USER MOD reduce.3.24.130724 H: found=0, std=0, add=796, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 791 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 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 79 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 54 SER OG : rot -108:sc= 0.0818 USER MOD Set 2.2: A 55 ASN : amide:sc= -0.0278 X(o=0.054,f=-0.039) USER MOD Set 3.1: A 23 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 109:sc= 0.216 USER MOD Single : A 11 CYS SG : rot 180:sc= 0 USER MOD Single : A 14 ASN : amide:sc= -2.92 K(o=-2.9,f=-9.4!) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 180:sc= 0.132 USER MOD Single : A 29 SER OG : rot -79:sc= 1.3 USER MOD Single : A 33 THR OG1 : rot 55:sc= 1.22 USER MOD Single : A 34 TYR OH : rot 180:sc= -1.87 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 THR OG1 : rot -160:sc= -0.579 USER MOD Single : A 39 THR OG1 : rot 180:sc= -0.921 USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 TYR OH : rot -136:sc= 1.29 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 166:sc=-0.00697 (180deg=-0.257) USER MOD Single : A 52 ASN : amide:sc= 0 K(o=0,f=-2.5!) USER MOD Single : A 58 SER OG : rot 180:sc= -0.608 USER MOD Single : A 67 HIS : no HD1:sc= -2.43 K(o=-2.4,f=-3.2) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 THR OG1 : rot -27:sc= 0.517 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 MET CE :methyl 136:sc= -0.112 (180deg=-0.744) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 HIS : no HD1:sc= -0.127 X(o=-0.13,f=0) USER MOD Single : A 95 ASN : amide:sc= 0.0915 K(o=0.091,f=-4.2!) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 SER OG : rot 180:sc=-0.00598 USER MOD Single : A 102 SER OG : rot 9:sc= 0.455 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 0.582 18.286 -1.977 1.00 0.00 N ATOM 2 CA GLY A 1 -0.689 17.678 -1.626 1.00 0.00 C ATOM 3 C GLY A 1 -1.181 16.713 -2.685 1.00 0.00 C ATOM 4 O GLY A 1 -2.111 17.021 -3.431 1.00 0.00 O ATOM 0 H1 GLY A 1 0.876 18.937 -1.221 1.00 0.00 H new ATOM 0 H2 GLY A 1 1.301 17.544 -2.093 1.00 0.00 H new ATOM 0 H3 GLY A 1 0.481 18.813 -2.868 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -0.586 17.151 -0.678 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -1.434 18.460 -1.477 1.00 0.00 H new ATOM 8 N SER A 2 -0.557 15.541 -2.754 1.00 0.00 N ATOM 9 CA SER A 2 -0.933 14.530 -3.734 1.00 0.00 C ATOM 10 C SER A 2 -2.334 13.994 -3.451 1.00 0.00 C ATOM 11 O SER A 2 -2.627 13.547 -2.342 1.00 0.00 O ATOM 12 CB SER A 2 0.076 13.381 -3.726 1.00 0.00 C ATOM 13 OG SER A 2 1.368 13.834 -4.092 1.00 0.00 O ATOM 0 H SER A 2 0.212 15.269 -2.142 1.00 0.00 H new ATOM 0 HA SER A 2 -0.933 14.997 -4.719 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.112 12.932 -2.734 1.00 0.00 H new ATOM 0 HB3 SER A 2 -0.249 12.603 -4.416 1.00 0.00 H new ATOM 0 HG SER A 2 1.995 13.081 -4.078 1.00 0.00 H new ATOM 19 N SER A 3 -3.194 14.042 -4.463 1.00 0.00 N ATOM 20 CA SER A 3 -4.566 13.566 -4.323 1.00 0.00 C ATOM 21 C SER A 3 -4.668 12.090 -4.696 1.00 0.00 C ATOM 22 O SER A 3 -4.995 11.747 -5.831 1.00 0.00 O ATOM 23 CB SER A 3 -5.508 14.393 -5.200 1.00 0.00 C ATOM 24 OG SER A 3 -6.708 14.698 -4.513 1.00 0.00 O ATOM 0 H SER A 3 -2.966 14.405 -5.388 1.00 0.00 H new ATOM 0 HA SER A 3 -4.860 13.681 -3.280 1.00 0.00 H new ATOM 0 HB2 SER A 3 -5.013 15.316 -5.501 1.00 0.00 H new ATOM 0 HB3 SER A 3 -5.738 13.842 -6.112 1.00 0.00 H new ATOM 0 HG SER A 3 -7.292 15.228 -5.094 1.00 0.00 H new ATOM 30 N GLY A 4 -4.387 11.220 -3.731 1.00 0.00 N ATOM 31 CA GLY A 4 -4.453 9.792 -3.976 1.00 0.00 C ATOM 32 C GLY A 4 -5.103 9.036 -2.834 1.00 0.00 C ATOM 33 O GLY A 4 -6.160 8.428 -3.004 1.00 0.00 O ATOM 0 H GLY A 4 -4.115 11.479 -2.783 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -5.013 9.610 -4.893 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -3.446 9.407 -4.135 1.00 0.00 H new ATOM 37 N SER A 5 -4.469 9.072 -1.666 1.00 0.00 N ATOM 38 CA SER A 5 -4.989 8.381 -0.492 1.00 0.00 C ATOM 39 C SER A 5 -5.349 6.937 -0.828 1.00 0.00 C ATOM 40 O SER A 5 -6.451 6.652 -1.296 1.00 0.00 O ATOM 41 CB SER A 5 -6.218 9.110 0.052 1.00 0.00 C ATOM 42 OG SER A 5 -6.742 8.447 1.189 1.00 0.00 O ATOM 0 H SER A 5 -3.594 9.572 -1.508 1.00 0.00 H new ATOM 0 HA SER A 5 -4.211 8.376 0.271 1.00 0.00 H new ATOM 0 HB2 SER A 5 -5.951 10.134 0.315 1.00 0.00 H new ATOM 0 HB3 SER A 5 -6.982 9.169 -0.723 1.00 0.00 H new ATOM 0 HG SER A 5 -7.526 8.933 1.519 1.00 0.00 H new ATOM 48 N SER A 6 -4.410 6.027 -0.584 1.00 0.00 N ATOM 49 CA SER A 6 -4.624 4.612 -0.862 1.00 0.00 C ATOM 50 C SER A 6 -3.362 3.805 -0.577 1.00 0.00 C ATOM 51 O SER A 6 -2.956 2.962 -1.378 1.00 0.00 O ATOM 52 CB SER A 6 -5.050 4.417 -2.319 1.00 0.00 C ATOM 53 OG SER A 6 -4.201 5.133 -3.199 1.00 0.00 O ATOM 0 H SER A 6 -3.493 6.246 -0.194 1.00 0.00 H new ATOM 0 HA SER A 6 -5.418 4.254 -0.207 1.00 0.00 H new ATOM 0 HB2 SER A 6 -5.027 3.356 -2.569 1.00 0.00 H new ATOM 0 HB3 SER A 6 -6.079 4.752 -2.448 1.00 0.00 H new ATOM 0 HG SER A 6 -3.639 4.503 -3.697 1.00 0.00 H new ATOM 59 N GLY A 7 -2.744 4.068 0.571 1.00 0.00 N ATOM 60 CA GLY A 7 -1.535 3.359 0.942 1.00 0.00 C ATOM 61 C GLY A 7 -1.773 2.343 2.042 1.00 0.00 C ATOM 62 O GLY A 7 -2.651 2.526 2.886 1.00 0.00 O ATOM 0 H GLY A 7 -3.060 4.760 1.250 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -1.131 2.853 0.065 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.783 4.076 1.271 1.00 0.00 H new ATOM 66 N LEU A 8 -0.991 1.269 2.032 1.00 0.00 N ATOM 67 CA LEU A 8 -1.123 0.219 3.036 1.00 0.00 C ATOM 68 C LEU A 8 0.235 -0.134 3.635 1.00 0.00 C ATOM 69 O LEU A 8 1.200 -0.377 2.911 1.00 0.00 O ATOM 70 CB LEU A 8 -1.759 -1.028 2.419 1.00 0.00 C ATOM 71 CG LEU A 8 -3.287 -1.038 2.353 1.00 0.00 C ATOM 72 CD1 LEU A 8 -3.774 -2.139 1.424 1.00 0.00 C ATOM 73 CD2 LEU A 8 -3.879 -1.212 3.744 1.00 0.00 C ATOM 0 H LEU A 8 -0.260 1.102 1.341 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.767 0.591 3.833 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -1.371 -1.147 1.408 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -1.434 -1.898 2.990 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.621 -0.080 1.954 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -4.863 -2.131 1.390 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -3.378 -1.971 0.422 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -3.430 -3.105 1.793 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -4.967 -1.217 3.678 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -3.537 -2.155 4.170 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -3.558 -0.389 4.382 1.00 0.00 H new ATOM 85 N ILE A 9 0.301 -0.161 4.963 1.00 0.00 N ATOM 86 CA ILE A 9 1.538 -0.489 5.659 1.00 0.00 C ATOM 87 C ILE A 9 1.547 -1.945 6.112 1.00 0.00 C ATOM 88 O ILE A 9 0.996 -2.282 7.160 1.00 0.00 O ATOM 89 CB ILE A 9 1.752 0.420 6.884 1.00 0.00 C ATOM 90 CG1 ILE A 9 1.846 1.885 6.451 1.00 0.00 C ATOM 91 CG2 ILE A 9 3.006 0.005 7.640 1.00 0.00 C ATOM 92 CD1 ILE A 9 3.026 2.174 5.549 1.00 0.00 C ATOM 0 H ILE A 9 -0.488 0.040 5.577 1.00 0.00 H new ATOM 0 HA ILE A 9 2.350 -0.328 4.950 1.00 0.00 H new ATOM 0 HB ILE A 9 0.896 0.312 7.551 1.00 0.00 H new ATOM 0 HG12 ILE A 9 0.927 2.162 5.934 1.00 0.00 H new ATOM 0 HG13 ILE A 9 1.915 2.514 7.338 1.00 0.00 H new ATOM 0 HG21 ILE A 9 3.143 0.657 8.503 1.00 0.00 H new ATOM 0 HG22 ILE A 9 2.903 -1.026 7.977 1.00 0.00 H new ATOM 0 HG23 ILE A 9 3.871 0.087 6.982 1.00 0.00 H new ATOM 0 HD11 ILE A 9 3.030 3.231 5.282 1.00 0.00 H new ATOM 0 HD12 ILE A 9 3.951 1.928 6.070 1.00 0.00 H new ATOM 0 HD13 ILE A 9 2.948 1.571 4.644 1.00 0.00 H new ATOM 104 N ALA A 10 2.177 -2.802 5.316 1.00 0.00 N ATOM 105 CA ALA A 10 2.261 -4.222 5.637 1.00 0.00 C ATOM 106 C ALA A 10 3.473 -4.515 6.515 1.00 0.00 C ATOM 107 O ALA A 10 4.589 -4.095 6.209 1.00 0.00 O ATOM 108 CB ALA A 10 2.318 -5.049 4.362 1.00 0.00 C ATOM 0 H ALA A 10 2.637 -2.538 4.444 1.00 0.00 H new ATOM 0 HA ALA A 10 1.366 -4.497 6.195 1.00 0.00 H new ATOM 0 HB1 ALA A 10 2.381 -6.107 4.617 1.00 0.00 H new ATOM 0 HB2 ALA A 10 1.419 -4.870 3.772 1.00 0.00 H new ATOM 0 HB3 ALA A 10 3.195 -4.763 3.782 1.00 0.00 H new ATOM 114 N CYS A 11 3.246 -5.239 7.606 1.00 0.00 N ATOM 115 CA CYS A 11 4.320 -5.587 8.529 1.00 0.00 C ATOM 116 C CYS A 11 4.593 -7.087 8.504 1.00 0.00 C ATOM 117 O CYS A 11 3.738 -7.891 8.875 1.00 0.00 O ATOM 118 CB CYS A 11 3.964 -5.145 9.949 1.00 0.00 C ATOM 119 SG CYS A 11 5.386 -4.996 11.055 1.00 0.00 S ATOM 0 H CYS A 11 2.328 -5.596 7.872 1.00 0.00 H new ATOM 0 HA CYS A 11 5.223 -5.066 8.210 1.00 0.00 H new ATOM 0 HB2 CYS A 11 3.452 -4.184 9.901 1.00 0.00 H new ATOM 0 HB3 CYS A 11 3.260 -5.860 10.375 1.00 0.00 H new ATOM 0 HG CYS A 11 4.983 -4.615 12.231 1.00 0.00 H new ATOM 125 N VAL A 12 5.790 -7.458 8.061 1.00 0.00 N ATOM 126 CA VAL A 12 6.177 -8.861 7.986 1.00 0.00 C ATOM 127 C VAL A 12 7.226 -9.201 9.040 1.00 0.00 C ATOM 128 O VAL A 12 7.934 -8.321 9.530 1.00 0.00 O ATOM 129 CB VAL A 12 6.730 -9.219 6.594 1.00 0.00 C ATOM 130 CG1 VAL A 12 6.270 -10.607 6.175 1.00 0.00 C ATOM 131 CG2 VAL A 12 6.307 -8.177 5.569 1.00 0.00 C ATOM 0 H VAL A 12 6.509 -6.805 7.748 1.00 0.00 H new ATOM 0 HA VAL A 12 5.276 -9.446 8.172 1.00 0.00 H new ATOM 0 HB VAL A 12 7.819 -9.225 6.646 1.00 0.00 H new ATOM 0 HG11 VAL A 12 6.671 -10.841 5.189 1.00 0.00 H new ATOM 0 HG12 VAL A 12 6.628 -11.342 6.896 1.00 0.00 H new ATOM 0 HG13 VAL A 12 5.181 -10.634 6.139 1.00 0.00 H new ATOM 0 HG21 VAL A 12 6.706 -8.446 4.591 1.00 0.00 H new ATOM 0 HG22 VAL A 12 5.219 -8.137 5.518 1.00 0.00 H new ATOM 0 HG23 VAL A 12 6.692 -7.201 5.863 1.00 0.00 H new ATOM 141 N ALA A 13 7.320 -10.481 9.383 1.00 0.00 N ATOM 142 CA ALA A 13 8.284 -10.936 10.377 1.00 0.00 C ATOM 143 C ALA A 13 9.478 -11.615 9.713 1.00 0.00 C ATOM 144 O ALA A 13 10.523 -11.798 10.335 1.00 0.00 O ATOM 145 CB ALA A 13 7.618 -11.885 11.364 1.00 0.00 C ATOM 0 H ALA A 13 6.740 -11.221 8.987 1.00 0.00 H new ATOM 0 HA ALA A 13 8.649 -10.063 10.918 1.00 0.00 H new ATOM 0 HB1 ALA A 13 8.350 -12.217 12.100 1.00 0.00 H new ATOM 0 HB2 ALA A 13 6.802 -11.369 11.870 1.00 0.00 H new ATOM 0 HB3 ALA A 13 7.225 -12.749 10.829 1.00 0.00 H new ATOM 151 N ASN A 14 9.314 -11.983 8.447 1.00 0.00 N ATOM 152 CA ASN A 14 10.379 -12.643 7.699 1.00 0.00 C ATOM 153 C ASN A 14 11.299 -11.617 7.044 1.00 0.00 C ATOM 154 O ASN A 14 10.980 -11.064 5.991 1.00 0.00 O ATOM 155 CB ASN A 14 9.785 -13.565 6.633 1.00 0.00 C ATOM 156 CG ASN A 14 9.011 -14.722 7.236 1.00 0.00 C ATOM 157 OD1 ASN A 14 9.035 -14.935 8.448 1.00 0.00 O ATOM 158 ND2 ASN A 14 8.320 -15.477 6.389 1.00 0.00 N ATOM 0 H ASN A 14 8.455 -11.836 7.917 1.00 0.00 H new ATOM 0 HA ASN A 14 10.966 -13.238 8.398 1.00 0.00 H new ATOM 0 HB2 ASN A 14 9.125 -12.989 5.985 1.00 0.00 H new ATOM 0 HB3 ASN A 14 10.587 -13.955 6.006 1.00 0.00 H new ATOM 0 HD21 ASN A 14 7.781 -16.270 6.736 1.00 0.00 H new ATOM 0 HD22 ASN A 14 8.329 -15.263 5.392 1.00 0.00 H new ATOM 165 N ASP A 15 12.442 -11.368 7.675 1.00 0.00 N ATOM 166 CA ASP A 15 13.409 -10.410 7.153 1.00 0.00 C ATOM 167 C ASP A 15 13.803 -10.761 5.722 1.00 0.00 C ATOM 168 O ASP A 15 14.314 -9.918 4.985 1.00 0.00 O ATOM 169 CB ASP A 15 14.653 -10.373 8.044 1.00 0.00 C ATOM 170 CG ASP A 15 15.193 -11.758 8.341 1.00 0.00 C ATOM 171 OD1 ASP A 15 15.872 -12.331 7.462 1.00 0.00 O ATOM 172 OD2 ASP A 15 14.938 -12.269 9.451 1.00 0.00 O ATOM 0 H ASP A 15 12.721 -11.816 8.548 1.00 0.00 H new ATOM 0 HA ASP A 15 12.943 -9.424 7.151 1.00 0.00 H new ATOM 0 HB2 ASP A 15 15.428 -9.781 7.557 1.00 0.00 H new ATOM 0 HB3 ASP A 15 14.411 -9.872 8.981 1.00 0.00 H new ATOM 177 N ASP A 16 13.564 -12.008 5.337 1.00 0.00 N ATOM 178 CA ASP A 16 13.895 -12.472 3.995 1.00 0.00 C ATOM 179 C ASP A 16 13.021 -11.780 2.952 1.00 0.00 C ATOM 180 O ASP A 16 13.432 -11.597 1.806 1.00 0.00 O ATOM 181 CB ASP A 16 13.722 -13.988 3.897 1.00 0.00 C ATOM 182 CG ASP A 16 14.932 -14.742 4.412 1.00 0.00 C ATOM 183 OD1 ASP A 16 16.067 -14.291 4.155 1.00 0.00 O ATOM 184 OD2 ASP A 16 14.743 -15.785 5.074 1.00 0.00 O ATOM 0 H ASP A 16 13.142 -12.718 5.936 1.00 0.00 H new ATOM 0 HA ASP A 16 14.937 -12.221 3.797 1.00 0.00 H new ATOM 0 HB2 ASP A 16 12.841 -14.288 4.465 1.00 0.00 H new ATOM 0 HB3 ASP A 16 13.540 -14.264 2.858 1.00 0.00 H new ATOM 189 N VAL A 17 11.813 -11.399 3.356 1.00 0.00 N ATOM 190 CA VAL A 17 10.882 -10.729 2.458 1.00 0.00 C ATOM 191 C VAL A 17 11.466 -9.420 1.937 1.00 0.00 C ATOM 192 O VAL A 17 10.991 -8.867 0.946 1.00 0.00 O ATOM 193 CB VAL A 17 9.540 -10.437 3.155 1.00 0.00 C ATOM 194 CG1 VAL A 17 8.755 -9.386 2.385 1.00 0.00 C ATOM 195 CG2 VAL A 17 8.730 -11.716 3.307 1.00 0.00 C ATOM 0 H VAL A 17 11.457 -11.544 4.301 1.00 0.00 H new ATOM 0 HA VAL A 17 10.709 -11.405 1.621 1.00 0.00 H new ATOM 0 HB VAL A 17 9.745 -10.044 4.151 1.00 0.00 H new ATOM 0 HG11 VAL A 17 7.810 -9.193 2.893 1.00 0.00 H new ATOM 0 HG12 VAL A 17 9.334 -8.464 2.334 1.00 0.00 H new ATOM 0 HG13 VAL A 17 8.557 -9.747 1.376 1.00 0.00 H new ATOM 0 HG21 VAL A 17 7.785 -11.492 3.801 1.00 0.00 H new ATOM 0 HG22 VAL A 17 8.533 -12.141 2.323 1.00 0.00 H new ATOM 0 HG23 VAL A 17 9.291 -12.433 3.906 1.00 0.00 H new ATOM 205 N PHE A 18 12.501 -8.931 2.613 1.00 0.00 N ATOM 206 CA PHE A 18 13.150 -7.687 2.219 1.00 0.00 C ATOM 207 C PHE A 18 14.271 -7.951 1.216 1.00 0.00 C ATOM 208 O PHE A 18 14.575 -7.109 0.373 1.00 0.00 O ATOM 209 CB PHE A 18 13.711 -6.968 3.448 1.00 0.00 C ATOM 210 CG PHE A 18 12.658 -6.577 4.445 1.00 0.00 C ATOM 211 CD1 PHE A 18 12.137 -7.511 5.326 1.00 0.00 C ATOM 212 CD2 PHE A 18 12.188 -5.274 4.502 1.00 0.00 C ATOM 213 CE1 PHE A 18 11.169 -7.154 6.245 1.00 0.00 C ATOM 214 CE2 PHE A 18 11.220 -4.912 5.419 1.00 0.00 C ATOM 215 CZ PHE A 18 10.709 -5.853 6.290 1.00 0.00 C ATOM 0 H PHE A 18 12.907 -9.377 3.435 1.00 0.00 H new ATOM 0 HA PHE A 18 12.402 -7.052 1.744 1.00 0.00 H new ATOM 0 HB2 PHE A 18 14.440 -7.615 3.936 1.00 0.00 H new ATOM 0 HB3 PHE A 18 14.244 -6.074 3.124 1.00 0.00 H new ATOM 0 HD1 PHE A 18 12.492 -8.531 5.294 1.00 0.00 H new ATOM 0 HD2 PHE A 18 12.583 -4.534 3.822 1.00 0.00 H new ATOM 0 HE1 PHE A 18 10.773 -7.892 6.927 1.00 0.00 H new ATOM 0 HE2 PHE A 18 10.863 -3.893 5.454 1.00 0.00 H new ATOM 0 HZ PHE A 18 9.950 -5.572 7.006 1.00 0.00 H new ATOM 225 N SER A 19 14.880 -9.128 1.317 1.00 0.00 N ATOM 226 CA SER A 19 15.969 -9.504 0.422 1.00 0.00 C ATOM 227 C SER A 19 15.510 -9.480 -1.032 1.00 0.00 C ATOM 228 O SER A 19 14.333 -9.690 -1.327 1.00 0.00 O ATOM 229 CB SER A 19 16.494 -10.896 0.780 1.00 0.00 C ATOM 230 OG SER A 19 17.880 -11.004 0.502 1.00 0.00 O ATOM 0 H SER A 19 14.638 -9.837 2.009 1.00 0.00 H new ATOM 0 HA SER A 19 16.773 -8.778 0.543 1.00 0.00 H new ATOM 0 HB2 SER A 19 16.315 -11.095 1.837 1.00 0.00 H new ATOM 0 HB3 SER A 19 15.947 -11.651 0.216 1.00 0.00 H new ATOM 0 HG SER A 19 18.193 -11.902 0.741 1.00 0.00 H new ATOM 236 N GLU A 20 16.448 -9.223 -1.938 1.00 0.00 N ATOM 237 CA GLU A 20 16.140 -9.170 -3.363 1.00 0.00 C ATOM 238 C GLU A 20 16.178 -10.566 -3.979 1.00 0.00 C ATOM 239 O GLU A 20 15.866 -10.744 -5.157 1.00 0.00 O ATOM 240 CB GLU A 20 17.127 -8.253 -4.088 1.00 0.00 C ATOM 241 CG GLU A 20 16.959 -6.783 -3.742 1.00 0.00 C ATOM 242 CD GLU A 20 17.551 -5.865 -4.793 1.00 0.00 C ATOM 243 OE1 GLU A 20 18.627 -6.198 -5.333 1.00 0.00 O ATOM 244 OE2 GLU A 20 16.941 -4.813 -5.076 1.00 0.00 O ATOM 0 H GLU A 20 17.427 -9.048 -1.711 1.00 0.00 H new ATOM 0 HA GLU A 20 15.133 -8.768 -3.477 1.00 0.00 H new ATOM 0 HB2 GLU A 20 18.143 -8.561 -3.843 1.00 0.00 H new ATOM 0 HB3 GLU A 20 17.006 -8.381 -5.164 1.00 0.00 H new ATOM 0 HG2 GLU A 20 15.898 -6.560 -3.626 1.00 0.00 H new ATOM 0 HG3 GLU A 20 17.434 -6.583 -2.781 1.00 0.00 H new ATOM 251 N SER A 21 16.563 -11.551 -3.175 1.00 0.00 N ATOM 252 CA SER A 21 16.647 -12.930 -3.642 1.00 0.00 C ATOM 253 C SER A 21 15.441 -13.285 -4.506 1.00 0.00 C ATOM 254 O SER A 21 15.556 -13.420 -5.724 1.00 0.00 O ATOM 255 CB SER A 21 16.736 -13.889 -2.452 1.00 0.00 C ATOM 256 OG SER A 21 15.671 -13.674 -1.543 1.00 0.00 O ATOM 0 H SER A 21 16.822 -11.420 -2.197 1.00 0.00 H new ATOM 0 HA SER A 21 17.548 -13.029 -4.248 1.00 0.00 H new ATOM 0 HB2 SER A 21 16.712 -14.919 -2.808 1.00 0.00 H new ATOM 0 HB3 SER A 21 17.688 -13.751 -1.940 1.00 0.00 H new ATOM 0 HG SER A 21 15.750 -14.300 -0.793 1.00 0.00 H new ATOM 262 N GLU A 22 14.285 -13.435 -3.866 1.00 0.00 N ATOM 263 CA GLU A 22 13.059 -13.775 -4.576 1.00 0.00 C ATOM 264 C GLU A 22 11.855 -13.722 -3.639 1.00 0.00 C ATOM 265 O GLU A 22 10.776 -13.265 -4.020 1.00 0.00 O ATOM 266 CB GLU A 22 13.173 -15.168 -5.200 1.00 0.00 C ATOM 267 CG GLU A 22 12.397 -15.321 -6.496 1.00 0.00 C ATOM 268 CD GLU A 22 12.802 -16.555 -7.278 1.00 0.00 C ATOM 269 OE1 GLU A 22 13.694 -17.290 -6.803 1.00 0.00 O ATOM 270 OE2 GLU A 22 12.229 -16.787 -8.362 1.00 0.00 O ATOM 0 H GLU A 22 14.173 -13.326 -2.858 1.00 0.00 H new ATOM 0 HA GLU A 22 12.914 -13.041 -5.369 1.00 0.00 H new ATOM 0 HB2 GLU A 22 14.224 -15.387 -5.388 1.00 0.00 H new ATOM 0 HB3 GLU A 22 12.816 -15.908 -4.484 1.00 0.00 H new ATOM 0 HG2 GLU A 22 11.331 -15.371 -6.273 1.00 0.00 H new ATOM 0 HG3 GLU A 22 12.552 -14.437 -7.114 1.00 0.00 H new ATOM 277 N THR A 23 12.047 -14.193 -2.412 1.00 0.00 N ATOM 278 CA THR A 23 10.978 -14.201 -1.420 1.00 0.00 C ATOM 279 C THR A 23 10.132 -12.937 -1.514 1.00 0.00 C ATOM 280 O THR A 23 8.921 -12.972 -1.297 1.00 0.00 O ATOM 281 CB THR A 23 11.539 -14.326 0.009 1.00 0.00 C ATOM 282 OG1 THR A 23 12.398 -15.468 0.101 1.00 0.00 O ATOM 283 CG2 THR A 23 10.413 -14.448 1.024 1.00 0.00 C ATOM 0 H THR A 23 12.933 -14.574 -2.080 1.00 0.00 H new ATOM 0 HA THR A 23 10.354 -15.069 -1.634 1.00 0.00 H new ATOM 0 HB THR A 23 12.110 -13.425 0.231 1.00 0.00 H new ATOM 0 HG1 THR A 23 12.752 -15.539 1.012 1.00 0.00 H new ATOM 0 HG21 THR A 23 10.834 -14.535 2.026 1.00 0.00 H new ATOM 0 HG22 THR A 23 9.779 -13.563 0.972 1.00 0.00 H new ATOM 0 HG23 THR A 23 9.818 -15.334 0.802 1.00 0.00 H new ATOM 291 N ARG A 24 10.778 -11.821 -1.837 1.00 0.00 N ATOM 292 CA ARG A 24 10.083 -10.545 -1.959 1.00 0.00 C ATOM 293 C ARG A 24 8.913 -10.653 -2.931 1.00 0.00 C ATOM 294 O ARG A 24 7.804 -10.208 -2.636 1.00 0.00 O ATOM 295 CB ARG A 24 11.050 -9.456 -2.427 1.00 0.00 C ATOM 296 CG ARG A 24 10.356 -8.203 -2.936 1.00 0.00 C ATOM 297 CD ARG A 24 11.361 -7.132 -3.331 1.00 0.00 C ATOM 298 NE ARG A 24 11.959 -7.398 -4.637 1.00 0.00 N ATOM 299 CZ ARG A 24 12.734 -6.531 -5.280 1.00 0.00 C ATOM 300 NH1 ARG A 24 13.003 -5.350 -4.741 1.00 0.00 N ATOM 301 NH2 ARG A 24 13.241 -6.846 -6.465 1.00 0.00 N ATOM 0 H ARG A 24 11.781 -11.775 -2.019 1.00 0.00 H new ATOM 0 HA ARG A 24 9.693 -10.278 -0.977 1.00 0.00 H new ATOM 0 HB2 ARG A 24 11.708 -9.187 -1.601 1.00 0.00 H new ATOM 0 HB3 ARG A 24 11.681 -9.859 -3.219 1.00 0.00 H new ATOM 0 HG2 ARG A 24 9.733 -8.454 -3.795 1.00 0.00 H new ATOM 0 HG3 ARG A 24 9.692 -7.814 -2.164 1.00 0.00 H new ATOM 0 HD2 ARG A 24 10.867 -6.160 -3.349 1.00 0.00 H new ATOM 0 HD3 ARG A 24 12.146 -7.076 -2.577 1.00 0.00 H new ATOM 0 HE ARG A 24 11.772 -8.298 -5.079 1.00 0.00 H new ATOM 0 HH11 ARG A 24 12.615 -5.105 -3.830 1.00 0.00 H new ATOM 0 HH12 ARG A 24 13.598 -4.687 -5.237 1.00 0.00 H new ATOM 0 HH21 ARG A 24 13.036 -7.754 -6.883 1.00 0.00 H new ATOM 0 HH22 ARG A 24 13.836 -6.180 -6.958 1.00 0.00 H new ATOM 315 N ALA A 25 9.168 -11.247 -4.093 1.00 0.00 N ATOM 316 CA ALA A 25 8.136 -11.415 -5.108 1.00 0.00 C ATOM 317 C ALA A 25 6.872 -12.025 -4.511 1.00 0.00 C ATOM 318 O ALA A 25 5.763 -11.556 -4.766 1.00 0.00 O ATOM 319 CB ALA A 25 8.654 -12.279 -6.249 1.00 0.00 C ATOM 0 H ALA A 25 10.081 -11.620 -4.354 1.00 0.00 H new ATOM 0 HA ALA A 25 7.882 -10.430 -5.499 1.00 0.00 H new ATOM 0 HB1 ALA A 25 7.873 -12.396 -7.000 1.00 0.00 H new ATOM 0 HB2 ALA A 25 9.523 -11.802 -6.701 1.00 0.00 H new ATOM 0 HB3 ALA A 25 8.937 -13.259 -5.864 1.00 0.00 H new ATOM 325 N LYS A 26 7.047 -13.074 -3.715 1.00 0.00 N ATOM 326 CA LYS A 26 5.921 -13.749 -3.080 1.00 0.00 C ATOM 327 C LYS A 26 5.063 -12.760 -2.299 1.00 0.00 C ATOM 328 O LYS A 26 3.869 -12.982 -2.096 1.00 0.00 O ATOM 329 CB LYS A 26 6.423 -14.854 -2.146 1.00 0.00 C ATOM 330 CG LYS A 26 7.172 -15.964 -2.864 1.00 0.00 C ATOM 331 CD LYS A 26 7.985 -16.805 -1.894 1.00 0.00 C ATOM 332 CE LYS A 26 9.231 -17.371 -2.558 1.00 0.00 C ATOM 333 NZ LYS A 26 10.081 -18.121 -1.592 1.00 0.00 N ATOM 0 H LYS A 26 7.958 -13.476 -3.494 1.00 0.00 H new ATOM 0 HA LYS A 26 5.308 -14.194 -3.864 1.00 0.00 H new ATOM 0 HB2 LYS A 26 7.077 -14.413 -1.394 1.00 0.00 H new ATOM 0 HB3 LYS A 26 5.573 -15.284 -1.616 1.00 0.00 H new ATOM 0 HG2 LYS A 26 6.462 -16.600 -3.393 1.00 0.00 H new ATOM 0 HG3 LYS A 26 7.833 -15.532 -3.615 1.00 0.00 H new ATOM 0 HD2 LYS A 26 8.273 -16.197 -1.036 1.00 0.00 H new ATOM 0 HD3 LYS A 26 7.370 -17.621 -1.515 1.00 0.00 H new ATOM 0 HE2 LYS A 26 8.939 -18.032 -3.374 1.00 0.00 H new ATOM 0 HE3 LYS A 26 9.810 -16.558 -2.997 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 10.920 -18.491 -2.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 10.380 -17.484 -0.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 9.537 -18.912 -1.192 1.00 0.00 H new ATOM 347 N PHE A 27 5.679 -11.665 -1.864 1.00 0.00 N ATOM 348 CA PHE A 27 4.971 -10.641 -1.105 1.00 0.00 C ATOM 349 C PHE A 27 4.369 -9.593 -2.036 1.00 0.00 C ATOM 350 O PHE A 27 3.257 -9.115 -1.815 1.00 0.00 O ATOM 351 CB PHE A 27 5.917 -9.969 -0.107 1.00 0.00 C ATOM 352 CG PHE A 27 5.343 -8.735 0.527 1.00 0.00 C ATOM 353 CD1 PHE A 27 5.227 -7.559 -0.196 1.00 0.00 C ATOM 354 CD2 PHE A 27 4.918 -8.750 1.846 1.00 0.00 C ATOM 355 CE1 PHE A 27 4.698 -6.422 0.384 1.00 0.00 C ATOM 356 CE2 PHE A 27 4.388 -7.616 2.431 1.00 0.00 C ATOM 357 CZ PHE A 27 4.280 -6.450 1.700 1.00 0.00 C ATOM 0 H PHE A 27 6.666 -11.465 -2.024 1.00 0.00 H new ATOM 0 HA PHE A 27 4.161 -11.125 -0.558 1.00 0.00 H new ATOM 0 HB2 PHE A 27 6.174 -10.683 0.675 1.00 0.00 H new ATOM 0 HB3 PHE A 27 6.844 -9.708 -0.617 1.00 0.00 H new ATOM 0 HD1 PHE A 27 5.554 -7.531 -1.225 1.00 0.00 H new ATOM 0 HD2 PHE A 27 5.002 -9.659 2.423 1.00 0.00 H new ATOM 0 HE1 PHE A 27 4.611 -5.512 -0.191 1.00 0.00 H new ATOM 0 HE2 PHE A 27 4.059 -7.642 3.459 1.00 0.00 H new ATOM 0 HZ PHE A 27 3.869 -5.561 2.156 1.00 0.00 H new ATOM 367 N GLU A 28 5.114 -9.239 -3.080 1.00 0.00 N ATOM 368 CA GLU A 28 4.654 -8.246 -4.044 1.00 0.00 C ATOM 369 C GLU A 28 3.540 -8.813 -4.919 1.00 0.00 C ATOM 370 O GLU A 28 2.416 -8.312 -4.912 1.00 0.00 O ATOM 371 CB GLU A 28 5.818 -7.777 -4.920 1.00 0.00 C ATOM 372 CG GLU A 28 6.226 -6.336 -4.671 1.00 0.00 C ATOM 373 CD GLU A 28 7.185 -5.811 -5.722 1.00 0.00 C ATOM 374 OE1 GLU A 28 7.870 -6.635 -6.363 1.00 0.00 O ATOM 375 OE2 GLU A 28 7.254 -4.577 -5.900 1.00 0.00 O ATOM 0 H GLU A 28 6.037 -9.625 -3.279 1.00 0.00 H new ATOM 0 HA GLU A 28 4.259 -7.394 -3.490 1.00 0.00 H new ATOM 0 HB2 GLU A 28 6.677 -8.424 -4.744 1.00 0.00 H new ATOM 0 HB3 GLU A 28 5.542 -7.891 -5.968 1.00 0.00 H new ATOM 0 HG2 GLU A 28 5.335 -5.708 -4.652 1.00 0.00 H new ATOM 0 HG3 GLU A 28 6.692 -6.259 -3.689 1.00 0.00 H new ATOM 382 N SER A 29 3.862 -9.859 -5.673 1.00 0.00 N ATOM 383 CA SER A 29 2.891 -10.492 -6.557 1.00 0.00 C ATOM 384 C SER A 29 1.500 -10.487 -5.929 1.00 0.00 C ATOM 385 O SER A 29 0.497 -10.282 -6.613 1.00 0.00 O ATOM 386 CB SER A 29 3.315 -11.927 -6.872 1.00 0.00 C ATOM 387 OG SER A 29 3.548 -12.663 -5.684 1.00 0.00 O ATOM 0 H SER A 29 4.788 -10.286 -5.689 1.00 0.00 H new ATOM 0 HA SER A 29 2.854 -9.920 -7.484 1.00 0.00 H new ATOM 0 HB2 SER A 29 2.540 -12.417 -7.461 1.00 0.00 H new ATOM 0 HB3 SER A 29 4.219 -11.917 -7.480 1.00 0.00 H new ATOM 0 HG SER A 29 4.431 -12.435 -5.326 1.00 0.00 H new ATOM 393 N LEU A 30 1.448 -10.716 -4.621 1.00 0.00 N ATOM 394 CA LEU A 30 0.181 -10.738 -3.898 1.00 0.00 C ATOM 395 C LEU A 30 -0.638 -9.487 -4.196 1.00 0.00 C ATOM 396 O LEU A 30 -1.732 -9.568 -4.755 1.00 0.00 O ATOM 397 CB LEU A 30 0.433 -10.851 -2.393 1.00 0.00 C ATOM 398 CG LEU A 30 0.727 -12.255 -1.864 1.00 0.00 C ATOM 399 CD1 LEU A 30 1.272 -12.188 -0.446 1.00 0.00 C ATOM 400 CD2 LEU A 30 -0.526 -13.117 -1.916 1.00 0.00 C ATOM 0 H LEU A 30 2.268 -10.889 -4.040 1.00 0.00 H new ATOM 0 HA LEU A 30 -0.385 -11.608 -4.232 1.00 0.00 H new ATOM 0 HB2 LEU A 30 1.272 -10.205 -2.136 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.440 -10.463 -1.869 1.00 0.00 H new ATOM 0 HG LEU A 30 1.485 -12.711 -2.501 1.00 0.00 H new ATOM 0 HD11 LEU A 30 1.475 -13.197 -0.086 1.00 0.00 H new ATOM 0 HD12 LEU A 30 2.194 -11.607 -0.438 1.00 0.00 H new ATOM 0 HD13 LEU A 30 0.538 -11.712 0.204 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.299 -14.113 -1.536 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -1.305 -12.664 -1.303 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -0.873 -13.193 -2.946 1.00 0.00 H new ATOM 412 N PHE A 31 -0.101 -8.331 -3.821 1.00 0.00 N ATOM 413 CA PHE A 31 -0.782 -7.062 -4.050 1.00 0.00 C ATOM 414 C PHE A 31 -0.845 -6.738 -5.540 1.00 0.00 C ATOM 415 O PHE A 31 -1.921 -6.509 -6.091 1.00 0.00 O ATOM 416 CB PHE A 31 -0.068 -5.933 -3.301 1.00 0.00 C ATOM 417 CG PHE A 31 0.251 -6.270 -1.873 1.00 0.00 C ATOM 418 CD1 PHE A 31 1.389 -6.993 -1.556 1.00 0.00 C ATOM 419 CD2 PHE A 31 -0.587 -5.863 -0.847 1.00 0.00 C ATOM 420 CE1 PHE A 31 1.685 -7.305 -0.242 1.00 0.00 C ATOM 421 CE2 PHE A 31 -0.297 -6.172 0.468 1.00 0.00 C ATOM 422 CZ PHE A 31 0.842 -6.893 0.771 1.00 0.00 C ATOM 0 H PHE A 31 0.804 -8.247 -3.357 1.00 0.00 H new ATOM 0 HA PHE A 31 -1.801 -7.153 -3.673 1.00 0.00 H new ATOM 0 HB2 PHE A 31 0.857 -5.689 -3.824 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.693 -5.040 -3.325 1.00 0.00 H new ATOM 0 HD1 PHE A 31 2.053 -7.317 -2.344 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -1.478 -5.297 -1.078 1.00 0.00 H new ATOM 0 HE1 PHE A 31 2.575 -7.871 -0.008 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -0.960 -5.850 1.258 1.00 0.00 H new ATOM 0 HZ PHE A 31 1.073 -7.134 1.798 1.00 0.00 H new ATOM 432 N ARG A 32 0.317 -6.723 -6.185 1.00 0.00 N ATOM 433 CA ARG A 32 0.396 -6.426 -7.610 1.00 0.00 C ATOM 434 C ARG A 32 -0.742 -7.103 -8.370 1.00 0.00 C ATOM 435 O ARG A 32 -1.363 -6.501 -9.247 1.00 0.00 O ATOM 436 CB ARG A 32 1.742 -6.882 -8.175 1.00 0.00 C ATOM 437 CG ARG A 32 2.299 -5.956 -9.244 1.00 0.00 C ATOM 438 CD ARG A 32 2.021 -6.490 -10.641 1.00 0.00 C ATOM 439 NE ARG A 32 3.012 -6.028 -11.611 1.00 0.00 N ATOM 440 CZ ARG A 32 3.013 -6.388 -12.889 1.00 0.00 C ATOM 441 NH1 ARG A 32 2.079 -7.209 -13.349 1.00 0.00 N ATOM 442 NH2 ARG A 32 3.948 -5.927 -13.709 1.00 0.00 N ATOM 0 H ARG A 32 1.217 -6.913 -5.743 1.00 0.00 H new ATOM 0 HA ARG A 32 0.304 -5.347 -7.736 1.00 0.00 H new ATOM 0 HB2 ARG A 32 2.462 -6.957 -7.360 1.00 0.00 H new ATOM 0 HB3 ARG A 32 1.630 -7.882 -8.595 1.00 0.00 H new ATOM 0 HG2 ARG A 32 1.856 -4.966 -9.137 1.00 0.00 H new ATOM 0 HG3 ARG A 32 3.374 -5.841 -9.104 1.00 0.00 H new ATOM 0 HD2 ARG A 32 2.017 -7.580 -10.618 1.00 0.00 H new ATOM 0 HD3 ARG A 32 1.028 -6.174 -10.959 1.00 0.00 H new ATOM 0 HE ARG A 32 3.743 -5.394 -11.288 1.00 0.00 H new ATOM 0 HH11 ARG A 32 1.358 -7.565 -12.721 1.00 0.00 H new ATOM 0 HH12 ARG A 32 2.081 -7.485 -14.331 1.00 0.00 H new ATOM 0 HH21 ARG A 32 4.668 -5.295 -13.358 1.00 0.00 H new ATOM 0 HH22 ARG A 32 3.947 -6.204 -14.691 1.00 0.00 H new ATOM 456 N THR A 33 -1.008 -8.359 -8.028 1.00 0.00 N ATOM 457 CA THR A 33 -2.069 -9.119 -8.678 1.00 0.00 C ATOM 458 C THR A 33 -3.303 -8.254 -8.909 1.00 0.00 C ATOM 459 O THR A 33 -3.919 -8.307 -9.974 1.00 0.00 O ATOM 460 CB THR A 33 -2.469 -10.352 -7.845 1.00 0.00 C ATOM 461 OG1 THR A 33 -1.469 -11.369 -7.964 1.00 0.00 O ATOM 462 CG2 THR A 33 -3.813 -10.899 -8.300 1.00 0.00 C ATOM 0 H THR A 33 -0.504 -8.872 -7.305 1.00 0.00 H new ATOM 0 HA THR A 33 -1.676 -9.451 -9.639 1.00 0.00 H new ATOM 0 HB THR A 33 -2.553 -10.047 -6.802 1.00 0.00 H new ATOM 0 HG1 THR A 33 -0.597 -11.001 -7.711 1.00 0.00 H new ATOM 0 HG21 THR A 33 -4.075 -11.769 -7.698 1.00 0.00 H new ATOM 0 HG22 THR A 33 -4.578 -10.131 -8.180 1.00 0.00 H new ATOM 0 HG23 THR A 33 -3.752 -11.189 -9.349 1.00 0.00 H new ATOM 470 N TYR A 34 -3.658 -7.458 -7.907 1.00 0.00 N ATOM 471 CA TYR A 34 -4.820 -6.583 -8.001 1.00 0.00 C ATOM 472 C TYR A 34 -4.557 -5.431 -8.967 1.00 0.00 C ATOM 473 O TYR A 34 -5.128 -5.377 -10.056 1.00 0.00 O ATOM 474 CB TYR A 34 -5.183 -6.032 -6.621 1.00 0.00 C ATOM 475 CG TYR A 34 -5.147 -7.074 -5.525 1.00 0.00 C ATOM 476 CD1 TYR A 34 -5.857 -8.262 -5.646 1.00 0.00 C ATOM 477 CD2 TYR A 34 -4.404 -6.869 -4.369 1.00 0.00 C ATOM 478 CE1 TYR A 34 -5.827 -9.216 -4.647 1.00 0.00 C ATOM 479 CE2 TYR A 34 -4.367 -7.818 -3.366 1.00 0.00 C ATOM 480 CZ TYR A 34 -5.080 -8.990 -3.510 1.00 0.00 C ATOM 481 OH TYR A 34 -5.048 -9.937 -2.512 1.00 0.00 O ATOM 0 H TYR A 34 -3.158 -7.401 -7.020 1.00 0.00 H new ATOM 0 HA TYR A 34 -5.656 -7.170 -8.382 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -4.494 -5.226 -6.368 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -6.181 -5.596 -6.664 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -6.442 -8.443 -6.536 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -3.846 -5.952 -4.253 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -6.386 -10.134 -4.756 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -3.783 -7.643 -2.474 1.00 0.00 H new ATOM 0 HH TYR A 34 -4.475 -9.623 -1.782 1.00 0.00 H new ATOM 491 N ASP A 35 -3.689 -4.512 -8.559 1.00 0.00 N ATOM 492 CA ASP A 35 -3.348 -3.361 -9.387 1.00 0.00 C ATOM 493 C ASP A 35 -1.947 -3.509 -9.973 1.00 0.00 C ATOM 494 O ASP A 35 -1.036 -4.011 -9.314 1.00 0.00 O ATOM 495 CB ASP A 35 -3.439 -2.072 -8.570 1.00 0.00 C ATOM 496 CG ASP A 35 -3.846 -0.880 -9.413 1.00 0.00 C ATOM 497 OD1 ASP A 35 -4.914 -0.945 -10.056 1.00 0.00 O ATOM 498 OD2 ASP A 35 -3.097 0.120 -9.429 1.00 0.00 O ATOM 0 H ASP A 35 -3.209 -4.542 -7.660 1.00 0.00 H new ATOM 0 HA ASP A 35 -4.063 -3.312 -10.208 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -4.160 -2.206 -7.764 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -2.474 -1.872 -8.104 1.00 0.00 H new ATOM 503 N LYS A 36 -1.781 -3.070 -11.216 1.00 0.00 N ATOM 504 CA LYS A 36 -0.492 -3.153 -11.892 1.00 0.00 C ATOM 505 C LYS A 36 0.309 -1.870 -11.695 1.00 0.00 C ATOM 506 O LYS A 36 1.439 -1.752 -12.170 1.00 0.00 O ATOM 507 CB LYS A 36 -0.691 -3.417 -13.386 1.00 0.00 C ATOM 508 CG LYS A 36 -1.489 -2.335 -14.093 1.00 0.00 C ATOM 509 CD LYS A 36 -0.744 -1.793 -15.301 1.00 0.00 C ATOM 510 CE LYS A 36 -1.641 -0.921 -16.166 1.00 0.00 C ATOM 511 NZ LYS A 36 -1.494 -1.238 -17.614 1.00 0.00 N ATOM 0 H LYS A 36 -2.524 -2.653 -11.776 1.00 0.00 H new ATOM 0 HA LYS A 36 0.066 -3.981 -11.454 1.00 0.00 H new ATOM 0 HB2 LYS A 36 0.285 -3.508 -13.864 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -1.199 -4.373 -13.513 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -2.451 -2.739 -14.409 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -1.697 -1.522 -13.398 1.00 0.00 H new ATOM 0 HD2 LYS A 36 0.117 -1.213 -14.968 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -0.360 -2.622 -15.895 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -2.680 -1.060 -15.867 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -1.399 0.128 -15.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -2.122 -0.622 -18.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -0.508 -1.081 -17.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -1.749 -2.232 -17.779 1.00 0.00 H new ATOM 525 N ASP A 37 -0.282 -0.912 -10.989 1.00 0.00 N ATOM 526 CA ASP A 37 0.378 0.362 -10.726 1.00 0.00 C ATOM 527 C ASP A 37 0.663 0.529 -9.237 1.00 0.00 C ATOM 528 O ASP A 37 0.888 1.642 -8.757 1.00 0.00 O ATOM 529 CB ASP A 37 -0.486 1.522 -11.226 1.00 0.00 C ATOM 530 CG ASP A 37 -0.131 1.940 -12.639 1.00 0.00 C ATOM 531 OD1 ASP A 37 0.303 1.072 -13.423 1.00 0.00 O ATOM 532 OD2 ASP A 37 -0.287 3.137 -12.961 1.00 0.00 O ATOM 0 H ASP A 37 -1.217 -0.993 -10.589 1.00 0.00 H new ATOM 0 HA ASP A 37 1.327 0.369 -11.262 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -1.536 1.232 -11.189 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -0.367 2.374 -10.557 1.00 0.00 H new ATOM 537 N THR A 38 0.653 -0.583 -8.509 1.00 0.00 N ATOM 538 CA THR A 38 0.908 -0.560 -7.074 1.00 0.00 C ATOM 539 C THR A 38 2.402 -0.486 -6.783 1.00 0.00 C ATOM 540 O THR A 38 3.169 -1.362 -7.185 1.00 0.00 O ATOM 541 CB THR A 38 0.322 -1.803 -6.380 1.00 0.00 C ATOM 542 OG1 THR A 38 0.047 -2.822 -7.348 1.00 0.00 O ATOM 543 CG2 THR A 38 -0.954 -1.452 -5.628 1.00 0.00 C ATOM 0 H THR A 38 0.471 -1.512 -8.890 1.00 0.00 H new ATOM 0 HA THR A 38 0.419 0.331 -6.680 1.00 0.00 H new ATOM 0 HB THR A 38 1.057 -2.172 -5.665 1.00 0.00 H new ATOM 0 HG1 THR A 38 -0.597 -3.460 -6.977 1.00 0.00 H new ATOM 0 HG21 THR A 38 -1.350 -2.346 -5.146 1.00 0.00 H new ATOM 0 HG22 THR A 38 -0.735 -0.698 -4.872 1.00 0.00 H new ATOM 0 HG23 THR A 38 -1.692 -1.060 -6.327 1.00 0.00 H new ATOM 551 N THR A 39 2.812 0.565 -6.080 1.00 0.00 N ATOM 552 CA THR A 39 4.215 0.754 -5.734 1.00 0.00 C ATOM 553 C THR A 39 4.515 0.223 -4.337 1.00 0.00 C ATOM 554 O THR A 39 3.721 0.402 -3.412 1.00 0.00 O ATOM 555 CB THR A 39 4.616 2.240 -5.803 1.00 0.00 C ATOM 556 OG1 THR A 39 3.753 3.020 -4.968 1.00 0.00 O ATOM 557 CG2 THR A 39 4.546 2.754 -7.234 1.00 0.00 C ATOM 0 H THR A 39 2.191 1.299 -5.739 1.00 0.00 H new ATOM 0 HA THR A 39 4.798 0.193 -6.465 1.00 0.00 H new ATOM 0 HB THR A 39 5.643 2.333 -5.450 1.00 0.00 H new ATOM 0 HG1 THR A 39 4.016 3.963 -5.016 1.00 0.00 H new ATOM 0 HG21 THR A 39 4.833 3.805 -7.258 1.00 0.00 H new ATOM 0 HG22 THR A 39 5.226 2.178 -7.861 1.00 0.00 H new ATOM 0 HG23 THR A 39 3.528 2.648 -7.609 1.00 0.00 H new ATOM 565 N PHE A 40 5.663 -0.428 -4.190 1.00 0.00 N ATOM 566 CA PHE A 40 6.066 -0.985 -2.903 1.00 0.00 C ATOM 567 C PHE A 40 7.331 -0.306 -2.389 1.00 0.00 C ATOM 568 O PHE A 40 8.256 -0.033 -3.154 1.00 0.00 O ATOM 569 CB PHE A 40 6.298 -2.493 -3.027 1.00 0.00 C ATOM 570 CG PHE A 40 5.156 -3.224 -3.673 1.00 0.00 C ATOM 571 CD1 PHE A 40 4.859 -3.029 -5.013 1.00 0.00 C ATOM 572 CD2 PHE A 40 4.378 -4.107 -2.941 1.00 0.00 C ATOM 573 CE1 PHE A 40 3.809 -3.700 -5.610 1.00 0.00 C ATOM 574 CE2 PHE A 40 3.326 -4.781 -3.533 1.00 0.00 C ATOM 575 CZ PHE A 40 3.042 -4.578 -4.869 1.00 0.00 C ATOM 0 H PHE A 40 6.331 -0.583 -4.945 1.00 0.00 H new ATOM 0 HA PHE A 40 5.262 -0.805 -2.189 1.00 0.00 H new ATOM 0 HB2 PHE A 40 7.204 -2.667 -3.607 1.00 0.00 H new ATOM 0 HB3 PHE A 40 6.470 -2.909 -2.034 1.00 0.00 H new ATOM 0 HD1 PHE A 40 5.456 -2.344 -5.597 1.00 0.00 H new ATOM 0 HD2 PHE A 40 4.596 -4.270 -1.896 1.00 0.00 H new ATOM 0 HE1 PHE A 40 3.588 -3.538 -6.655 1.00 0.00 H new ATOM 0 HE2 PHE A 40 2.727 -5.466 -2.951 1.00 0.00 H new ATOM 0 HZ PHE A 40 2.222 -5.105 -5.334 1.00 0.00 H new ATOM 585 N GLN A 41 7.363 -0.036 -1.088 1.00 0.00 N ATOM 586 CA GLN A 41 8.514 0.613 -0.471 1.00 0.00 C ATOM 587 C GLN A 41 8.917 -0.101 0.815 1.00 0.00 C ATOM 588 O GLN A 41 8.238 0.007 1.836 1.00 0.00 O ATOM 589 CB GLN A 41 8.201 2.082 -0.177 1.00 0.00 C ATOM 590 CG GLN A 41 9.406 2.999 -0.311 1.00 0.00 C ATOM 591 CD GLN A 41 9.122 4.211 -1.176 1.00 0.00 C ATOM 592 OE1 GLN A 41 9.250 4.159 -2.400 1.00 0.00 O ATOM 593 NE2 GLN A 41 8.736 5.313 -0.543 1.00 0.00 N ATOM 0 H GLN A 41 6.606 -0.256 -0.441 1.00 0.00 H new ATOM 0 HA GLN A 41 9.348 0.560 -1.171 1.00 0.00 H new ATOM 0 HB2 GLN A 41 7.419 2.421 -0.856 1.00 0.00 H new ATOM 0 HB3 GLN A 41 7.802 2.165 0.834 1.00 0.00 H new ATOM 0 HG2 GLN A 41 9.719 3.329 0.680 1.00 0.00 H new ATOM 0 HG3 GLN A 41 10.238 2.439 -0.738 1.00 0.00 H new ATOM 0 HE21 GLN A 41 8.643 5.312 0.473 1.00 0.00 H new ATOM 0 HE22 GLN A 41 8.533 6.161 -1.073 1.00 0.00 H new ATOM 602 N TYR A 42 10.026 -0.830 0.757 1.00 0.00 N ATOM 603 CA TYR A 42 10.519 -1.565 1.917 1.00 0.00 C ATOM 604 C TYR A 42 11.466 -0.703 2.745 1.00 0.00 C ATOM 605 O TYR A 42 12.341 -0.026 2.205 1.00 0.00 O ATOM 606 CB TYR A 42 11.231 -2.843 1.472 1.00 0.00 C ATOM 607 CG TYR A 42 10.324 -3.828 0.770 1.00 0.00 C ATOM 608 CD1 TYR A 42 9.715 -3.504 -0.437 1.00 0.00 C ATOM 609 CD2 TYR A 42 10.075 -5.083 1.313 1.00 0.00 C ATOM 610 CE1 TYR A 42 8.885 -4.400 -1.081 1.00 0.00 C ATOM 611 CE2 TYR A 42 9.248 -5.986 0.673 1.00 0.00 C ATOM 612 CZ TYR A 42 8.655 -5.641 -0.523 1.00 0.00 C ATOM 613 OH TYR A 42 7.830 -6.537 -1.161 1.00 0.00 O ATOM 0 H TYR A 42 10.601 -0.928 -0.080 1.00 0.00 H new ATOM 0 HA TYR A 42 9.663 -1.832 2.538 1.00 0.00 H new ATOM 0 HB2 TYR A 42 12.052 -2.578 0.805 1.00 0.00 H new ATOM 0 HB3 TYR A 42 11.672 -3.326 2.344 1.00 0.00 H new ATOM 0 HD1 TYR A 42 9.894 -2.535 -0.879 1.00 0.00 H new ATOM 0 HD2 TYR A 42 10.536 -5.357 2.251 1.00 0.00 H new ATOM 0 HE1 TYR A 42 8.418 -4.131 -2.017 1.00 0.00 H new ATOM 0 HE2 TYR A 42 9.067 -6.958 1.108 1.00 0.00 H new ATOM 0 HH TYR A 42 7.236 -6.959 -0.505 1.00 0.00 H new ATOM 623 N PHE A 43 11.286 -0.735 4.061 1.00 0.00 N ATOM 624 CA PHE A 43 12.124 0.043 4.966 1.00 0.00 C ATOM 625 C PHE A 43 12.957 -0.872 5.859 1.00 0.00 C ATOM 626 O PHE A 43 12.461 -1.411 6.849 1.00 0.00 O ATOM 627 CB PHE A 43 11.262 0.968 5.828 1.00 0.00 C ATOM 628 CG PHE A 43 10.482 1.976 5.031 1.00 0.00 C ATOM 629 CD1 PHE A 43 11.115 3.073 4.471 1.00 0.00 C ATOM 630 CD2 PHE A 43 9.118 1.826 4.845 1.00 0.00 C ATOM 631 CE1 PHE A 43 10.402 4.002 3.737 1.00 0.00 C ATOM 632 CE2 PHE A 43 8.400 2.751 4.112 1.00 0.00 C ATOM 633 CZ PHE A 43 9.042 3.841 3.558 1.00 0.00 C ATOM 0 H PHE A 43 10.568 -1.291 4.525 1.00 0.00 H new ATOM 0 HA PHE A 43 12.801 0.647 4.362 1.00 0.00 H new ATOM 0 HB2 PHE A 43 10.569 0.364 6.413 1.00 0.00 H new ATOM 0 HB3 PHE A 43 11.903 1.494 6.536 1.00 0.00 H new ATOM 0 HD1 PHE A 43 12.178 3.204 4.609 1.00 0.00 H new ATOM 0 HD2 PHE A 43 8.610 0.977 5.278 1.00 0.00 H new ATOM 0 HE1 PHE A 43 10.908 4.853 3.304 1.00 0.00 H new ATOM 0 HE2 PHE A 43 7.337 2.622 3.972 1.00 0.00 H new ATOM 0 HZ PHE A 43 8.482 4.566 2.986 1.00 0.00 H new ATOM 643 N LYS A 44 14.224 -1.045 5.501 1.00 0.00 N ATOM 644 CA LYS A 44 15.128 -1.895 6.269 1.00 0.00 C ATOM 645 C LYS A 44 15.385 -1.305 7.651 1.00 0.00 C ATOM 646 O LYS A 44 15.913 -1.979 8.536 1.00 0.00 O ATOM 647 CB LYS A 44 16.452 -2.071 5.523 1.00 0.00 C ATOM 648 CG LYS A 44 17.112 -3.418 5.764 1.00 0.00 C ATOM 649 CD LYS A 44 17.392 -4.143 4.459 1.00 0.00 C ATOM 650 CE LYS A 44 17.625 -5.629 4.687 1.00 0.00 C ATOM 651 NZ LYS A 44 18.825 -6.121 3.956 1.00 0.00 N ATOM 0 H LYS A 44 14.649 -0.608 4.683 1.00 0.00 H new ATOM 0 HA LYS A 44 14.655 -2.869 6.391 1.00 0.00 H new ATOM 0 HB2 LYS A 44 16.276 -1.948 4.454 1.00 0.00 H new ATOM 0 HB3 LYS A 44 17.138 -1.280 5.826 1.00 0.00 H new ATOM 0 HG2 LYS A 44 18.045 -3.275 6.309 1.00 0.00 H new ATOM 0 HG3 LYS A 44 16.467 -4.033 6.392 1.00 0.00 H new ATOM 0 HD2 LYS A 44 16.553 -4.005 3.778 1.00 0.00 H new ATOM 0 HD3 LYS A 44 18.267 -3.706 3.979 1.00 0.00 H new ATOM 0 HE2 LYS A 44 17.747 -5.818 5.754 1.00 0.00 H new ATOM 0 HE3 LYS A 44 16.747 -6.188 4.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 18.949 -7.138 4.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 18.699 -5.964 2.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 19.667 -5.606 4.284 1.00 0.00 H new ATOM 665 N SER A 45 15.009 -0.043 7.831 1.00 0.00 N ATOM 666 CA SER A 45 15.203 0.638 9.106 1.00 0.00 C ATOM 667 C SER A 45 14.035 0.366 10.050 1.00 0.00 C ATOM 668 O SER A 45 14.217 0.240 11.262 1.00 0.00 O ATOM 669 CB SER A 45 15.355 2.145 8.887 1.00 0.00 C ATOM 670 OG SER A 45 16.511 2.434 8.119 1.00 0.00 O ATOM 0 H SER A 45 14.568 0.529 7.110 1.00 0.00 H new ATOM 0 HA SER A 45 16.115 0.251 9.561 1.00 0.00 H new ATOM 0 HB2 SER A 45 14.471 2.533 8.380 1.00 0.00 H new ATOM 0 HB3 SER A 45 15.418 2.651 9.850 1.00 0.00 H new ATOM 0 HG SER A 45 16.585 3.403 7.991 1.00 0.00 H new ATOM 676 N PHE A 46 12.835 0.276 9.486 1.00 0.00 N ATOM 677 CA PHE A 46 11.637 0.020 10.276 1.00 0.00 C ATOM 678 C PHE A 46 11.006 -1.315 9.889 1.00 0.00 C ATOM 679 O PHE A 46 9.855 -1.592 10.227 1.00 0.00 O ATOM 680 CB PHE A 46 10.623 1.150 10.085 1.00 0.00 C ATOM 681 CG PHE A 46 11.086 2.469 10.631 1.00 0.00 C ATOM 682 CD1 PHE A 46 11.190 2.669 11.999 1.00 0.00 C ATOM 683 CD2 PHE A 46 11.418 3.510 9.780 1.00 0.00 C ATOM 684 CE1 PHE A 46 11.616 3.883 12.505 1.00 0.00 C ATOM 685 CE2 PHE A 46 11.845 4.727 10.280 1.00 0.00 C ATOM 686 CZ PHE A 46 11.944 4.912 11.645 1.00 0.00 C ATOM 0 H PHE A 46 12.667 0.377 8.485 1.00 0.00 H new ATOM 0 HA PHE A 46 11.927 -0.025 11.326 1.00 0.00 H new ATOM 0 HB2 PHE A 46 10.410 1.261 9.022 1.00 0.00 H new ATOM 0 HB3 PHE A 46 9.687 0.873 10.570 1.00 0.00 H new ATOM 0 HD1 PHE A 46 10.935 1.868 12.677 1.00 0.00 H new ATOM 0 HD2 PHE A 46 11.343 3.370 8.712 1.00 0.00 H new ATOM 0 HE1 PHE A 46 11.692 4.026 13.573 1.00 0.00 H new ATOM 0 HE2 PHE A 46 12.100 5.530 9.605 1.00 0.00 H new ATOM 0 HZ PHE A 46 12.278 5.861 12.039 1.00 0.00 H new ATOM 696 N LYS A 47 11.768 -2.139 9.179 1.00 0.00 N ATOM 697 CA LYS A 47 11.287 -3.445 8.746 1.00 0.00 C ATOM 698 C LYS A 47 9.805 -3.387 8.386 1.00 0.00 C ATOM 699 O LYS A 47 9.018 -4.227 8.824 1.00 0.00 O ATOM 700 CB LYS A 47 11.515 -4.485 9.844 1.00 0.00 C ATOM 701 CG LYS A 47 12.940 -5.009 9.899 1.00 0.00 C ATOM 702 CD LYS A 47 13.135 -6.195 8.971 1.00 0.00 C ATOM 703 CE LYS A 47 14.572 -6.695 8.998 1.00 0.00 C ATOM 704 NZ LYS A 47 15.001 -7.073 10.372 1.00 0.00 N ATOM 0 H LYS A 47 12.723 -1.925 8.891 1.00 0.00 H new ATOM 0 HA LYS A 47 11.848 -3.735 7.858 1.00 0.00 H new ATOM 0 HB2 LYS A 47 11.261 -4.045 10.808 1.00 0.00 H new ATOM 0 HB3 LYS A 47 10.835 -5.322 9.687 1.00 0.00 H new ATOM 0 HG2 LYS A 47 13.632 -4.213 9.624 1.00 0.00 H new ATOM 0 HG3 LYS A 47 13.181 -5.302 10.921 1.00 0.00 H new ATOM 0 HD2 LYS A 47 12.463 -7.001 9.264 1.00 0.00 H new ATOM 0 HD3 LYS A 47 12.867 -5.910 7.954 1.00 0.00 H new ATOM 0 HE2 LYS A 47 14.669 -7.556 8.337 1.00 0.00 H new ATOM 0 HE3 LYS A 47 15.234 -5.920 8.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 15.883 -7.623 10.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 15.161 -6.213 10.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 14.260 -7.648 10.821 1.00 0.00 H new ATOM 718 N ARG A 48 9.434 -2.393 7.586 1.00 0.00 N ATOM 719 CA ARG A 48 8.046 -2.227 7.168 1.00 0.00 C ATOM 720 C ARG A 48 7.927 -2.278 5.648 1.00 0.00 C ATOM 721 O ARG A 48 8.931 -2.257 4.935 1.00 0.00 O ATOM 722 CB ARG A 48 7.491 -0.901 7.690 1.00 0.00 C ATOM 723 CG ARG A 48 6.900 -0.996 9.087 1.00 0.00 C ATOM 724 CD ARG A 48 5.966 0.168 9.378 1.00 0.00 C ATOM 725 NE ARG A 48 6.555 1.123 10.313 1.00 0.00 N ATOM 726 CZ ARG A 48 7.380 2.097 9.947 1.00 0.00 C ATOM 727 NH1 ARG A 48 7.709 2.247 8.671 1.00 0.00 N ATOM 728 NH2 ARG A 48 7.875 2.926 10.857 1.00 0.00 N ATOM 0 H ARG A 48 10.074 -1.691 7.214 1.00 0.00 H new ATOM 0 HA ARG A 48 7.464 -3.047 7.588 1.00 0.00 H new ATOM 0 HB2 ARG A 48 8.289 -0.158 7.692 1.00 0.00 H new ATOM 0 HB3 ARG A 48 6.724 -0.543 7.004 1.00 0.00 H new ATOM 0 HG2 ARG A 48 6.356 -1.935 9.190 1.00 0.00 H new ATOM 0 HG3 ARG A 48 7.704 -1.011 9.823 1.00 0.00 H new ATOM 0 HD2 ARG A 48 5.721 0.677 8.446 1.00 0.00 H new ATOM 0 HD3 ARG A 48 5.031 -0.212 9.789 1.00 0.00 H new ATOM 0 HE ARG A 48 6.320 1.037 11.302 1.00 0.00 H new ATOM 0 HH11 ARG A 48 7.328 1.613 7.968 1.00 0.00 H new ATOM 0 HH12 ARG A 48 8.343 2.996 8.392 1.00 0.00 H new ATOM 0 HH21 ARG A 48 7.622 2.815 11.839 1.00 0.00 H new ATOM 0 HH22 ARG A 48 8.509 3.674 10.575 1.00 0.00 H new ATOM 742 N VAL A 49 6.694 -2.346 5.158 1.00 0.00 N ATOM 743 CA VAL A 49 6.443 -2.399 3.723 1.00 0.00 C ATOM 744 C VAL A 49 5.278 -1.496 3.335 1.00 0.00 C ATOM 745 O VAL A 49 4.119 -1.810 3.607 1.00 0.00 O ATOM 746 CB VAL A 49 6.141 -3.837 3.259 1.00 0.00 C ATOM 747 CG1 VAL A 49 6.252 -3.944 1.746 1.00 0.00 C ATOM 748 CG2 VAL A 49 7.075 -4.824 3.942 1.00 0.00 C ATOM 0 H VAL A 49 5.852 -2.366 5.734 1.00 0.00 H new ATOM 0 HA VAL A 49 7.350 -2.049 3.230 1.00 0.00 H new ATOM 0 HB VAL A 49 5.118 -4.085 3.542 1.00 0.00 H new ATOM 0 HG11 VAL A 49 6.035 -4.967 1.437 1.00 0.00 H new ATOM 0 HG12 VAL A 49 5.538 -3.265 1.280 1.00 0.00 H new ATOM 0 HG13 VAL A 49 7.262 -3.677 1.436 1.00 0.00 H new ATOM 0 HG21 VAL A 49 6.848 -5.835 3.603 1.00 0.00 H new ATOM 0 HG22 VAL A 49 8.108 -4.581 3.692 1.00 0.00 H new ATOM 0 HG23 VAL A 49 6.940 -4.765 5.022 1.00 0.00 H new ATOM 758 N ARG A 50 5.592 -0.374 2.696 1.00 0.00 N ATOM 759 CA ARG A 50 4.570 0.575 2.271 1.00 0.00 C ATOM 760 C ARG A 50 4.119 0.283 0.842 1.00 0.00 C ATOM 761 O ARG A 50 4.888 0.437 -0.107 1.00 0.00 O ATOM 762 CB ARG A 50 5.103 2.006 2.366 1.00 0.00 C ATOM 763 CG ARG A 50 4.086 3.062 1.965 1.00 0.00 C ATOM 764 CD ARG A 50 4.011 4.181 2.992 1.00 0.00 C ATOM 765 NE ARG A 50 3.600 5.448 2.391 1.00 0.00 N ATOM 766 CZ ARG A 50 2.333 5.775 2.162 1.00 0.00 C ATOM 767 NH1 ARG A 50 1.360 4.934 2.480 1.00 0.00 N ATOM 768 NH2 ARG A 50 2.039 6.947 1.613 1.00 0.00 N ATOM 0 H ARG A 50 6.546 -0.100 2.461 1.00 0.00 H new ATOM 0 HA ARG A 50 3.712 0.469 2.934 1.00 0.00 H new ATOM 0 HB2 ARG A 50 5.428 2.197 3.389 1.00 0.00 H new ATOM 0 HB3 ARG A 50 5.983 2.100 1.729 1.00 0.00 H new ATOM 0 HG2 ARG A 50 4.354 3.476 0.993 1.00 0.00 H new ATOM 0 HG3 ARG A 50 3.105 2.601 1.856 1.00 0.00 H new ATOM 0 HD2 ARG A 50 3.306 3.906 3.777 1.00 0.00 H new ATOM 0 HD3 ARG A 50 4.985 4.304 3.467 1.00 0.00 H new ATOM 0 HE ARG A 50 4.325 6.117 2.133 1.00 0.00 H new ATOM 0 HH11 ARG A 50 1.583 4.032 2.902 1.00 0.00 H new ATOM 0 HH12 ARG A 50 0.388 5.188 2.303 1.00 0.00 H new ATOM 0 HH21 ARG A 50 2.786 7.597 1.367 1.00 0.00 H new ATOM 0 HH22 ARG A 50 1.066 7.198 1.437 1.00 0.00 H new ATOM 782 N ILE A 51 2.867 -0.138 0.698 1.00 0.00 N ATOM 783 CA ILE A 51 2.312 -0.451 -0.614 1.00 0.00 C ATOM 784 C ILE A 51 1.256 0.570 -1.021 1.00 0.00 C ATOM 785 O ILE A 51 0.154 0.591 -0.472 1.00 0.00 O ATOM 786 CB ILE A 51 1.688 -1.858 -0.639 1.00 0.00 C ATOM 787 CG1 ILE A 51 2.612 -2.863 0.051 1.00 0.00 C ATOM 788 CG2 ILE A 51 1.408 -2.287 -2.073 1.00 0.00 C ATOM 789 CD1 ILE A 51 1.962 -3.580 1.214 1.00 0.00 C ATOM 0 H ILE A 51 2.218 -0.270 1.473 1.00 0.00 H new ATOM 0 HA ILE A 51 3.139 -0.417 -1.324 1.00 0.00 H new ATOM 0 HB ILE A 51 0.743 -1.830 -0.096 1.00 0.00 H new ATOM 0 HG12 ILE A 51 2.945 -3.600 -0.680 1.00 0.00 H new ATOM 0 HG13 ILE A 51 3.501 -2.343 0.406 1.00 0.00 H new ATOM 0 HG21 ILE A 51 0.967 -3.284 -2.075 1.00 0.00 H new ATOM 0 HG22 ILE A 51 0.716 -1.583 -2.535 1.00 0.00 H new ATOM 0 HG23 ILE A 51 2.341 -2.302 -2.637 1.00 0.00 H new ATOM 0 HD11 ILE A 51 2.674 -4.277 1.656 1.00 0.00 H new ATOM 0 HD12 ILE A 51 1.654 -2.852 1.964 1.00 0.00 H new ATOM 0 HD13 ILE A 51 1.089 -4.129 0.861 1.00 0.00 H new ATOM 801 N ASN A 52 1.598 1.415 -1.989 1.00 0.00 N ATOM 802 CA ASN A 52 0.677 2.438 -2.472 1.00 0.00 C ATOM 803 C ASN A 52 -0.066 1.958 -3.714 1.00 0.00 C ATOM 804 O ASN A 52 0.536 1.405 -4.636 1.00 0.00 O ATOM 805 CB ASN A 52 1.437 3.729 -2.784 1.00 0.00 C ATOM 806 CG ASN A 52 1.672 4.575 -1.548 1.00 0.00 C ATOM 807 OD1 ASN A 52 2.249 4.111 -0.565 1.00 0.00 O ATOM 808 ND2 ASN A 52 1.224 5.824 -1.592 1.00 0.00 N ATOM 0 H ASN A 52 2.506 1.411 -2.454 1.00 0.00 H new ATOM 0 HA ASN A 52 -0.054 2.635 -1.688 1.00 0.00 H new ATOM 0 HB2 ASN A 52 2.396 3.482 -3.239 1.00 0.00 H new ATOM 0 HB3 ASN A 52 0.876 4.309 -3.517 1.00 0.00 H new ATOM 0 HD21 ASN A 52 1.353 6.441 -0.790 1.00 0.00 H new ATOM 0 HD22 ASN A 52 0.751 6.167 -2.428 1.00 0.00 H new ATOM 815 N PHE A 53 -1.377 2.172 -3.732 1.00 0.00 N ATOM 816 CA PHE A 53 -2.204 1.762 -4.861 1.00 0.00 C ATOM 817 C PHE A 53 -2.674 2.974 -5.660 1.00 0.00 C ATOM 818 O PHE A 53 -2.325 4.112 -5.346 1.00 0.00 O ATOM 819 CB PHE A 53 -3.411 0.960 -4.372 1.00 0.00 C ATOM 820 CG PHE A 53 -3.039 -0.246 -3.558 1.00 0.00 C ATOM 821 CD1 PHE A 53 -2.372 -0.107 -2.352 1.00 0.00 C ATOM 822 CD2 PHE A 53 -3.356 -1.521 -4.001 1.00 0.00 C ATOM 823 CE1 PHE A 53 -2.029 -1.215 -1.600 1.00 0.00 C ATOM 824 CE2 PHE A 53 -3.015 -2.633 -3.254 1.00 0.00 C ATOM 825 CZ PHE A 53 -2.349 -2.480 -2.053 1.00 0.00 C ATOM 0 H PHE A 53 -1.890 2.627 -2.977 1.00 0.00 H new ATOM 0 HA PHE A 53 -1.598 1.132 -5.513 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -4.050 1.609 -3.774 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -3.998 0.640 -5.233 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -2.117 0.880 -1.995 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -3.875 -1.647 -4.940 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -1.512 -1.092 -0.660 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -3.269 -3.621 -3.609 1.00 0.00 H new ATOM 0 HZ PHE A 53 -2.079 -3.348 -1.470 1.00 0.00 H new ATOM 835 N SER A 54 -3.469 2.722 -6.695 1.00 0.00 N ATOM 836 CA SER A 54 -3.984 3.790 -7.542 1.00 0.00 C ATOM 837 C SER A 54 -5.408 4.164 -7.140 1.00 0.00 C ATOM 838 O SER A 54 -5.843 5.297 -7.338 1.00 0.00 O ATOM 839 CB SER A 54 -3.952 3.366 -9.011 1.00 0.00 C ATOM 840 OG SER A 54 -5.057 2.536 -9.327 1.00 0.00 O ATOM 0 H SER A 54 -3.770 1.786 -6.967 1.00 0.00 H new ATOM 0 HA SER A 54 -3.346 4.664 -7.410 1.00 0.00 H new ATOM 0 HB2 SER A 54 -3.964 4.250 -9.648 1.00 0.00 H new ATOM 0 HB3 SER A 54 -3.023 2.835 -9.219 1.00 0.00 H new ATOM 0 HG SER A 54 -4.748 1.614 -9.453 1.00 0.00 H new ATOM 846 N ASN A 55 -6.127 3.200 -6.574 1.00 0.00 N ATOM 847 CA ASN A 55 -7.502 3.426 -6.144 1.00 0.00 C ATOM 848 C ASN A 55 -7.705 2.966 -4.703 1.00 0.00 C ATOM 849 O ASN A 55 -7.134 1.971 -4.258 1.00 0.00 O ATOM 850 CB ASN A 55 -8.475 2.691 -7.068 1.00 0.00 C ATOM 851 CG ASN A 55 -8.022 2.706 -8.515 1.00 0.00 C ATOM 852 OD1 ASN A 55 -7.842 3.769 -9.109 1.00 0.00 O ATOM 853 ND2 ASN A 55 -7.835 1.523 -9.088 1.00 0.00 N ATOM 0 H ASN A 55 -5.781 2.256 -6.403 1.00 0.00 H new ATOM 0 HA ASN A 55 -7.701 4.496 -6.196 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -8.580 1.659 -6.734 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -9.460 3.151 -6.994 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -7.530 1.470 -10.060 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -7.997 0.668 -8.556 1.00 0.00 H new ATOM 860 N PRO A 56 -8.538 3.705 -3.956 1.00 0.00 N ATOM 861 CA PRO A 56 -8.837 3.391 -2.556 1.00 0.00 C ATOM 862 C PRO A 56 -9.674 2.126 -2.412 1.00 0.00 C ATOM 863 O PRO A 56 -10.024 1.724 -1.301 1.00 0.00 O ATOM 864 CB PRO A 56 -9.628 4.613 -2.080 1.00 0.00 C ATOM 865 CG PRO A 56 -10.238 5.176 -3.317 1.00 0.00 C ATOM 866 CD PRO A 56 -9.255 4.905 -4.423 1.00 0.00 C ATOM 0 HA PRO A 56 -7.932 3.200 -1.979 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -10.392 4.332 -1.355 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -8.978 5.340 -1.593 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -11.200 4.708 -3.526 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -10.421 6.245 -3.210 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -9.758 4.728 -5.373 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -8.577 5.745 -4.573 1.00 0.00 H new ATOM 874 N LEU A 57 -9.991 1.499 -3.539 1.00 0.00 N ATOM 875 CA LEU A 57 -10.786 0.277 -3.538 1.00 0.00 C ATOM 876 C LEU A 57 -9.904 -0.947 -3.318 1.00 0.00 C ATOM 877 O LEU A 57 -10.006 -1.623 -2.295 1.00 0.00 O ATOM 878 CB LEU A 57 -11.549 0.140 -4.857 1.00 0.00 C ATOM 879 CG LEU A 57 -12.484 1.296 -5.215 1.00 0.00 C ATOM 880 CD1 LEU A 57 -12.025 1.976 -6.495 1.00 0.00 C ATOM 881 CD2 LEU A 57 -13.916 0.800 -5.356 1.00 0.00 C ATOM 0 H LEU A 57 -9.709 1.817 -4.466 1.00 0.00 H new ATOM 0 HA LEU A 57 -11.500 0.339 -2.717 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -10.824 0.023 -5.662 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -12.136 -0.778 -4.820 1.00 0.00 H new ATOM 0 HG LEU A 57 -12.452 2.027 -4.408 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -12.702 2.796 -6.734 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -11.017 2.366 -6.358 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -12.027 1.254 -7.311 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -14.567 1.636 -5.611 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -13.965 0.049 -6.144 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -14.243 0.360 -4.414 1.00 0.00 H new ATOM 893 N SER A 58 -9.035 -1.226 -4.285 1.00 0.00 N ATOM 894 CA SER A 58 -8.136 -2.370 -4.198 1.00 0.00 C ATOM 895 C SER A 58 -7.508 -2.463 -2.811 1.00 0.00 C ATOM 896 O SER A 58 -7.495 -3.527 -2.193 1.00 0.00 O ATOM 897 CB SER A 58 -7.039 -2.265 -5.261 1.00 0.00 C ATOM 898 OG SER A 58 -6.808 -3.518 -5.880 1.00 0.00 O ATOM 0 H SER A 58 -8.935 -0.675 -5.138 1.00 0.00 H new ATOM 0 HA SER A 58 -8.719 -3.274 -4.375 1.00 0.00 H new ATOM 0 HB2 SER A 58 -7.327 -1.531 -6.014 1.00 0.00 H new ATOM 0 HB3 SER A 58 -6.117 -1.907 -4.803 1.00 0.00 H new ATOM 0 HG SER A 58 -6.105 -3.424 -6.556 1.00 0.00 H new ATOM 904 N ALA A 59 -6.987 -1.340 -2.327 1.00 0.00 N ATOM 905 CA ALA A 59 -6.359 -1.292 -1.013 1.00 0.00 C ATOM 906 C ALA A 59 -7.162 -2.093 0.008 1.00 0.00 C ATOM 907 O ALA A 59 -6.595 -2.739 0.888 1.00 0.00 O ATOM 908 CB ALA A 59 -6.206 0.149 -0.552 1.00 0.00 C ATOM 0 H ALA A 59 -6.988 -0.451 -2.826 1.00 0.00 H new ATOM 0 HA ALA A 59 -5.370 -1.742 -1.094 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -5.735 0.169 0.431 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -5.585 0.694 -1.263 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -7.188 0.619 -0.494 1.00 0.00 H new ATOM 914 N ALA A 60 -8.484 -2.045 -0.117 1.00 0.00 N ATOM 915 CA ALA A 60 -9.363 -2.768 0.794 1.00 0.00 C ATOM 916 C ALA A 60 -9.260 -4.274 0.578 1.00 0.00 C ATOM 917 O ALA A 60 -8.960 -5.025 1.507 1.00 0.00 O ATOM 918 CB ALA A 60 -10.802 -2.305 0.617 1.00 0.00 C ATOM 0 H ALA A 60 -8.970 -1.514 -0.840 1.00 0.00 H new ATOM 0 HA ALA A 60 -9.045 -2.551 1.814 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -11.448 -2.853 1.303 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -10.870 -1.238 0.829 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -11.121 -2.492 -0.408 1.00 0.00 H new ATOM 924 N ASP A 61 -9.510 -4.709 -0.652 1.00 0.00 N ATOM 925 CA ASP A 61 -9.444 -6.126 -0.989 1.00 0.00 C ATOM 926 C ASP A 61 -8.063 -6.695 -0.680 1.00 0.00 C ATOM 927 O ASP A 61 -7.923 -7.878 -0.373 1.00 0.00 O ATOM 928 CB ASP A 61 -9.777 -6.336 -2.467 1.00 0.00 C ATOM 929 CG ASP A 61 -11.056 -7.124 -2.666 1.00 0.00 C ATOM 930 OD1 ASP A 61 -12.131 -6.619 -2.278 1.00 0.00 O ATOM 931 OD2 ASP A 61 -10.984 -8.247 -3.209 1.00 0.00 O ATOM 0 H ASP A 61 -9.760 -4.101 -1.432 1.00 0.00 H new ATOM 0 HA ASP A 61 -10.178 -6.654 -0.380 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -9.871 -5.367 -2.956 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -8.952 -6.859 -2.951 1.00 0.00 H new ATOM 936 N ALA A 62 -7.046 -5.845 -0.765 1.00 0.00 N ATOM 937 CA ALA A 62 -5.675 -6.262 -0.494 1.00 0.00 C ATOM 938 C ALA A 62 -5.505 -6.667 0.967 1.00 0.00 C ATOM 939 O ALA A 62 -4.604 -7.436 1.305 1.00 0.00 O ATOM 940 CB ALA A 62 -4.704 -5.148 -0.853 1.00 0.00 C ATOM 0 H ALA A 62 -7.145 -4.862 -1.020 1.00 0.00 H new ATOM 0 HA ALA A 62 -5.455 -7.132 -1.113 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -3.684 -5.473 -0.646 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -4.800 -4.909 -1.912 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -4.930 -4.263 -0.259 1.00 0.00 H new ATOM 946 N ARG A 63 -6.372 -6.144 1.826 1.00 0.00 N ATOM 947 CA ARG A 63 -6.315 -6.450 3.251 1.00 0.00 C ATOM 948 C ARG A 63 -7.070 -7.739 3.560 1.00 0.00 C ATOM 949 O ARG A 63 -6.635 -8.542 4.387 1.00 0.00 O ATOM 950 CB ARG A 63 -6.900 -5.295 4.066 1.00 0.00 C ATOM 951 CG ARG A 63 -6.721 -5.457 5.566 1.00 0.00 C ATOM 952 CD ARG A 63 -7.576 -4.466 6.340 1.00 0.00 C ATOM 953 NE ARG A 63 -8.977 -4.876 6.392 1.00 0.00 N ATOM 954 CZ ARG A 63 -9.906 -4.233 7.091 1.00 0.00 C ATOM 955 NH1 ARG A 63 -9.584 -3.156 7.793 1.00 0.00 N ATOM 956 NH2 ARG A 63 -11.159 -4.669 7.089 1.00 0.00 N ATOM 0 H ARG A 63 -7.123 -5.506 1.561 1.00 0.00 H new ATOM 0 HA ARG A 63 -5.269 -6.587 3.527 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.429 -4.364 3.751 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -7.963 -5.206 3.843 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -6.986 -6.473 5.857 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -5.672 -5.315 5.826 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.189 -4.368 7.354 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -7.503 -3.483 5.875 1.00 0.00 H new ATOM 0 HE ARG A 63 -9.258 -5.701 5.862 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -8.621 -2.819 7.797 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -10.299 -2.664 8.329 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -11.410 -5.498 6.551 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -11.872 -4.175 7.626 1.00 0.00 H new ATOM 970 N LEU A 64 -8.202 -7.931 2.893 1.00 0.00 N ATOM 971 CA LEU A 64 -9.019 -9.122 3.096 1.00 0.00 C ATOM 972 C LEU A 64 -8.294 -10.371 2.603 1.00 0.00 C ATOM 973 O LEU A 64 -8.353 -11.426 3.234 1.00 0.00 O ATOM 974 CB LEU A 64 -10.358 -8.977 2.373 1.00 0.00 C ATOM 975 CG LEU A 64 -10.427 -9.565 0.962 1.00 0.00 C ATOM 976 CD1 LEU A 64 -10.622 -11.072 1.022 1.00 0.00 C ATOM 977 CD2 LEU A 64 -11.546 -8.911 0.167 1.00 0.00 C ATOM 0 H LEU A 64 -8.576 -7.276 2.206 1.00 0.00 H new ATOM 0 HA LEU A 64 -9.201 -9.228 4.165 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -11.129 -9.451 2.980 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -10.604 -7.917 2.315 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.483 -9.362 0.456 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -10.669 -11.473 0.010 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -9.786 -11.526 1.554 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -11.551 -11.298 1.545 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -11.581 -9.341 -0.834 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -12.498 -9.083 0.669 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -11.363 -7.839 0.095 1.00 0.00 H new ATOM 989 N ARG A 65 -7.608 -10.241 1.471 1.00 0.00 N ATOM 990 CA ARG A 65 -6.870 -11.358 0.893 1.00 0.00 C ATOM 991 C ARG A 65 -5.534 -11.553 1.603 1.00 0.00 C ATOM 992 O ARG A 65 -4.838 -12.545 1.380 1.00 0.00 O ATOM 993 CB ARG A 65 -6.637 -11.124 -0.601 1.00 0.00 C ATOM 994 CG ARG A 65 -7.804 -11.554 -1.474 1.00 0.00 C ATOM 995 CD ARG A 65 -7.326 -12.230 -2.750 1.00 0.00 C ATOM 996 NE ARG A 65 -8.160 -13.374 -3.109 1.00 0.00 N ATOM 997 CZ ARG A 65 -7.958 -14.121 -4.188 1.00 0.00 C ATOM 998 NH1 ARG A 65 -6.955 -13.846 -5.010 1.00 0.00 N ATOM 999 NH2 ARG A 65 -8.761 -15.145 -4.447 1.00 0.00 N ATOM 0 H ARG A 65 -7.548 -9.374 0.937 1.00 0.00 H new ATOM 0 HA ARG A 65 -7.466 -12.261 1.024 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -6.440 -10.065 -0.768 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -5.744 -11.667 -0.910 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -8.444 -12.238 -0.917 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -8.410 -10.684 -1.727 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -7.331 -11.508 -3.566 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -6.295 -12.559 -2.621 1.00 0.00 H new ATOM 0 HE ARG A 65 -8.941 -13.612 -2.497 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -6.336 -13.059 -4.814 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -6.802 -14.421 -5.838 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -9.534 -15.359 -3.817 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -8.605 -15.718 -5.276 1.00 0.00 H new ATOM 1013 N LEU A 66 -5.181 -10.600 2.459 1.00 0.00 N ATOM 1014 CA LEU A 66 -3.927 -10.666 3.202 1.00 0.00 C ATOM 1015 C LEU A 66 -4.160 -10.405 4.687 1.00 0.00 C ATOM 1016 O LEU A 66 -5.223 -10.717 5.224 1.00 0.00 O ATOM 1017 CB LEU A 66 -2.927 -9.652 2.644 1.00 0.00 C ATOM 1018 CG LEU A 66 -2.828 -9.575 1.120 1.00 0.00 C ATOM 1019 CD1 LEU A 66 -1.942 -8.413 0.701 1.00 0.00 C ATOM 1020 CD2 LEU A 66 -2.299 -10.884 0.553 1.00 0.00 C ATOM 0 H LEU A 66 -5.745 -9.773 2.656 1.00 0.00 H new ATOM 0 HA LEU A 66 -3.518 -11.670 3.089 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -3.193 -8.664 3.021 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -1.940 -9.889 3.041 1.00 0.00 H new ATOM 0 HG LEU A 66 -3.827 -9.406 0.718 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -1.883 -8.374 -0.387 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -2.364 -7.480 1.075 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -0.942 -8.550 1.114 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.235 -10.811 -0.533 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -1.309 -11.084 0.962 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.974 -11.696 0.823 1.00 0.00 H new ATOM 1032 N HIS A 67 -3.159 -9.828 5.345 1.00 0.00 N ATOM 1033 CA HIS A 67 -3.255 -9.521 6.767 1.00 0.00 C ATOM 1034 C HIS A 67 -2.916 -10.746 7.611 1.00 0.00 C ATOM 1035 O HIS A 67 -2.072 -11.559 7.234 1.00 0.00 O ATOM 1036 CB HIS A 67 -4.661 -9.024 7.109 1.00 0.00 C ATOM 1037 CG HIS A 67 -4.695 -8.074 8.265 1.00 0.00 C ATOM 1038 ND1 HIS A 67 -3.557 -7.591 8.876 1.00 0.00 N ATOM 1039 CD2 HIS A 67 -5.739 -7.514 8.921 1.00 0.00 C ATOM 1040 CE1 HIS A 67 -3.899 -6.777 9.860 1.00 0.00 C ATOM 1041 NE2 HIS A 67 -5.218 -6.713 9.907 1.00 0.00 N ATOM 0 H HIS A 67 -2.272 -9.564 4.916 1.00 0.00 H new ATOM 0 HA HIS A 67 -2.535 -8.735 6.994 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -5.087 -8.534 6.234 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -5.296 -9.881 7.335 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -6.786 -7.669 8.708 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -3.217 -6.254 10.514 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -5.761 -6.158 10.569 1.00 0.00 H new ATOM 1049 N LYS A 68 -3.579 -10.872 8.756 1.00 0.00 N ATOM 1050 CA LYS A 68 -3.350 -11.998 9.654 1.00 0.00 C ATOM 1051 C LYS A 68 -3.018 -13.261 8.868 1.00 0.00 C ATOM 1052 O LYS A 68 -2.231 -14.096 9.318 1.00 0.00 O ATOM 1053 CB LYS A 68 -4.582 -12.238 10.529 1.00 0.00 C ATOM 1054 CG LYS A 68 -4.817 -11.146 11.560 1.00 0.00 C ATOM 1055 CD LYS A 68 -6.143 -10.440 11.331 1.00 0.00 C ATOM 1056 CE LYS A 68 -7.316 -11.291 11.794 1.00 0.00 C ATOM 1057 NZ LYS A 68 -8.240 -10.529 12.677 1.00 0.00 N ATOM 0 H LYS A 68 -4.280 -10.207 9.084 1.00 0.00 H new ATOM 0 HA LYS A 68 -2.501 -11.755 10.292 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -5.461 -12.318 9.890 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -4.473 -13.193 11.042 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -4.802 -11.579 12.560 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -4.005 -10.421 11.515 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -6.148 -9.490 11.866 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -6.255 -10.210 10.272 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -7.864 -11.658 10.926 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -6.942 -12.165 12.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -9.026 -11.144 12.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -7.724 -10.201 13.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -8.617 -9.709 12.160 1.00 0.00 H new ATOM 1071 N THR A 69 -3.620 -13.397 7.691 1.00 0.00 N ATOM 1072 CA THR A 69 -3.387 -14.559 6.842 1.00 0.00 C ATOM 1073 C THR A 69 -1.954 -15.060 6.977 1.00 0.00 C ATOM 1074 O THR A 69 -1.005 -14.278 6.910 1.00 0.00 O ATOM 1075 CB THR A 69 -3.671 -14.240 5.362 1.00 0.00 C ATOM 1076 OG1 THR A 69 -2.776 -13.222 4.901 1.00 0.00 O ATOM 1077 CG2 THR A 69 -5.109 -13.781 5.173 1.00 0.00 C ATOM 0 H THR A 69 -4.273 -12.716 7.303 1.00 0.00 H new ATOM 0 HA THR A 69 -4.074 -15.337 7.176 1.00 0.00 H new ATOM 0 HB THR A 69 -3.518 -15.149 4.781 1.00 0.00 H new ATOM 0 HG1 THR A 69 -2.495 -12.666 5.658 1.00 0.00 H new ATOM 0 HG21 THR A 69 -5.285 -13.562 4.120 1.00 0.00 H new ATOM 0 HG22 THR A 69 -5.788 -14.569 5.498 1.00 0.00 H new ATOM 0 HG23 THR A 69 -5.285 -12.883 5.765 1.00 0.00 H new ATOM 1085 N GLU A 70 -1.804 -16.367 7.165 1.00 0.00 N ATOM 1086 CA GLU A 70 -0.484 -16.972 7.309 1.00 0.00 C ATOM 1087 C GLU A 70 0.300 -16.882 6.003 1.00 0.00 C ATOM 1088 O GLU A 70 0.191 -17.753 5.139 1.00 0.00 O ATOM 1089 CB GLU A 70 -0.612 -18.434 7.741 1.00 0.00 C ATOM 1090 CG GLU A 70 -0.377 -18.653 9.225 1.00 0.00 C ATOM 1091 CD GLU A 70 -0.576 -20.098 9.640 1.00 0.00 C ATOM 1092 OE1 GLU A 70 -1.689 -20.626 9.432 1.00 0.00 O ATOM 1093 OE2 GLU A 70 0.379 -20.700 10.172 1.00 0.00 O ATOM 0 H GLU A 70 -2.579 -17.027 7.221 1.00 0.00 H new ATOM 0 HA GLU A 70 0.058 -16.421 8.077 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -1.608 -18.795 7.482 1.00 0.00 H new ATOM 0 HB3 GLU A 70 0.101 -19.035 7.176 1.00 0.00 H new ATOM 0 HG2 GLU A 70 0.637 -18.342 9.478 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -1.056 -18.019 9.794 1.00 0.00 H new ATOM 1100 N PHE A 71 1.090 -15.822 5.866 1.00 0.00 N ATOM 1101 CA PHE A 71 1.892 -15.617 4.665 1.00 0.00 C ATOM 1102 C PHE A 71 3.156 -16.472 4.702 1.00 0.00 C ATOM 1103 O PHE A 71 4.074 -16.212 5.481 1.00 0.00 O ATOM 1104 CB PHE A 71 2.267 -14.141 4.523 1.00 0.00 C ATOM 1105 CG PHE A 71 3.366 -13.894 3.529 1.00 0.00 C ATOM 1106 CD1 PHE A 71 4.695 -13.975 3.912 1.00 0.00 C ATOM 1107 CD2 PHE A 71 3.069 -13.581 2.212 1.00 0.00 C ATOM 1108 CE1 PHE A 71 5.708 -13.747 2.999 1.00 0.00 C ATOM 1109 CE2 PHE A 71 4.078 -13.354 1.295 1.00 0.00 C ATOM 1110 CZ PHE A 71 5.399 -13.438 1.689 1.00 0.00 C ATOM 0 H PHE A 71 1.192 -15.092 6.571 1.00 0.00 H new ATOM 0 HA PHE A 71 1.295 -15.918 3.804 1.00 0.00 H new ATOM 0 HB2 PHE A 71 1.384 -13.577 4.223 1.00 0.00 H new ATOM 0 HB3 PHE A 71 2.575 -13.758 5.496 1.00 0.00 H new ATOM 0 HD1 PHE A 71 4.942 -14.219 4.935 1.00 0.00 H new ATOM 0 HD2 PHE A 71 2.038 -13.514 1.899 1.00 0.00 H new ATOM 0 HE1 PHE A 71 6.740 -13.811 3.310 1.00 0.00 H new ATOM 0 HE2 PHE A 71 3.834 -13.111 0.271 1.00 0.00 H new ATOM 0 HZ PHE A 71 6.189 -13.262 0.974 1.00 0.00 H new ATOM 1120 N LEU A 72 3.195 -17.496 3.856 1.00 0.00 N ATOM 1121 CA LEU A 72 4.345 -18.391 3.790 1.00 0.00 C ATOM 1122 C LEU A 72 4.551 -19.110 5.119 1.00 0.00 C ATOM 1123 O LEU A 72 5.648 -19.581 5.418 1.00 0.00 O ATOM 1124 CB LEU A 72 5.605 -17.607 3.419 1.00 0.00 C ATOM 1125 CG LEU A 72 5.574 -16.884 2.073 1.00 0.00 C ATOM 1126 CD1 LEU A 72 6.935 -16.279 1.761 1.00 0.00 C ATOM 1127 CD2 LEU A 72 5.144 -17.835 0.966 1.00 0.00 C ATOM 0 H LEU A 72 2.443 -17.727 3.206 1.00 0.00 H new ATOM 0 HA LEU A 72 4.150 -19.138 3.021 1.00 0.00 H new ATOM 0 HB2 LEU A 72 5.793 -16.870 4.200 1.00 0.00 H new ATOM 0 HB3 LEU A 72 6.450 -18.295 3.420 1.00 0.00 H new ATOM 0 HG LEU A 72 4.845 -16.076 2.133 1.00 0.00 H new ATOM 0 HD11 LEU A 72 6.894 -15.768 0.799 1.00 0.00 H new ATOM 0 HD12 LEU A 72 7.203 -15.565 2.540 1.00 0.00 H new ATOM 0 HD13 LEU A 72 7.684 -17.070 1.720 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.128 -17.303 0.015 1.00 0.00 H new ATOM 0 HD22 LEU A 72 5.848 -18.665 0.905 1.00 0.00 H new ATOM 0 HD23 LEU A 72 4.148 -18.220 1.184 1.00 0.00 H new ATOM 1139 N GLY A 73 3.488 -19.191 5.914 1.00 0.00 N ATOM 1140 CA GLY A 73 3.573 -19.855 7.201 1.00 0.00 C ATOM 1141 C GLY A 73 3.579 -18.878 8.360 1.00 0.00 C ATOM 1142 O GLY A 73 3.170 -19.217 9.471 1.00 0.00 O ATOM 0 H GLY A 73 2.570 -18.808 5.689 1.00 0.00 H new ATOM 0 HA2 GLY A 73 2.730 -20.538 7.310 1.00 0.00 H new ATOM 0 HA3 GLY A 73 4.479 -20.459 7.235 1.00 0.00 H new ATOM 1146 N LYS A 74 4.044 -17.661 8.102 1.00 0.00 N ATOM 1147 CA LYS A 74 4.103 -16.629 9.131 1.00 0.00 C ATOM 1148 C LYS A 74 2.963 -15.629 8.964 1.00 0.00 C ATOM 1149 O LYS A 74 2.622 -15.244 7.846 1.00 0.00 O ATOM 1150 CB LYS A 74 5.446 -15.900 9.075 1.00 0.00 C ATOM 1151 CG LYS A 74 6.645 -16.820 9.229 1.00 0.00 C ATOM 1152 CD LYS A 74 7.125 -16.875 10.669 1.00 0.00 C ATOM 1153 CE LYS A 74 8.624 -17.120 10.748 1.00 0.00 C ATOM 1154 NZ LYS A 74 9.144 -16.940 12.133 1.00 0.00 N ATOM 0 H LYS A 74 4.386 -17.364 7.188 1.00 0.00 H new ATOM 0 HA LYS A 74 4.000 -17.113 10.102 1.00 0.00 H new ATOM 0 HB2 LYS A 74 5.524 -15.372 8.125 1.00 0.00 H new ATOM 0 HB3 LYS A 74 5.474 -15.146 9.862 1.00 0.00 H new ATOM 0 HG2 LYS A 74 6.380 -17.823 8.894 1.00 0.00 H new ATOM 0 HG3 LYS A 74 7.455 -16.473 8.588 1.00 0.00 H new ATOM 0 HD2 LYS A 74 6.881 -15.939 11.171 1.00 0.00 H new ATOM 0 HD3 LYS A 74 6.597 -17.668 11.200 1.00 0.00 H new ATOM 0 HE2 LYS A 74 8.845 -18.131 10.406 1.00 0.00 H new ATOM 0 HE3 LYS A 74 9.140 -16.435 10.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 10.169 -17.116 12.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 8.956 -15.968 12.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 8.671 -17.611 12.771 1.00 0.00 H new ATOM 1168 N GLU A 75 2.379 -15.213 10.084 1.00 0.00 N ATOM 1169 CA GLU A 75 1.278 -14.257 10.060 1.00 0.00 C ATOM 1170 C GLU A 75 1.792 -12.839 9.829 1.00 0.00 C ATOM 1171 O GLU A 75 2.672 -12.363 10.547 1.00 0.00 O ATOM 1172 CB GLU A 75 0.491 -14.319 11.371 1.00 0.00 C ATOM 1173 CG GLU A 75 -0.367 -13.090 11.625 1.00 0.00 C ATOM 1174 CD GLU A 75 -1.383 -13.307 12.729 1.00 0.00 C ATOM 1175 OE1 GLU A 75 -2.404 -13.978 12.471 1.00 0.00 O ATOM 1176 OE2 GLU A 75 -1.159 -12.805 13.850 1.00 0.00 O ATOM 0 H GLU A 75 2.650 -15.522 11.017 1.00 0.00 H new ATOM 0 HA GLU A 75 0.618 -14.524 9.235 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -0.148 -15.202 11.360 1.00 0.00 H new ATOM 0 HB3 GLU A 75 1.189 -14.442 12.199 1.00 0.00 H new ATOM 0 HG2 GLU A 75 0.276 -12.250 11.888 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -0.887 -12.818 10.706 1.00 0.00 H new ATOM 1183 N MET A 76 1.239 -12.171 8.823 1.00 0.00 N ATOM 1184 CA MET A 76 1.642 -10.808 8.498 1.00 0.00 C ATOM 1185 C MET A 76 0.525 -9.820 8.820 1.00 0.00 C ATOM 1186 O MET A 76 -0.657 -10.153 8.731 1.00 0.00 O ATOM 1187 CB MET A 76 2.020 -10.704 7.019 1.00 0.00 C ATOM 1188 CG MET A 76 1.785 -9.324 6.427 1.00 0.00 C ATOM 1189 SD MET A 76 2.148 -9.254 4.662 1.00 0.00 S ATOM 1190 CE MET A 76 0.870 -10.326 4.011 1.00 0.00 C ATOM 0 H MET A 76 0.511 -12.551 8.219 1.00 0.00 H new ATOM 0 HA MET A 76 2.511 -10.558 9.106 1.00 0.00 H new ATOM 0 HB2 MET A 76 3.071 -10.966 6.902 1.00 0.00 H new ATOM 0 HB3 MET A 76 1.444 -11.436 6.453 1.00 0.00 H new ATOM 0 HG2 MET A 76 0.747 -9.034 6.592 1.00 0.00 H new ATOM 0 HG3 MET A 76 2.406 -8.598 6.951 1.00 0.00 H new ATOM 0 HE1 MET A 76 0.427 -9.869 3.126 1.00 0.00 H new ATOM 0 HE2 MET A 76 1.305 -11.289 3.743 1.00 0.00 H new ATOM 0 HE3 MET A 76 0.099 -10.474 4.767 1.00 0.00 H new ATOM 1200 N LYS A 77 0.908 -8.604 9.194 1.00 0.00 N ATOM 1201 CA LYS A 77 -0.061 -7.566 9.528 1.00 0.00 C ATOM 1202 C LYS A 77 -0.121 -6.505 8.434 1.00 0.00 C ATOM 1203 O LYS A 77 0.773 -6.416 7.592 1.00 0.00 O ATOM 1204 CB LYS A 77 0.300 -6.915 10.864 1.00 0.00 C ATOM 1205 CG LYS A 77 -0.456 -7.495 12.048 1.00 0.00 C ATOM 1206 CD LYS A 77 -1.361 -6.461 12.695 1.00 0.00 C ATOM 1207 CE LYS A 77 -0.762 -5.924 13.986 1.00 0.00 C ATOM 1208 NZ LYS A 77 -1.796 -5.736 15.040 1.00 0.00 N ATOM 0 H LYS A 77 1.882 -8.313 9.274 1.00 0.00 H new ATOM 0 HA LYS A 77 -1.042 -8.033 9.611 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.370 -7.028 11.036 1.00 0.00 H new ATOM 0 HB3 LYS A 77 0.098 -5.846 10.804 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -1.052 -8.346 11.718 1.00 0.00 H new ATOM 0 HG3 LYS A 77 0.254 -7.870 12.785 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -1.529 -5.638 12.001 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -2.334 -6.907 12.902 1.00 0.00 H new ATOM 0 HE2 LYS A 77 0.002 -6.613 14.346 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -0.267 -4.973 13.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -1.348 -5.369 15.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -2.512 -5.059 14.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -2.251 -6.648 15.247 1.00 0.00 H new ATOM 1222 N LEU A 78 -1.180 -5.703 8.452 1.00 0.00 N ATOM 1223 CA LEU A 78 -1.356 -4.646 7.462 1.00 0.00 C ATOM 1224 C LEU A 78 -2.142 -3.477 8.047 1.00 0.00 C ATOM 1225 O LEU A 78 -3.115 -3.673 8.776 1.00 0.00 O ATOM 1226 CB LEU A 78 -2.075 -5.192 6.227 1.00 0.00 C ATOM 1227 CG LEU A 78 -1.190 -5.863 5.176 1.00 0.00 C ATOM 1228 CD1 LEU A 78 -1.848 -7.131 4.655 1.00 0.00 C ATOM 1229 CD2 LEU A 78 -0.898 -4.904 4.033 1.00 0.00 C ATOM 0 H LEU A 78 -1.930 -5.764 9.141 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.369 -4.286 7.171 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -2.823 -5.913 6.556 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -2.611 -4.371 5.751 1.00 0.00 H new ATOM 0 HG LEU A 78 -0.245 -6.135 5.646 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -1.204 -7.595 3.908 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -2.005 -7.825 5.481 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -2.808 -6.883 4.202 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.267 -5.399 3.295 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -1.834 -4.600 3.565 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.383 -4.024 4.419 1.00 0.00 H new ATOM 1241 N TYR A 79 -1.717 -2.262 7.720 1.00 0.00 N ATOM 1242 CA TYR A 79 -2.380 -1.061 8.213 1.00 0.00 C ATOM 1243 C TYR A 79 -2.753 -0.133 7.061 1.00 0.00 C ATOM 1244 O TYR A 79 -2.299 -0.313 5.931 1.00 0.00 O ATOM 1245 CB TYR A 79 -1.477 -0.324 9.204 1.00 0.00 C ATOM 1246 CG TYR A 79 -1.499 -0.914 10.596 1.00 0.00 C ATOM 1247 CD1 TYR A 79 -0.700 -2.002 10.925 1.00 0.00 C ATOM 1248 CD2 TYR A 79 -2.320 -0.382 11.584 1.00 0.00 C ATOM 1249 CE1 TYR A 79 -0.718 -2.544 12.195 1.00 0.00 C ATOM 1250 CE2 TYR A 79 -2.343 -0.917 12.858 1.00 0.00 C ATOM 1251 CZ TYR A 79 -1.540 -1.998 13.159 1.00 0.00 C ATOM 1252 OH TYR A 79 -1.560 -2.534 14.425 1.00 0.00 O ATOM 0 H TYR A 79 -0.916 -2.083 7.115 1.00 0.00 H new ATOM 0 HA TYR A 79 -3.295 -1.365 8.722 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -0.454 -0.337 8.829 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -1.785 0.720 9.256 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -0.053 -2.431 10.174 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -2.950 0.464 11.352 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -0.092 -3.391 12.432 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -2.986 -0.491 13.614 1.00 0.00 H new ATOM 0 HH TYR A 79 -2.191 -2.033 14.983 1.00 0.00 H new ATOM 1262 N PHE A 80 -3.584 0.862 7.356 1.00 0.00 N ATOM 1263 CA PHE A 80 -4.020 1.819 6.347 1.00 0.00 C ATOM 1264 C PHE A 80 -3.140 3.065 6.364 1.00 0.00 C ATOM 1265 O PHE A 80 -3.614 4.176 6.124 1.00 0.00 O ATOM 1266 CB PHE A 80 -5.481 2.209 6.580 1.00 0.00 C ATOM 1267 CG PHE A 80 -6.437 1.544 5.633 1.00 0.00 C ATOM 1268 CD1 PHE A 80 -6.285 0.208 5.298 1.00 0.00 C ATOM 1269 CD2 PHE A 80 -7.489 2.255 5.077 1.00 0.00 C ATOM 1270 CE1 PHE A 80 -7.165 -0.407 4.426 1.00 0.00 C ATOM 1271 CE2 PHE A 80 -8.372 1.645 4.206 1.00 0.00 C ATOM 1272 CZ PHE A 80 -8.208 0.313 3.878 1.00 0.00 C ATOM 0 H PHE A 80 -3.969 1.026 8.286 1.00 0.00 H new ATOM 0 HA PHE A 80 -3.930 1.345 5.370 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -5.758 1.953 7.603 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -5.580 3.290 6.484 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -5.470 -0.359 5.723 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -7.620 3.297 5.327 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -7.036 -1.449 4.174 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -9.190 2.209 3.782 1.00 0.00 H new ATOM 0 HZ PHE A 80 -8.894 -0.164 3.194 1.00 0.00 H new ATOM 1282 N ALA A 81 -1.856 2.872 6.648 1.00 0.00 N ATOM 1283 CA ALA A 81 -0.909 3.979 6.696 1.00 0.00 C ATOM 1284 C ALA A 81 -1.493 5.170 7.449 1.00 0.00 C ATOM 1285 O ALA A 81 -2.092 6.062 6.848 1.00 0.00 O ATOM 1286 CB ALA A 81 -0.506 4.389 5.287 1.00 0.00 C ATOM 0 H ALA A 81 -1.448 1.959 6.848 1.00 0.00 H new ATOM 0 HA ALA A 81 -0.022 3.643 7.233 1.00 0.00 H new ATOM 0 HB1 ALA A 81 0.201 5.217 5.337 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -0.040 3.543 4.781 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -1.391 4.701 4.732 1.00 0.00 H new ATOM 1292 N GLN A 82 -1.315 5.176 8.766 1.00 0.00 N ATOM 1293 CA GLN A 82 -1.827 6.257 9.600 1.00 0.00 C ATOM 1294 C GLN A 82 -1.002 6.396 10.876 1.00 0.00 C ATOM 1295 O GLN A 82 -0.514 5.408 11.423 1.00 0.00 O ATOM 1296 CB GLN A 82 -3.294 6.008 9.951 1.00 0.00 C ATOM 1297 CG GLN A 82 -3.498 4.885 10.955 1.00 0.00 C ATOM 1298 CD GLN A 82 -4.946 4.736 11.379 1.00 0.00 C ATOM 1299 OE1 GLN A 82 -5.816 4.442 10.559 1.00 0.00 O ATOM 1300 NE2 GLN A 82 -5.211 4.938 12.663 1.00 0.00 N ATOM 0 H GLN A 82 -0.821 4.445 9.278 1.00 0.00 H new ATOM 0 HA GLN A 82 -1.750 7.186 9.036 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -3.723 6.926 10.353 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -3.842 5.772 9.039 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -3.153 3.947 10.520 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -2.883 5.074 11.835 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -4.458 5.180 13.307 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -6.168 4.851 13.006 1.00 0.00 H new ATOM 1309 N THR A 83 -0.851 7.631 11.345 1.00 0.00 N ATOM 1310 CA THR A 83 -0.086 7.901 12.556 1.00 0.00 C ATOM 1311 C THR A 83 -0.475 6.944 13.677 1.00 0.00 C ATOM 1312 O THR A 83 -1.643 6.577 13.817 1.00 0.00 O ATOM 1313 CB THR A 83 -0.289 9.349 13.039 1.00 0.00 C ATOM 1314 OG1 THR A 83 0.072 9.460 14.420 1.00 0.00 O ATOM 1315 CG2 THR A 83 -1.734 9.784 12.849 1.00 0.00 C ATOM 0 H THR A 83 -1.249 8.460 10.904 1.00 0.00 H new ATOM 0 HA THR A 83 0.964 7.754 12.305 1.00 0.00 H new ATOM 0 HB THR A 83 0.351 10.001 12.444 1.00 0.00 H new ATOM 0 HG1 THR A 83 -0.058 10.384 14.719 1.00 0.00 H new ATOM 0 HG21 THR A 83 -1.854 10.810 13.197 1.00 0.00 H new ATOM 0 HG22 THR A 83 -1.995 9.726 11.792 1.00 0.00 H new ATOM 0 HG23 THR A 83 -2.390 9.128 13.421 1.00 0.00 H new ATOM 1323 N LEU A 84 0.508 6.543 14.475 1.00 0.00 N ATOM 1324 CA LEU A 84 0.267 5.629 15.585 1.00 0.00 C ATOM 1325 C LEU A 84 -0.729 6.225 16.575 1.00 0.00 C ATOM 1326 O LEU A 84 -0.378 7.088 17.381 1.00 0.00 O ATOM 1327 CB LEU A 84 1.582 5.305 16.299 1.00 0.00 C ATOM 1328 CG LEU A 84 2.496 6.494 16.594 1.00 0.00 C ATOM 1329 CD1 LEU A 84 3.158 6.334 17.954 1.00 0.00 C ATOM 1330 CD2 LEU A 84 3.545 6.645 15.503 1.00 0.00 C ATOM 0 H LEU A 84 1.480 6.837 14.374 1.00 0.00 H new ATOM 0 HA LEU A 84 -0.157 4.709 15.181 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.348 4.810 17.241 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.135 4.589 15.691 1.00 0.00 H new ATOM 0 HG LEU A 84 1.888 7.398 16.613 1.00 0.00 H new ATOM 0 HD11 LEU A 84 3.805 7.190 18.147 1.00 0.00 H new ATOM 0 HD12 LEU A 84 2.392 6.277 18.727 1.00 0.00 H new ATOM 0 HD13 LEU A 84 3.752 5.420 17.964 1.00 0.00 H new ATOM 0 HD21 LEU A 84 4.186 7.497 15.730 1.00 0.00 H new ATOM 0 HD22 LEU A 84 4.149 5.739 15.451 1.00 0.00 H new ATOM 0 HD23 LEU A 84 3.052 6.808 14.544 1.00 0.00 H new ATOM 1342 N HIS A 85 -1.971 5.757 16.511 1.00 0.00 N ATOM 1343 CA HIS A 85 -3.017 6.242 17.404 1.00 0.00 C ATOM 1344 C HIS A 85 -3.462 5.144 18.367 1.00 0.00 C ATOM 1345 O HIS A 85 -4.480 4.487 18.147 1.00 0.00 O ATOM 1346 CB HIS A 85 -4.215 6.742 16.596 1.00 0.00 C ATOM 1347 CG HIS A 85 -4.811 8.009 17.131 1.00 0.00 C ATOM 1348 ND1 HIS A 85 -5.937 8.033 17.926 1.00 0.00 N ATOM 1349 CD2 HIS A 85 -4.429 9.299 16.983 1.00 0.00 C ATOM 1350 CE1 HIS A 85 -6.223 9.284 18.241 1.00 0.00 C ATOM 1351 NE2 HIS A 85 -5.323 10.071 17.681 1.00 0.00 N ATOM 0 H HIS A 85 -2.278 5.043 15.850 1.00 0.00 H new ATOM 0 HA HIS A 85 -2.609 7.069 17.986 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -3.905 6.904 15.564 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -4.982 5.967 16.581 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -3.579 9.655 16.420 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -7.052 9.608 18.853 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -5.297 11.088 17.755 1.00 0.00 H new ATOM 1359 N ILE A 86 -2.692 4.951 19.432 1.00 0.00 N ATOM 1360 CA ILE A 86 -3.007 3.934 20.428 1.00 0.00 C ATOM 1361 C ILE A 86 -2.888 4.494 21.842 1.00 0.00 C ATOM 1362 O ILE A 86 -1.789 4.626 22.378 1.00 0.00 O ATOM 1363 CB ILE A 86 -2.082 2.709 20.294 1.00 0.00 C ATOM 1364 CG1 ILE A 86 -2.185 2.118 18.886 1.00 0.00 C ATOM 1365 CG2 ILE A 86 -2.434 1.664 21.341 1.00 0.00 C ATOM 1366 CD1 ILE A 86 -1.339 2.842 17.862 1.00 0.00 C ATOM 0 H ILE A 86 -1.845 5.485 19.628 1.00 0.00 H new ATOM 0 HA ILE A 86 -4.036 3.624 20.248 1.00 0.00 H new ATOM 0 HB ILE A 86 -1.053 3.028 20.459 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -1.885 1.071 18.918 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -3.227 2.142 18.566 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -1.772 0.804 21.234 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -2.315 2.092 22.336 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -3.467 1.346 21.204 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -1.462 2.368 16.888 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -1.654 3.884 17.801 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.291 2.796 18.158 1.00 0.00 H new ATOM 1378 N GLY A 87 -4.030 4.818 22.442 1.00 0.00 N ATOM 1379 CA GLY A 87 -4.032 5.357 23.789 1.00 0.00 C ATOM 1380 C GLY A 87 -4.775 4.470 24.768 1.00 0.00 C ATOM 1381 O GLY A 87 -5.848 3.952 24.455 1.00 0.00 O ATOM 0 H GLY A 87 -4.953 4.717 22.019 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -3.004 5.484 24.127 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -4.490 6.346 23.780 1.00 0.00 H new ATOM 1385 N SER A 88 -4.204 4.292 25.954 1.00 0.00 N ATOM 1386 CA SER A 88 -4.817 3.456 26.980 1.00 0.00 C ATOM 1387 C SER A 88 -4.081 3.599 28.309 1.00 0.00 C ATOM 1388 O SER A 88 -2.861 3.759 28.341 1.00 0.00 O ATOM 1389 CB SER A 88 -4.818 1.991 26.540 1.00 0.00 C ATOM 1390 OG SER A 88 -5.812 1.252 27.229 1.00 0.00 O ATOM 0 H SER A 88 -3.318 4.715 26.229 1.00 0.00 H new ATOM 0 HA SER A 88 -5.846 3.788 27.117 1.00 0.00 H new ATOM 0 HB2 SER A 88 -4.995 1.931 25.466 1.00 0.00 H new ATOM 0 HB3 SER A 88 -3.838 1.551 26.727 1.00 0.00 H new ATOM 0 HG SER A 88 -5.793 0.319 26.929 1.00 0.00 H new ATOM 1396 N SER A 89 -4.832 3.539 29.403 1.00 0.00 N ATOM 1397 CA SER A 89 -4.254 3.666 30.736 1.00 0.00 C ATOM 1398 C SER A 89 -3.900 2.296 31.307 1.00 0.00 C ATOM 1399 O SER A 89 -4.711 1.370 31.278 1.00 0.00 O ATOM 1400 CB SER A 89 -5.226 4.386 31.671 1.00 0.00 C ATOM 1401 OG SER A 89 -5.102 5.793 31.553 1.00 0.00 O ATOM 0 H SER A 89 -5.843 3.403 29.393 1.00 0.00 H new ATOM 0 HA SER A 89 -3.340 4.253 30.654 1.00 0.00 H new ATOM 0 HB2 SER A 89 -6.248 4.087 31.438 1.00 0.00 H new ATOM 0 HB3 SER A 89 -5.034 4.086 32.701 1.00 0.00 H new ATOM 0 HG SER A 89 -5.736 6.229 32.160 1.00 0.00 H new ATOM 1407 N HIS A 90 -2.682 2.175 31.826 1.00 0.00 N ATOM 1408 CA HIS A 90 -2.219 0.918 32.405 1.00 0.00 C ATOM 1409 C HIS A 90 -1.112 1.165 33.425 1.00 0.00 C ATOM 1410 O HIS A 90 -0.542 2.256 33.486 1.00 0.00 O ATOM 1411 CB HIS A 90 -1.718 -0.019 31.308 1.00 0.00 C ATOM 1412 CG HIS A 90 -2.535 -1.267 31.166 1.00 0.00 C ATOM 1413 ND1 HIS A 90 -2.930 -1.775 29.946 1.00 0.00 N ATOM 1414 CD2 HIS A 90 -3.029 -2.111 32.101 1.00 0.00 C ATOM 1415 CE1 HIS A 90 -3.633 -2.876 30.136 1.00 0.00 C ATOM 1416 NE2 HIS A 90 -3.708 -3.103 31.436 1.00 0.00 N ATOM 0 H HIS A 90 -1.998 2.931 31.858 1.00 0.00 H new ATOM 0 HA HIS A 90 -3.061 0.450 32.915 1.00 0.00 H new ATOM 0 HB2 HIS A 90 -1.718 0.515 30.358 1.00 0.00 H new ATOM 0 HB3 HIS A 90 -0.685 -0.293 31.520 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -2.911 -2.022 33.171 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -4.072 -3.487 29.361 1.00 0.00 H new ATOM 0 HE2 HIS A 90 -4.191 -3.887 31.874 1.00 0.00 H new ATOM 1424 N LEU A 91 -0.813 0.147 34.224 1.00 0.00 N ATOM 1425 CA LEU A 91 0.227 0.254 35.242 1.00 0.00 C ATOM 1426 C LEU A 91 0.823 -1.115 35.557 1.00 0.00 C ATOM 1427 O LEU A 91 2.028 -1.323 35.425 1.00 0.00 O ATOM 1428 CB LEU A 91 -0.342 0.880 36.516 1.00 0.00 C ATOM 1429 CG LEU A 91 -0.134 2.387 36.674 1.00 0.00 C ATOM 1430 CD1 LEU A 91 -1.393 3.144 36.280 1.00 0.00 C ATOM 1431 CD2 LEU A 91 0.268 2.724 38.103 1.00 0.00 C ATOM 0 H LEU A 91 -1.275 -0.761 34.187 1.00 0.00 H new ATOM 0 HA LEU A 91 1.019 0.894 34.852 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -1.412 0.676 36.551 1.00 0.00 H new ATOM 0 HB3 LEU A 91 0.106 0.380 37.374 1.00 0.00 H new ATOM 0 HG LEU A 91 0.673 2.694 36.009 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -1.226 4.215 36.399 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -1.637 2.928 35.240 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -2.220 2.833 36.919 1.00 0.00 H new ATOM 0 HD21 LEU A 91 0.412 3.800 38.196 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -0.517 2.402 38.787 1.00 0.00 H new ATOM 0 HD23 LEU A 91 1.198 2.211 38.350 1.00 0.00 H new ATOM 1443 N ALA A 92 -0.031 -2.044 35.973 1.00 0.00 N ATOM 1444 CA ALA A 92 0.410 -3.395 36.303 1.00 0.00 C ATOM 1445 C ALA A 92 1.545 -3.367 37.320 1.00 0.00 C ATOM 1446 O ALA A 92 2.712 -3.580 36.990 1.00 0.00 O ATOM 1447 CB ALA A 92 0.844 -4.130 35.043 1.00 0.00 C ATOM 0 H ALA A 92 -1.032 -1.887 36.090 1.00 0.00 H new ATOM 0 HA ALA A 92 -0.430 -3.928 36.750 1.00 0.00 H new ATOM 0 HB1 ALA A 92 1.171 -5.137 35.303 1.00 0.00 H new ATOM 0 HB2 ALA A 92 0.006 -4.189 34.349 1.00 0.00 H new ATOM 0 HB3 ALA A 92 1.667 -3.592 34.573 1.00 0.00 H new ATOM 1453 N PRO A 93 1.200 -3.098 38.588 1.00 0.00 N ATOM 1454 CA PRO A 93 2.176 -3.037 39.679 1.00 0.00 C ATOM 1455 C PRO A 93 2.748 -4.409 40.023 1.00 0.00 C ATOM 1456 O PRO A 93 2.129 -5.444 39.779 1.00 0.00 O ATOM 1457 CB PRO A 93 1.362 -2.487 40.853 1.00 0.00 C ATOM 1458 CG PRO A 93 -0.046 -2.872 40.552 1.00 0.00 C ATOM 1459 CD PRO A 93 -0.172 -2.834 39.054 1.00 0.00 C ATOM 0 HA PRO A 93 3.040 -2.426 39.419 1.00 0.00 H new ATOM 0 HB2 PRO A 93 1.695 -2.913 41.799 1.00 0.00 H new ATOM 0 HB3 PRO A 93 1.468 -1.405 40.935 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -0.270 -3.867 40.938 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -0.748 -2.183 41.021 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -0.871 -3.587 38.691 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -0.535 -1.867 38.706 1.00 0.00 H new ATOM 1467 N PRO A 94 3.958 -4.418 40.603 1.00 0.00 N ATOM 1468 CA PRO A 94 4.639 -5.655 40.993 1.00 0.00 C ATOM 1469 C PRO A 94 3.959 -6.343 42.173 1.00 0.00 C ATOM 1470 O PRO A 94 3.450 -5.685 43.077 1.00 0.00 O ATOM 1471 CB PRO A 94 6.040 -5.179 41.386 1.00 0.00 C ATOM 1472 CG PRO A 94 5.858 -3.757 41.788 1.00 0.00 C ATOM 1473 CD PRO A 94 4.752 -3.220 40.923 1.00 0.00 C ATOM 0 HA PRO A 94 4.634 -6.394 40.192 1.00 0.00 H new ATOM 0 HB2 PRO A 94 6.445 -5.773 42.205 1.00 0.00 H new ATOM 0 HB3 PRO A 94 6.737 -5.269 40.553 1.00 0.00 H new ATOM 0 HG2 PRO A 94 5.600 -3.680 42.844 1.00 0.00 H new ATOM 0 HG3 PRO A 94 6.777 -3.190 41.643 1.00 0.00 H new ATOM 0 HD2 PRO A 94 4.158 -2.472 41.448 1.00 0.00 H new ATOM 0 HD3 PRO A 94 5.141 -2.743 40.023 1.00 0.00 H new ATOM 1481 N ASN A 95 3.958 -7.672 42.155 1.00 0.00 N ATOM 1482 CA ASN A 95 3.341 -8.450 43.223 1.00 0.00 C ATOM 1483 C ASN A 95 4.014 -8.164 44.563 1.00 0.00 C ATOM 1484 O ASN A 95 5.226 -7.962 44.645 1.00 0.00 O ATOM 1485 CB ASN A 95 3.423 -9.945 42.908 1.00 0.00 C ATOM 1486 CG ASN A 95 4.852 -10.417 42.714 1.00 0.00 C ATOM 1487 OD1 ASN A 95 5.618 -9.820 41.958 1.00 0.00 O ATOM 1488 ND2 ASN A 95 5.215 -11.495 43.398 1.00 0.00 N ATOM 0 H ASN A 95 4.377 -8.232 41.413 1.00 0.00 H new ATOM 0 HA ASN A 95 2.293 -8.157 43.292 1.00 0.00 H new ATOM 0 HB2 ASN A 95 2.963 -10.510 43.719 1.00 0.00 H new ATOM 0 HB3 ASN A 95 2.848 -10.156 42.006 1.00 0.00 H new ATOM 0 HD21 ASN A 95 6.163 -11.861 43.308 1.00 0.00 H new ATOM 0 HD22 ASN A 95 4.546 -11.958 44.013 1.00 0.00 H new ATOM 1495 N PRO A 96 3.211 -8.146 45.637 1.00 0.00 N ATOM 1496 CA PRO A 96 3.707 -7.888 46.992 1.00 0.00 C ATOM 1497 C PRO A 96 4.560 -9.034 47.525 1.00 0.00 C ATOM 1498 O PRO A 96 4.036 -10.032 48.022 1.00 0.00 O ATOM 1499 CB PRO A 96 2.426 -7.745 47.817 1.00 0.00 C ATOM 1500 CG PRO A 96 1.402 -8.524 47.065 1.00 0.00 C ATOM 1501 CD PRO A 96 1.757 -8.379 45.611 1.00 0.00 C ATOM 0 HA PRO A 96 4.354 -7.012 47.030 1.00 0.00 H new ATOM 0 HB2 PRO A 96 2.559 -8.136 48.826 1.00 0.00 H new ATOM 0 HB3 PRO A 96 2.134 -6.700 47.917 1.00 0.00 H new ATOM 0 HG2 PRO A 96 1.410 -9.572 47.366 1.00 0.00 H new ATOM 0 HG3 PRO A 96 0.400 -8.143 47.262 1.00 0.00 H new ATOM 0 HD2 PRO A 96 1.504 -9.275 45.044 1.00 0.00 H new ATOM 0 HD3 PRO A 96 1.225 -7.548 45.148 1.00 0.00 H new ATOM 1509 N ASP A 97 5.876 -8.885 47.421 1.00 0.00 N ATOM 1510 CA ASP A 97 6.802 -9.907 47.895 1.00 0.00 C ATOM 1511 C ASP A 97 8.155 -9.295 48.242 1.00 0.00 C ATOM 1512 O ASP A 97 8.852 -8.769 47.374 1.00 0.00 O ATOM 1513 CB ASP A 97 6.977 -10.997 46.837 1.00 0.00 C ATOM 1514 CG ASP A 97 8.000 -10.622 45.783 1.00 0.00 C ATOM 1515 OD1 ASP A 97 7.617 -9.972 44.789 1.00 0.00 O ATOM 1516 OD2 ASP A 97 9.185 -10.978 45.954 1.00 0.00 O ATOM 0 H ASP A 97 6.326 -8.066 47.012 1.00 0.00 H new ATOM 0 HA ASP A 97 6.383 -10.352 48.797 1.00 0.00 H new ATOM 0 HB2 ASP A 97 7.282 -11.924 47.322 1.00 0.00 H new ATOM 0 HB3 ASP A 97 6.018 -11.190 46.356 1.00 0.00 H new ATOM 1521 N LYS A 98 8.522 -9.367 49.518 1.00 0.00 N ATOM 1522 CA LYS A 98 9.792 -8.820 49.982 1.00 0.00 C ATOM 1523 C LYS A 98 10.216 -9.470 51.295 1.00 0.00 C ATOM 1524 O LYS A 98 9.376 -9.845 52.112 1.00 0.00 O ATOM 1525 CB LYS A 98 9.684 -7.304 50.161 1.00 0.00 C ATOM 1526 CG LYS A 98 10.912 -6.547 49.688 1.00 0.00 C ATOM 1527 CD LYS A 98 11.162 -5.308 50.532 1.00 0.00 C ATOM 1528 CE LYS A 98 11.705 -4.162 49.693 1.00 0.00 C ATOM 1529 NZ LYS A 98 11.311 -2.836 50.244 1.00 0.00 N ATOM 0 H LYS A 98 7.957 -9.799 50.249 1.00 0.00 H new ATOM 0 HA LYS A 98 10.549 -9.036 49.229 1.00 0.00 H new ATOM 0 HB2 LYS A 98 8.812 -6.943 49.615 1.00 0.00 H new ATOM 0 HB3 LYS A 98 9.514 -7.082 51.215 1.00 0.00 H new ATOM 0 HG2 LYS A 98 11.783 -7.201 49.732 1.00 0.00 H new ATOM 0 HG3 LYS A 98 10.783 -6.258 48.645 1.00 0.00 H new ATOM 0 HD2 LYS A 98 10.233 -5.000 51.012 1.00 0.00 H new ATOM 0 HD3 LYS A 98 11.869 -5.545 51.327 1.00 0.00 H new ATOM 0 HE2 LYS A 98 12.792 -4.228 49.648 1.00 0.00 H new ATOM 0 HE3 LYS A 98 11.338 -4.254 48.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 11.700 -2.081 49.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 10.274 -2.762 50.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 11.683 -2.737 51.210 1.00 0.00 H new ATOM 1543 N SER A 99 11.524 -9.597 51.491 1.00 0.00 N ATOM 1544 CA SER A 99 12.060 -10.203 52.705 1.00 0.00 C ATOM 1545 C SER A 99 13.575 -10.040 52.769 1.00 0.00 C ATOM 1546 O SER A 99 14.248 -9.978 51.742 1.00 0.00 O ATOM 1547 CB SER A 99 11.691 -11.686 52.765 1.00 0.00 C ATOM 1548 OG SER A 99 12.407 -12.348 53.793 1.00 0.00 O ATOM 0 H SER A 99 12.233 -9.289 50.825 1.00 0.00 H new ATOM 0 HA SER A 99 11.621 -9.692 53.562 1.00 0.00 H new ATOM 0 HB2 SER A 99 10.620 -11.791 52.938 1.00 0.00 H new ATOM 0 HB3 SER A 99 11.907 -12.157 51.806 1.00 0.00 H new ATOM 0 HG SER A 99 12.152 -13.294 53.812 1.00 0.00 H new ATOM 1554 N GLY A 100 14.105 -9.974 53.987 1.00 0.00 N ATOM 1555 CA GLY A 100 15.537 -9.819 54.165 1.00 0.00 C ATOM 1556 C GLY A 100 16.335 -10.507 53.075 1.00 0.00 C ATOM 1557 O GLY A 100 16.596 -11.709 53.133 1.00 0.00 O ATOM 0 H GLY A 100 13.568 -10.025 54.853 1.00 0.00 H new ATOM 0 HA2 GLY A 100 15.786 -8.758 54.178 1.00 0.00 H new ATOM 0 HA3 GLY A 100 15.826 -10.226 55.134 1.00 0.00 H new ATOM 1561 N PRO A 101 16.733 -9.736 52.052 1.00 0.00 N ATOM 1562 CA PRO A 101 17.511 -10.259 50.923 1.00 0.00 C ATOM 1563 C PRO A 101 18.933 -10.634 51.324 1.00 0.00 C ATOM 1564 O PRO A 101 19.518 -10.023 52.219 1.00 0.00 O ATOM 1565 CB PRO A 101 17.524 -9.093 49.933 1.00 0.00 C ATOM 1566 CG PRO A 101 17.339 -7.877 50.774 1.00 0.00 C ATOM 1567 CD PRO A 101 16.457 -8.296 51.919 1.00 0.00 C ATOM 0 HA PRO A 101 17.079 -11.175 50.519 1.00 0.00 H new ATOM 0 HB2 PRO A 101 18.463 -9.053 49.381 1.00 0.00 H new ATOM 0 HB3 PRO A 101 16.726 -9.190 49.197 1.00 0.00 H new ATOM 0 HG2 PRO A 101 18.297 -7.503 51.136 1.00 0.00 H new ATOM 0 HG3 PRO A 101 16.879 -7.072 50.201 1.00 0.00 H new ATOM 0 HD2 PRO A 101 16.700 -7.754 52.833 1.00 0.00 H new ATOM 0 HD3 PRO A 101 15.405 -8.106 51.706 1.00 0.00 H new ATOM 1575 N SER A 102 19.484 -11.642 50.655 1.00 0.00 N ATOM 1576 CA SER A 102 20.838 -12.100 50.944 1.00 0.00 C ATOM 1577 C SER A 102 21.472 -12.734 49.709 1.00 0.00 C ATOM 1578 O SER A 102 20.879 -12.745 48.630 1.00 0.00 O ATOM 1579 CB SER A 102 20.824 -13.106 52.096 1.00 0.00 C ATOM 1580 OG SER A 102 20.550 -12.465 53.330 1.00 0.00 O ATOM 0 H SER A 102 19.014 -12.156 49.910 1.00 0.00 H new ATOM 0 HA SER A 102 21.434 -11.234 51.234 1.00 0.00 H new ATOM 0 HB2 SER A 102 20.072 -13.871 51.905 1.00 0.00 H new ATOM 0 HB3 SER A 102 21.787 -13.613 52.152 1.00 0.00 H new ATOM 0 HG SER A 102 20.281 -11.537 53.164 1.00 0.00 H new ATOM 1586 N SER A 103 22.682 -13.259 49.876 1.00 0.00 N ATOM 1587 CA SER A 103 23.399 -13.892 48.775 1.00 0.00 C ATOM 1588 C SER A 103 22.634 -15.104 48.254 1.00 0.00 C ATOM 1589 O SER A 103 21.860 -15.724 48.982 1.00 0.00 O ATOM 1590 CB SER A 103 24.800 -14.311 49.225 1.00 0.00 C ATOM 1591 OG SER A 103 25.745 -14.129 48.186 1.00 0.00 O ATOM 0 H SER A 103 23.186 -13.258 50.763 1.00 0.00 H new ATOM 0 HA SER A 103 23.488 -13.167 47.966 1.00 0.00 H new ATOM 0 HB2 SER A 103 25.096 -13.726 50.096 1.00 0.00 H new ATOM 0 HB3 SER A 103 24.789 -15.357 49.532 1.00 0.00 H new ATOM 0 HG SER A 103 26.632 -14.402 48.499 1.00 0.00 H new ATOM 1597 N GLY A 104 22.859 -15.439 46.987 1.00 0.00 N ATOM 1598 CA GLY A 104 22.185 -16.576 46.389 1.00 0.00 C ATOM 1599 C GLY A 104 22.608 -17.893 47.008 1.00 0.00 C ATOM 1600 O GLY A 104 23.452 -17.921 47.905 1.00 0.00 O ATOM 0 H GLY A 104 23.496 -14.943 46.364 1.00 0.00 H new ATOM 0 HA2 GLY A 104 21.107 -16.455 46.501 1.00 0.00 H new ATOM 0 HA3 GLY A 104 22.394 -16.597 45.320 1.00 0.00 H new TER 1604 GLY A 104