 -5.550 -7.453 1.00 0.00 C ATOM 328 O LYS A 23 9.919 -6.574 -6.821 1.00 0.00 O ATOM 329 CB LYS A 23 12.067 -5.640 -9.091 1.00 0.00 C ATOM 330 CG LYS A 23 12.547 -6.075 -10.469 1.00 0.00 C ATOM 331 CD LYS A 23 14.063 -6.011 -10.572 1.00 0.00 C ATOM 332 CE LYS A 23 14.544 -6.433 -11.953 1.00 0.00 C ATOM 333 NZ LYS A 23 16.024 -6.351 -12.076 1.00 0.00 N ATOM 0 H LYS A 23 10.659 -3.872 -10.086 1.00 0.00 H new ATOM 0 HA LYS A 23 10.132 -6.537 -9.343 1.00 0.00 H new ATOM 0 HB2 LYS A 23 12.457 -4.644 -8.881 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.489 -6.312 -8.344 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.209 -7.092 -10.670 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.101 -5.435 -11.230 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.401 -4.996 -10.362 1.00 0.00 H new ATOM 0 HD3 LYS A 23 14.508 -6.658 -9.816 1.00 0.00 H new ATOM 0 HE2 LYS A 23 14.219 -7.454 -12.154 1.00 0.00 H new ATOM 0 HE3 LYS A 23 14.082 -5.797 -12.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 16.310 -6.647 -13.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 16.332 -5.372 -11.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 16.466 -6.977 -11.373 1.00 0.00 H new ATOM 347 N TRP A 24 10.153 -4.338 -6.909 1.00 0.00 N ATOM 348 CA TRP A 24 9.757 -4.129 -5.522 1.00 0.00 C ATOM 349 C TRP A 24 8.281 -4.446 -5.316 1.00 0.00 C ATOM 350 O TRP A 24 7.895 -5.011 -4.293 1.00 0.00 O ATOM 351 CB TRP A 24 10.035 -2.685 -5.100 1.00 0.00 C ATOM 352 CG TRP A 24 11.488 -2.319 -5.139 1.00 0.00 C ATOM 353 CD1 TRP A 24 12.546 -3.170 -5.019 1.00 0.00 C ATOM 354 CD2 TRP A 24 12.054 -0.997 -5.311 1.00 0.00 C ATOM 355 NE1 TRP A 24 13.726 -2.473 -5.103 1.00 0.00 N ATOM 356 CE2 TRP A 24 13.443 -1.142 -5.284 1.00 0.00 C ATOM 357 CE3 TRP A 24 11.501 0.277 -5.485 1.00 0.00 C ATOM 358 CZ2 TRP A 24 14.297 -0.058 -5.422 1.00 0.00 C ATOM 359 CZ3 TRP A 24 12.356 1.364 -5.625 1.00 0.00 C ATOM 360 CH2 TRP A 24 13.718 1.199 -5.594 1.00 0.00 C ATOM 0 H TRP A 24 10.404 -3.485 -7.409 1.00 0.00 H new ATOM 0 HA TRP A 24 10.346 -4.806 -4.904 1.00 0.00 H new ATOM 0 HB2 TRP A 24 9.481 -2.011 -5.754 1.00 0.00 H new ATOM 0 HB3 TRP A 24 9.657 -2.531 -4.089 1.00 0.00 H new ATOM 0 HD1 TRP A 24 12.467 -4.238 -4.878 1.00 0.00 H new ATOM 0 HE1 TRP A 24 14.660 -2.878 -5.041 1.00 0.00 H new ATOM 0 HE3 TRP A 24 10.430 0.413 -5.510 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 15.370 -0.183 -5.397 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 11.943 2.353 -5.760 1.00 0.00 H new ATOM 0 HH2 TRP A 24 14.356 2.063 -5.705 1.00 0.00 H new ATOM 371 N LEU A 25 7.460 -4.079 -6.294 1.00 0.00 N ATOM 372 CA LEU A 25 6.025 -4.328 -6.224 1.00 0.00 C ATOM 373 C LEU A 25 5.724 -5.821 -6.238 1.00 0.00 C ATOM 374 O LEU A 25 4.771 -6.278 -5.608 1.00 0.00 O ATOM 375 CB LEU A 25 5.311 -3.645 -7.397 1.00 0.00 C ATOM 376 CG LEU A 25 5.278 -2.112 -7.354 1.00 0.00 C ATOM 377 CD1 LEU A 25 4.723 -1.579 -8.668 1.00 0.00 C ATOM 378 CD2 LEU A 25 4.429 -1.655 -6.177 1.00 0.00 C ATOM 0 H LEU A 25 7.764 -3.607 -7.146 1.00 0.00 H new ATOM 0 HA LEU A 25 5.659 -3.912 -5.285 1.00 0.00 H new ATOM 0 HB2 LEU A 25 5.796 -3.954 -8.323 1.00 0.00 H new ATOM 0 HB3 LEU A 25 4.285 -4.011 -7.437 1.00 0.00 H new ATOM 0 HG LEU A 25 6.287 -1.721 -7.223 1.00 0.00 H new ATOM 0 HD11 LEU A 25 4.699 -0.490 -8.638 1.00 0.00 H new ATOM 0 HD12 LEU A 25 5.359 -1.906 -9.491 1.00 0.00 H new ATOM 0 HD13 LEU A 25 3.713 -1.960 -8.817 1.00 0.00 H new ATOM 0 HD21 LEU A 25 4.406 -0.566 -6.146 1.00 0.00 H new ATOM 0 HD22 LEU A 25 3.414 -2.037 -6.290 1.00 0.00 H new ATOM 0 HD23 LEU A 25 4.858 -2.035 -5.250 1.00 0.00 H new ATOM 390 N LEU A 26 6.543 -6.578 -6.961 1.00 0.00 N ATOM 391 CA LEU A 26 6.349 -8.018 -7.081 1.00 0.00 C ATOM 392 C LEU A 26 6.532 -8.713 -5.738 1.00 0.00 C ATOM 393 O LEU A 26 6.122 -9.860 -5.560 1.00 0.00 O ATOM 394 CB LEU A 26 7.332 -8.602 -8.103 1.00 0.00 C ATOM 395 CG LEU A 26 7.076 -8.219 -9.567 1.00 0.00 C ATOM 396 CD1 LEU A 26 8.247 -8.679 -10.425 1.00 0.00 C ATOM 397 CD2 LEU A 26 5.773 -8.848 -10.036 1.00 0.00 C ATOM 0 H LEU A 26 7.348 -6.217 -7.473 1.00 0.00 H new ATOM 0 HA LEU A 26 5.328 -8.190 -7.421 1.00 0.00 H new ATOM 0 HB2 LEU A 26 8.339 -8.283 -7.834 1.00 0.00 H new ATOM 0 HB3 LEU A 26 7.309 -9.689 -8.022 1.00 0.00 H new ATOM 0 HG LEU A 26 6.987 -7.137 -9.659 1.00 0.00 H new ATOM 0 HD11 LEU A 26 8.065 -8.407 -11.465 1.00 0.00 H new ATOM 0 HD12 LEU A 26 9.162 -8.199 -10.079 1.00 0.00 H new ATOM 0 HD13 LEU A 26 8.353 -9.761 -10.346 1.00 0.00 H new ATOM 0 HD21 LEU A 26 5.591 -8.576 -11.076 1.00 0.00 H new ATOM 0 HD22 LEU A 26 5.841 -9.933 -9.951 1.00 0.00 H new ATOM 0 HD23 LEU A 26 4.951 -8.487 -9.418 1.00 0.00 H new ATOM 409 N LEU A 27 7.150 -8.011 -4.794 1.00 0.00 N ATOM 410 CA LEU A 27 7.441 -8.579 -3.483 1.00 0.00 C ATOM 411 C LEU A 27 6.164 -8.801 -2.683 1.00 0.00 C ATOM 412 O LEU A 27 6.152 -9.557 -1.711 1.00 0.00 O ATOM 413 CB LEU A 27 8.387 -7.657 -2.704 1.00 0.00 C ATOM 414 CG LEU A 27 9.790 -7.487 -3.299 1.00 0.00 C ATOM 415 CD1 LEU A 27 10.564 -6.454 -2.490 1.00 0.00 C ATOM 416 CD2 LEU A 27 10.508 -8.829 -3.301 1.00 0.00 C ATOM 0 H LEU A 27 7.459 -7.046 -4.913 1.00 0.00 H new ATOM 0 HA LEU A 27 7.922 -9.545 -3.636 1.00 0.00 H new ATOM 0 HB2 LEU A 27 7.924 -6.673 -2.627 1.00 0.00 H new ATOM 0 HB3 LEU A 27 8.487 -8.043 -1.690 1.00 0.00 H new ATOM 0 HG LEU A 27 9.717 -7.134 -4.328 1.00 0.00 H new ATOM 0 HD11 LEU A 27 11.561 -6.333 -2.913 1.00 0.00 H new ATOM 0 HD12 LEU A 27 10.039 -5.499 -2.521 1.00 0.00 H new ATOM 0 HD13 LEU A 27 10.647 -6.789 -1.456 1.00 0.00 H new ATOM 0 HD21 LEU A 27 11.505 -8.708 -3.724 1.00 0.00 H new ATOM 0 HD22 LEU A 27 10.590 -9.199 -2.279 1.00 0.00 H new ATOM 0 HD23 LEU A 27 9.944 -9.543 -3.901 1.00 0.00 H new ATOM 428 N GLN A 28 5.090 -8.137 -3.096 1.00 0.00 N ATOM 429 CA GLN A 28 3.799 -8.279 -2.433 1.00 0.00 C ATOM 430 C GLN A 28 2.691 -8.559 -3.440 1.00 0.00 C ATOM 431 O GLN A 28 1.830 -7.713 -3.681 1.00 0.00 O ATOM 432 CB GLN A 28 3.468 -7.020 -1.628 1.00 0.00 C ATOM 433 CG GLN A 28 4.419 -6.750 -0.475 1.00 0.00 C ATOM 434 CD GLN A 28 3.984 -5.568 0.370 1.00 0.00 C ATOM 435 OE1 GLN A 28 3.506 -4.556 -0.151 1.00 0.00 O ATOM 436 NE2 GLN A 28 4.146 -5.688 1.683 1.00 0.00 N ATOM 0 H GLN A 28 5.088 -7.494 -3.888 1.00 0.00 H new ATOM 0 HA GLN A 28 3.866 -9.128 -1.753 1.00 0.00 H new ATOM 0 HB2 GLN A 28 3.475 -6.161 -2.299 1.00 0.00 H new ATOM 0 HB3 GLN A 28 2.455 -7.109 -1.235 1.00 0.00 H new ATOM 0 HG2 GLN A 28 4.484 -7.638 0.154 1.00 0.00 H new ATOM 0 HG3 GLN A 28 5.418 -6.564 -0.868 1.00 0.00 H new ATOM 0 HE21 GLN A 28 4.545 -6.542 2.072 1.00 0.00 H new ATOM 0 HE22 GLN A 28 3.871 -4.926 2.303 1.00 0.00 H new ATOM 445 N TYR A 29 2.717 -9.752 -4.024 1.00 0.00 N ATOM 446 CA TYR A 29 1.697 -10.158 -4.984 1.00 0.00 C ATOM 447 C TYR A 29 0.322 -10.223 -4.331 1.00 0.00 C ATOM 448 O TYR A 29 -0.700 -10.072 -4.999 1.00 0.00 O ATOM 449 CB TYR A 29 2.054 -11.510 -5.605 1.00 0.00 C ATOM 450 CG TYR A 29 1.883 -12.680 -4.661 1.00 0.00 C ATOM 451 CD1 TYR A 29 0.684 -13.377 -4.630 1.00 0.00 C ATOM 452 CD2 TYR A 29 2.926 -13.056 -3.827 1.00 0.00 C ATOM 453 CE1 TYR A 29 0.528 -14.445 -3.768 1.00 0.00 C ATOM 454 CE2 TYR A 29 2.770 -14.124 -2.965 1.00 0.00 C ATOM 455 CZ TYR A 29 1.577 -14.817 -2.934 1.00 0.00 C ATOM 456 OH TYR A 29 1.422 -15.881 -2.076 1.00 0.00 O ATOM 0 H TYR A 29 3.434 -10.456 -3.849 1.00 0.00 H new ATOM 0 HA TYR A 29 1.662 -9.407 -5.773 1.00 0.00 H new ATOM 0 HB2 TYR A 29 1.431 -11.671 -6.485 1.00 0.00 H new ATOM 0 HB3 TYR A 29 3.088 -11.480 -5.948 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -0.128 -13.085 -5.280 1.00 0.00 H new ATOM 0 HD2 TYR A 29 3.860 -12.514 -3.852 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -0.405 -14.989 -3.742 1.00 0.00 H new ATOM 0 HE2 TYR A 29 3.582 -14.417 -2.315 1.00 0.00 H new ATOM 0 HH TYR A 29 2.247 -16.011 -1.564 1.00 0.00 H new ATOM 466 N ARG A 30 0.305 -10.450 -3.022 1.00 0.00 N ATOM 467 CA ARG A 30 -0.945 -10.530 -2.275 1.00 0.00 C ATOM 468 C ARG A 30 -1.605 -9.162 -2.158 1.00 0.00 C ATOM 469 O ARG A 30 -2.801 -9.061 -1.882 1.00 0.00 O ATOM 470 CB ARG A 30 -0.701 -11.093 -0.882 1.00 0.00 C ATOM 471 CG ARG A 30 -0.271 -12.551 -0.848 1.00 0.00 C ATOM 472 CD ARG A 30 -0.045 -13.024 0.542 1.00 0.00 C ATOM 473 NE ARG A 30 0.406 -14.406 0.577 1.00 0.00 N ATOM 474 CZ ARG A 30 0.686 -15.091 1.703 1.00 0.00 C ATOM 475 NH1 ARG A 30 0.558 -14.509 2.875 1.00 0.00 N ATOM 476 NH2 ARG A 30 1.090 -16.347 1.630 1.00 0.00 N ATOM 0 H ARG A 30 1.143 -10.582 -2.456 1.00 0.00 H new ATOM 0 HA ARG A 30 -1.612 -11.196 -2.823 1.00 0.00 H new ATOM 0 HB2 ARG A 30 0.065 -10.492 -0.392 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -1.614 -10.985 -0.297 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -1.035 -13.167 -1.323 1.00 0.00 H new ATOM 0 HG3 ARG A 30 0.644 -12.674 -1.428 1.00 0.00 H new ATOM 0 HD2 ARG A 30 0.696 -12.388 1.026 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -0.969 -12.929 1.113 1.00 0.00 H new ATOM 0 HE ARG A 30 0.518 -14.891 -0.313 1.00 0.00 H new ATOM 0 HH11 ARG A 30 0.247 -13.539 2.932 1.00 0.00 H new ATOM 0 HH12 ARG A 30 0.770 -15.027 3.728 1.00 0.00 H new ATOM 0 HH21 ARG A 30 1.190 -16.799 0.721 1.00 0.00 H new ATOM 0 HH22 ARG A 30 1.302 -16.865 2.483 1.00 0.00 H new ATOM 490 N ASP A 31 -0.820 -8.112 -2.368 1.00 0.00 N ATOM 491 CA ASP A 31 -1.337 -6.749 -2.332 1.00 0.00 C ATOM 492 C ASP A 31 -1.420 -6.154 -3.732 1.00 0.00 C ATOM 493 O ASP A 31 -1.400 -4.935 -3.901 1.00 0.00 O ATOM 494 CB ASP A 31 -0.456 -5.864 -1.447 1.00 0.00 C ATOM 495 CG ASP A 31 -0.534 -6.236 0.028 1.00 0.00 C ATOM 496 OD1 ASP A 31 -1.622 -6.435 0.513 1.00 0.00 O ATOM 497 OD2 ASP A 31 0.495 -6.318 0.654 1.00 0.00 O ATOM 0 H ASP A 31 0.179 -8.178 -2.565 1.00 0.00 H new ATOM 0 HA ASP A 31 -2.342 -6.788 -1.912 1.00 0.00 H new ATOM 0 HB2 ASP A 31 0.579 -5.940 -1.781 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -0.755 -4.823 -1.570 1.00 0.00 H new ATOM 502 N ALA A 32 -1.514 -7.022 -4.734 1.00 0.00 N ATOM 503 CA ALA A 32 -1.578 -6.585 -6.123 1.00 0.00 C ATOM 504 C ALA A 32 -2.795 -5.702 -6.367 1.00 0.00 C ATOM 505 O ALA A 32 -2.705 -4.677 -7.043 1.00 0.00 O ATOM 506 CB ALA A 32 -1.601 -7.787 -7.056 1.00 0.00 C ATOM 0 H ALA A 32 -1.548 -8.034 -4.609 1.00 0.00 H new ATOM 0 HA ALA A 32 -0.686 -5.994 -6.331 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -1.649 -7.444 -8.090 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -0.696 -8.378 -6.911 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -2.474 -8.401 -6.837 1.00 0.00 H new ATOM 512 N PRO A 33 -3.934 -6.105 -5.812 1.00 0.00 N ATOM 513 CA PRO A 33 -5.151 -5.308 -5.896 1.00 0.00 C ATOM 514 C PRO A 33 -4.912 -3.884 -5.412 1.00 0.00 C ATOM 515 O PRO A 33 -5.420 -2.926 -5.995 1.00 0.00 O ATOM 516 CB PRO A 33 -6.120 -6.061 -4.979 1.00 0.00 C ATOM 517 CG PRO A 33 -5.664 -7.478 -5.050 1.00 0.00 C ATOM 518 CD PRO A 33 -4.161 -7.388 -5.051 1.00 0.00 C ATOM 0 HA PRO A 33 -5.527 -5.200 -6.914 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -6.080 -5.680 -3.958 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -7.151 -5.957 -5.318 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -6.027 -8.055 -4.200 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -6.033 -7.970 -5.950 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -3.753 -7.343 -4.041 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -3.700 -8.244 -5.544 1.00 0.00 H new ATOM 526 N LYS A 34 -4.134 -3.751 -4.343 1.00 0.00 N ATOM 527 CA LYS A 34 -3.836 -2.443 -3.770 1.00 0.00 C ATOM 528 C LYS A 34 -2.944 -1.627 -4.696 1.00 0.00 C ATOM 529 O LYS A 34 -3.127 -0.418 -4.843 1.00 0.00 O ATOM 530 CB LYS A 34 -3.172 -2.597 -2.401 1.00 0.00 C ATOM 531 CG LYS A 34 -4.078 -3.180 -1.324 1.00 0.00 C ATOM 532 CD LYS A 34 -3.304 -3.465 -0.046 1.00 0.00 C ATOM 533 CE LYS A 34 -4.165 -4.200 0.971 1.00 0.00 C ATOM 534 NZ LYS A 34 -3.359 -4.727 2.105 1.00 0.00 N ATOM 0 H LYS A 34 -3.698 -4.534 -3.855 1.00 0.00 H new ATOM 0 HA LYS A 34 -4.779 -1.910 -3.648 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -2.295 -3.236 -2.506 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -2.817 -1.621 -2.071 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -4.890 -2.484 -1.113 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -4.534 -4.100 -1.688 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -2.422 -4.062 -0.278 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -2.950 -2.528 0.384 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -4.931 -3.525 1.353 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -4.683 -5.024 0.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -3.981 -5.235 2.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -2.633 -5.378 1.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -2.899 -3.937 2.601 1.00 0.00 H new ATOM 548 N VAL A 35 -1.979 -2.294 -5.319 1.00 0.00 N ATOM 549 CA VAL A 35 -1.085 -1.640 -6.267 1.00 0.00 C ATOM 550 C VAL A 35 -1.853 -1.105 -7.469 1.00 0.00 C ATOM 551 O VAL A 35 -1.622 0.019 -7.915 1.00 0.00 O ATOM 552 CB VAL A 35 -0.004 -2.626 -6.750 1.00 0.00 C ATOM 553 CG1 VAL A 35 0.812 -2.012 -7.877 1.00 0.00 C ATOM 554 CG2 VAL A 35 0.893 -3.020 -5.587 1.00 0.00 C ATOM 0 H VAL A 35 -1.796 -3.288 -5.184 1.00 0.00 H new ATOM 0 HA VAL A 35 -0.613 -0.803 -5.753 1.00 0.00 H new ATOM 0 HB VAL A 35 -0.489 -3.523 -7.135 1.00 0.00 H new ATOM 0 HG11 VAL A 35 1.571 -2.722 -8.206 1.00 0.00 H new ATOM 0 HG12 VAL A 35 0.155 -1.771 -8.712 1.00 0.00 H new ATOM 0 HG13 VAL A 35 1.296 -1.102 -7.522 1.00 0.00 H new ATOM 0 HG21 VAL A 35 1.655 -3.717 -5.935 1.00 0.00 H new ATOM 0 HG22 VAL A 35 1.374 -2.130 -5.181 1.00 0.00 H new ATOM 0 HG23 VAL A 35 0.294 -3.495 -4.810 1.00 0.00 H new ATOM 564 N ALA A 36 -2.767 -1.916 -7.990 1.00 0.00 N ATOM 565 CA ALA A 36 -3.597 -1.511 -9.118 1.00 0.00 C ATOM 566 C ALA A 36 -4.514 -0.354 -8.739 1.00 0.00 C ATOM 567 O ALA A 36 -4.787 0.527 -9.555 1.00 0.00 O ATOM 568 CB ALA A 36 -4.415 -2.690 -9.624 1.00 0.00 C ATOM 0 H ALA A 36 -2.952 -2.859 -7.648 1.00 0.00 H new ATOM 0 HA ALA A 36 -2.937 -1.171 -9.916 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -5.030 -2.372 -10.466 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -3.744 -3.487 -9.945 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -5.058 -3.057 -8.824 1.00 0.00 H new ATOM 574 N GLU A 37 -4.987 -0.363 -7.498 1.00 0.00 N ATOM 575 CA GLU A 37 -5.832 0.713 -6.992 1.00 0.00 C ATOM 576 C GLU A 37 -5.064 2.026 -6.917 1.00 0.00 C ATOM 577 O GLU A 37 -5.581 3.080 -7.289 1.00 0.00 O ATOM 578 CB GLU A 37 -6.384 0.353 -5.611 1.00 0.00 C ATOM 579 CG GLU A 37 -7.282 1.417 -4.997 1.00 0.00 C ATOM 580 CD GLU A 37 -8.559 1.619 -5.764 1.00 0.00 C ATOM 581 OE1 GLU A 37 -8.952 0.722 -6.472 1.00 0.00 O ATOM 582 OE2 GLU A 37 -9.142 2.670 -5.643 1.00 0.00 O ATOM 0 H GLU A 37 -4.800 -1.104 -6.823 1.00 0.00 H new ATOM 0 HA GLU A 37 -6.662 0.840 -7.687 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -6.945 -0.578 -5.689 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -5.548 0.166 -4.936 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -7.521 1.136 -3.971 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -6.739 2.361 -4.951 1.00 0.00 H new ATOM 589 N MET A 38 -3.829 1.957 -6.433 1.00 0.00 N ATOM 590 CA MET A 38 -2.955 3.124 -6.393 1.00 0.00 C ATOM 591 C MET A 38 -2.607 3.600 -7.797 1.00 0.00 C ATOM 592 O MET A 38 -2.524 4.801 -8.053 1.00 0.00 O ATOM 593 CB MET A 38 -1.685 2.805 -5.607 1.00 0.00 C ATOM 594 CG MET A 38 -1.898 2.629 -4.110 1.00 0.00 C ATOM 595 SD MET A 38 -0.347 2.490 -3.199 1.00 0.00 S ATOM 596 CE MET A 38 0.198 0.861 -3.705 1.00 0.00 C ATOM 0 H MET A 38 -3.410 1.104 -6.062 1.00 0.00 H new ATOM 0 HA MET A 38 -3.489 3.930 -5.890 1.00 0.00 H new ATOM 0 HB2 MET A 38 -1.244 1.893 -6.008 1.00 0.00 H new ATOM 0 HB3 MET A 38 -0.963 3.606 -5.767 1.00 0.00 H new ATOM 0 HG2 MET A 38 -2.466 3.476 -3.726 1.00 0.00 H new ATOM 0 HG3 MET A 38 -2.499 1.737 -3.935 1.00 0.00 H new ATOM 0 HE1 MET A 38 1.025 0.541 -3.071 1.00 0.00 H new ATOM 0 HE2 MET A 38 -0.627 0.155 -3.609 1.00 0.00 H new ATOM 0 HE3 MET A 38 0.528 0.894 -4.743 1.00 0.00 H new ATOM 606 N TRP A 39 -2.403 2.651 -8.705 1.00 0.00 N ATOM 607 CA TRP A 39 -2.131 2.972 -10.101 1.00 0.00 C ATOM 608 C TRP A 39 -3.304 3.708 -10.735 1.00 0.00 C ATOM 609 O TRP A 39 -3.119 4.704 -11.435 1.00 0.00 O ATOM 610 CB TRP A 39 -1.837 1.696 -10.893 1.00 0.00 C ATOM 611 CG TRP A 39 -1.547 1.946 -12.342 1.00 0.00 C ATOM 612 CD1 TRP A 39 -0.372 2.387 -12.874 1.00 0.00 C ATOM 613 CD2 TRP A 39 -2.451 1.768 -13.459 1.00 0.00 C ATOM 614 NE1 TRP A 39 -0.483 2.497 -14.238 1.00 0.00 N ATOM 615 CE2 TRP A 39 -1.748 2.121 -14.614 1.00 0.00 C ATOM 616 CE3 TRP A 39 -3.781 1.344 -13.570 1.00 0.00 C ATOM 617 CZ2 TRP A 39 -2.327 2.066 -15.872 1.00 0.00 C ATOM 618 CZ3 TRP A 39 -4.362 1.287 -14.831 1.00 0.00 C ATOM 619 CH2 TRP A 39 -3.653 1.639 -15.952 1.00 0.00 C ATOM 0 H TRP A 39 -2.421 1.652 -8.498 1.00 0.00 H new ATOM 0 HA TRP A 39 -1.258 3.624 -10.128 1.00 0.00 H new ATOM 0 HB2 TRP A 39 -0.985 1.186 -10.443 1.00 0.00 H new ATOM 0 HB3 TRP A 39 -2.690 1.023 -10.812 1.00 0.00 H new ATOM 0 HD1 TRP A 39 0.517 2.616 -12.305 1.00 0.00 H new ATOM 0 HE1 TRP A 39 0.255 2.808 -14.870 1.00 0.00 H new ATOM 0 HE3 TRP A 39 -4.345 1.066 -12.692 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 -1.773 2.343 -16.757 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 -5.387 0.961 -14.930 1.00 0.00 H new ATOM 0 HH2 TRP A 39 -4.132 1.584 -16.918 1.00 0.00 H new ATOM 630 N LYS A 40 -4.512 3.214 -10.485 1.00 0.00 N ATOM 631 CA LYS A 40 -5.721 3.852 -10.991 1.00 0.00 C ATOM 632 C LYS A 40 -5.809 5.303 -10.536 1.00 0.00 C ATOM 633 O LYS A 40 -5.996 6.209 -11.349 1.00 0.00 O ATOM 634 CB LYS A 40 -6.963 3.083 -10.538 1.00 0.00 C ATOM 635 CG LYS A 40 -8.282 3.689 -11.000 1.00 0.00 C ATOM 636 CD LYS A 40 -9.462 2.819 -10.594 1.00 0.00 C ATOM 637 CE LYS A 40 -10.780 3.423 -11.054 1.00 0.00 C ATOM 638 NZ LYS A 40 -11.942 2.569 -10.687 1.00 0.00 N ATOM 0 H LYS A 40 -4.680 2.372 -9.934 1.00 0.00 H new ATOM 0 HA LYS A 40 -5.674 3.838 -12.080 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -6.897 2.060 -10.909 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -6.964 3.028 -9.449 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -8.397 4.685 -10.572 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -8.271 3.808 -12.083 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -9.347 1.824 -11.023 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -9.473 2.700 -9.511 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -10.901 4.411 -10.609 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -10.758 3.561 -12.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -12.496 2.351 -11.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -11.601 1.684 -10.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -12.542 3.074 -10.004 1.00 0.00 H new ATOM 652 N GLU A 41 -5.673 5.519 -9.232 1.00 0.00 N ATOM 653 CA GLU A 41 -5.736 6.861 -8.667 1.00 0.00 C ATOM 654 C GLU A 41 -4.627 7.745 -9.222 1.00 0.00 C ATOM 655 O GLU A 41 -4.858 8.903 -9.571 1.00 0.00 O ATOM 656 CB GLU A 41 -5.639 6.802 -7.140 1.00 0.00 C ATOM 657 CG GLU A 41 -5.611 8.163 -6.459 1.00 0.00 C ATOM 658 CD GLU A 41 -6.893 8.928 -6.629 1.00 0.00 C ATOM 659 OE1 GLU A 41 -7.888 8.322 -6.948 1.00 0.00 O ATOM 660 OE2 GLU A 41 -6.879 10.122 -6.440 1.00 0.00 O ATOM 0 H GLU A 41 -5.518 4.780 -8.546 1.00 0.00 H new ATOM 0 HA GLU A 41 -6.695 7.296 -8.949 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -6.487 6.234 -6.756 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -4.738 6.254 -6.866 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -5.413 8.028 -5.396 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -4.787 8.750 -6.865 1.00 0.00 H new ATOM 667 N TYR A 42 -3.421 7.193 -9.301 1.00 0.00 N ATOM 668 CA TYR A 42 -2.275 7.926 -9.826 1.00 0.00 C ATOM 669 C TYR A 42 -2.521 8.380 -11.259 1.00 0.00 C ATOM 670 O TYR A 42 -2.345 9.553 -11.588 1.00 0.00 O ATOM 671 CB TYR A 42 -1.010 7.068 -9.751 1.00 0.00 C ATOM 672 CG TYR A 42 0.206 7.719 -10.372 1.00 0.00 C ATOM 673 CD1 TYR A 42 0.887 8.713 -9.685 1.00 0.00 C ATOM 674 CD2 TYR A 42 0.641 7.321 -11.627 1.00 0.00 C ATOM 675 CE1 TYR A 42 1.999 9.307 -10.252 1.00 0.00 C ATOM 676 CE2 TYR A 42 1.752 7.915 -12.194 1.00 0.00 C ATOM 677 CZ TYR A 42 2.429 8.904 -11.511 1.00 0.00 C ATOM 678 OH TYR A 42 3.536 9.496 -12.075 1.00 0.00 O ATOM 0 H TYR A 42 -3.212 6.239 -9.008 1.00 0.00 H new ATOM 0 HA TYR A 42 -2.135 8.814 -9.209 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -0.796 6.843 -8.706 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -1.197 6.117 -10.250 1.00 0.00 H new ATOM 0 HD1 TYR A 42 0.549 9.023 -8.707 1.00 0.00 H new ATOM 0 HD2 TYR A 42 0.111 6.546 -12.161 1.00 0.00 H new ATOM 0 HE1 TYR A 42 2.531 10.081 -9.719 1.00 0.00 H new ATOM 0 HE2 TYR A 42 2.090 7.605 -13.172 1.00 0.00 H new ATOM 0 HH TYR A 42 3.772 9.027 -12.903 1.00 0.00 H new ATOM 688 N MET A 43 -2.929 7.443 -12.109 1.00 0.00 N ATOM 689 CA MET A 43 -3.153 7.734 -13.520 1.00 0.00 C ATOM 690 C MET A 43 -4.312 8.706 -13.704 1.00 0.00 C ATOM 691 O MET A 43 -4.356 9.457 -14.679 1.00 0.00 O ATOM 692 CB MET A 43 -3.414 6.442 -14.291 1.00 0.00 C ATOM 693 CG MET A 43 -2.205 5.524 -14.409 1.00 0.00 C ATOM 694 SD MET A 43 -0.815 6.312 -15.246 1.00 0.00 S ATOM 695 CE MET A 43 -1.453 6.443 -16.914 1.00 0.00 C ATOM 0 H MET A 43 -3.111 6.475 -11.845 1.00 0.00 H new ATOM 0 HA MET A 43 -2.253 8.206 -13.916 1.00 0.00 H new ATOM 0 HB2 MET A 43 -4.221 5.898 -13.801 1.00 0.00 H new ATOM 0 HB3 MET A 43 -3.762 6.695 -15.293 1.00 0.00 H new ATOM 0 HG2 MET A 43 -1.894 5.210 -13.413 1.00 0.00 H new ATOM 0 HG3 MET A 43 -2.489 4.623 -14.953 1.00 0.00 H new ATOM 0 HE1 MET A 43 -0.634 6.658 -17.601 1.00 0.00 H new ATOM 0 HE2 MET A 43 -1.927 5.503 -17.197 1.00 0.00 H new ATOM 0 HE3 MET A 43 -2.187 7.248 -16.961 1.00 0.00 H new ATOM 705 N LEU A 44 -5.249 8.687 -12.763 1.00 0.00 N ATOM 706 CA LEU A 44 -6.418 9.556 -12.828 1.00 0.00 C ATOM 707 C LEU A 44 -6.306 10.705 -11.834 1.00 0.00 C ATOM 708 O LEU A 44 -7.312 11.284 -11.425 1.00 0.00 O ATOM 709 CB LEU A 44 -7.693 8.751 -12.546 1.00 0.00 C ATOM 710 CG LEU A 44 -7.945 7.557 -13.476 1.00 0.00 C ATOM 711 CD1 LEU A 44 -9.223 6.845 -13.054 1.00 0.00 C ATOM 712 CD2 LEU A 44 -8.041 8.045 -14.914 1.00 0.00 C ATOM 0 H LEU A 44 -5.222 8.078 -11.945 1.00 0.00 H new ATOM 0 HA LEU A 44 -6.468 9.974 -13.833 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.651 8.386 -11.520 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -8.548 9.425 -12.610 1.00 0.00 H new ATOM 0 HG LEU A 44 -7.118 6.850 -13.407 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -9.402 5.997 -13.715 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -9.120 6.491 -12.028 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -10.063 7.537 -13.116 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -8.220 7.197 -15.575 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -8.864 8.755 -15.003 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -7.108 8.534 -15.195 1.00 0.00 H new ATOM 724 N ARG A 45 -5.077 11.031 -11.450 1.00 0.00 N ATOM 725 CA ARG A 45 -4.830 12.124 -10.517 1.00 0.00 C ATOM 726 C ARG A 45 -4.566 13.430 -11.256 1.00 0.00 C ATOM 727 O ARG A 45 -3.666 13.510 -12.092 1.00 0.00 O ATOM 728 CB ARG A 45 -3.644 11.803 -9.619 1.00 0.00 C ATOM 729 CG ARG A 45 -3.474 12.733 -8.428 1.00 0.00 C ATOM 730 CD ARG A 45 -4.430 12.408 -7.338 1.00 0.00 C ATOM 731 NE ARG A 45 -4.266 13.288 -6.192 1.00 0.00 N ATOM 732 CZ ARG A 45 -4.941 13.169 -5.033 1.00 0.00 C ATOM 733 NH1 ARG A 45 -5.821 12.205 -4.881 1.00 0.00 N ATOM 734 NH2 ARG A 45 -4.719 14.022 -4.048 1.00 0.00 N ATOM 0 H ARG A 45 -4.235 10.553 -11.771 1.00 0.00 H new ATOM 0 HA ARG A 45 -5.725 12.242 -9.906 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -3.750 10.782 -9.252 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -2.734 11.833 -10.218 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -2.454 12.660 -8.051 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -3.623 13.765 -8.747 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -5.450 12.488 -7.714 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -4.286 11.374 -7.025 1.00 0.00 H new ATOM 0 HE ARG A 45 -3.592 14.049 -6.272 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -5.993 11.547 -5.641 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -6.332 12.115 -4.003 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -4.036 14.771 -4.166 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -5.230 13.932 -3.170 1.00 0.00 H new ATOM 748 N PRO A 46 -5.355 14.451 -10.941 1.00 0.00 N ATOM 749 CA PRO A 46 -5.272 15.727 -11.643 1.00 0.00 C ATOM 750 C PRO A 46 -4.038 16.511 -11.216 1.00 0.00 C ATOM 751 O PRO A 46 -3.622 17.450 -11.896 1.00 0.00 O ATOM 752 CB PRO A 46 -6.565 16.435 -11.223 1.00 0.00 C ATOM 753 CG PRO A 46 -6.880 15.858 -9.885 1.00 0.00 C ATOM 754 CD PRO A 46 -6.489 14.408 -10.001 1.00 0.00 C ATOM 0 HA PRO A 46 -5.178 15.621 -12.724 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -6.428 17.515 -11.169 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -7.369 16.251 -11.935 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -6.320 16.358 -9.095 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -7.938 15.966 -9.644 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -6.200 13.988 -9.037 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -7.308 13.797 -10.382 1.00 0.00 H new ATOM 762 N SER A 47 -3.457 16.121 -10.087 1.00 0.00 N ATOM 763 CA SER A 47 -2.251 16.769 -9.583 1.00 0.00 C ATOM 764 C SER A 47 -1.002 16.195 -10.239 1.00 0.00 C ATOM 765 O SER A 47 0.105 16.689 -10.026 1.00 0.00 O ATOM 766 CB SER A 47 -2.163 16.608 -8.078 1.00 0.00 C ATOM 767 OG SER A 47 -1.947 15.268 -7.728 1.00 0.00 O ATOM 0 H SER A 47 -3.801 15.359 -9.503 1.00 0.00 H new ATOM 0 HA SER A 47 -2.310 17.829 -9.830 1.00 0.00 H new ATOM 0 HB2 SER A 47 -1.352 17.224 -7.690 1.00 0.00 H new ATOM 0 HB3 SER A 47 -3.084 16.964 -7.616 1.00 0.00 H new ATOM 0 HG SER A 47 -1.892 15.189 -6.753 1.00 0.00 H new ATOM 773 N VAL A 48 -1.187 15.149 -11.037 1.00 0.00 N ATOM 774 CA VAL A 48 -0.073 14.495 -11.713 1.00 0.00 C ATOM 775 C VAL A 48 -0.029 14.868 -13.189 1.00 0.00 C ATOM 776 O VAL A 48 -1.055 14.871 -13.869 1.00 0.00 O ATOM 777 CB VAL A 48 -0.188 12.965 -11.576 1.00 0.00 C ATOM 778 CG1 VAL A 48 0.909 12.275 -12.374 1.00 0.00 C ATOM 779 CG2 VAL A 48 -0.118 12.570 -10.109 1.00 0.00 C ATOM 0 H VAL A 48 -2.099 14.736 -11.232 1.00 0.00 H new ATOM 0 HA VAL A 48 0.848 14.836 -11.239 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.150 12.645 -11.977 1.00 0.00 H new ATOM 0 HG11 VAL A 48 0.813 11.195 -12.266 1.00 0.00 H new ATOM 0 HG12 VAL A 48 0.818 12.544 -13.426 1.00 0.00 H new ATOM 0 HG13 VAL A 48 1.883 12.591 -12.002 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -0.200 11.487 -10.020 1.00 0.00 H new ATOM 0 HG22 VAL A 48 0.833 12.898 -9.689 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -0.937 13.042 -9.566 1.00 0.00 H new ATOM 789 N ASN A 49 1.165 15.181 -13.680 1.00 0.00 N ATOM 790 CA ASN A 49 1.342 15.574 -15.073 1.00 0.00 C ATOM 791 C ASN A 49 1.203 14.377 -16.005 1.00 0.00 C ATOM 792 O ASN A 49 1.430 13.236 -15.603 1.00 0.00 O ATOM 793 CB ASN A 49 2.687 16.251 -15.270 1.00 0.00 C ATOM 794 CG ASN A 49 2.766 17.588 -14.589 1.00 0.00 C ATOM 795 OD1 ASN A 49 1.774 18.323 -14.518 1.00 0.00 O ATOM 796 ND2 ASN A 49 3.928 17.920 -14.086 1.00 0.00 N ATOM 0 H ASN A 49 2.026 15.170 -13.133 1.00 0.00 H new ATOM 0 HA ASN A 49 0.556 16.286 -15.323 1.00 0.00 H new ATOM 0 HB2 ASN A 49 3.475 15.604 -14.885 1.00 0.00 H new ATOM 0 HB3 ASN A 49 2.872 16.379 -16.336 1.00 0.00 H new ATOM 0 HD21 ASN A 49 4.041 18.816 -13.612 1.00 0.00 H new ATOM 0 HD22 ASN A 49 4.720 17.282 -14.168 1.00 0.00 H new ATOM 803 N THR A 50 0.827 14.645 -17.251 1.00 0.00 N ATOM 804 CA THR A 50 0.575 13.585 -18.219 1.00 0.00 C ATOM 805 C THR A 50 1.856 12.832 -18.559 1.00 0.00 C ATOM 806 O THR A 50 1.822 11.647 -18.888 1.00 0.00 O ATOM 807 CB THR A 50 -0.050 14.149 -19.509 1.00 0.00 C ATOM 808 OG1 THR A 50 0.818 15.142 -20.069 1.00 0.00 O ATOM 809 CG2 THR A 50 -1.406 14.773 -19.215 1.00 0.00 C ATOM 0 H THR A 50 0.690 15.588 -17.614 1.00 0.00 H new ATOM 0 HA THR A 50 -0.129 12.891 -17.760 1.00 0.00 H new ATOM 0 HB THR A 50 -0.183 13.332 -20.218 1.00 0.00 H new ATOM 0 HG1 THR A 50 0.420 15.499 -20.890 1.00 0.00 H new ATOM 0 HG21 THR A 50 -1.833 15.166 -20.137 1.00 0.00 H new ATOM 0 HG22 THR A 50 -2.072 14.017 -18.800 1.00 0.00 H new ATOM 0 HG23 THR A 50 -1.285 15.584 -18.496 1.00 0.00 H new ATOM 817 N ARG A 51 2.984 13.529 -18.477 1.00 0.00 N ATOM 818 CA ARG A 51 4.289 12.890 -18.601 1.00 0.00 C ATOM 819 C ARG A 51 4.531 11.904 -17.466 1.00 0.00 C ATOM 820 O ARG A 51 5.014 10.794 -17.687 1.00 0.00 O ATOM 821 CB ARG A 51 5.397 13.933 -18.607 1.00 0.00 C ATOM 822 CG ARG A 51 6.805 13.370 -18.713 1.00 0.00 C ATOM 823 CD ARG A 51 7.824 14.448 -18.792 1.00 0.00 C ATOM 824 NE ARG A 51 9.178 13.920 -18.735 1.00 0.00 N ATOM 825 CZ ARG A 51 10.294 14.674 -18.759 1.00 0.00 C ATOM 826 NH1 ARG A 51 10.202 15.983 -18.838 1.00 0.00 N ATOM 827 NH2 ARG A 51 11.482 14.097 -18.703 1.00 0.00 N ATOM 0 H ARG A 51 3.021 14.537 -18.325 1.00 0.00 H new ATOM 0 HA ARG A 51 4.298 12.346 -19.545 1.00 0.00 H new ATOM 0 HB2 ARG A 51 5.230 14.615 -19.441 1.00 0.00 H new ATOM 0 HB3 ARG A 51 5.325 14.524 -17.694 1.00 0.00 H new ATOM 0 HG2 ARG A 51 7.010 12.738 -17.849 1.00 0.00 H new ATOM 0 HG3 ARG A 51 6.878 12.735 -19.596 1.00 0.00 H new ATOM 0 HD2 ARG A 51 7.691 15.006 -19.719 1.00 0.00 H new ATOM 0 HD3 ARG A 51 7.674 15.151 -17.972 1.00 0.00 H new ATOM 0 HE ARG A 51 9.290 12.908 -18.672 1.00 0.00 H new ATOM 0 HH11 ARG A 51 9.285 16.428 -18.881 1.00 0.00 H new ATOM 0 HH12 ARG A 51 11.047 16.553 -18.856 1.00 0.00 H new ATOM 0 HH21 ARG A 51 11.553 13.081 -18.642 1.00 0.00 H new ATOM 0 HH22 ARG A 51 12.327 14.667 -18.721 1.00 0.00 H new ATOM 841 N ARG A 52 4.191 12.316 -16.249 1.00 0.00 N ATOM 842 CA ARG A 52 4.351 11.461 -15.079 1.00 0.00 C ATOM 843 C ARG A 52 3.375 10.292 -15.113 1.00 0.00 C ATOM 844 O ARG A 52 3.685 9.199 -14.639 1.00 0.00 O ATOM 845 CB ARG A 52 4.137 12.259 -13.800 1.00 0.00 C ATOM 846 CG ARG A 52 5.226 13.274 -13.491 1.00 0.00 C ATOM 847 CD ARG A 52 4.923 14.046 -12.259 1.00 0.00 C ATOM 848 NE ARG A 52 5.960 15.021 -11.960 1.00 0.00 N ATOM 849 CZ ARG A 52 5.910 15.903 -10.944 1.00 0.00 C ATOM 850 NH1 ARG A 52 4.871 15.922 -10.139 1.00 0.00 N ATOM 851 NH2 ARG A 52 6.907 16.751 -10.756 1.00 0.00 N ATOM 0 H ARG A 52 3.803 13.237 -16.048 1.00 0.00 H new ATOM 0 HA ARG A 52 5.368 11.069 -15.096 1.00 0.00 H new ATOM 0 HB2 ARG A 52 3.183 12.781 -13.870 1.00 0.00 H new ATOM 0 HB3 ARG A 52 4.060 11.564 -12.964 1.00 0.00 H new ATOM 0 HG2 ARG A 52 6.180 12.760 -13.373 1.00 0.00 H new ATOM 0 HG3 ARG A 52 5.335 13.959 -14.332 1.00 0.00 H new ATOM 0 HD2 ARG A 52 3.968 14.557 -12.377 1.00 0.00 H new ATOM 0 HD3 ARG A 52 4.816 13.360 -11.418 1.00 0.00 H new ATOM 0 HE ARG A 52 6.783 15.038 -12.562 1.00 0.00 H new ATOM 0 HH11 ARG A 52 4.102 15.268 -10.284 1.00 0.00 H new ATOM 0 HH12 ARG A 52 4.834 16.591 -9.370 1.00 0.00 H new ATOM 0 HH21 ARG A 52 7.713 16.737 -11.381 1.00 0.00 H new ATOM 0 HH22 ARG A 52 6.870 17.419 -9.986 1.00 0.00 H new ATOM 865 N LYS A 53 2.195 10.528 -15.676 1.00 0.00 N ATOM 866 CA LYS A 53 1.220 9.465 -15.888 1.00 0.00 C ATOM 867 C LYS A 53 1.749 8.418 -16.860 1.00 0.00 C ATOM 868 O LYS A 53 1.586 7.218 -16.643 1.00 0.00 O ATOM 869 CB LYS A 53 -0.099 10.043 -16.403 1.00 0.00 C ATOM 870 CG LYS A 53 -0.887 10.832 -15.366 1.00 0.00 C ATOM 871 CD LYS A 53 -2.146 11.436 -15.972 1.00 0.00 C ATOM 872 CE LYS A 53 -2.932 12.230 -14.939 1.00 0.00 C ATOM 873 NZ LYS A 53 -4.104 12.921 -15.542 1.00 0.00 N ATOM 0 H LYS A 53 1.890 11.448 -15.994 1.00 0.00 H new ATOM 0 HA LYS A 53 1.042 8.979 -14.928 1.00 0.00 H new ATOM 0 HB2 LYS A 53 0.110 10.692 -17.254 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -0.721 9.226 -16.770 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -1.157 10.178 -14.537 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -0.261 11.625 -14.956 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -1.876 12.086 -16.804 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -2.773 10.642 -16.378 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -3.273 11.560 -14.149 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -2.277 12.966 -14.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -4.714 13.293 -14.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -3.775 13.706 -16.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -4.644 12.247 -16.122 1.00 0.00 H new ATOM 887 N LEU A 54 2.382 8.881 -17.932 1.00 0.00 N ATOM 888 CA LEU A 54 3.007 7.985 -18.899 1.00 0.00 C ATOM 889 C LEU A 54 3.996 7.046 -18.220 1.00 0.00 C ATOM 890 O LEU A 54 4.077 5.865 -18.557 1.00 0.00 O ATOM 891 CB LEU A 54 3.725 8.796 -19.985 1.00 0.00 C ATOM 892 CG LEU A 54 4.380 7.975 -21.104 1.00 0.00 C ATOM 893 CD1 LEU A 54 3.309 7.200 -21.859 1.00 0.00 C ATOM 894 CD2 LEU A 54 5.143 8.905 -22.036 1.00 0.00 C ATOM 0 H LEU A 54 2.476 9.872 -18.154 1.00 0.00 H new ATOM 0 HA LEU A 54 2.221 7.384 -19.356 1.00 0.00 H new ATOM 0 HB2 LEU A 54 3.007 9.482 -20.435 1.00 0.00 H new ATOM 0 HB3 LEU A 54 4.493 9.406 -19.509 1.00 0.00 H new ATOM 0 HG LEU A 54 5.085 7.261 -20.679 1.00 0.00 H new ATOM 0 HD11 LEU A 54 3.774 6.617 -22.654 1.00 0.00 H new ATOM 0 HD12 LEU A 54 2.792 6.530 -21.172 1.00 0.00 H new ATOM 0 HD13 LEU A 54 2.593 7.898 -22.293 1.00 0.00 H new ATOM 0 HD21 LEU A 54 5.608 8.322 -22.831 1.00 0.00 H new ATOM 0 HD22 LEU A 54 4.454 9.628 -22.472 1.00 0.00 H new ATOM 0 HD23 LEU A 54 5.914 9.432 -21.473 1.00 0.00 H new ATOM 906 N LEU A 55 4.748 7.578 -17.262 1.00 0.00 N ATOM 907 CA LEU A 55 5.698 6.777 -16.500 1.00 0.00 C ATOM 908 C LEU A 55 4.989 5.684 -15.711 1.00 0.00 C ATOM 909 O LEU A 55 5.455 4.547 -15.651 1.00 0.00 O ATOM 910 CB LEU A 55 6.497 7.671 -15.543 1.00 0.00 C ATOM 911 CG LEU A 55 7.438 8.684 -16.208 1.00 0.00 C ATOM 912 CD1 LEU A 55 8.040 9.592 -15.145 1.00 0.00 C ATOM 913 CD2 LEU A 55 8.524 7.942 -16.973 1.00 0.00 C ATOM 0 H LEU A 55 4.717 8.562 -16.995 1.00 0.00 H new ATOM 0 HA LEU A 55 6.379 6.303 -17.207 1.00 0.00 H new ATOM 0 HB2 LEU A 55 5.794 8.215 -14.912 1.00 0.00 H new ATOM 0 HB3 LEU A 55 7.087 7.032 -14.886 1.00 0.00 H new ATOM 0 HG LEU A 55 6.882 9.302 -16.913 1.00 0.00 H new ATOM 0 HD11 LEU A 55 8.709 10.312 -15.617 1.00 0.00 H new ATOM 0 HD12 LEU A 55 7.242 10.124 -14.626 1.00 0.00 H new ATOM 0 HD13 LEU A 55 8.601 8.992 -14.429 1.00 0.00 H new ATOM 0 HD21 LEU A 55 9.193 8.662 -17.446 1.00 0.00 H new ATOM 0 HD22 LEU A 55 9.092 7.317 -16.284 1.00 0.00 H new ATOM 0 HD23 LEU A 55 8.066 7.315 -17.738 1.00 0.00 H new ATOM 925 N GLY A 56 3.859 6.036 -15.107 1.00 0.00 N ATOM 926 CA GLY A 56 3.043 5.068 -14.384 1.00 0.00 C ATOM 927 C GLY A 56 2.499 3.997 -15.321 1.00 0.00 C ATOM 928 O GLY A 56 2.430 2.821 -14.962 1.00 0.00 O ATOM 0 H GLY A 56 3.487 6.986 -15.104 1.00 0.00 H new ATOM 0 HA2 GLY A 56 3.638 4.600 -13.600 1.00 0.00 H new ATOM 0 HA3 GLY A 56 2.215 5.580 -13.894 1.00 0.00 H new ATOM 932 N LEU A 57 2.113 4.410 -16.523 1.00 0.00 N ATOM 933 CA LEU A 57 1.687 3.473 -17.555 1.00 0.00 C ATOM 934 C LEU A 57 2.787 2.468 -17.874 1.00 0.00 C ATOM 935 O LEU A 57 2.535 1.267 -17.973 1.00 0.00 O ATOM 936 CB LEU A 57 1.293 4.230 -18.829 1.00 0.00 C ATOM 937 CG LEU A 57 0.848 3.359 -20.011 1.00 0.00 C ATOM 938 CD1 LEU A 57 -0.400 2.577 -19.624 1.00 0.00 C ATOM 939 CD2 LEU A 57 0.588 4.241 -21.223 1.00 0.00 C ATOM 0 H LEU A 57 2.086 5.389 -16.807 1.00 0.00 H new ATOM 0 HA LEU A 57 0.822 2.928 -17.176 1.00 0.00 H new ATOM 0 HB2 LEU A 57 0.484 4.919 -18.585 1.00 0.00 H new ATOM 0 HB3 LEU A 57 2.142 4.835 -19.147 1.00 0.00 H new ATOM 0 HG LEU A 57 1.634 2.648 -20.267 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -0.716 1.958 -20.464 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -0.179 1.941 -18.767 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -1.199 3.272 -19.364 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.272 3.622 -22.063 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.196 4.961 -20.988 1.00 0.00 H new ATOM 0 HD23 LEU A 57 1.501 4.773 -21.488 1.00 0.00 H new ATOM 951 N TYR A 58 4.008 2.967 -18.034 1.00 0.00 N ATOM 952 CA TYR A 58 5.157 2.109 -18.303 1.00 0.00 C ATOM 953 C TYR A 58 5.373 1.109 -17.175 1.00 0.00 C ATOM 954 O TYR A 58 5.708 -0.051 -17.417 1.00 0.00 O ATOM 955 CB TYR A 58 6.417 2.952 -18.513 1.00 0.00 C ATOM 956 CG TYR A 58 6.428 3.719 -19.817 1.00 0.00 C ATOM 957 CD1 TYR A 58 5.702 3.252 -20.902 1.00 0.00 C ATOM 958 CD2 TYR A 58 7.164 4.889 -19.927 1.00 0.00 C ATOM 959 CE1 TYR A 58 5.712 3.952 -22.093 1.00 0.00 C ATOM 960 CE2 TYR A 58 7.175 5.589 -21.117 1.00 0.00 C ATOM 961 CZ TYR A 58 6.452 5.124 -22.197 1.00 0.00 C ATOM 962 OH TYR A 58 6.463 5.822 -23.384 1.00 0.00 O ATOM 0 H TYR A 58 4.228 3.962 -17.982 1.00 0.00 H new ATOM 0 HA TYR A 58 4.951 1.550 -19.216 1.00 0.00 H new ATOM 0 HB2 TYR A 58 6.513 3.657 -17.687 1.00 0.00 H new ATOM 0 HB3 TYR A 58 7.289 2.299 -18.479 1.00 0.00 H new ATOM 0 HD1 TYR A 58 5.129 2.341 -20.816 1.00 0.00 H new ATOM 0 HD2 TYR A 58 7.729 5.253 -19.081 1.00 0.00 H new ATOM 0 HE1 TYR A 58 5.147 3.590 -22.940 1.00 0.00 H new ATOM 0 HE2 TYR A 58 7.749 6.500 -21.203 1.00 0.00 H new ATOM 0 HH TYR A 58 7.027 6.618 -23.290 1.00 0.00 H new ATOM 972 N LEU A 59 5.179 1.564 -15.942 1.00 0.00 N ATOM 973 CA LEU A 59 5.373 0.715 -14.772 1.00 0.00 C ATOM 974 C LEU A 59 4.459 -0.503 -14.818 1.00 0.00 C ATOM 975 O LEU A 59 4.912 -1.637 -14.663 1.00 0.00 O ATOM 976 CB LEU A 59 5.109 1.512 -13.489 1.00 0.00 C ATOM 977 CG LEU A 59 5.259 0.731 -12.177 1.00 0.00 C ATOM 978 CD1 LEU A 59 6.682 0.201 -12.061 1.00 0.00 C ATOM 979 CD2 LEU A 59 4.915 1.636 -11.004 1.00 0.00 C ATOM 0 H LEU A 59 4.887 2.517 -15.727 1.00 0.00 H new ATOM 0 HA LEU A 59 6.407 0.370 -14.777 1.00 0.00 H new ATOM 0 HB2 LEU A 59 5.791 2.362 -13.464 1.00 0.00 H new ATOM 0 HB3 LEU A 59 4.098 1.916 -13.536 1.00 0.00 H new ATOM 0 HG LEU A 59 4.574 -0.117 -12.168 1.00 0.00 H new ATOM 0 HD11 LEU A 59 6.789 -0.354 -11.129 1.00 0.00 H new ATOM 0 HD12 LEU A 59 6.894 -0.459 -12.902 1.00 0.00 H new ATOM 0 HD13 LEU A 59 7.383 1.036 -12.069 1.00 0.00 H new ATOM 0 HD21 LEU A 59 5.022 1.080 -10.072 1.00 0.00 H new ATOM 0 HD22 LEU A 59 5.589 2.492 -10.995 1.00 0.00 H new ATOM 0 HD23 LEU A 59 3.887 1.985 -11.103 1.00 0.00 H new ATOM 991 N MET A 60 3.170 -0.261 -15.030 1.00 0.00 N ATOM 992 CA MET A 60 2.191 -1.339 -15.113 1.00 0.00 C ATOM 993 C MET A 60 2.650 -2.426 -16.076 1.00 0.00 C ATOM 994 O MET A 60 2.636 -3.611 -15.743 1.00 0.00 O ATOM 995 CB MET A 60 0.833 -0.787 -15.539 1.00 0.00 C ATOM 996 CG MET A 60 -0.230 -1.849 -15.782 1.00 0.00 C ATOM 997 SD MET A 60 -1.782 -1.154 -16.384 1.00 0.00 S ATOM 998 CE MET A 60 -1.357 -0.800 -18.087 1.00 0.00 C ATOM 0 H MET A 60 2.778 0.673 -15.148 1.00 0.00 H new ATOM 0 HA MET A 60 2.095 -1.787 -14.124 1.00 0.00 H new ATOM 0 HB2 MET A 60 0.476 -0.102 -14.770 1.00 0.00 H new ATOM 0 HB3 MET A 60 0.961 -0.204 -16.451 1.00 0.00 H new ATOM 0 HG2 MET A 60 0.144 -2.573 -16.506 1.00 0.00 H new ATOM 0 HG3 MET A 60 -0.415 -2.391 -14.855 1.00 0.00 H new ATOM 0 HE1 MET A 60 -1.622 0.231 -18.321 1.00 0.00 H new ATOM 0 HE2 MET A 60 -0.286 -0.941 -18.232 1.00 0.00 H new ATOM 0 HE3 MET A 60 -1.904 -1.474 -18.746 1.00 0.00 H new ATOM 1008 N ASN A 61 3.055 -2.016 -17.273 1.00 0.00 N ATOM 1009 CA ASN A 61 3.527 -2.954 -18.285 1.00 0.00 C ATOM 1010 C ASN A 61 4.652 -3.827 -17.744 1.00 0.00 C ATOM 1011 O ASN A 61 4.671 -5.038 -17.964 1.00 0.00 O ATOM 1012 CB ASN A 61 3.978 -2.213 -19.531 1.00 0.00 C ATOM 1013 CG ASN A 61 4.376 -3.143 -20.643 1.00 0.00 C ATOM 1014 OD1 ASN A 61 3.708 -4.152 -20.895 1.00 0.00 O ATOM 1015 ND2 ASN A 61 5.453 -2.823 -21.314 1.00 0.00 N ATOM 0 H ASN A 61 3.066 -1.039 -17.566 1.00 0.00 H new ATOM 0 HA ASN A 61 2.695 -3.606 -18.552 1.00 0.00 H new ATOM 0 HB2 ASN A 61 3.172 -1.564 -19.875 1.00 0.00 H new ATOM 0 HB3 ASN A 61 4.821 -1.569 -19.281 1.00 0.00 H new ATOM 0 HD21 ASN A 61 5.772 -3.416 -22.080 1.00 0.00 H new ATOM 0 HD22 ASN A 61 5.974 -1.980 -21.071 1.00 0.00 H new ATOM 1022 N HIS A 62 5.589 -3.205 -17.037 1.00 0.00 N ATOM 1023 CA HIS A 62 6.734 -3.920 -16.486 1.00 0.00 C ATOM 1024 C HIS A 62 6.309 -4.865 -15.369 1.00 0.00 C ATOM 1025 O HIS A 62 6.795 -5.992 -15.277 1.00 0.00 O ATOM 1026 CB HIS A 62 7.784 -2.937 -15.958 1.00 0.00 C ATOM 1027 CG HIS A 62 8.469 -2.154 -17.035 1.00 0.00 C ATOM 1028 ND1 HIS A 62 9.401 -1.174 -16.763 1.00 0.00 N ATOM 1029 CD2 HIS A 62 8.358 -2.205 -18.383 1.00 0.00 C ATOM 1030 CE1 HIS A 62 9.835 -0.657 -17.900 1.00 0.00 C ATOM 1031 NE2 HIS A 62 9.217 -1.264 -18.896 1.00 0.00 N ATOM 0 H HIS A 62 5.578 -2.206 -16.832 1.00 0.00 H new ATOM 0 HA HIS A 62 7.171 -4.510 -17.292 1.00 0.00 H new ATOM 0 HB2 HIS A 62 7.305 -2.244 -15.266 1.00 0.00 H new ATOM 0 HB3 HIS A 62 8.533 -3.489 -15.390 1.00 0.00 H new ATOM 0 HD2 HIS A 62 7.715 -2.862 -18.949 1.00 0.00 H new ATOM 0 HE1 HIS A 62 10.570 0.128 -17.997 1.00 0.00 H new ATOM 0 HE2 HIS A 62 9.355 -1.066 -19.887 1.00 0.00 H new ATOM 1039 N VAL A 63 5.398 -4.398 -14.522 1.00 0.00 N ATOM 1040 CA VAL A 63 4.957 -5.173 -13.368 1.00 0.00 C ATOM 1041 C VAL A 63 4.280 -6.467 -13.800 1.00 0.00 C ATOM 1042 O VAL A 63 4.637 -7.551 -13.338 1.00 0.00 O ATOM 1043 CB VAL A 63 3.980 -4.347 -12.511 1.00 0.00 C ATOM 1044 CG1 VAL A 63 3.333 -5.222 -11.447 1.00 0.00 C ATOM 1045 CG2 VAL A 63 4.712 -3.176 -11.874 1.00 0.00 C ATOM 0 H VAL A 63 4.950 -3.486 -14.613 1.00 0.00 H new ATOM 0 HA VAL A 63 5.840 -5.421 -12.779 1.00 0.00 H new ATOM 0 HB VAL A 63 3.190 -3.957 -13.153 1.00 0.00 H new ATOM 0 HG11 VAL A 63 2.646 -4.622 -10.851 1.00 0.00 H new ATOM 0 HG12 VAL A 63 2.784 -6.033 -11.927 1.00 0.00 H new ATOM 0 HG13 VAL A 63 4.105 -5.639 -10.800 1.00 0.00 H new ATOM 0 HG21 VAL A 63 4.014 -2.596 -11.269 1.00 0.00 H new ATOM 0 HG22 VAL A 63 5.516 -3.551 -11.241 1.00 0.00 H new ATOM 0 HG23 VAL A 63 5.131 -2.541 -12.654 1.00 0.00 H new ATOM 1055 N VAL A 64 3.300 -6.348 -14.689 1.00 0.00 N ATOM 1056 CA VAL A 64 2.482 -7.488 -15.085 1.00 0.00 C ATOM 1057 C VAL A 64 3.275 -8.463 -15.947 1.00 0.00 C ATOM 1058 O VAL A 64 3.155 -9.678 -15.796 1.00 0.00 O ATOM 1059 CB VAL A 64 1.241 -7.011 -15.864 1.00 0.00 C ATOM 1060 CG1 VAL A 64 0.421 -8.201 -16.340 1.00 0.00 C ATOM 1061 CG2 VAL A 64 0.402 -6.092 -14.990 1.00 0.00 C ATOM 0 H VAL A 64 3.053 -5.472 -15.150 1.00 0.00 H new ATOM 0 HA VAL A 64 2.168 -8.001 -14.176 1.00 0.00 H new ATOM 0 HB VAL A 64 1.567 -6.454 -16.742 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -0.452 -7.846 -16.888 1.00 0.00 H new ATOM 0 HG12 VAL A 64 1.031 -8.825 -16.993 1.00 0.00 H new ATOM 0 HG13 VAL A 64 0.096 -8.786 -15.480 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -0.473 -5.759 -15.548 1.00 0.00 H new ATOM 0 HG22 VAL A 64 0.081 -6.631 -14.099 1.00 0.00 H new ATOM 0 HG23 VAL A 64 0.996 -5.227 -14.697 1.00 0.00 H new ATOM 1071 N GLN A 65 4.085 -7.921 -16.850 1.00 0.00 N ATOM 1072 CA GLN A 65 4.954 -8.740 -17.688 1.00 0.00 C ATOM 1073 C GLN A 65 5.907 -9.575 -16.843 1.00 0.00 C ATOM 1074 O GLN A 65 6.056 -10.777 -17.063 1.00 0.00 O ATOM 1075 CB GLN A 65 5.748 -7.860 -18.657 1.00 0.00 C ATOM 1076 CG GLN A 65 6.639 -8.634 -19.613 1.00 0.00 C ATOM 1077 CD GLN A 65 7.306 -7.736 -20.638 1.00 0.00 C ATOM 1078 OE1 GLN A 65 6.664 -6.865 -21.232 1.00 0.00 O ATOM 1079 NE2 GLN A 65 8.600 -7.942 -20.851 1.00 0.00 N ATOM 0 H GLN A 65 4.158 -6.918 -17.021 1.00 0.00 H new ATOM 0 HA GLN A 65 4.321 -9.418 -18.260 1.00 0.00 H new ATOM 0 HB2 GLN A 65 5.050 -7.256 -19.237 1.00 0.00 H new ATOM 0 HB3 GLN A 65 6.365 -7.170 -18.081 1.00 0.00 H new ATOM 0 HG2 GLN A 65 7.404 -9.163 -19.045 1.00 0.00 H new ATOM 0 HG3 GLN A 65 6.045 -9.389 -20.128 1.00 0.00 H new ATOM 0 HE21 GLN A 65 9.091 -8.674 -20.337 1.00 0.00 H new ATOM 0 HE22 GLN A 65 9.103 -7.369 -21.528 1.00 0.00 H new ATOM 1088 N GLN A 66 6.551 -8.931 -15.876 1.00 0.00 N ATOM 1089 CA GLN A 66 7.446 -9.625 -14.958 1.00 0.00 C ATOM 1090 C GLN A 66 6.678 -10.586 -14.059 1.00 0.00 C ATOM 1091 O GLN A 66 7.157 -11.675 -13.745 1.00 0.00 O ATOM 1092 CB GLN A 66 8.223 -8.619 -14.103 1.00 0.00 C ATOM 1093 CG GLN A 66 9.251 -7.810 -14.875 1.00 0.00 C ATOM 1094 CD GLN A 66 9.887 -6.724 -14.029 1.00 0.00 C ATOM 1095 OE1 GLN A 66 9.367 -6.357 -12.971 1.00 0.00 O ATOM 1096 NE2 GLN A 66 11.018 -6.202 -14.489 1.00 0.00 N ATOM 0 H GLN A 66 6.470 -7.928 -15.708 1.00 0.00 H new ATOM 0 HA GLN A 66 8.150 -10.204 -15.556 1.00 0.00 H new ATOM 0 HB2 GLN A 66 7.516 -7.935 -13.634 1.00 0.00 H new ATOM 0 HB3 GLN A 66 8.728 -9.155 -13.299 1.00 0.00 H new ATOM 0 HG2 GLN A 66 10.028 -8.477 -15.249 1.00 0.00 H new ATOM 0 HG3 GLN A 66 8.774 -7.357 -15.744 1.00 0.00 H new ATOM 0 HE21 GLN A 66 11.413 -6.535 -15.368 1.00 0.00 H new ATOM 0 HE22 GLN A 66 11.492 -5.468 -13.963 1.00 0.00 H new ATOM 1105 N ALA A 67 5.482 -10.176 -13.649 1.00 0.00 N ATOM 1106 CA ALA A 67 4.618 -11.025 -12.838 1.00 0.00 C ATOM 1107 C ALA A 67 4.346 -12.355 -13.530 1.00 0.00 C ATOM 1108 O ALA A 67 4.343 -13.408 -12.893 1.00 0.00 O ATOM 1109 CB ALA A 67 3.310 -10.311 -12.532 1.00 0.00 C ATOM 0 H ALA A 67 5.089 -9.260 -13.866 1.00 0.00 H new ATOM 0 HA ALA A 67 5.134 -11.232 -11.901 1.00 0.00 H new ATOM 0 HB1 ALA A 67 2.676 -10.958 -11.926 1.00 0.00 H new ATOM 0 HB2 ALA A 67 3.517 -9.391 -11.986 1.00 0.00 H new ATOM 0 HB3 ALA A 67 2.799 -10.072 -13.465 1.00 0.00 H new ATOM 1115 N LYS A 68 4.116 -12.299 -14.837 1.00 0.00 N ATOM 1116 CA LYS A 68 3.950 -13.507 -15.638 1.00 0.00 C ATOM 1117 C LYS A 68 5.160 -14.423 -15.509 1.00 0.00 C ATOM 1118 O LYS A 68 5.018 -15.637 -15.364 1.00 0.00 O ATOM 1119 CB LYS A 68 3.716 -13.148 -17.106 1.00 0.00 C ATOM 1120 CG LYS A 68 2.335 -12.578 -17.402 1.00 0.00 C ATOM 1121 CD LYS A 68 2.222 -12.127 -18.851 1.00 0.00 C ATOM 1122 CE LYS A 68 2.384 -13.298 -19.809 1.00 0.00 C ATOM 1123 NZ LYS A 68 2.288 -12.870 -21.231 1.00 0.00 N ATOM 0 H LYS A 68 4.040 -11.430 -15.365 1.00 0.00 H new ATOM 0 HA LYS A 68 3.077 -14.040 -15.261 1.00 0.00 H new ATOM 0 HB2 LYS A 68 4.469 -12.423 -17.414 1.00 0.00 H new ATOM 0 HB3 LYS A 68 3.865 -14.040 -17.714 1.00 0.00 H new ATOM 0 HG2 LYS A 68 1.576 -13.332 -17.193 1.00 0.00 H new ATOM 0 HG3 LYS A 68 2.138 -11.735 -16.740 1.00 0.00 H new ATOM 0 HD2 LYS A 68 1.253 -11.654 -19.012 1.00 0.00 H new ATOM 0 HD3 LYS A 68 2.983 -11.375 -19.060 1.00 0.00 H new ATOM 0 HE2 LYS A 68 3.349 -13.776 -19.638 1.00 0.00 H new ATOM 0 HE3 LYS A 68 1.617 -14.045 -19.602 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 2.471 -13.684 -21.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 1.335 -12.499 -21.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 2.991 -12.127 -21.418 1.00 0.00 H new ATOM 1137 N GLY A 69 6.350 -13.835 -15.563 1.00 0.00 N ATOM 1138 CA GLY A 69 7.587 -14.593 -15.415 1.00 0.00 C ATOM 1139 C GLY A 69 7.727 -15.149 -14.004 1.00 0.00 C ATOM 1140 O GLY A 69 8.421 -16.141 -13.783 1.00 0.00 O ATOM 0 H GLY A 69 6.484 -12.834 -15.708 1.00 0.00 H new ATOM 0 HA2 GLY A 69 7.603 -15.412 -16.135 1.00 0.00 H new ATOM 0 HA3 GLY A 69 8.439 -13.952 -15.642 1.00 0.00 H new ATOM 1144 N GLN A 70 7.063 -14.503 -13.051 1.00 0.00 N ATOM 1145 CA GLN A 70 7.083 -14.953 -11.664 1.00 0.00 C ATOM 1146 C GLN A 70 5.917 -15.890 -11.372 1.00 0.00 C ATOM 1147 O GLN A 70 5.702 -16.291 -10.228 1.00 0.00 O ATOM 1148 CB GLN A 70 7.043 -13.756 -10.711 1.00 0.00 C ATOM 1149 CG GLN A 70 8.242 -12.830 -10.824 1.00 0.00 C ATOM 1150 CD GLN A 70 9.545 -13.528 -10.482 1.00 0.00 C ATOM 1151 OE1 GLN A 70 9.656 -14.196 -9.451 1.00 0.00 O ATOM 1152 NE2 GLN A 70 10.540 -13.376 -11.349 1.00 0.00 N ATOM 0 H GLN A 70 6.504 -13.666 -13.214 1.00 0.00 H new ATOM 0 HA GLN A 70 8.011 -15.502 -11.506 1.00 0.00 H new ATOM 0 HB2 GLN A 70 6.136 -13.183 -10.903 1.00 0.00 H new ATOM 0 HB3 GLN A 70 6.977 -14.123 -9.687 1.00 0.00 H new ATOM 0 HG2 GLN A 70 8.299 -12.436 -11.839 1.00 0.00 H new ATOM 0 HG3 GLN A 70 8.104 -11.978 -10.159 1.00 0.00 H new ATOM 0 HE21 GLN A 70 10.403 -12.814 -12.189 1.00 0.00 H new ATOM 0 HE22 GLN A 70 11.441 -13.821 -11.175 1.00 0.00 H new ATOM 1161 N LYS A 71 5.167 -16.235 -12.413 1.00 0.00 N ATOM 1162 CA LYS A 71 4.002 -17.100 -12.265 1.00 0.00 C ATOM 1163 C LYS A 71 2.939 -16.447 -11.391 1.00 0.00 C ATOM 1164 O LYS A 71 2.256 -17.122 -10.620 1.00 0.00 O ATOM 1165 CB LYS A 71 4.411 -18.451 -11.677 1.00 0.00 C ATOM 1166 CG LYS A 71 5.444 -19.209 -12.500 1.00 0.00 C ATOM 1167 CD LYS A 71 5.740 -20.573 -11.894 1.00 0.00 C ATOM 1168 CE LYS A 71 6.802 -21.315 -12.692 1.00 0.00 C ATOM 1169 NZ LYS A 71 7.126 -22.638 -12.092 1.00 0.00 N ATOM 0 H LYS A 71 5.345 -15.929 -13.369 1.00 0.00 H new ATOM 0 HA LYS A 71 3.576 -17.260 -13.256 1.00 0.00 H new ATOM 0 HB2 LYS A 71 4.809 -18.292 -10.675 1.00 0.00 H new ATOM 0 HB3 LYS A 71 3.521 -19.072 -11.572 1.00 0.00 H new ATOM 0 HG2 LYS A 71 5.080 -19.333 -13.520 1.00 0.00 H new ATOM 0 HG3 LYS A 71 6.364 -18.627 -12.558 1.00 0.00 H new ATOM 0 HD2 LYS A 71 6.076 -20.450 -10.864 1.00 0.00 H new ATOM 0 HD3 LYS A 71 4.826 -21.165 -11.863 1.00 0.00 H new ATOM 0 HE2 LYS A 71 6.454 -21.456 -13.715 1.00 0.00 H new ATOM 0 HE3 LYS A 71 7.706 -20.709 -12.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 7.853 -23.111 -12.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 7.482 -22.502 -11.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 6.269 -23.227 -12.066 1.00 0.00 H new ATOM 1183 N ILE A 72 2.804 -15.131 -11.515 1.00 0.00 N ATOM 1184 CA ILE A 72 1.815 -14.387 -10.745 1.00 0.00 C ATOM 1185 C ILE A 72 0.717 -13.835 -11.646 1.00 0.00 C ATOM 1186 O ILE A 72 0.984 -13.052 -12.557 1.00 0.00 O ATOM 1187 CB ILE A 72 2.476 -13.230 -9.974 1.00 0.00 C ATOM 1188 CG1 ILE A 72 3.534 -13.770 -9.007 1.00 0.00 C ATOM 1189 CG2 ILE A 72 1.428 -12.423 -9.224 1.00 0.00 C ATOM 1190 CD1 ILE A 72 4.414 -12.698 -8.405 1.00 0.00 C ATOM 0 H ILE A 72 3.368 -14.557 -12.142 1.00 0.00 H new ATOM 0 HA ILE A 72 1.369 -15.081 -10.033 1.00 0.00 H new ATOM 0 HB ILE A 72 2.967 -12.572 -10.690 1.00 0.00 H new ATOM 0 HG12 ILE A 72 3.035 -14.312 -8.203 1.00 0.00 H new ATOM 0 HG13 ILE A 72 4.162 -14.489 -9.534 1.00 0.00 H new ATOM 0 HG21 ILE A 72 1.913 -11.609 -8.685 1.00 0.00 H new ATOM 0 HG22 ILE A 72 0.710 -12.011 -9.933 1.00 0.00 H new ATOM 0 HG23 ILE A 72 0.909 -13.069 -8.516 1.00 0.00 H new ATOM 0 HD11 ILE A 72 5.138 -13.157 -7.732 1.00 0.00 H new ATOM 0 HD12 ILE A 72 4.942 -12.171 -9.200 1.00 0.00 H new ATOM 0 HD13 ILE A 72 3.798 -11.992 -7.849 1.00 0.00 H new ATOM 1202 N ILE A 73 -0.519 -14.248 -11.386 1.00 0.00 N ATOM 1203 CA ILE A 73 -1.661 -13.784 -12.163 1.00 0.00 C ATOM 1204 C ILE A 73 -2.451 -12.725 -11.404 1.00 0.00 C ATOM 1205 O ILE A 73 -3.427 -12.178 -11.917 1.00 0.00 O ATOM 1206 CB ILE A 73 -2.591 -14.957 -12.526 1.00 0.00 C ATOM 1207 CG1 ILE A 73 -3.201 -15.566 -11.261 1.00 0.00 C ATOM 1208 CG2 ILE A 73 -1.833 -16.012 -13.317 1.00 0.00 C ATOM 1209 CD1 ILE A 73 -4.303 -16.564 -11.534 1.00 0.00 C ATOM 0 H ILE A 73 -0.755 -14.904 -10.642 1.00 0.00 H new ATOM 0 HA ILE A 73 -1.271 -13.341 -13.079 1.00 0.00 H new ATOM 0 HB ILE A 73 -3.400 -14.577 -13.150 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -2.413 -16.056 -10.689 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -3.596 -14.764 -10.637 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -2.505 -16.833 -13.565 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -1.446 -15.570 -14.235 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -1.004 -16.390 -12.718 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -4.685 -16.952 -10.590 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -5.110 -16.075 -12.079 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -3.909 -17.387 -12.131 1.00 0.00 H new ATOM 1221 N GLN A 74 -2.022 -12.440 -10.179 1.00 0.00 N ATOM 1222 CA GLN A 74 -2.731 -11.501 -9.319 1.00 0.00 C ATOM 1223 C GLN A 74 -2.648 -10.082 -9.866 1.00 0.00 C ATOM 1224 O GLN A 74 -3.616 -9.324 -9.804 1.00 0.00 O ATOM 1225 CB GLN A 74 -2.168 -11.546 -7.896 1.00 0.00 C ATOM 1226 CG GLN A 74 -2.397 -12.865 -7.177 1.00 0.00 C ATOM 1227 CD GLN A 74 -3.870 -13.208 -7.054 1.00 0.00 C ATOM 1228 OE1 GLN A 74 -4.692 -12.358 -6.702 1.00 0.00 O ATOM 1229 NE2 GLN A 74 -4.211 -14.458 -7.344 1.00 0.00 N ATOM 0 H GLN A 74 -1.186 -12.847 -9.760 1.00 0.00 H new ATOM 0 HA GLN A 74 -3.779 -11.799 -9.296 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -1.097 -11.347 -7.935 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -2.620 -10.744 -7.313 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -1.885 -13.663 -7.715 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -1.954 -12.815 -6.182 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -3.497 -15.128 -7.631 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -5.187 -14.748 -7.280 1.00 0.00 H new ATOM 1238 N PHE A 75 -1.485 -9.728 -10.403 1.00 0.00 N ATOM 1239 CA PHE A 75 -1.279 -8.405 -10.980 1.00 0.00 C ATOM 1240 C PHE A 75 -2.020 -8.259 -12.303 1.00 0.00 C ATOM 1241 O PHE A 75 -2.571 -7.200 -12.603 1.00 0.00 O ATOM 1242 CB PHE A 75 0.213 -8.142 -11.193 1.00 0.00 C ATOM 1243 CG PHE A 75 0.968 -7.865 -9.924 1.00 0.00 C ATOM 1244 CD1 PHE A 75 1.820 -8.818 -9.386 1.00 0.00 C ATOM 1245 CD2 PHE A 75 0.826 -6.653 -9.266 1.00 0.00 C ATOM 1246 CE1 PHE A 75 2.515 -8.564 -8.218 1.00 0.00 C ATOM 1247 CE2 PHE A 75 1.520 -6.397 -8.099 1.00 0.00 C ATOM 1248 CZ PHE A 75 2.365 -7.354 -7.575 1.00 0.00 C ATOM 0 H PHE A 75 -0.670 -10.340 -10.450 1.00 0.00 H new ATOM 0 HA PHE A 75 -1.677 -7.672 -10.279 1.00 0.00 H new ATOM 0 HB2 PHE A 75 0.657 -9.006 -11.688 1.00 0.00 H new ATOM 0 HB3 PHE A 75 0.330 -7.293 -11.867 1.00 0.00 H new ATOM 0 HD1 PHE A 75 1.942 -9.768 -9.885 1.00 0.00 H new ATOM 0 HD2 PHE A 75 0.165 -5.900 -9.670 1.00 0.00 H new ATOM 0 HE1 PHE A 75 3.176 -9.314 -7.809 1.00 0.00 H new ATOM 0 HE2 PHE A 75 1.401 -5.448 -7.597 1.00 0.00 H new ATOM 0 HZ PHE A 75 2.908 -7.155 -6.663 1.00 0.00 H new ATOM 1258 N GLN A 76 -2.029 -9.328 -13.091 1.00 0.00 N ATOM 1259 CA GLN A 76 -2.733 -9.333 -14.367 1.00 0.00 C ATOM 1260 C GLN A 76 -4.208 -8.998 -14.184 1.00 0.00 C ATOM 1261 O GLN A 76 -4.746 -8.128 -14.869 1.00 0.00 O ATOM 1262 CB GLN A 76 -2.588 -10.694 -15.054 1.00 0.00 C ATOM 1263 CG GLN A 76 -3.268 -10.782 -16.410 1.00 0.00 C ATOM 1264 CD GLN A 76 -3.086 -12.140 -17.061 1.00 0.00 C ATOM 1265 OE1 GLN A 76 -3.556 -13.159 -16.547 1.00 0.00 O ATOM 1266 NE2 GLN A 76 -2.401 -12.163 -18.199 1.00 0.00 N ATOM 0 H GLN A 76 -1.556 -10.204 -12.868 1.00 0.00 H new ATOM 0 HA GLN A 76 -2.283 -8.566 -14.998 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -1.528 -10.916 -15.177 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -3.001 -11.464 -14.402 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -4.332 -10.578 -16.294 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -2.865 -10.011 -17.066 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -2.030 -11.296 -18.589 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -2.246 -13.047 -18.683 1.00 0.00 H new ATOM 1275 N ASP A 77 -4.857 -9.693 -13.256 1.00 0.00 N ATOM 1276 CA ASP A 77 -6.275 -9.481 -12.992 1.00 0.00 C ATOM 1277 C ASP A 77 -6.514 -8.142 -12.306 1.00 0.00 C ATOM 1278 O ASP A 77 -7.461 -7.427 -12.632 1.00 0.00 O ATOM 1279 CB ASP A 77 -6.834 -10.612 -12.125 1.00 0.00 C ATOM 1280 CG ASP A 77 -6.953 -11.931 -12.877 1.00 0.00 C ATOM 1281 OD1 ASP A 77 -6.884 -11.914 -14.083 1.00 0.00 O ATOM 1282 OD2 ASP A 77 -7.113 -12.943 -12.238 1.00 0.00 O ATOM 0 H ASP A 77 -4.423 -10.409 -12.673 1.00 0.00 H new ATOM 0 HA ASP A 77 -6.792 -9.475 -13.951 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -6.189 -10.751 -11.258 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -7.816 -10.324 -11.749 1.00 0.00 H new ATOM 1287 N SER A 78 -5.649 -7.808 -11.355 1.00 0.00 N ATOM 1288 CA SER A 78 -5.799 -6.583 -10.579 1.00 0.00 C ATOM 1289 C SER A 78 -5.695 -5.351 -11.468 1.00 0.00 C ATOM 1290 O SER A 78 -6.494 -4.422 -11.355 1.00 0.00 O ATOM 1291 CB SER A 78 -4.745 -6.522 -9.490 1.00 0.00 C ATOM 1292 OG SER A 78 -4.947 -7.531 -8.539 1.00 0.00 O ATOM 0 H SER A 78 -4.836 -8.369 -11.103 1.00 0.00 H new ATOM 0 HA SER A 78 -6.789 -6.593 -10.124 1.00 0.00 H new ATOM 0 HB2 SER A 78 -3.754 -6.627 -9.932 1.00 0.00 H new ATOM 0 HB3 SER A 78 -4.776 -5.547 -9.003 1.00 0.00 H new ATOM 0 HG SER A 78 -4.352 -8.286 -8.732 1.00 0.00 H new ATOM 1298 N PHE A 79 -4.704 -5.349 -12.354 1.00 0.00 N ATOM 1299 CA PHE A 79 -4.501 -4.236 -13.274 1.00 0.00 C ATOM 1300 C PHE A 79 -5.528 -4.257 -14.399 1.00 0.00 C ATOM 1301 O PHE A 79 -6.064 -3.217 -14.782 1.00 0.00 O ATOM 1302 CB PHE A 79 -3.090 -4.281 -13.864 1.00 0.00 C ATOM 1303 CG PHE A 79 -2.048 -3.639 -12.993 1.00 0.00 C ATOM 1304 CD1 PHE A 79 -1.077 -4.407 -12.368 1.00 0.00 C ATOM 1305 CD2 PHE A 79 -2.038 -2.267 -12.797 1.00 0.00 C ATOM 1306 CE1 PHE A 79 -0.118 -3.817 -11.567 1.00 0.00 C ATOM 1307 CE2 PHE A 79 -1.080 -1.674 -11.997 1.00 0.00 C ATOM 1308 CZ PHE A 79 -0.119 -2.451 -11.381 1.00 0.00 C ATOM 0 H PHE A 79 -4.028 -6.107 -12.454 1.00 0.00 H new ATOM 0 HA PHE A 79 -4.626 -3.312 -12.709 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -2.813 -5.320 -14.040 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -3.096 -3.784 -14.834 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.070 -5.478 -12.509 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -2.788 -1.654 -13.275 1.00 0.00 H new ATOM 0 HE1 PHE A 79 0.633 -4.426 -11.086 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -1.083 -0.604 -11.854 1.00 0.00 H new ATOM 0 HZ PHE A 79 0.630 -1.990 -10.755 1.00 0.00 H new ATOM 1318 N GLY A 80 -5.799 -5.447 -14.924 1.00 0.00 N ATOM 1319 CA GLY A 80 -6.741 -5.601 -16.026 1.00 0.00 C ATOM 1320 C GLY A 80 -8.130 -5.112 -15.637 1.00 0.00 C ATOM 1321 O GLY A 80 -8.873 -4.595 -16.471 1.00 0.00 O ATOM 0 H GLY A 80 -5.379 -6.320 -14.604 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -6.386 -5.043 -16.892 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -6.791 -6.649 -16.321 1.00 0.00 H new ATOM 1325 N LYS A 81 -8.475 -5.278 -14.364 1.00 0.00 N ATOM 1326 CA LYS A 81 -9.758 -4.813 -13.852 1.00 0.00 C ATOM 1327 C LYS A 81 -9.936 -3.318 -14.085 1.00 0.00 C ATOM 1328 O LYS A 81 -11.034 -2.855 -14.392 1.00 0.00 O ATOM 1329 CB LYS A 81 -9.887 -5.132 -12.362 1.00 0.00 C ATOM 1330 CG LYS A 81 -11.215 -4.717 -11.742 1.00 0.00 C ATOM 1331 CD LYS A 81 -11.291 -5.121 -10.277 1.00 0.00 C ATOM 1332 CE LYS A 81 -12.603 -4.676 -9.647 1.00 0.00 C ATOM 1333 NZ LYS A 81 -12.692 -5.065 -8.214 1.00 0.00 N ATOM 0 H LYS A 81 -7.883 -5.732 -13.668 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.543 -5.338 -14.396 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -9.753 -6.204 -12.220 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -9.079 -4.636 -11.825 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -11.339 -3.638 -11.831 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -12.035 -5.178 -12.292 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -11.192 -6.203 -10.191 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -10.456 -4.680 -9.732 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -12.699 -3.594 -9.736 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -13.436 -5.116 -10.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -13.600 -4.743 -7.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -12.626 -6.100 -8.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -11.912 -4.624 -7.686 1.00 0.00 H new ATOM 1347 N VAL A 82 -8.850 -2.568 -13.937 1.00 0.00 N ATOM 1348 CA VAL A 82 -8.918 -1.112 -13.942 1.00 0.00 C ATOM 1349 C VAL A 82 -8.258 -0.534 -15.187 1.00 0.00 C ATOM 1350 O VAL A 82 -8.423 0.646 -15.498 1.00 0.00 O ATOM 1351 CB VAL A 82 -8.230 -0.541 -12.688 1.00 0.00 C ATOM 1352 CG1 VAL A 82 -8.929 -1.029 -11.428 1.00 0.00 C ATOM 1353 CG2 VAL A 82 -6.761 -0.935 -12.677 1.00 0.00 C ATOM 0 H VAL A 82 -7.911 -2.945 -13.812 1.00 0.00 H new ATOM 0 HA VAL A 82 -9.971 -0.830 -13.942 1.00 0.00 H new ATOM 0 HB VAL A 82 -8.298 0.547 -12.712 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -8.430 -0.616 -10.552 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -9.969 -0.704 -11.440 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -8.890 -2.118 -11.388 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -6.282 -0.527 -11.787 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -6.676 -2.022 -12.670 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -6.271 -0.539 -13.567 1.00 0.00 H new ATOM 1363 N ALA A 83 -7.509 -1.371 -15.897 1.00 0.00 N ATOM 1364 CA ALA A 83 -6.771 -0.930 -17.074 1.00 0.00 C ATOM 1365 C ALA A 83 -7.708 -0.348 -18.125 1.00 0.00 C ATOM 1366 O ALA A 83 -7.455 0.726 -18.670 1.00 0.00 O ATOM 1367 CB ALA A 83 -5.969 -2.082 -17.660 1.00 0.00 C ATOM 0 H ALA A 83 -7.397 -2.361 -15.677 1.00 0.00 H new ATOM 0 HA ALA A 83 -6.082 -0.144 -16.764 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -5.424 -1.736 -18.538 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -5.263 -2.449 -16.916 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -6.645 -2.887 -17.947 1.00 0.00 H new ATOM 1373 N ALA A 84 -8.791 -1.064 -18.406 1.00 0.00 N ATOM 1374 CA ALA A 84 -9.742 -0.646 -19.430 1.00 0.00 C ATOM 1375 C ALA A 84 -10.254 0.763 -19.164 1.00 0.00 C ATOM 1376 O ALA A 84 -10.234 1.619 -20.049 1.00 0.00 O ATOM 1377 CB ALA A 84 -10.904 -1.626 -19.506 1.00 0.00 C ATOM 0 H ALA A 84 -9.033 -1.938 -17.939 1.00 0.00 H new ATOM 0 HA ALA A 84 -9.223 -0.640 -20.388 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -11.605 -1.300 -20.275 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -10.528 -2.618 -19.755 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -11.413 -1.662 -18.543 1.00 0.00 H new ATOM 1383 N GLU A 85 -10.713 0.999 -17.939 1.00 0.00 N ATOM 1384 CA GLU A 85 -11.261 2.297 -17.563 1.00 0.00 C ATOM 1385 C GLU A 85 -10.200 3.387 -17.639 1.00 0.00 C ATOM 1386 O GLU A 85 -10.397 4.414 -18.289 1.00 0.00 O ATOM 1387 CB GLU A 85 -11.847 2.239 -16.151 1.00 0.00 C ATOM 1388 CG GLU A 85 -12.468 3.544 -15.674 1.00 0.00 C ATOM 1389 CD GLU A 85 -13.033 3.450 -14.284 1.00 0.00 C ATOM 1390 OE1 GLU A 85 -12.934 2.402 -13.692 1.00 0.00 O ATOM 1391 OE2 GLU A 85 -13.565 4.427 -13.813 1.00 0.00 O ATOM 0 H GLU A 85 -10.716 0.307 -17.189 1.00 0.00 H new ATOM 0 HA GLU A 85 -12.054 2.541 -18.270 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -12.605 1.456 -16.117 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -11.059 1.950 -15.455 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -11.714 4.331 -15.702 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -13.260 3.837 -16.363 1.00 0.00 H new ATOM 1398 N VAL A 86 -9.074 3.157 -16.972 1.00 0.00 N ATOM 1399 CA VAL A 86 -8.022 4.161 -16.876 1.00 0.00 C ATOM 1400 C VAL A 86 -7.485 4.529 -18.254 1.00 0.00 C ATOM 1401 O VAL A 86 -7.357 5.707 -18.587 1.00 0.00 O ATOM 1402 CB VAL A 86 -6.866 3.642 -16.000 1.00 0.00 C ATOM 1403 CG1 VAL A 86 -5.668 4.576 -16.091 1.00 0.00 C ATOM 1404 CG2 VAL A 86 -7.332 3.502 -14.559 1.00 0.00 C ATOM 0 H VAL A 86 -8.867 2.283 -16.489 1.00 0.00 H new ATOM 0 HA VAL A 86 -8.455 5.052 -16.420 1.00 0.00 H new ATOM 0 HB VAL A 86 -6.558 2.662 -16.364 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -4.861 4.194 -15.466 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -5.330 4.634 -17.126 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -5.954 5.570 -15.747 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -6.510 3.135 -13.945 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -7.658 4.473 -14.186 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -8.163 2.798 -14.512 1.00 0.00 H new ATOM 1414 N LEU A 87 -7.171 3.513 -19.051 1.00 0.00 N ATOM 1415 CA LEU A 87 -6.579 3.727 -20.366 1.00 0.00 C ATOM 1416 C LEU A 87 -7.492 4.565 -21.252 1.00 0.00 C ATOM 1417 O LEU A 87 -7.026 5.408 -22.018 1.00 0.00 O ATOM 1418 CB LEU A 87 -6.294 2.380 -21.044 1.00 0.00 C ATOM 1419 CG LEU A 87 -5.173 1.543 -20.415 1.00 0.00 C ATOM 1420 CD1 LEU A 87 -5.134 0.170 -21.072 1.00 0.00 C ATOM 1421 CD2 LEU A 87 -3.845 2.266 -20.580 1.00 0.00 C ATOM 0 H LEU A 87 -7.317 2.533 -18.809 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.643 4.269 -20.227 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -7.210 1.790 -21.038 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -6.042 2.566 -22.088 1.00 0.00 H new ATOM 0 HG LEU A 87 -5.361 1.409 -19.350 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -4.337 -0.425 -20.625 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -6.090 -0.332 -20.922 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.947 0.283 -22.140 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.049 1.671 -20.133 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.639 2.410 -21.641 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -3.895 3.236 -20.085 1.00 0.00 H new ATOM 1433 N GLY A 88 -8.795 4.328 -21.142 1.00 0.00 N ATOM 1434 CA GLY A 88 -9.782 5.127 -21.858 1.00 0.00 C ATOM 1435 C GLY A 88 -9.774 6.572 -21.378 1.00 0.00 C ATOM 1436 O GLY A 88 -9.781 7.504 -22.182 1.00 0.00 O ATOM 0 H GLY A 88 -9.192 3.588 -20.563 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -9.573 5.095 -22.927 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -10.774 4.699 -21.714 1.00 0.00 H new ATOM 1440 N ARG A 89 -9.758 6.753 -20.061 1.00 0.00 N ATOM 1441 CA ARG A 89 -9.845 8.083 -19.470 1.00 0.00 C ATOM 1442 C ARG A 89 -8.629 8.927 -19.832 1.00 0.00 C ATOM 1443 O ARG A 89 -8.758 10.099 -20.183 1.00 0.00 O ATOM 1444 CB ARG A 89 -9.960 7.988 -17.955 1.00 0.00 C ATOM 1445 CG ARG A 89 -11.307 7.502 -17.446 1.00 0.00 C ATOM 1446 CD ARG A 89 -11.387 7.561 -15.964 1.00 0.00 C ATOM 1447 NE ARG A 89 -12.634 7.002 -15.465 1.00 0.00 N ATOM 1448 CZ ARG A 89 -13.815 7.650 -15.462 1.00 0.00 C ATOM 1449 NH1 ARG A 89 -13.894 8.876 -15.932 1.00 0.00 N ATOM 1450 NH2 ARG A 89 -14.895 7.055 -14.986 1.00 0.00 N ATOM 0 H ARG A 89 -9.686 5.995 -19.383 1.00 0.00 H new ATOM 0 HA ARG A 89 -10.737 8.563 -19.872 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -9.185 7.316 -17.588 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -9.759 8.970 -17.527 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -12.101 8.111 -17.878 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -11.474 6.478 -17.779 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -10.547 7.016 -15.533 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -11.297 8.597 -15.637 1.00 0.00 H new ATOM 0 HE ARG A 89 -12.613 6.053 -15.091 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -13.061 9.336 -16.299 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -14.788 9.366 -15.930 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -14.835 6.105 -14.621 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -15.789 7.546 -14.984 1.00 0.00 H new ATOM 1464 N ILE A 90 -7.449 8.323 -19.744 1.00 0.00 N ATOM 1465 CA ILE A 90 -6.203 9.037 -19.997 1.00 0.00 C ATOM 1466 C ILE A 90 -5.992 9.265 -21.488 1.00 0.00 C ATOM 1467 O ILE A 90 -5.247 10.159 -21.890 1.00 0.00 O ATOM 1468 CB ILE A 90 -5.001 8.266 -19.420 1.00 0.00 C ATOM 1469 CG1 ILE A 90 -4.811 6.941 -20.163 1.00 0.00 C ATOM 1470 CG2 ILE A 90 -5.191 8.022 -17.931 1.00 0.00 C ATOM 1471 CD1 ILE A 90 -3.567 6.185 -19.754 1.00 0.00 C ATOM 0 H ILE A 90 -7.329 7.340 -19.499 1.00 0.00 H new ATOM 0 HA ILE A 90 -6.277 10.005 -19.501 1.00 0.00 H new ATOM 0 HB ILE A 90 -4.104 8.869 -19.557 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -5.682 6.310 -19.989 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -4.769 7.139 -21.234 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -4.333 7.476 -17.539 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -5.280 8.978 -17.414 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -6.097 7.437 -17.771 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -3.501 5.258 -20.323 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -2.687 6.797 -19.954 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -3.615 5.955 -18.690 1.00 0.00 H new ATOM 1483 N ASN A 91 -6.652 8.451 -22.306 1.00 0.00 N ATOM 1484 CA ASN A 91 -6.696 8.681 -23.745 1.00 0.00 C ATOM 1485 C ASN A 91 -7.328 10.029 -24.068 1.00 0.00 C ATOM 1486 O ASN A 91 -6.883 10.732 -24.975 1.00 0.00 O ATOM 1487 CB ASN A 91 -7.443 7.559 -24.442 1.00 0.00 C ATOM 1488 CG ASN A 91 -7.352 7.649 -25.940 1.00 0.00 C ATOM 1489 OD1 ASN A 91 -6.256 7.738 -26.504 1.00 0.00 O ATOM 1490 ND2 ASN A 91 -8.485 7.627 -26.596 1.00 0.00 N ATOM 0 H ASN A 91 -7.164 7.625 -21.996 1.00 0.00 H new ATOM 0 HA ASN A 91 -5.671 8.695 -24.114 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -7.041 6.601 -24.114 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -8.491 7.584 -24.143 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -8.486 7.684 -27.614 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -9.367 7.552 -26.089 1.00 0.00 H new ATOM 1497 N GLN A 92 -8.369 10.383 -23.321 1.00 0.00 N ATOM 1498 CA GLN A 92 -8.989 11.696 -23.445 1.00 0.00 C ATOM 1499 C GLN A 92 -8.092 12.786 -22.874 1.00 0.00 C ATOM 1500 O GLN A 92 -7.939 13.853 -23.468 1.00 0.00 O ATOM 1501 CB GLN A 92 -10.348 11.715 -22.741 1.00 0.00 C ATOM 1502 CG GLN A 92 -11.112 13.020 -22.896 1.00 0.00 C ATOM 1503 CD GLN A 92 -12.456 12.991 -22.194 1.00 0.00 C ATOM 1504 OE1 GLN A 92 -12.536 12.749 -20.986 1.00 0.00 O ATOM 1505 NE2 GLN A 92 -13.521 13.238 -22.947 1.00 0.00 N ATOM 0 H GLN A 92 -8.801 9.778 -22.623 1.00 0.00 H new ATOM 0 HA GLN A 92 -9.135 11.895 -24.507 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -10.958 10.901 -23.132 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -10.197 11.519 -21.679 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -10.513 13.838 -22.495 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -11.263 13.225 -23.956 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -13.408 13.433 -23.942 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -14.452 13.233 -22.531 1.00 0.00 H new ATOM 1514 N GLU A 93 -7.500 12.511 -21.716 1.00 0.00 N ATOM 1515 CA GLU A 93 -6.678 13.496 -21.023 1.00 0.00 C ATOM 1516 C GLU A 93 -5.405 13.799 -21.804 1.00 0.00 C ATOM 1517 O GLU A 93 -4.965 14.947 -21.871 1.00 0.00 O ATOM 1518 CB GLU A 93 -6.322 13.001 -19.620 1.00 0.00 C ATOM 1519 CG GLU A 93 -7.502 12.923 -18.662 1.00 0.00 C ATOM 1520 CD GLU A 93 -7.121 12.398 -17.306 1.00 0.00 C ATOM 1521 OE1 GLU A 93 -6.048 11.859 -17.178 1.00 0.00 O ATOM 1522 OE2 GLU A 93 -7.905 12.535 -16.396 1.00 0.00 O ATOM 0 H GLU A 93 -7.575 11.613 -21.238 1.00 0.00 H new ATOM 0 HA GLU A 93 -7.258 14.416 -20.942 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -5.869 12.013 -19.701 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -5.568 13.663 -19.195 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -7.940 13.915 -18.552 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -8.271 12.281 -19.092 1.00 0.00 H new ATOM 1529 N PHE A 94 -4.818 12.763 -22.393 1.00 0.00 N ATOM 1530 CA PHE A 94 -3.538 12.896 -23.077 1.00 0.00 C ATOM 1531 C PHE A 94 -3.683 13.693 -24.367 1.00 0.00 C ATOM 1532 O PHE A 94 -4.691 13.585 -25.065 1.00 0.00 O ATOM 1533 CB PHE A 94 -2.952 11.517 -23.387 1.00 0.00 C ATOM 1534 CG PHE A 94 -2.351 10.831 -22.194 1.00 0.00 C ATOM 1535 CD1 PHE A 94 -2.302 11.468 -20.962 1.00 0.00 C ATOM 1536 CD2 PHE A 94 -1.833 9.550 -22.299 1.00 0.00 C ATOM 1537 CE1 PHE A 94 -1.749 10.838 -19.863 1.00 0.00 C ATOM 1538 CE2 PHE A 94 -1.281 8.917 -21.202 1.00 0.00 C ATOM 1539 CZ PHE A 94 -1.238 9.563 -19.983 1.00 0.00 C ATOM 0 H PHE A 94 -5.209 11.821 -22.410 1.00 0.00 H new ATOM 0 HA PHE A 94 -2.862 13.434 -22.412 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -3.737 10.884 -23.801 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -2.188 11.622 -24.157 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -2.700 12.467 -20.861 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -1.861 9.040 -23.251 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -1.717 11.345 -18.910 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -0.883 7.917 -21.298 1.00 0.00 H new ATOM 0 HZ PHE A 94 -0.805 9.071 -19.125 1.00 0.00 H new ATOM 1549 N PRO A 95 -2.670 14.495 -24.679 1.00 0.00 N ATOM 1550 CA PRO A 95 -2.583 15.151 -25.978 1.00 0.00 C ATOM 1551 C PRO A 95 -2.280 14.147 -27.083 1.00 0.00 C ATOM 1552 O PRO A 95 -1.952 12.991 -26.812 1.00 0.00 O ATOM 1553 CB PRO A 95 -1.433 16.144 -25.786 1.00 0.00 C ATOM 1554 CG PRO A 95 -0.529 15.474 -24.809 1.00 0.00 C ATOM 1555 CD PRO A 95 -1.462 14.771 -23.858 1.00 0.00 C ATOM 0 HA PRO A 95 -3.513 15.632 -26.282 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -0.922 16.347 -26.727 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -1.792 17.100 -25.405 1.00 0.00 H new ATOM 0 HG2 PRO A 95 0.139 14.769 -25.304 1.00 0.00 H new ATOM 0 HG3 PRO A 95 0.099 16.197 -24.288 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -1.022 13.851 -23.474 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -1.699 15.395 -22.996 1.00 0.00 H new ATOM 1563 N ARG A 96 -2.392 14.594 -28.329 1.00 0.00 N ATOM 1564 CA ARG A 96 -2.224 13.712 -29.477 1.00 0.00 C ATOM 1565 C ARG A 96 -0.902 12.959 -29.405 1.00 0.00 C ATOM 1566 O ARG A 96 -0.829 11.779 -29.748 1.00 0.00 O ATOM 1567 CB ARG A 96 -2.282 14.505 -30.775 1.00 0.00 C ATOM 1568 CG ARG A 96 -3.658 15.044 -31.133 1.00 0.00 C ATOM 1569 CD ARG A 96 -3.623 15.854 -32.378 1.00 0.00 C ATOM 1570 NE ARG A 96 -4.936 16.376 -32.722 1.00 0.00 N ATOM 1571 CZ ARG A 96 -5.173 17.256 -33.714 1.00 0.00 C ATOM 1572 NH1 ARG A 96 -4.179 17.702 -34.449 1.00 0.00 N ATOM 1573 NH2 ARG A 96 -6.406 17.671 -33.949 1.00 0.00 N ATOM 0 H ARG A 96 -2.599 15.563 -28.569 1.00 0.00 H new ATOM 0 HA ARG A 96 -3.040 12.990 -29.457 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -1.587 15.342 -30.704 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -1.934 13.869 -31.589 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -4.353 14.214 -31.258 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -4.035 15.654 -30.312 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -2.925 16.681 -32.253 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -3.249 15.242 -33.199 1.00 0.00 H new ATOM 0 HE ARG A 96 -5.733 16.053 -32.174 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -3.228 17.382 -34.268 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -4.359 18.368 -35.200 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -7.178 17.325 -33.379 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -6.585 18.337 -34.700 1.00 0.00 H new ATOM 1587 N ASP A 97 0.142 13.649 -28.957 1.00 0.00 N ATOM 1588 CA ASP A 97 1.473 13.059 -28.880 1.00 0.00 C ATOM 1589 C ASP A 97 1.489 11.853 -27.950 1.00 0.00 C ATOM 1590 O ASP A 97 2.033 10.802 -28.290 1.00 0.00 O ATOM 1591 CB ASP A 97 2.491 14.096 -28.397 1.00 0.00 C ATOM 1592 CG ASP A 97 2.786 15.166 -29.439 1.00 0.00 C ATOM 1593 OD1 ASP A 97 2.452 14.963 -30.582 1.00 0.00 O ATOM 1594 OD2 ASP A 97 3.343 16.177 -29.082 1.00 0.00 O ATOM 0 H ASP A 97 0.092 14.618 -28.642 1.00 0.00 H new ATOM 0 HA ASP A 97 1.746 12.726 -29.882 1.00 0.00 H new ATOM 0 HB2 ASP A 97 2.116 14.572 -27.491 1.00 0.00 H new ATOM 0 HB3 ASP A 97 3.419 13.590 -28.130 1.00 0.00 H new ATOM 1599 N LEU A 98 0.888 12.010 -26.775 1.00 0.00 N ATOM 1600 CA LEU A 98 0.903 10.962 -25.762 1.00 0.00 C ATOM 1601 C LEU A 98 -0.184 9.927 -26.022 1.00 0.00 C ATOM 1602 O LEU A 98 -0.093 8.788 -25.565 1.00 0.00 O ATOM 1603 CB LEU A 98 0.714 11.571 -24.367 1.00 0.00 C ATOM 1604 CG LEU A 98 1.840 12.495 -23.886 1.00 0.00 C ATOM 1605 CD1 LEU A 98 1.552 12.948 -22.461 1.00 0.00 C ATOM 1606 CD2 LEU A 98 3.170 11.760 -23.968 1.00 0.00 C ATOM 0 H LEU A 98 0.384 12.854 -26.501 1.00 0.00 H new ATOM 0 HA LEU A 98 1.871 10.463 -25.812 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -0.220 12.133 -24.360 1.00 0.00 H new ATOM 0 HB3 LEU A 98 0.603 10.759 -23.648 1.00 0.00 H new ATOM 0 HG LEU A 98 1.895 13.378 -24.523 1.00 0.00 H new ATOM 0 HD11 LEU A 98 2.352 13.605 -22.119 1.00 0.00 H new ATOM 0 HD12 LEU A 98 0.605 13.486 -22.435 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.493 12.078 -21.807 1.00 0.00 H new ATOM 0 HD21 LEU A 98 3.970 12.417 -23.626 1.00 0.00 H new ATOM 0 HD22 LEU A 98 3.135 10.872 -23.337 1.00 0.00 H new ATOM 0 HD23 LEU A 98 3.359 11.464 -25.000 1.00 0.00 H new ATOM 1618 N LYS A 99 -1.213 10.331 -26.761 1.00 0.00 N ATOM 1619 CA LYS A 99 -2.236 9.400 -27.223 1.00 0.00 C ATOM 1620 C LYS A 99 -1.654 8.379 -28.191 1.00 0.00 C ATOM 1621 O LYS A 99 -2.020 7.204 -28.163 1.00 0.00 O ATOM 1622 CB LYS A 99 -3.388 10.157 -27.886 1.00 0.00 C ATOM 1623 CG LYS A 99 -4.310 10.878 -26.912 1.00 0.00 C ATOM 1624 CD LYS A 99 -5.321 11.745 -27.647 1.00 0.00 C ATOM 1625 CE LYS A 99 -6.333 10.897 -28.403 1.00 0.00 C ATOM 1626 NZ LYS A 99 -7.385 11.728 -29.048 1.00 0.00 N ATOM 0 H LYS A 99 -1.360 11.297 -27.053 1.00 0.00 H new ATOM 0 HA LYS A 99 -2.618 8.865 -26.353 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -2.974 10.886 -28.583 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -3.978 9.454 -28.473 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -4.834 10.148 -26.296 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -3.718 11.498 -26.238 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -5.841 12.385 -26.934 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -4.801 12.402 -28.344 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -5.818 10.310 -29.163 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -6.799 10.191 -27.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -8.054 11.111 -29.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -7.894 12.270 -28.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -6.943 12.385 -29.723 1.00 0.00 H new ATOM 1640 N LYS A 100 -0.745 8.833 -29.048 1.00 0.00 N ATOM 1641 CA LYS A 100 -0.013 7.937 -29.935 1.00 0.00 C ATOM 1642 C LYS A 100 0.847 6.960 -29.143 1.00 0.00 C ATOM 1643 O LYS A 100 0.833 5.757 -29.402 1.00 0.00 O ATOM 1644 CB LYS A 100 0.858 8.738 -30.904 1.00 0.00 C ATOM 1645 CG LYS A 100 0.080 9.490 -31.975 1.00 0.00 C ATOM 1646 CD LYS A 100 1.008 10.304 -32.864 1.00 0.00 C ATOM 1647 CE LYS A 100 0.229 11.074 -33.921 1.00 0.00 C ATOM 1648 NZ LYS A 100 1.123 11.898 -34.780 1.00 0.00 N ATOM 0 H LYS A 100 -0.498 9.818 -29.147 1.00 0.00 H new ATOM 0 HA LYS A 100 -0.743 7.363 -30.506 1.00 0.00 H new ATOM 0 HB2 LYS A 100 1.451 9.453 -30.334 1.00 0.00 H new ATOM 0 HB3 LYS A 100 1.558 8.059 -31.390 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -0.482 8.782 -32.584 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -0.647 10.151 -31.503 1.00 0.00 H new ATOM 0 HD2 LYS A 100 1.582 11.001 -32.253 1.00 0.00 H new ATOM 0 HD3 LYS A 100 1.724 9.641 -33.349 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -0.328 10.374 -34.543 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -0.503 11.719 -33.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 0.554 12.406 -35.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 1.636 12.584 -34.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 1.805 11.280 -35.265 1.00 0.00 H new ATOM 1662 N LYS A 101 1.594 7.485 -28.178 1.00 0.00 N ATOM 1663 CA LYS A 101 2.413 6.652 -27.305 1.00 0.00 C ATOM 1664 C LYS A 101 1.552 5.696 -26.490 1.00 0.00 C ATOM 1665 O LYS A 101 1.933 4.549 -26.255 1.00 0.00 O ATOM 1666 CB LYS A 101 3.258 7.522 -26.374 1.00 0.00 C ATOM 1667 CG LYS A 101 4.375 8.289 -27.071 1.00 0.00 C ATOM 1668 CD LYS A 101 5.178 9.117 -26.079 1.00 0.00 C ATOM 1669 CE LYS A 101 6.266 9.918 -26.780 1.00 0.00 C ATOM 1670 NZ LYS A 101 7.045 10.752 -25.825 1.00 0.00 N ATOM 0 H LYS A 101 1.649 8.484 -27.980 1.00 0.00 H new ATOM 0 HA LYS A 101 3.077 6.060 -27.935 1.00 0.00 H new ATOM 0 HB2 LYS A 101 2.605 8.234 -25.870 1.00 0.00 H new ATOM 0 HB3 LYS A 101 3.695 6.889 -25.602 1.00 0.00 H new ATOM 0 HG2 LYS A 101 5.036 7.589 -27.583 1.00 0.00 H new ATOM 0 HG3 LYS A 101 3.950 8.942 -27.833 1.00 0.00 H new ATOM 0 HD2 LYS A 101 4.512 9.794 -25.544 1.00 0.00 H new ATOM 0 HD3 LYS A 101 5.629 8.460 -25.335 1.00 0.00 H new ATOM 0 HE2 LYS A 101 6.940 9.237 -27.300 1.00 0.00 H new ATOM 0 HE3 LYS A 101 5.814 10.559 -27.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 7.776 11.281 -26.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 6.407 11.420 -25.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 7.498 10.139 -25.118 1.00 0.00 H new ATOM 1684 N LEU A 102 0.389 6.174 -26.060 1.00 0.00 N ATOM 1685 CA LEU A 102 -0.557 5.343 -25.325 1.00 0.00 C ATOM 1686 C LEU A 102 -0.998 4.145 -26.155 1.00 0.00 C ATOM 1687 O LEU A 102 -0.965 3.007 -25.687 1.00 0.00 O ATOM 1688 CB LEU A 102 -1.783 6.170 -24.917 1.00 0.00 C ATOM 1689 CG LEU A 102 -2.917 5.389 -24.241 1.00 0.00 C ATOM 1690 CD1 LEU A 102 -2.399 4.746 -22.961 1.00 0.00 C ATOM 1691 CD2 LEU A 102 -4.077 6.328 -23.949 1.00 0.00 C ATOM 0 H LEU A 102 0.079 7.134 -26.208 1.00 0.00 H new ATOM 0 HA LEU A 102 -0.055 4.975 -24.430 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -1.457 6.960 -24.240 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -2.182 6.657 -25.807 1.00 0.00 H new ATOM 0 HG LEU A 102 -3.272 4.600 -24.904 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -3.205 4.191 -22.481 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -1.582 4.065 -23.201 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -2.039 5.521 -22.284 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -4.883 5.773 -23.469 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -3.741 7.126 -23.287 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -4.440 6.759 -24.882 1.00 0.00 H new ATOM 1703 N SER A 103 -1.411 4.408 -27.391 1.00 0.00 N ATOM 1704 CA SER A 103 -1.899 3.356 -28.275 1.00 0.00 C ATOM 1705 C SER A 103 -0.804 2.342 -28.581 1.00 0.00 C ATOM 1706 O SER A 103 -1.081 1.163 -28.804 1.00 0.00 O ATOM 1707 CB SER A 103 -2.417 3.959 -29.567 1.00 0.00 C ATOM 1708 OG SER A 103 -1.368 4.494 -30.327 1.00 0.00 O ATOM 0 H SER A 103 -1.417 5.341 -27.803 1.00 0.00 H new ATOM 0 HA SER A 103 -2.712 2.838 -27.765 1.00 0.00 H new ATOM 0 HB2 SER A 103 -2.938 3.196 -30.146 1.00 0.00 H new ATOM 0 HB3 SER A 103 -3.143 4.740 -29.343 1.00 0.00 H new ATOM 0 HG SER A 103 -0.711 4.909 -29.731 1.00 0.00 H new ATOM 1714 N ARG A 104 0.441 2.807 -28.590 1.00 0.00 N ATOM 1715 CA ARG A 104 1.587 1.925 -28.775 1.00 0.00 C ATOM 1716 C ARG A 104 1.739 0.965 -27.602 1.00 0.00 C ATOM 1717 O ARG A 104 1.988 -0.225 -27.789 1.00 0.00 O ATOM 1718 CB ARG A 104 2.865 2.734 -28.934 1.00 0.00 C ATOM 1719 CG ARG A 104 3.000 3.463 -30.262 1.00 0.00 C ATOM 1720 CD ARG A 104 4.227 4.299 -30.307 1.00 0.00 C ATOM 1721 NE ARG A 104 4.372 4.980 -31.584 1.00 0.00 N ATOM 1722 CZ ARG A 104 5.316 5.903 -31.855 1.00 0.00 C ATOM 1723 NH1 ARG A 104 6.187 6.244 -30.932 1.00 0.00 N ATOM 1724 NH2 ARG A 104 5.365 6.465 -33.050 1.00 0.00 N ATOM 0 H ARG A 104 0.682 3.791 -28.471 1.00 0.00 H new ATOM 0 HA ARG A 104 1.411 1.345 -29.681 1.00 0.00 H new ATOM 0 HB2 ARG A 104 2.917 3.465 -28.128 1.00 0.00 H new ATOM 0 HB3 ARG A 104 3.718 2.066 -28.814 1.00 0.00 H new ATOM 0 HG2 ARG A 104 3.024 2.737 -31.075 1.00 0.00 H new ATOM 0 HG3 ARG A 104 2.125 4.092 -30.422 1.00 0.00 H new ATOM 0 HD2 ARG A 104 4.194 5.036 -29.504 1.00 0.00 H new ATOM 0 HD3 ARG A 104 5.100 3.672 -30.129 1.00 0.00 H new ATOM 0 HE ARG A 104 3.714 4.743 -32.326 1.00 0.00 H new ATOM 0 HH11 ARG A 104 6.149 5.810 -30.010 1.00 0.00 H new ATOM 0 HH12 ARG A 104 6.901 6.943 -31.138 1.00 0.00 H new ATOM 0 HH21 ARG A 104 4.689 6.200 -33.766 1.00 0.00 H new ATOM 0 HH22 ARG A 104 6.079 7.164 -33.256 1.00 0.00 H new ATOM 1738 N VAL A 105 1.588 1.491 -26.391 1.00 0.00 N ATOM 1739 CA VAL A 105 1.640 0.670 -25.187 1.00 0.00 C ATOM 1740 C VAL A 105 0.518 -0.360 -25.174 1.00 0.00 C ATOM 1741 O VAL A 105 0.735 -1.524 -24.838 1.00 0.00 O ATOM 1742 CB VAL A 105 1.534 1.556 -23.932 1.00 0.00 C ATOM 1743 CG1 VAL A 105 1.348 0.698 -22.689 1.00 0.00 C ATOM 1744 CG2 VAL A 105 2.776 2.425 -23.805 1.00 0.00 C ATOM 0 H VAL A 105 1.428 2.483 -26.217 1.00 0.00 H new ATOM 0 HA VAL A 105 2.595 0.145 -25.185 1.00 0.00 H new ATOM 0 HB VAL A 105 0.663 2.204 -24.029 1.00 0.00 H new ATOM 0 HG11 VAL A 105 1.275 1.340 -21.811 1.00 0.00 H new ATOM 0 HG12 VAL A 105 0.435 0.110 -22.786 1.00 0.00 H new ATOM 0 HG13 VAL A 105 2.201 0.028 -22.578 1.00 0.00 H new ATOM 0 HG21 VAL A 105 2.694 3.049 -22.915 1.00 0.00 H new ATOM 0 HG22 VAL A 105 3.658 1.790 -23.723 1.00 0.00 H new ATOM 0 HG23 VAL A 105 2.867 3.060 -24.686 1.00 0.00 H new ATOM 1754 N VAL A 106 -0.682 0.075 -25.543 1.00 0.00 N ATOM 1755 CA VAL A 106 -1.832 -0.819 -25.616 1.00 0.00 C ATOM 1756 C VAL A 106 -1.584 -1.956 -26.599 1.00 0.00 C ATOM 1757 O VAL A 106 -1.914 -3.109 -26.324 1.00 0.00 O ATOM 1758 CB VAL A 106 -3.089 -0.038 -26.044 1.00 0.00 C ATOM 1759 CG1 VAL A 106 -4.234 -0.995 -26.342 1.00 0.00 C ATOM 1760 CG2 VAL A 106 -3.481 0.950 -24.956 1.00 0.00 C ATOM 0 H VAL A 106 -0.884 1.042 -25.796 1.00 0.00 H new ATOM 0 HA VAL A 106 -1.986 -1.243 -24.624 1.00 0.00 H new ATOM 0 HB VAL A 106 -2.867 0.518 -26.955 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -5.114 -0.427 -26.643 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -3.944 -1.669 -27.148 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -4.465 -1.576 -25.449 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -4.371 1.498 -25.266 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -3.691 0.410 -24.033 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -2.663 1.651 -24.789 1.00 0.00 H new ATOM 1770 N ASN A 107 -1.001 -1.623 -27.745 1.00 0.00 N ATOM 1771 CA ASN A 107 -0.622 -2.628 -28.731 1.00 0.00 C ATOM 1772 C ASN A 107 0.409 -3.596 -28.164 1.00 0.00 C ATOM 1773 O ASN A 107 0.355 -4.798 -28.424 1.00 0.00 O ATOM 1774 CB ASN A 107 -0.096 -1.967 -29.992 1.00 0.00 C ATOM 1775 CG ASN A 107 -1.187 -1.334 -30.811 1.00 0.00 C ATOM 1776 OD1 ASN A 107 -2.364 -1.688 -30.679 1.00 0.00 O ATOM 1777 ND2 ASN A 107 -0.819 -0.403 -31.654 1.00 0.00 N ATOM 0 H ASN A 107 -0.780 -0.664 -28.014 1.00 0.00 H new ATOM 0 HA ASN A 107 -1.514 -3.200 -28.985 1.00 0.00 H new ATOM 0 HB2 ASN A 107 0.637 -1.207 -29.721 1.00 0.00 H new ATOM 0 HB3 ASN A 107 0.424 -2.710 -30.598 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -1.516 0.063 -32.236 1.00 0.00 H new ATOM 0 HD22 ASN A 107 0.164 -0.143 -31.729 1.00 0.00 H new ATOM 1784 N ILE A 108 1.347 -3.064 -27.388 1.00 0.00 N ATOM 1785 CA ILE A 108 2.337 -3.891 -26.708 1.00 0.00 C ATOM 1786 C ILE A 108 1.678 -4.824 -25.700 1.00 0.00 C ATOM 1787 O ILE A 108 2.013 -6.006 -25.622 1.00 0.00 O ATOM 1788 CB ILE A 108 3.384 -3.018 -25.992 1.00 0.00 C ATOM 1789 CG1 ILE A 108 4.265 -2.295 -27.014 1.00 0.00 C ATOM 1790 CG2 ILE A 108 4.233 -3.864 -25.056 1.00 0.00 C ATOM 1791 CD1 ILE A 108 5.113 -1.194 -26.419 1.00 0.00 C ATOM 0 H ILE A 108 1.443 -2.063 -27.214 1.00 0.00 H new ATOM 0 HA ILE A 108 2.834 -4.492 -27.469 1.00 0.00 H new ATOM 0 HB ILE A 108 2.862 -2.269 -25.397 1.00 0.00 H new ATOM 0 HG12 ILE A 108 4.917 -3.023 -27.496 1.00 0.00 H new ATOM 0 HG13 ILE A 108 3.630 -1.871 -27.792 1.00 0.00 H new ATOM 0 HG21 ILE A 108 4.967 -3.231 -24.559 1.00 0.00 H new ATOM 0 HG22 ILE A 108 3.593 -4.333 -24.309 1.00 0.00 H new ATOM 0 HG23 ILE A 108 4.748 -4.635 -25.629 1.00 0.00 H new ATOM 0 HD11 ILE A 108 5.709 -0.729 -27.204 1.00 0.00 H new ATOM 0 HD12 ILE A 108 4.467 -0.444 -25.962 1.00 0.00 H new ATOM 0 HD13 ILE A 108 5.775 -1.614 -25.662 1.00 0.00 H new ATOM 1803 N LEU A 109 0.739 -4.285 -24.930 1.00 0.00 N ATOM 1804 CA LEU A 109 0.014 -5.074 -23.941 1.00 0.00 C ATOM 1805 C LEU A 109 -0.726 -6.233 -24.596 1.00 0.00 C ATOM 1806 O LEU A 109 -0.777 -7.336 -24.052 1.00 0.00 O ATOM 1807 CB LEU A 109 -0.982 -4.188 -23.183 1.00 0.00 C ATOM 1808 CG LEU A 109 -0.363 -3.124 -22.267 1.00 0.00 C ATOM 1809 CD1 LEU A 109 -1.456 -2.196 -21.754 1.00 0.00 C ATOM 1810 CD2 LEU A 109 0.362 -3.804 -21.116 1.00 0.00 C ATOM 0 H LEU A 109 0.462 -3.304 -24.972 1.00 0.00 H new ATOM 0 HA LEU A 109 0.742 -5.482 -23.240 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -1.621 -3.687 -23.910 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -1.626 -4.829 -22.581 1.00 0.00 H new ATOM 0 HG LEU A 109 0.360 -2.528 -22.824 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -1.016 -1.440 -21.103 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -1.945 -1.708 -22.597 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -2.191 -2.774 -21.193 1.00 0.00 H new ATOM 0 HD21 LEU A 109 0.802 -3.048 -20.465 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -0.345 -4.407 -20.546 1.00 0.00 H new ATOM 0 HD23 LEU A 109 1.150 -4.446 -21.511 1.00 0.00 H new ATOM 1822 N LYS A 110 -1.297 -5.977 -25.768 1.00 0.00 N ATOM 1823 CA LYS A 110 -2.002 -7.010 -26.519 1.00 0.00 C ATOM 1824 C LYS A 110 -1.028 -8.001 -27.141 1.00 0.00 C ATOM 1825 O LYS A 110 -1.217 -9.214 -27.048 1.00 0.00 O ATOM 1826 CB LYS A 110 -2.877 -6.380 -27.604 1.00 0.00 C ATOM 1827 CG LYS A 110 -3.727 -7.375 -28.383 1.00 0.00 C ATOM 1828 CD LYS A 110 -4.663 -6.665 -29.350 1.00 0.00 C ATOM 1829 CE LYS A 110 -5.585 -7.649 -30.052 1.00 0.00 C ATOM 1830 NZ LYS A 110 -6.527 -6.965 -30.979 1.00 0.00 N ATOM 0 H LYS A 110 -1.286 -5.062 -26.219 1.00 0.00 H new ATOM 0 HA LYS A 110 -2.640 -7.553 -25.821 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -3.534 -5.643 -27.142 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -2.237 -5.842 -28.303 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -3.079 -8.056 -28.935 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -4.309 -7.981 -27.689 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -5.258 -5.929 -28.809 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -4.078 -6.120 -30.091 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -4.988 -8.371 -30.609 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -6.151 -8.210 -29.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -7.203 -7.657 -31.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -7.043 -6.223 -30.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -5.993 -6.536 -31.762 1.00 0.00 H new ATOM 1844 N GLU A 111 0.016 -7.478 -27.776 1.00 0.00 N ATOM 1845 CA GLU A 111 0.934 -8.305 -28.550 1.00 0.00 C ATOM 1846 C GLU A 111 1.712 -9.255 -27.649 1.00 0.00 C ATOM 1847 O GLU A 111 1.959 -10.406 -28.011 1.00 0.00 O ATOM 1848 CB GLU A 111 1.906 -7.425 -29.340 1.00 0.00 C ATOM 1849 CG GLU A 111 2.891 -8.198 -30.206 1.00 0.00 C ATOM 1850 CD GLU A 111 2.219 -8.982 -31.298 1.00 0.00 C ATOM 1851 OE1 GLU A 111 1.108 -8.657 -31.641 1.00 0.00 O ATOM 1852 OE2 GLU A 111 2.819 -9.909 -31.791 1.00 0.00 O ATOM 0 H GLU A 111 0.247 -6.485 -27.770 1.00 0.00 H new ATOM 0 HA GLU A 111 0.342 -8.900 -29.246 1.00 0.00 H new ATOM 0 HB2 GLU A 111 1.332 -6.751 -29.976 1.00 0.00 H new ATOM 0 HB3 GLU A 111 2.465 -6.804 -28.641 1.00 0.00 H new ATOM 0 HG2 GLU A 111 3.601 -7.501 -30.650 1.00 0.00 H new ATOM 0 HG3 GLU A 111 3.464 -8.879 -29.577 1.00 0.00 H new ATOM 1859 N ARG A 112 2.096 -8.768 -26.474 1.00 0.00 N ATOM 1860 CA ARG A 112 2.887 -9.558 -25.538 1.00 0.00 C ATOM 1861 C ARG A 112 1.993 -10.389 -24.626 1.00 0.00 C ATOM 1862 O ARG A 112 2.472 -11.044 -23.701 1.00 0.00 O ATOM 1863 CB ARG A 112 3.772 -8.657 -24.691 1.00 0.00 C ATOM 1864 CG ARG A 112 4.867 -7.932 -25.458 1.00 0.00 C ATOM 1865 CD ARG A 112 5.763 -7.172 -24.550 1.00 0.00 C ATOM 1866 NE ARG A 112 6.800 -6.462 -25.280 1.00 0.00 N ATOM 1867 CZ ARG A 112 7.762 -5.711 -24.708 1.00 0.00 C ATOM 1868 NH1 ARG A 112 7.805 -5.583 -23.401 1.00 0.00 N ATOM 1869 NH2 ARG A 112 8.662 -5.104 -25.462 1.00 0.00 N ATOM 0 H ARG A 112 1.872 -7.828 -26.147 1.00 0.00 H new ATOM 0 HA ARG A 112 3.512 -10.231 -26.125 1.00 0.00 H new ATOM 0 HB2 ARG A 112 3.144 -7.916 -24.196 1.00 0.00 H new ATOM 0 HB3 ARG A 112 4.234 -9.258 -23.908 1.00 0.00 H new ATOM 0 HG2 ARG A 112 5.453 -8.655 -26.026 1.00 0.00 H new ATOM 0 HG3 ARG A 112 4.416 -7.250 -26.179 1.00 0.00 H new ATOM 0 HD2 ARG A 112 5.174 -6.460 -23.971 1.00 0.00 H new ATOM 0 HD3 ARG A 112 6.224 -7.857 -23.838 1.00 0.00 H new ATOM 0 HE ARG A 112 6.800 -6.537 -26.297 1.00 0.00 H new ATOM 0 HH11 ARG A 112 7.110 -6.052 -22.820 1.00 0.00 H new ATOM 0 HH12 ARG A 112 8.533 -5.015 -22.968 1.00 0.00 H new ATOM 0 HH21 ARG A 112 8.628 -5.204 -26.477 1.00 0.00 H new ATOM 0 HH22 ARG A 112 9.390 -4.536 -25.029 1.00 0.00 H new ATOM 1883 N ASN A 113 0.692 -10.357 -24.893 1.00 0.00 N ATOM 1884 CA ASN A 113 -0.270 -11.119 -24.105 1.00 0.00 C ATOM 1885 C ASN A 113 -0.161 -10.779 -22.625 1.00 0.00 C ATOM 1886 O ASN A 113 -0.154 -11.668 -21.773 1.00 0.00 O ATOM 1887 CB ASN A 113 -0.082 -12.608 -24.327 1.00 0.00 C ATOM 1888 CG ASN A 113 -0.321 -13.015 -25.755 1.00 0.00 C ATOM 1889 OD1 ASN A 113 -1.274 -12.554 -26.394 1.00 0.00 O ATOM 1890 ND2 ASN A 113 0.527 -13.870 -26.268 1.00 0.00 N ATOM 0 H ASN A 113 0.279 -9.811 -25.649 1.00 0.00 H new ATOM 0 HA ASN A 113 -1.270 -10.843 -24.439 1.00 0.00 H new ATOM 0 HB2 ASN A 113 0.930 -12.890 -24.037 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -0.764 -13.157 -23.678 1.00 0.00 H new ATOM 0 HD21 ASN A 113 0.416 -14.182 -27.233 1.00 0.00 H new ATOM 0 HD22 ASN A 113 1.299 -14.224 -25.703 1.00 0.00 H new ATOM 1897 N ILE A 114 -0.077 -9.488 -22.323 1.00 0.00 N ATOM 1898 CA ILE A 114 0.085 -9.031 -20.948 1.00 0.00 C ATOM 1899 C ILE A 114 -1.192 -9.240 -20.144 1.00 0.00 C ATOM 1900 O ILE A 114 -1.145 -9.635 -18.979 1.00 0.00 O ATOM 1901 CB ILE A 114 0.480 -7.543 -20.907 1.00 0.00 C ATOM 1902 CG1 ILE A 114 1.840 -7.334 -21.579 1.00 0.00 C ATOM 1903 CG2 ILE A 114 0.509 -7.040 -19.472 1.00 0.00 C ATOM 1904 CD1 ILE A 114 2.961 -8.130 -20.950 1.00 0.00 C ATOM 0 H ILE A 114 -0.119 -8.738 -23.013 1.00 0.00 H new ATOM 0 HA ILE A 114 0.882 -9.624 -20.501 1.00 0.00 H new ATOM 0 HB ILE A 114 -0.267 -6.970 -21.456 1.00 0.00 H new ATOM 0 HG12 ILE A 114 1.760 -7.606 -22.632 1.00 0.00 H new ATOM 0 HG13 ILE A 114 2.094 -6.275 -21.542 1.00 0.00 H new ATOM 0 HG21 ILE A 114 0.790 -5.987 -19.461 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -0.478 -7.157 -19.026 1.00 0.00 H new ATOM 0 HG23 ILE A 114 1.236 -7.615 -18.899 1.00 0.00 H new ATOM 0 HD11 ILE A 114 3.892 -7.929 -21.480 1.00 0.00 H new ATOM 0 HD12 ILE A 114 3.070 -7.842 -19.904 1.00 0.00 H new ATOM 0 HD13 ILE A 114 2.731 -9.194 -21.011 1.00 0.00 H new ATOM 1916 N PHE A 115 -2.332 -8.973 -20.773 1.00 0.00 N ATOM 1917 CA PHE A 115 -3.626 -9.195 -20.140 1.00 0.00 C ATOM 1918 C PHE A 115 -4.455 -10.207 -20.921 1.00 0.00 C ATOM 1919 O PHE A 115 -4.130 -10.542 -22.060 1.00 0.00 O ATOM 1920 CB PHE A 115 -4.397 -7.879 -20.023 1.00 0.00 C ATOM 1921 CG PHE A 115 -3.727 -6.860 -19.146 1.00 0.00 C ATOM 1922 CD1 PHE A 115 -3.176 -5.710 -19.691 1.00 0.00 C ATOM 1923 CD2 PHE A 115 -3.645 -7.050 -17.775 1.00 0.00 C ATOM 1924 CE1 PHE A 115 -2.559 -4.772 -18.885 1.00 0.00 C ATOM 1925 CE2 PHE A 115 -3.030 -6.113 -16.967 1.00 0.00 C ATOM 1926 CZ PHE A 115 -2.486 -4.973 -17.523 1.00 0.00 C ATOM 0 H PHE A 115 -2.385 -8.602 -21.722 1.00 0.00 H new ATOM 0 HA PHE A 115 -3.442 -9.594 -19.143 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -4.530 -7.457 -21.019 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -5.392 -8.085 -19.629 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -3.230 -5.546 -20.757 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -4.067 -7.941 -17.334 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -2.134 -3.881 -19.322 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -2.975 -6.273 -15.900 1.00 0.00 H new ATOM 0 HZ PHE A 115 -2.004 -4.240 -16.893 1.00 0.00 H new ATOM 1936 N SER A 116 -5.526 -10.690 -20.302 1.00 0.00 N ATOM 1937 CA SER A 116 -6.395 -11.677 -20.932 1.00 0.00 C ATOM 1938 C SER A 116 -7.149 -11.074 -22.110 1.00 0.00 C ATOM 1939 O SER A 116 -7.246 -9.854 -22.239 1.00 0.00 O ATOM 1940 CB SER A 116 -7.379 -12.229 -19.919 1.00 0.00 C ATOM 1941 OG SER A 116 -8.329 -11.262 -19.563 1.00 0.00 O ATOM 0 H SER A 116 -5.814 -10.414 -19.363 1.00 0.00 H new ATOM 0 HA SER A 116 -5.769 -12.487 -21.305 1.00 0.00 H new ATOM 0 HB2 SER A 116 -7.882 -13.103 -20.334 1.00 0.00 H new ATOM 0 HB3 SER A 116 -6.843 -12.562 -19.030 1.00 0.00 H new ATOM 0 HG SER A 116 -8.954 -11.642 -18.910 1.00 0.00 H new ATOM 1947 N LYS A 117 -7.683 -11.937 -22.969 1.00 0.00 N ATOM 1948 CA LYS A 117 -8.384 -11.491 -24.167 1.00 0.00 C ATOM 1949 C LYS A 117 -9.582 -10.620 -23.811 1.00 0.00 C ATOM 1950 O LYS A 117 -9.901 -9.666 -24.522 1.00 0.00 O ATOM 1951 CB LYS A 117 -8.836 -12.691 -25.001 1.00 0.00 C ATOM 1952 CG LYS A 117 -7.702 -13.447 -25.681 1.00 0.00 C ATOM 1953 CD LYS A 117 -8.227 -14.635 -26.473 1.00 0.00 C ATOM 1954 CE LYS A 117 -7.095 -15.396 -27.146 1.00 0.00 C ATOM 1955 NZ LYS A 117 -7.590 -16.584 -27.894 1.00 0.00 N ATOM 0 H LYS A 117 -7.643 -12.950 -22.857 1.00 0.00 H new ATOM 0 HA LYS A 117 -7.690 -10.892 -24.756 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -9.382 -13.381 -24.357 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -9.535 -12.346 -25.763 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -7.161 -12.774 -26.346 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -6.991 -13.793 -24.931 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -8.773 -15.305 -25.809 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -8.933 -14.288 -27.227 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -6.567 -14.731 -27.830 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -6.375 -15.716 -26.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -6.787 -17.074 -28.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -8.072 -17.231 -27.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -8.258 -16.277 -28.630 1.00 0.00 H new ATOM 1969 N GLN A 118 -10.243 -10.952 -22.708 1.00 0.00 N ATOM 1970 CA GLN A 118 -11.397 -10.190 -22.247 1.00 0.00 C ATOM 1971 C GLN A 118 -10.995 -8.782 -21.826 1.00 0.00 C ATOM 1972 O GLN A 118 -11.672 -7.809 -22.155 1.00 0.00 O ATOM 1973 CB GLN A 118 -12.083 -10.908 -21.082 1.00 0.00 C ATOM 1974 CG GLN A 118 -13.344 -10.223 -20.584 1.00 0.00 C ATOM 1975 CD GLN A 118 -14.444 -10.206 -21.629 1.00 0.00 C ATOM 1976 OE1 GLN A 118 -14.849 -11.253 -22.142 1.00 0.00 O ATOM 1977 NE2 GLN A 118 -14.934 -9.014 -21.951 1.00 0.00 N ATOM 0 H GLN A 118 -9.999 -11.745 -22.115 1.00 0.00 H new ATOM 0 HA GLN A 118 -12.097 -10.112 -23.079 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -12.332 -11.923 -21.392 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -11.378 -10.991 -20.255 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -13.703 -10.734 -19.691 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -13.107 -9.200 -20.293 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -14.569 -8.174 -21.501 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -15.675 -8.939 -22.648 1.00 0.00 H new ATOM 1986 N VAL A 119 -9.890 -8.682 -21.096 1.00 0.00 N ATOM 1987 CA VAL A 119 -9.375 -7.389 -20.660 1.00 0.00 C ATOM 1988 C VAL A 119 -8.966 -6.530 -21.849 1.00 0.00 C ATOM 1989 O VAL A 119 -9.265 -5.337 -21.897 1.00 0.00 O ATOM 1990 CB VAL A 119 -8.163 -7.583 -19.729 1.00 0.00 C ATOM 1991 CG1 VAL A 119 -7.485 -6.249 -19.452 1.00 0.00 C ATOM 1992 CG2 VAL A 119 -8.607 -8.242 -18.432 1.00 0.00 C ATOM 0 H VAL A 119 -9.333 -9.481 -20.793 1.00 0.00 H new ATOM 0 HA VAL A 119 -10.173 -6.880 -20.120 1.00 0.00 H new ATOM 0 HB VAL A 119 -7.440 -8.233 -20.221 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -6.631 -6.405 -18.793 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -7.144 -5.812 -20.391 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -8.194 -5.573 -18.974 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -7.745 -8.376 -17.778 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -9.343 -7.610 -17.936 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -9.051 -9.213 -18.651 1.00 0.00 H new ATOM 2002 N VAL A 120 -8.280 -7.143 -22.808 1.00 0.00 N ATOM 2003 CA VAL A 120 -7.873 -6.448 -24.023 1.00 0.00 C ATOM 2004 C VAL A 120 -9.080 -5.904 -24.776 1.00 0.00 C ATOM 2005 O VAL A 120 -9.075 -4.760 -25.231 1.00 0.00 O ATOM 2006 CB VAL A 120 -7.083 -7.399 -24.943 1.00 0.00 C ATOM 2007 CG1 VAL A 120 -6.874 -6.765 -26.310 1.00 0.00 C ATOM 2008 CG2 VAL A 120 -5.750 -7.751 -24.302 1.00 0.00 C ATOM 0 H VAL A 120 -7.994 -8.121 -22.767 1.00 0.00 H new ATOM 0 HA VAL A 120 -7.238 -5.612 -23.730 1.00 0.00 H new ATOM 0 HB VAL A 120 -7.656 -8.316 -25.080 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -6.314 -7.450 -26.947 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -7.842 -6.555 -26.765 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -6.316 -5.835 -26.198 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -5.197 -8.423 -24.958 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -5.171 -6.841 -24.144 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -5.925 -8.241 -23.344 1.00 0.00 H new ATOM 2018 N ASN A 121 -10.113 -6.729 -24.905 1.00 0.00 N ATOM 2019 CA ASN A 121 -11.349 -6.314 -25.555 1.00 0.00 C ATOM 2020 C ASN A 121 -12.005 -5.160 -24.808 1.00 0.00 C ATOM 2021 O ASN A 121 -12.511 -4.219 -25.419 1.00 0.00 O ATOM 2022 CB ASN A 121 -12.308 -7.484 -25.678 1.00 0.00 C ATOM 2023 CG ASN A 121 -11.883 -8.472 -26.728 1.00 0.00 C ATOM 2024 OD1 ASN A 121 -11.084 -8.149 -27.614 1.00 0.00 O ATOM 2025 ND2 ASN A 121 -12.401 -9.671 -26.646 1.00 0.00 N ATOM 0 H ASN A 121 -10.118 -7.691 -24.567 1.00 0.00 H new ATOM 0 HA ASN A 121 -11.098 -5.965 -26.557 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -12.382 -7.991 -24.716 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -13.303 -7.110 -25.918 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -12.149 -10.383 -27.331 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -13.057 -9.893 -25.897 1.00 0.00 H new ATOM 2032 N ASP A 122 -11.991 -5.237 -23.481 1.00 0.00 N ATOM 2033 CA ASP A 122 -12.524 -4.168 -22.646 1.00 0.00 C ATOM 2034 C ASP A 122 -11.746 -2.873 -22.845 1.00 0.00 C ATOM 2035 O ASP A 122 -12.328 -1.789 -22.893 1.00 0.00 O ATOM 2036 CB ASP A 122 -12.486 -4.571 -21.170 1.00 0.00 C ATOM 2037 CG ASP A 122 -13.466 -5.687 -20.835 1.00 0.00 C ATOM 2038 OD1 ASP A 122 -14.294 -5.992 -21.660 1.00 0.00 O ATOM 2039 OD2 ASP A 122 -13.376 -6.225 -19.757 1.00 0.00 O ATOM 0 H ASP A 122 -11.616 -6.030 -22.961 1.00 0.00 H new ATOM 0 HA ASP A 122 -13.558 -3.999 -22.945 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -11.477 -4.891 -20.912 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -12.711 -3.700 -20.555 1.00 0.00 H new ATOM 2044 N ILE A 123 -10.428 -2.993 -22.962 1.00 0.00 N ATOM 2045 CA ILE A 123 -9.572 -1.838 -23.202 1.00 0.00 C ATOM 2046 C ILE A 123 -9.881 -1.194 -24.548 1.00 0.00 C ATOM 2047 O ILE A 123 -10.048 0.022 -24.641 1.00 0.00 O ATOM 2048 CB ILE A 123 -8.086 -2.235 -23.151 1.00 0.00 C ATOM 2049 CG1 ILE A 123 -7.684 -2.617 -21.724 1.00 0.00 C ATOM 2050 CG2 ILE A 123 -7.214 -1.101 -23.667 1.00 0.00 C ATOM 2051 CD1 ILE A 123 -6.345 -3.314 -21.632 1.00 0.00 C ATOM 0 H ILE A 123 -9.929 -3.880 -22.894 1.00 0.00 H new ATOM 0 HA ILE A 123 -9.774 -1.115 -22.412 1.00 0.00 H new ATOM 0 HB ILE A 123 -7.937 -3.102 -23.794 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -7.657 -1.716 -21.111 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -8.451 -3.267 -21.302 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -6.166 -1.399 -23.624 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -7.485 -0.874 -24.698 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.365 -0.216 -23.049 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -6.130 -3.553 -20.590 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -6.372 -4.233 -22.217 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -5.566 -2.659 -22.022 1.00 0.00 H new ATOM 2063 N GLU A 124 -9.955 -2.017 -25.588 1.00 0.00 N ATOM 2064 CA GLU A 124 -10.178 -1.522 -26.942 1.00 0.00 C ATOM 2065 C GLU A 124 -11.515 -0.801 -27.051 1.00 0.00 C ATOM 2066 O GLU A 124 -11.618 0.241 -27.697 1.00 0.00 O ATOM 2067 CB GLU A 124 -10.125 -2.676 -27.946 1.00 0.00 C ATOM 2068 CG GLU A 124 -8.735 -3.255 -28.166 1.00 0.00 C ATOM 2069 CD GLU A 124 -8.731 -4.424 -29.111 1.00 0.00 C ATOM 2070 OE1 GLU A 124 -9.791 -4.868 -29.481 1.00 0.00 O ATOM 2071 OE2 GLU A 124 -7.666 -4.874 -29.463 1.00 0.00 O ATOM 0 H GLU A 124 -9.864 -3.031 -25.520 1.00 0.00 H new ATOM 0 HA GLU A 124 -9.385 -0.810 -27.172 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -10.786 -3.471 -27.602 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -10.516 -2.328 -28.902 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -8.080 -2.476 -28.557 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -8.321 -3.568 -27.207 1.00 0.00 H new ATOM 2078 N ARG A 125 -12.538 -1.363 -26.416 1.00 0.00 N ATOM 2079 CA ARG A 125 -13.870 -0.771 -26.436 1.00 0.00 C ATOM 2080 C ARG A 125 -13.919 0.505 -25.606 1.00 0.00 C ATOM 2081 O ARG A 125 -14.620 1.456 -25.952 1.00 0.00 O ATOM 2082 CB ARG A 125 -14.902 -1.757 -25.907 1.00 0.00 C ATOM 2083 CG ARG A 125 -15.181 -2.942 -26.818 1.00 0.00 C ATOM 2084 CD ARG A 125 -16.311 -3.765 -26.316 1.00 0.00 C ATOM 2085 NE ARG A 125 -15.988 -4.423 -25.060 1.00 0.00 N ATOM 2086 CZ ARG A 125 -16.884 -5.041 -24.268 1.00 0.00 C ATOM 2087 NH1 ARG A 125 -18.152 -5.078 -24.613 1.00 0.00 N ATOM 2088 NH2 ARG A 125 -16.489 -5.610 -23.142 1.00 0.00 N ATOM 0 H ARG A 125 -12.470 -2.229 -25.881 1.00 0.00 H new ATOM 0 HA ARG A 125 -14.103 -0.524 -27.472 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -14.563 -2.132 -24.941 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -15.836 -1.224 -25.732 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -15.409 -2.584 -27.822 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -14.287 -3.560 -26.896 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -17.188 -3.132 -26.179 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -16.573 -4.515 -27.062 1.00 0.00 H new ATOM 0 HE ARG A 125 -15.014 -4.416 -24.758 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -18.457 -4.638 -25.481 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -18.830 -5.546 -24.012 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -15.505 -5.581 -22.873 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -17.168 -6.078 -22.542 1.00 0.00 H new ATOM 2102 N SER A 126 -13.169 0.520 -24.509 1.00 0.00 N ATOM 2103 CA SER A 126 -13.071 1.704 -23.664 1.00 0.00 C ATOM 2104 C SER A 126 -12.364 2.841 -24.390 1.00 0.00 C ATOM 2105 O SER A 126 -12.761 4.001 -24.280 1.00 0.00 O ATOM 2106 CB SER A 126 -12.330 1.371 -22.383 1.00 0.00 C ATOM 2107 OG SER A 126 -13.055 0.458 -21.606 1.00 0.00 O ATOM 0 H SER A 126 -12.620 -0.276 -24.184 1.00 0.00 H new ATOM 0 HA SER A 126 -14.083 2.030 -23.422 1.00 0.00 H new ATOM 0 HB2 SER A 126 -11.352 0.954 -22.623 1.00 0.00 H new ATOM 0 HB3 SER A 126 -12.156 2.283 -21.812 1.00 0.00 H new ATOM 0 HG SER A 126 -12.906 -0.450 -21.944 1.00 0.00 H new ATOM 2113 N LEU A 127 -11.315 2.502 -25.131 1.00 0.00 N ATOM 2114 CA LEU A 127 -10.600 3.481 -25.941 1.00 0.00 C ATOM 2115 C LEU A 127 -11.492 4.043 -27.041 1.00 0.00 C ATOM 2116 O LEU A 127 -11.468 5.241 -27.321 1.00 0.00 O ATOM 2117 CB LEU A 127 -9.351 2.844 -26.563 1.00 0.00 C ATOM 2118 CG LEU A 127 -8.229 2.484 -25.581 1.00 0.00 C ATOM 2119 CD1 LEU A 127 -7.180 1.642 -26.294 1.00 0.00 C ATOM 2120 CD2 LEU A 127 -7.617 3.760 -25.021 1.00 0.00 C ATOM 0 H LEU A 127 -10.940 1.555 -25.187 1.00 0.00 H new ATOM 0 HA LEU A 127 -10.301 4.301 -25.288 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -9.652 1.939 -27.090 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -8.949 3.529 -27.310 1.00 0.00 H new ATOM 0 HG LEU A 127 -8.632 1.902 -24.752 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -6.383 1.386 -25.596 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -7.641 0.728 -26.669 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -6.765 2.208 -27.128 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -6.820 3.505 -24.323 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -7.208 4.356 -25.837 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -8.384 4.334 -24.501 1.00 0.00 H new ATOM 2132 N ALA A 128 -12.279 3.170 -27.662 1.00 0.00 N ATOM 2133 CA ALA A 128 -13.232 3.588 -28.682 1.00 0.00 C ATOM 2134 C ALA A 128 -14.267 4.548 -28.109 1.00 0.00 C ATOM 2135 O ALA A 128 -14.618 5.546 -28.739 1.00 0.00 O ATOM 2136 CB ALA A 128 -13.917 2.376 -29.296 1.00 0.00 C ATOM 0 H ALA A 128 -12.275 2.167 -27.476 1.00 0.00 H new ATOM 0 HA ALA A 128 -12.681 4.114 -29.462 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -14.626 2.705 -30.056 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -13.169 1.728 -29.753 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -14.448 1.825 -28.519 1.00 0.00 H new ATOM 2142 N ALA A 129 -14.752 4.241 -26.911 1.00 0.00 N ATOM 2143 CA ALA A 129 -15.701 5.108 -26.223 1.00 0.00 C ATOM 2144 C ALA A 129 -15.095 6.479 -25.950 1.00 0.00 C ATOM 2145 O ALA A 129 -15.768 7.502 -26.078 1.00 0.00 O ATOM 2146 CB ALA A 129 -16.161 4.464 -24.923 1.00 0.00 C ATOM 0 H ALA A 129 -14.503 3.397 -26.396 1.00 0.00 H new ATOM 0 HA ALA A 129 -16.565 5.245 -26.873 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -16.869 5.123 -24.421 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -16.644 3.511 -25.140 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -15.300 4.296 -24.276 1.00 0.00 H new ATOM 2152 N ALA A 130 -13.822 6.493 -25.571 1.00 0.00 N ATOM 2153 CA ALA A 130 -13.104 7.741 -25.342 1.00 0.00 C ATOM 2154 C ALA A 130 -12.979 8.549 -26.628 1.00 0.00 C ATOM 2155 O ALA A 130 -13.052 9.777 -26.610 1.00 0.00 O ATOM 2156 CB ALA A 130 -11.728 7.462 -24.757 1.00 0.00 C ATOM 0 H ALA A 130 -13.265 5.653 -25.416 1.00 0.00 H new ATOM 0 HA ALA A 130 -13.677 8.332 -24.627 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -11.205 8.404 -24.592 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -11.836 6.936 -23.809 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -11.156 6.846 -25.451 1.00 0.00 H new ATOM 2162 N LEU A 131 -12.789 7.851 -27.742 1.00 0.00 N ATOM 2163 CA LEU A 131 -12.723 8.496 -29.048 1.00 0.00 C ATOM 2164 C LEU A 131 -14.078 9.061 -29.453 1.00 0.00 C ATOM 2165 O LEU A 131 -14.158 10.114 -30.087 1.00 0.00 O ATOM 2166 CB LEU A 131 -12.241 7.498 -30.109 1.00 0.00 C ATOM 2167 CG LEU A 131 -10.779 7.050 -29.985 1.00 0.00 C ATOM 2168 CD1 LEU A 131 -10.504 5.929 -30.978 1.00 0.00 C ATOM 2169 CD2 LEU A 131 -9.861 8.238 -30.234 1.00 0.00 C ATOM 0 H LEU A 131 -12.678 6.837 -27.767 1.00 0.00 H new ATOM 0 HA LEU A 131 -12.014 9.321 -28.977 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -12.878 6.614 -30.066 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -12.383 7.945 -31.093 1.00 0.00 H new ATOM 0 HG LEU A 131 -10.589 6.673 -28.980 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -9.465 5.611 -30.889 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -11.161 5.086 -30.766 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -10.689 6.287 -31.991 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -8.822 7.920 -30.146 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -10.037 8.630 -31.236 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -10.066 9.016 -29.499 1.00 0.00 H new ATOM 2181 N GLU A 132 -15.142 8.356 -29.084 1.00 0.00 N ATOM 2182 CA GLU A 132 -16.497 8.799 -29.388 1.00 0.00 C ATOM 2183 C GLU A 132 -16.883 10.009 -28.547 1.00 0.00 C ATOM 2184 O GLU A 132 -17.470 10.966 -29.051 1.00 0.00 O ATOM 2185 CB GLU A 132 -17.495 7.662 -29.151 1.00 0.00 C ATOM 2186 CG GLU A 132 -17.405 6.527 -30.161 1.00 0.00 C ATOM 2187 CD GLU A 132 -18.304 5.371 -29.822 1.00 0.00 C ATOM 2188 OE1 GLU A 132 -18.811 5.338 -28.727 1.00 0.00 O ATOM 2189 OE2 GLU A 132 -18.484 4.518 -30.660 1.00 0.00 O ATOM 0 H GLU A 132 -15.092 7.474 -28.573 1.00 0.00 H new ATOM 0 HA GLU A 132 -16.525 9.088 -30.439 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -17.335 7.257 -28.152 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -18.505 8.071 -29.171 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -17.665 6.905 -31.150 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -16.374 6.176 -30.215 1.00 0.00 H new ATOM 2196 N HIS A 133 -16.550 9.960 -27.261 1.00 0.00 N ATOM 2197 CA HIS A 133 -16.895 11.035 -26.339 1.00 0.00 C ATOM 2198 C HIS A 133 -15.711 11.403 -25.454 1.00 0.00 C ATOM 2199 O HIS A 133 -14.842 12.113 -25.879 1.00 0.00 O ATOM 2200 CB HIS A 133 -18.089 10.636 -25.465 1.00 0.00 C ATOM 2201 CG HIS A 133 -19.331 10.336 -26.245 1.00 0.00 C ATOM 2202 ND1 HIS A 133 -20.158 11.324 -26.736 1.00 0.00 N ATOM 2203 CD2 HIS A 133 -19.887 9.159 -26.618 1.00 0.00 C ATOM 2204 CE1 HIS A 133 -21.170 10.767 -27.379 1.00 0.00 C ATOM 2205 NE2 HIS A 133 -21.029 9.455 -27.321 1.00 0.00 N ATOM 0 H HIS A 133 -16.041 9.186 -26.834 1.00 0.00 H new ATOM 0 HA HIS A 133 -17.165 11.906 -26.936 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -17.820 9.759 -24.876 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -18.298 11.441 -24.761 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -19.504 8.172 -26.403 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -21.975 11.295 -27.868 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -21.665 8.772 -27.732 1.00 0.00 H new TER 2213 HIS A 133