USER MOD reduce.3.24.130724 H: found=0, std=0, add=858, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 862 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 128 ASN : amide:sc= 1.49 K(o=2.1,f=-1.8) USER MOD Set 1.2: A 135 HIS : no HD1:sc= 0.578 K(o=2.1,f=-7.3!) USER MOD Set 2.1: A 59 THR OG1 : rot 105:sc= 1.43 USER MOD Set 2.2: A 62 GLN : amide:sc= -1.44! C(o=-0.014!,f=-0.83!) USER MOD Set 3.1: A 51 LYS NZ :NH3+ -171:sc= 0.66 (180deg=0.448) USER MOD Set 3.2: A 57 TYR OH : rot 30:sc= 0.15 USER MOD Set 4.1: A 49 MET CE :methyl -162:sc= -0.159 (180deg=-0.598) USER MOD Set 4.2: A 85 TYR OH : rot 30:sc= -0.49 USER MOD Single : A 25 MET CE :methyl 165:sc= -0.118 (180deg=-0.563) USER MOD Single : A 27 ASN : amide:sc= -0.326 K(o=-0.33,f=-3.2!) USER MOD Single : A 28 LYS NZ :NH3+ -165:sc= -0.0543 (180deg=-0.302) USER MOD Single : A 30 LYS NZ :NH3+ -174:sc= -0.0112 (180deg=-0.0876) USER MOD Single : A 34 GLN : amide:sc= 0 K(o=0,f=-1.6) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 68:sc= 1.13 USER MOD Single : A 50 TYR OH : rot -31:sc= 2.01 USER MOD Single : A 54 ASN : amide:sc= -0.734 K(o=-0.73,f=-1.8) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 90:sc= 1.26 USER MOD Single : A 65 GLN : amide:sc= -2.16! K(o=-2.2!,f=-0.73) USER MOD Single : A 69 SER OG : rot 180:sc=-0.00239 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 76 HIS : no HD1:sc= -2.2 K(o=-2.2,f=-0.9) USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 GLN : amide:sc=-0.00354 K(o=-0.0035,f=-0.84) USER MOD Single : A 96 SER OG : rot -160:sc= 1.2 USER MOD Single : A 98 TYR OH : rot -103:sc= 0.197 USER MOD Single : A 99 GLN : amide:sc= -2.89! C(o=-2.9!,f=-4.4!) USER MOD Single : A 102 SER OG : rot 52:sc= 1.06 USER MOD Single : A 105 GLN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 106 HIS : no HE2:sc= 0.482 K(o=0.48,f=-5.2!) USER MOD Single : A 108 GLN : amide:sc= -2.41! C(o=-2.4!,f=-3.1!) USER MOD Single : A 113 SER OG : rot 97:sc= 1.23 USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 130 THR OG1 : rot -11:sc= 1.73 USER MOD Single : A 134 HIS : no HD1:sc= -1.75 K(o=-1.8,f=0.17) USER MOD Single : A 136 HIS : no HD1:sc=-0.00312 X(o=-0.0031,f=-0.0031) USER MOD Single : A 137 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 138 HIS : no HD1:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 139 HIS : no HD1:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 140 LYS NZ :NH3+ -167:sc= -0.0249 (180deg=-0.285) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 25 16.085 -10.483 -2.975 1.00 0.00 N ATOM 2 CA MET A 25 17.224 -11.428 -2.934 1.00 0.00 C ATOM 3 C MET A 25 18.456 -10.785 -2.298 1.00 0.00 C ATOM 4 O MET A 25 19.357 -11.483 -1.833 1.00 0.00 O ATOM 5 CB MET A 25 17.559 -11.925 -4.342 1.00 0.00 C ATOM 6 CG MET A 25 17.985 -10.827 -5.300 1.00 0.00 C ATOM 7 SD MET A 25 18.452 -11.462 -6.920 1.00 0.00 S ATOM 8 CE MET A 25 16.913 -12.206 -7.460 1.00 0.00 C ATOM 0 HA MET A 25 16.928 -12.278 -2.319 1.00 0.00 H new ATOM 0 HB2 MET A 25 18.357 -12.664 -4.275 1.00 0.00 H new ATOM 0 HB3 MET A 25 16.687 -12.434 -4.753 1.00 0.00 H new ATOM 0 HG2 MET A 25 17.169 -10.114 -5.415 1.00 0.00 H new ATOM 0 HG3 MET A 25 18.826 -10.282 -4.871 1.00 0.00 H new ATOM 0 HE1 MET A 25 16.960 -12.401 -8.531 1.00 0.00 H new ATOM 0 HE2 MET A 25 16.755 -13.143 -6.927 1.00 0.00 H new ATOM 0 HE3 MET A 25 16.087 -11.526 -7.251 1.00 0.00 H new ATOM 20 N GLY A 26 18.512 -9.458 -2.298 1.00 0.00 N ATOM 21 CA GLY A 26 19.606 -8.764 -1.650 1.00 0.00 C ATOM 22 C GLY A 26 20.694 -8.360 -2.623 1.00 0.00 C ATOM 23 O GLY A 26 21.143 -7.215 -2.620 1.00 0.00 O ATOM 0 H GLY A 26 17.819 -8.851 -2.736 1.00 0.00 H new ATOM 0 HA2 GLY A 26 19.222 -7.875 -1.149 1.00 0.00 H new ATOM 0 HA3 GLY A 26 20.033 -9.405 -0.879 1.00 0.00 H new ATOM 27 N ASN A 27 21.106 -9.301 -3.464 1.00 0.00 N ATOM 28 CA ASN A 27 22.200 -9.070 -4.408 1.00 0.00 C ATOM 29 C ASN A 27 21.786 -8.106 -5.515 1.00 0.00 C ATOM 30 O ASN A 27 22.628 -7.438 -6.115 1.00 0.00 O ATOM 31 CB ASN A 27 22.678 -10.388 -5.033 1.00 0.00 C ATOM 32 CG ASN A 27 23.192 -11.388 -4.008 1.00 0.00 C ATOM 33 OD1 ASN A 27 22.688 -11.473 -2.888 1.00 0.00 O ATOM 34 ND2 ASN A 27 24.206 -12.151 -4.384 1.00 0.00 N ATOM 0 H ASN A 27 20.699 -10.235 -3.514 1.00 0.00 H new ATOM 0 HA ASN A 27 23.019 -8.625 -3.843 1.00 0.00 H new ATOM 0 HB2 ASN A 27 21.855 -10.838 -5.589 1.00 0.00 H new ATOM 0 HB3 ASN A 27 23.469 -10.175 -5.752 1.00 0.00 H new ATOM 0 HD21 ASN A 27 24.595 -12.837 -3.737 1.00 0.00 H new ATOM 0 HD22 ASN A 27 24.598 -12.053 -5.320 1.00 0.00 H new ATOM 41 N LYS A 28 20.489 -8.043 -5.786 1.00 0.00 N ATOM 42 CA LYS A 28 19.964 -7.146 -6.806 1.00 0.00 C ATOM 43 C LYS A 28 19.038 -6.117 -6.172 1.00 0.00 C ATOM 44 O LYS A 28 17.815 -6.201 -6.300 1.00 0.00 O ATOM 45 CB LYS A 28 19.222 -7.936 -7.887 1.00 0.00 C ATOM 46 CG LYS A 28 20.112 -8.905 -8.647 1.00 0.00 C ATOM 47 CD LYS A 28 19.329 -9.668 -9.703 1.00 0.00 C ATOM 48 CE LYS A 28 20.227 -10.595 -10.503 1.00 0.00 C ATOM 49 NZ LYS A 28 21.315 -9.857 -11.196 1.00 0.00 N ATOM 0 H LYS A 28 19.780 -8.604 -5.313 1.00 0.00 H new ATOM 0 HA LYS A 28 20.799 -6.626 -7.274 1.00 0.00 H new ATOM 0 HB2 LYS A 28 18.406 -8.491 -7.425 1.00 0.00 H new ATOM 0 HB3 LYS A 28 18.773 -7.237 -8.593 1.00 0.00 H new ATOM 0 HG2 LYS A 28 20.927 -8.357 -9.121 1.00 0.00 H new ATOM 0 HG3 LYS A 28 20.565 -9.609 -7.949 1.00 0.00 H new ATOM 0 HD2 LYS A 28 18.541 -10.248 -9.224 1.00 0.00 H new ATOM 0 HD3 LYS A 28 18.841 -8.963 -10.376 1.00 0.00 H new ATOM 0 HE2 LYS A 28 20.662 -11.341 -9.838 1.00 0.00 H new ATOM 0 HE3 LYS A 28 19.629 -11.133 -11.238 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 21.743 -10.469 -11.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 20.924 -9.006 -11.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 22.041 -9.579 -10.505 1.00 0.00 H new ATOM 63 N GLU A 29 19.640 -5.146 -5.499 1.00 0.00 N ATOM 64 CA GLU A 29 18.908 -4.150 -4.725 1.00 0.00 C ATOM 65 C GLU A 29 17.930 -3.366 -5.596 1.00 0.00 C ATOM 66 O GLU A 29 16.787 -3.131 -5.202 1.00 0.00 O ATOM 67 CB GLU A 29 19.896 -3.190 -4.061 1.00 0.00 C ATOM 68 CG GLU A 29 19.266 -2.296 -3.009 1.00 0.00 C ATOM 69 CD GLU A 29 18.738 -3.083 -1.828 1.00 0.00 C ATOM 70 OE1 GLU A 29 17.533 -3.401 -1.811 1.00 0.00 O ATOM 71 OE2 GLU A 29 19.528 -3.387 -0.910 1.00 0.00 O ATOM 0 H GLU A 29 20.653 -5.026 -5.474 1.00 0.00 H new ATOM 0 HA GLU A 29 18.329 -4.673 -3.964 1.00 0.00 H new ATOM 0 HB2 GLU A 29 20.697 -3.768 -3.601 1.00 0.00 H new ATOM 0 HB3 GLU A 29 20.354 -2.566 -4.828 1.00 0.00 H new ATOM 0 HG2 GLU A 29 20.004 -1.573 -2.661 1.00 0.00 H new ATOM 0 HG3 GLU A 29 18.451 -1.728 -3.458 1.00 0.00 H new ATOM 78 N LYS A 30 18.378 -2.981 -6.788 1.00 0.00 N ATOM 79 CA LYS A 30 17.554 -2.183 -7.689 1.00 0.00 C ATOM 80 C LYS A 30 16.297 -2.947 -8.074 1.00 0.00 C ATOM 81 O LYS A 30 15.188 -2.424 -7.990 1.00 0.00 O ATOM 82 CB LYS A 30 18.329 -1.816 -8.958 1.00 0.00 C ATOM 83 CG LYS A 30 19.619 -1.050 -8.709 1.00 0.00 C ATOM 84 CD LYS A 30 19.361 0.285 -8.030 1.00 0.00 C ATOM 85 CE LYS A 30 20.627 1.124 -7.948 1.00 0.00 C ATOM 86 NZ LYS A 30 21.715 0.428 -7.213 1.00 0.00 N ATOM 0 H LYS A 30 19.304 -3.208 -7.151 1.00 0.00 H new ATOM 0 HA LYS A 30 17.278 -1.268 -7.165 1.00 0.00 H new ATOM 0 HB2 LYS A 30 18.564 -2.731 -9.503 1.00 0.00 H new ATOM 0 HB3 LYS A 30 17.684 -1.218 -9.602 1.00 0.00 H new ATOM 0 HG2 LYS A 30 20.284 -1.651 -8.089 1.00 0.00 H new ATOM 0 HG3 LYS A 30 20.131 -0.883 -9.657 1.00 0.00 H new ATOM 0 HD2 LYS A 30 18.596 0.832 -8.581 1.00 0.00 H new ATOM 0 HD3 LYS A 30 18.971 0.114 -7.027 1.00 0.00 H new ATOM 0 HE2 LYS A 30 20.967 1.364 -8.955 1.00 0.00 H new ATOM 0 HE3 LYS A 30 20.403 2.069 -7.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 22.521 1.074 -7.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 21.368 0.131 -6.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 22.018 -0.408 -7.752 1.00 0.00 H new ATOM 100 N ALA A 31 16.481 -4.198 -8.465 1.00 0.00 N ATOM 101 CA ALA A 31 15.376 -5.028 -8.915 1.00 0.00 C ATOM 102 C ALA A 31 14.466 -5.419 -7.755 1.00 0.00 C ATOM 103 O ALA A 31 13.245 -5.484 -7.910 1.00 0.00 O ATOM 104 CB ALA A 31 15.908 -6.263 -9.621 1.00 0.00 C ATOM 0 H ALA A 31 17.389 -4.662 -8.480 1.00 0.00 H new ATOM 0 HA ALA A 31 14.778 -4.449 -9.619 1.00 0.00 H new ATOM 0 HB1 ALA A 31 15.073 -6.879 -9.955 1.00 0.00 H new ATOM 0 HB2 ALA A 31 16.504 -5.961 -10.483 1.00 0.00 H new ATOM 0 HB3 ALA A 31 16.530 -6.836 -8.933 1.00 0.00 H new ATOM 110 N ASP A 32 15.060 -5.663 -6.591 1.00 0.00 N ATOM 111 CA ASP A 32 14.293 -6.071 -5.417 1.00 0.00 C ATOM 112 C ASP A 32 13.324 -4.983 -4.992 1.00 0.00 C ATOM 113 O ASP A 32 12.148 -5.252 -4.751 1.00 0.00 O ATOM 114 CB ASP A 32 15.212 -6.425 -4.245 1.00 0.00 C ATOM 115 CG ASP A 32 15.851 -7.790 -4.387 1.00 0.00 C ATOM 116 OD1 ASP A 32 16.949 -8.000 -3.833 1.00 0.00 O ATOM 117 OD2 ASP A 32 15.256 -8.675 -5.035 1.00 0.00 O ATOM 0 H ASP A 32 16.065 -5.586 -6.435 1.00 0.00 H new ATOM 0 HA ASP A 32 13.727 -6.959 -5.698 1.00 0.00 H new ATOM 0 HB2 ASP A 32 15.994 -5.670 -4.163 1.00 0.00 H new ATOM 0 HB3 ASP A 32 14.639 -6.393 -3.318 1.00 0.00 H new ATOM 122 N ARG A 33 13.809 -3.750 -4.917 1.00 0.00 N ATOM 123 CA ARG A 33 12.954 -2.639 -4.529 1.00 0.00 C ATOM 124 C ARG A 33 11.906 -2.368 -5.600 1.00 0.00 C ATOM 125 O ARG A 33 10.788 -1.984 -5.287 1.00 0.00 O ATOM 126 CB ARG A 33 13.753 -1.373 -4.194 1.00 0.00 C ATOM 127 CG ARG A 33 14.567 -0.791 -5.335 1.00 0.00 C ATOM 128 CD ARG A 33 15.280 0.474 -4.888 1.00 0.00 C ATOM 129 NE ARG A 33 15.919 1.185 -5.993 1.00 0.00 N ATOM 130 CZ ARG A 33 16.776 2.193 -5.826 1.00 0.00 C ATOM 131 NH1 ARG A 33 17.142 2.562 -4.604 1.00 0.00 N ATOM 132 NH2 ARG A 33 17.271 2.829 -6.882 1.00 0.00 N ATOM 0 H ARG A 33 14.777 -3.497 -5.117 1.00 0.00 H new ATOM 0 HA ARG A 33 12.441 -2.931 -3.612 1.00 0.00 H new ATOM 0 HB2 ARG A 33 13.059 -0.610 -3.840 1.00 0.00 H new ATOM 0 HB3 ARG A 33 14.428 -1.598 -3.368 1.00 0.00 H new ATOM 0 HG2 ARG A 33 15.296 -1.524 -5.680 1.00 0.00 H new ATOM 0 HG3 ARG A 33 13.914 -0.569 -6.179 1.00 0.00 H new ATOM 0 HD2 ARG A 33 14.564 1.136 -4.402 1.00 0.00 H new ATOM 0 HD3 ARG A 33 16.033 0.217 -4.143 1.00 0.00 H new ATOM 0 HE ARG A 33 15.697 0.894 -6.945 1.00 0.00 H new ATOM 0 HH11 ARG A 33 16.768 2.074 -3.790 1.00 0.00 H new ATOM 0 HH12 ARG A 33 17.798 3.333 -4.479 1.00 0.00 H new ATOM 0 HH21 ARG A 33 16.996 2.547 -7.823 1.00 0.00 H new ATOM 0 HH22 ARG A 33 17.926 3.600 -6.752 1.00 0.00 H new ATOM 146 N GLN A 34 12.271 -2.558 -6.865 1.00 0.00 N ATOM 147 CA GLN A 34 11.325 -2.378 -7.964 1.00 0.00 C ATOM 148 C GLN A 34 10.154 -3.358 -7.866 1.00 0.00 C ATOM 149 O GLN A 34 9.025 -3.020 -8.232 1.00 0.00 O ATOM 150 CB GLN A 34 12.027 -2.520 -9.313 1.00 0.00 C ATOM 151 CG GLN A 34 12.871 -1.311 -9.674 1.00 0.00 C ATOM 152 CD GLN A 34 13.623 -1.488 -10.975 1.00 0.00 C ATOM 153 OE1 GLN A 34 14.009 -2.598 -11.341 1.00 0.00 O ATOM 154 NE2 GLN A 34 13.825 -0.393 -11.687 1.00 0.00 N ATOM 0 H GLN A 34 13.209 -2.835 -7.154 1.00 0.00 H new ATOM 0 HA GLN A 34 10.922 -1.368 -7.885 1.00 0.00 H new ATOM 0 HB2 GLN A 34 12.661 -3.406 -9.294 1.00 0.00 H new ATOM 0 HB3 GLN A 34 11.279 -2.679 -10.090 1.00 0.00 H new ATOM 0 HG2 GLN A 34 12.228 -0.434 -9.748 1.00 0.00 H new ATOM 0 HG3 GLN A 34 13.583 -1.118 -8.872 1.00 0.00 H new ATOM 0 HE21 GLN A 34 13.488 0.507 -11.345 1.00 0.00 H new ATOM 0 HE22 GLN A 34 14.318 -0.448 -12.578 1.00 0.00 H new ATOM 163 N LYS A 35 10.414 -4.567 -7.373 1.00 0.00 N ATOM 164 CA LYS A 35 9.339 -5.521 -7.117 1.00 0.00 C ATOM 165 C LYS A 35 8.444 -4.989 -6.006 1.00 0.00 C ATOM 166 O LYS A 35 7.219 -5.074 -6.081 1.00 0.00 O ATOM 167 CB LYS A 35 9.889 -6.899 -6.736 1.00 0.00 C ATOM 168 CG LYS A 35 8.795 -7.939 -6.537 1.00 0.00 C ATOM 169 CD LYS A 35 9.356 -9.305 -6.178 1.00 0.00 C ATOM 170 CE LYS A 35 8.236 -10.321 -6.013 1.00 0.00 C ATOM 171 NZ LYS A 35 8.738 -11.670 -5.641 1.00 0.00 N ATOM 0 H LYS A 35 11.349 -4.906 -7.145 1.00 0.00 H new ATOM 0 HA LYS A 35 8.760 -5.639 -8.033 1.00 0.00 H new ATOM 0 HB2 LYS A 35 10.571 -7.241 -7.515 1.00 0.00 H new ATOM 0 HB3 LYS A 35 10.471 -6.811 -5.819 1.00 0.00 H new ATOM 0 HG2 LYS A 35 8.120 -7.607 -5.748 1.00 0.00 H new ATOM 0 HG3 LYS A 35 8.203 -8.020 -7.449 1.00 0.00 H new ATOM 0 HD2 LYS A 35 10.043 -9.637 -6.956 1.00 0.00 H new ATOM 0 HD3 LYS A 35 9.930 -9.236 -5.254 1.00 0.00 H new ATOM 0 HE2 LYS A 35 7.543 -9.971 -5.248 1.00 0.00 H new ATOM 0 HE3 LYS A 35 7.674 -10.391 -6.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 7.935 -12.324 -5.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 9.378 -12.019 -6.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 9.252 -11.613 -4.739 1.00 0.00 H new ATOM 185 N VAL A 36 9.079 -4.403 -4.999 1.00 0.00 N ATOM 186 CA VAL A 36 8.371 -3.780 -3.888 1.00 0.00 C ATOM 187 C VAL A 36 7.485 -2.646 -4.391 1.00 0.00 C ATOM 188 O VAL A 36 6.328 -2.533 -4.003 1.00 0.00 O ATOM 189 CB VAL A 36 9.369 -3.223 -2.850 1.00 0.00 C ATOM 190 CG1 VAL A 36 8.650 -2.474 -1.738 1.00 0.00 C ATOM 191 CG2 VAL A 36 10.220 -4.347 -2.282 1.00 0.00 C ATOM 0 H VAL A 36 10.095 -4.346 -4.929 1.00 0.00 H new ATOM 0 HA VAL A 36 7.751 -4.542 -3.415 1.00 0.00 H new ATOM 0 HB VAL A 36 10.023 -2.512 -3.355 1.00 0.00 H new ATOM 0 HG11 VAL A 36 9.380 -2.094 -1.024 1.00 0.00 H new ATOM 0 HG12 VAL A 36 8.091 -1.640 -2.163 1.00 0.00 H new ATOM 0 HG13 VAL A 36 7.963 -3.150 -1.229 1.00 0.00 H new ATOM 0 HG21 VAL A 36 10.919 -3.940 -1.551 1.00 0.00 H new ATOM 0 HG22 VAL A 36 9.576 -5.082 -1.798 1.00 0.00 H new ATOM 0 HG23 VAL A 36 10.775 -4.826 -3.088 1.00 0.00 H new ATOM 201 N VAL A 37 8.037 -1.822 -5.273 1.00 0.00 N ATOM 202 CA VAL A 37 7.289 -0.730 -5.884 1.00 0.00 C ATOM 203 C VAL A 37 6.070 -1.268 -6.630 1.00 0.00 C ATOM 204 O VAL A 37 4.999 -0.668 -6.600 1.00 0.00 O ATOM 205 CB VAL A 37 8.168 0.089 -6.856 1.00 0.00 C ATOM 206 CG1 VAL A 37 7.378 1.228 -7.484 1.00 0.00 C ATOM 207 CG2 VAL A 37 9.394 0.625 -6.138 1.00 0.00 C ATOM 0 H VAL A 37 9.006 -1.890 -5.583 1.00 0.00 H new ATOM 0 HA VAL A 37 6.962 -0.072 -5.079 1.00 0.00 H new ATOM 0 HB VAL A 37 8.494 -0.575 -7.657 1.00 0.00 H new ATOM 0 HG11 VAL A 37 8.022 1.787 -8.163 1.00 0.00 H new ATOM 0 HG12 VAL A 37 6.532 0.822 -8.038 1.00 0.00 H new ATOM 0 HG13 VAL A 37 7.013 1.893 -6.701 1.00 0.00 H new ATOM 0 HG21 VAL A 37 10.003 1.199 -6.836 1.00 0.00 H new ATOM 0 HG22 VAL A 37 9.082 1.268 -5.315 1.00 0.00 H new ATOM 0 HG23 VAL A 37 9.979 -0.207 -5.746 1.00 0.00 H new ATOM 217 N SER A 38 6.241 -2.408 -7.283 1.00 0.00 N ATOM 218 CA SER A 38 5.159 -3.036 -8.030 1.00 0.00 C ATOM 219 C SER A 38 4.001 -3.411 -7.102 1.00 0.00 C ATOM 220 O SER A 38 2.835 -3.157 -7.408 1.00 0.00 O ATOM 221 CB SER A 38 5.680 -4.276 -8.756 1.00 0.00 C ATOM 222 OG SER A 38 6.792 -3.955 -9.580 1.00 0.00 O ATOM 0 H SER A 38 7.123 -2.920 -7.311 1.00 0.00 H new ATOM 0 HA SER A 38 4.786 -2.323 -8.765 1.00 0.00 H new ATOM 0 HB2 SER A 38 5.970 -5.033 -8.027 1.00 0.00 H new ATOM 0 HB3 SER A 38 4.885 -4.707 -9.364 1.00 0.00 H new ATOM 0 HG SER A 38 7.556 -3.709 -9.017 1.00 0.00 H new ATOM 228 N ASP A 39 4.318 -4.017 -5.967 1.00 0.00 N ATOM 229 CA ASP A 39 3.297 -4.356 -4.981 1.00 0.00 C ATOM 230 C ASP A 39 2.752 -3.097 -4.317 1.00 0.00 C ATOM 231 O ASP A 39 1.568 -3.010 -3.997 1.00 0.00 O ATOM 232 CB ASP A 39 3.849 -5.321 -3.931 1.00 0.00 C ATOM 233 CG ASP A 39 3.966 -6.734 -4.461 1.00 0.00 C ATOM 234 OD1 ASP A 39 2.997 -7.508 -4.313 1.00 0.00 O ATOM 235 OD2 ASP A 39 5.010 -7.073 -5.055 1.00 0.00 O ATOM 0 H ASP A 39 5.267 -4.283 -5.705 1.00 0.00 H new ATOM 0 HA ASP A 39 2.478 -4.854 -5.501 1.00 0.00 H new ATOM 0 HB2 ASP A 39 4.829 -4.976 -3.602 1.00 0.00 H new ATOM 0 HB3 ASP A 39 3.198 -5.315 -3.056 1.00 0.00 H new ATOM 240 N LEU A 40 3.626 -2.120 -4.131 1.00 0.00 N ATOM 241 CA LEU A 40 3.269 -0.852 -3.511 1.00 0.00 C ATOM 242 C LEU A 40 2.240 -0.095 -4.355 1.00 0.00 C ATOM 243 O LEU A 40 1.261 0.427 -3.825 1.00 0.00 O ATOM 244 CB LEU A 40 4.530 -0.004 -3.323 1.00 0.00 C ATOM 245 CG LEU A 40 4.405 1.172 -2.354 1.00 0.00 C ATOM 246 CD1 LEU A 40 4.140 0.676 -0.939 1.00 0.00 C ATOM 247 CD2 LEU A 40 5.665 2.020 -2.392 1.00 0.00 C ATOM 0 H LEU A 40 4.606 -2.184 -4.406 1.00 0.00 H new ATOM 0 HA LEU A 40 2.818 -1.054 -2.539 1.00 0.00 H new ATOM 0 HB2 LEU A 40 5.333 -0.654 -2.974 1.00 0.00 H new ATOM 0 HB3 LEU A 40 4.833 0.383 -4.296 1.00 0.00 H new ATOM 0 HG LEU A 40 3.560 1.787 -2.664 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.054 1.528 -0.265 1.00 0.00 H new ATOM 0 HD12 LEU A 40 3.212 0.105 -0.922 1.00 0.00 H new ATOM 0 HD13 LEU A 40 4.964 0.039 -0.616 1.00 0.00 H new ATOM 0 HD21 LEU A 40 5.563 2.854 -1.698 1.00 0.00 H new ATOM 0 HD22 LEU A 40 6.522 1.411 -2.105 1.00 0.00 H new ATOM 0 HD23 LEU A 40 5.815 2.404 -3.401 1.00 0.00 H new ATOM 259 N VAL A 41 2.458 -0.038 -5.668 1.00 0.00 N ATOM 260 CA VAL A 41 1.504 0.609 -6.565 1.00 0.00 C ATOM 261 C VAL A 41 0.190 -0.165 -6.588 1.00 0.00 C ATOM 262 O VAL A 41 -0.884 0.423 -6.719 1.00 0.00 O ATOM 263 CB VAL A 41 2.044 0.802 -8.006 1.00 0.00 C ATOM 264 CG1 VAL A 41 3.315 1.633 -7.992 1.00 0.00 C ATOM 265 CG2 VAL A 41 2.283 -0.524 -8.709 1.00 0.00 C ATOM 0 H VAL A 41 3.279 -0.428 -6.130 1.00 0.00 H new ATOM 0 HA VAL A 41 1.335 1.609 -6.165 1.00 0.00 H new ATOM 0 HB VAL A 41 1.278 1.335 -8.570 1.00 0.00 H new ATOM 0 HG11 VAL A 41 3.679 1.758 -9.012 1.00 0.00 H new ATOM 0 HG12 VAL A 41 3.105 2.611 -7.559 1.00 0.00 H new ATOM 0 HG13 VAL A 41 4.074 1.127 -7.395 1.00 0.00 H new ATOM 0 HG21 VAL A 41 2.661 -0.340 -9.715 1.00 0.00 H new ATOM 0 HG22 VAL A 41 3.014 -1.107 -8.148 1.00 0.00 H new ATOM 0 HG23 VAL A 41 1.346 -1.078 -8.769 1.00 0.00 H new ATOM 275 N ALA A 42 0.281 -1.488 -6.480 1.00 0.00 N ATOM 276 CA ALA A 42 -0.905 -2.327 -6.367 1.00 0.00 C ATOM 277 C ALA A 42 -1.691 -1.977 -5.104 1.00 0.00 C ATOM 278 O ALA A 42 -2.920 -1.947 -5.120 1.00 0.00 O ATOM 279 CB ALA A 42 -0.521 -3.799 -6.368 1.00 0.00 C ATOM 0 H ALA A 42 1.163 -2.000 -6.469 1.00 0.00 H new ATOM 0 HA ALA A 42 -1.542 -2.139 -7.231 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -1.420 -4.410 -6.283 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -0.005 -4.040 -7.298 1.00 0.00 H new ATOM 0 HB3 ALA A 42 0.138 -4.004 -5.524 1.00 0.00 H new ATOM 285 N LEU A 43 -0.972 -1.697 -4.016 1.00 0.00 N ATOM 286 CA LEU A 43 -1.596 -1.236 -2.777 1.00 0.00 C ATOM 287 C LEU A 43 -2.330 0.077 -3.019 1.00 0.00 C ATOM 288 O LEU A 43 -3.453 0.271 -2.552 1.00 0.00 O ATOM 289 CB LEU A 43 -0.548 -1.054 -1.675 1.00 0.00 C ATOM 290 CG LEU A 43 0.110 -2.336 -1.167 1.00 0.00 C ATOM 291 CD1 LEU A 43 1.149 -2.001 -0.112 1.00 0.00 C ATOM 292 CD2 LEU A 43 -0.933 -3.288 -0.599 1.00 0.00 C ATOM 0 H LEU A 43 0.043 -1.782 -3.969 1.00 0.00 H new ATOM 0 HA LEU A 43 -2.311 -1.992 -2.451 1.00 0.00 H new ATOM 0 HB2 LEU A 43 0.232 -0.390 -2.047 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -1.019 -0.550 -0.831 1.00 0.00 H new ATOM 0 HG LEU A 43 0.601 -2.831 -2.005 1.00 0.00 H new ATOM 0 HD11 LEU A 43 1.614 -2.920 0.246 1.00 0.00 H new ATOM 0 HD12 LEU A 43 1.911 -1.353 -0.545 1.00 0.00 H new ATOM 0 HD13 LEU A 43 0.669 -1.489 0.722 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -0.443 -4.194 -0.243 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -1.452 -2.807 0.230 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -1.652 -3.546 -1.377 1.00 0.00 H new ATOM 304 N GLU A 44 -1.687 0.974 -3.763 1.00 0.00 N ATOM 305 CA GLU A 44 -2.326 2.208 -4.206 1.00 0.00 C ATOM 306 C GLU A 44 -3.594 1.896 -4.988 1.00 0.00 C ATOM 307 O GLU A 44 -4.587 2.603 -4.881 1.00 0.00 O ATOM 308 CB GLU A 44 -1.372 3.030 -5.072 1.00 0.00 C ATOM 309 CG GLU A 44 -0.400 3.877 -4.276 1.00 0.00 C ATOM 310 CD GLU A 44 -1.068 5.084 -3.653 1.00 0.00 C ATOM 311 OE1 GLU A 44 -1.771 4.930 -2.635 1.00 0.00 O ATOM 312 OE2 GLU A 44 -0.900 6.199 -4.182 1.00 0.00 O ATOM 0 H GLU A 44 -0.721 0.868 -4.072 1.00 0.00 H new ATOM 0 HA GLU A 44 -2.587 2.791 -3.323 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -0.808 2.355 -5.716 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -1.956 3.680 -5.724 1.00 0.00 H new ATOM 0 HG2 GLU A 44 0.051 3.269 -3.492 1.00 0.00 H new ATOM 0 HG3 GLU A 44 0.409 4.208 -4.928 1.00 0.00 H new ATOM 319 N GLY A 45 -3.549 0.819 -5.766 1.00 0.00 N ATOM 320 CA GLY A 45 -4.706 0.394 -6.527 1.00 0.00 C ATOM 321 C GLY A 45 -5.903 0.129 -5.637 1.00 0.00 C ATOM 322 O GLY A 45 -7.014 0.557 -5.940 1.00 0.00 O ATOM 0 H GLY A 45 -2.724 0.230 -5.882 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -4.961 1.161 -7.259 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -4.461 -0.510 -7.085 1.00 0.00 H new ATOM 326 N ALA A 46 -5.671 -0.565 -4.529 1.00 0.00 N ATOM 327 CA ALA A 46 -6.727 -0.827 -3.558 1.00 0.00 C ATOM 328 C ALA A 46 -7.251 0.476 -2.967 1.00 0.00 C ATOM 329 O ALA A 46 -8.455 0.666 -2.835 1.00 0.00 O ATOM 330 CB ALA A 46 -6.222 -1.735 -2.449 1.00 0.00 C ATOM 0 H ALA A 46 -4.762 -0.956 -4.281 1.00 0.00 H new ATOM 0 HA ALA A 46 -7.544 -1.329 -4.076 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -7.025 -1.918 -1.735 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -5.893 -2.682 -2.876 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -5.386 -1.257 -1.940 1.00 0.00 H new ATOM 336 N LEU A 47 -6.336 1.373 -2.629 1.00 0.00 N ATOM 337 CA LEU A 47 -6.692 2.653 -2.022 1.00 0.00 C ATOM 338 C LEU A 47 -7.498 3.522 -2.982 1.00 0.00 C ATOM 339 O LEU A 47 -8.485 4.148 -2.587 1.00 0.00 O ATOM 340 CB LEU A 47 -5.429 3.395 -1.568 1.00 0.00 C ATOM 341 CG LEU A 47 -4.928 3.073 -0.152 1.00 0.00 C ATOM 342 CD1 LEU A 47 -4.905 1.576 0.109 1.00 0.00 C ATOM 343 CD2 LEU A 47 -3.540 3.659 0.056 1.00 0.00 C ATOM 0 H LEU A 47 -5.334 1.239 -2.765 1.00 0.00 H new ATOM 0 HA LEU A 47 -7.317 2.447 -1.153 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -4.629 3.173 -2.274 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -5.620 4.466 -1.629 1.00 0.00 H new ATOM 0 HG LEU A 47 -5.623 3.524 0.557 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -4.545 1.389 1.121 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -5.912 1.172 0.002 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -4.242 1.092 -0.608 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -3.194 3.425 1.063 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -2.852 3.232 -0.673 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -3.579 4.741 -0.072 1.00 0.00 H new ATOM 355 N ASP A 48 -7.077 3.563 -4.237 1.00 0.00 N ATOM 356 CA ASP A 48 -7.774 4.338 -5.255 1.00 0.00 C ATOM 357 C ASP A 48 -9.137 3.736 -5.556 1.00 0.00 C ATOM 358 O ASP A 48 -10.124 4.459 -5.703 1.00 0.00 O ATOM 359 CB ASP A 48 -6.946 4.434 -6.540 1.00 0.00 C ATOM 360 CG ASP A 48 -5.842 5.473 -6.453 1.00 0.00 C ATOM 361 OD1 ASP A 48 -6.103 6.650 -6.786 1.00 0.00 O ATOM 362 OD2 ASP A 48 -4.709 5.121 -6.062 1.00 0.00 O ATOM 0 H ASP A 48 -6.253 3.067 -4.577 1.00 0.00 H new ATOM 0 HA ASP A 48 -7.916 5.344 -4.862 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -6.506 3.461 -6.757 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -7.604 4.679 -7.373 1.00 0.00 H new ATOM 367 N MET A 49 -9.194 2.410 -5.629 1.00 0.00 N ATOM 368 CA MET A 49 -10.448 1.717 -5.901 1.00 0.00 C ATOM 369 C MET A 49 -11.421 1.865 -4.740 1.00 0.00 C ATOM 370 O MET A 49 -12.604 2.136 -4.941 1.00 0.00 O ATOM 371 CB MET A 49 -10.210 0.232 -6.196 1.00 0.00 C ATOM 372 CG MET A 49 -9.590 -0.029 -7.559 1.00 0.00 C ATOM 373 SD MET A 49 -10.603 0.596 -8.915 1.00 0.00 S ATOM 374 CE MET A 49 -12.139 -0.290 -8.643 1.00 0.00 C ATOM 0 H MET A 49 -8.389 1.796 -5.504 1.00 0.00 H new ATOM 0 HA MET A 49 -10.887 2.180 -6.785 1.00 0.00 H new ATOM 0 HB2 MET A 49 -9.560 -0.183 -5.426 1.00 0.00 H new ATOM 0 HB3 MET A 49 -11.160 -0.299 -6.131 1.00 0.00 H new ATOM 0 HG2 MET A 49 -8.606 0.437 -7.601 1.00 0.00 H new ATOM 0 HG3 MET A 49 -9.441 -1.101 -7.687 1.00 0.00 H new ATOM 0 HE1 MET A 49 -12.740 -0.264 -9.552 1.00 0.00 H new ATOM 0 HE2 MET A 49 -11.920 -1.325 -8.382 1.00 0.00 H new ATOM 0 HE3 MET A 49 -12.691 0.181 -7.830 1.00 0.00 H new ATOM 384 N TYR A 50 -10.917 1.703 -3.526 1.00 0.00 N ATOM 385 CA TYR A 50 -11.750 1.801 -2.339 1.00 0.00 C ATOM 386 C TYR A 50 -12.344 3.201 -2.209 1.00 0.00 C ATOM 387 O TYR A 50 -13.513 3.353 -1.851 1.00 0.00 O ATOM 388 CB TYR A 50 -10.948 1.442 -1.086 1.00 0.00 C ATOM 389 CG TYR A 50 -11.771 1.467 0.181 1.00 0.00 C ATOM 390 CD1 TYR A 50 -12.561 0.385 0.546 1.00 0.00 C ATOM 391 CD2 TYR A 50 -11.762 2.579 1.006 1.00 0.00 C ATOM 392 CE1 TYR A 50 -13.319 0.414 1.701 1.00 0.00 C ATOM 393 CE2 TYR A 50 -12.512 2.615 2.159 1.00 0.00 C ATOM 394 CZ TYR A 50 -13.290 1.533 2.503 1.00 0.00 C ATOM 395 OH TYR A 50 -14.039 1.575 3.656 1.00 0.00 O ATOM 0 H TYR A 50 -9.935 1.503 -3.338 1.00 0.00 H new ATOM 0 HA TYR A 50 -12.569 1.089 -2.440 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -10.518 0.448 -1.211 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -10.116 2.139 -0.984 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -12.583 -0.493 -0.083 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -11.156 3.433 0.740 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -13.930 -0.434 1.973 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -12.490 3.490 2.792 1.00 0.00 H new ATOM 0 HH TYR A 50 -14.852 1.040 3.538 1.00 0.00 H new ATOM 405 N LYS A 51 -11.546 4.222 -2.509 1.00 0.00 N ATOM 406 CA LYS A 51 -12.036 5.594 -2.472 1.00 0.00 C ATOM 407 C LYS A 51 -13.017 5.835 -3.613 1.00 0.00 C ATOM 408 O LYS A 51 -13.946 6.621 -3.483 1.00 0.00 O ATOM 409 CB LYS A 51 -10.897 6.620 -2.539 1.00 0.00 C ATOM 410 CG LYS A 51 -11.381 8.042 -2.274 1.00 0.00 C ATOM 411 CD LYS A 51 -10.289 9.082 -2.459 1.00 0.00 C ATOM 412 CE LYS A 51 -10.809 10.476 -2.129 1.00 0.00 C ATOM 413 NZ LYS A 51 -9.817 11.543 -2.432 1.00 0.00 N ATOM 0 H LYS A 51 -10.567 4.126 -2.778 1.00 0.00 H new ATOM 0 HA LYS A 51 -12.544 5.728 -1.517 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -10.131 6.357 -1.809 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -10.429 6.576 -3.522 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -12.210 8.269 -2.945 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -11.768 8.105 -1.257 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -9.441 8.844 -1.817 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -9.927 9.058 -3.487 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -11.722 10.663 -2.695 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -11.074 10.520 -1.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -10.155 12.450 -2.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -8.904 11.303 -1.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -9.697 11.623 -3.462 1.00 0.00 H new ATOM 427 N LEU A 52 -12.803 5.163 -4.732 1.00 0.00 N ATOM 428 CA LEU A 52 -13.702 5.289 -5.870 1.00 0.00 C ATOM 429 C LEU A 52 -15.113 4.843 -5.487 1.00 0.00 C ATOM 430 O LEU A 52 -16.088 5.550 -5.743 1.00 0.00 O ATOM 431 CB LEU A 52 -13.184 4.456 -7.048 1.00 0.00 C ATOM 432 CG LEU A 52 -14.025 4.527 -8.323 1.00 0.00 C ATOM 433 CD1 LEU A 52 -14.035 5.941 -8.886 1.00 0.00 C ATOM 434 CD2 LEU A 52 -13.500 3.543 -9.357 1.00 0.00 C ATOM 0 H LEU A 52 -12.019 4.527 -4.878 1.00 0.00 H new ATOM 0 HA LEU A 52 -13.739 6.336 -6.170 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -12.171 4.782 -7.283 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -13.119 3.414 -6.734 1.00 0.00 H new ATOM 0 HG LEU A 52 -15.051 4.255 -8.074 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -14.639 5.967 -9.793 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -14.457 6.623 -8.148 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -13.015 6.246 -9.121 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -14.108 3.604 -10.259 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -12.466 3.787 -9.599 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -13.549 2.531 -8.954 1.00 0.00 H new ATOM 446 N ASP A 53 -15.213 3.674 -4.866 1.00 0.00 N ATOM 447 CA ASP A 53 -16.509 3.133 -4.455 1.00 0.00 C ATOM 448 C ASP A 53 -17.054 3.802 -3.192 1.00 0.00 C ATOM 449 O ASP A 53 -18.221 4.189 -3.140 1.00 0.00 O ATOM 450 CB ASP A 53 -16.422 1.622 -4.226 1.00 0.00 C ATOM 451 CG ASP A 53 -16.249 0.833 -5.508 1.00 0.00 C ATOM 452 OD1 ASP A 53 -17.204 0.776 -6.316 1.00 0.00 O ATOM 453 OD2 ASP A 53 -15.169 0.242 -5.704 1.00 0.00 O ATOM 0 H ASP A 53 -14.416 3.081 -4.635 1.00 0.00 H new ATOM 0 HA ASP A 53 -17.199 3.345 -5.272 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -15.585 1.409 -3.560 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -17.326 1.285 -3.719 1.00 0.00 H new ATOM 458 N ASN A 54 -16.211 3.943 -2.175 1.00 0.00 N ATOM 459 CA ASN A 54 -16.681 4.357 -0.850 1.00 0.00 C ATOM 460 C ASN A 54 -16.434 5.836 -0.583 1.00 0.00 C ATOM 461 O ASN A 54 -16.813 6.353 0.465 1.00 0.00 O ATOM 462 CB ASN A 54 -16.013 3.515 0.239 1.00 0.00 C ATOM 463 CG ASN A 54 -16.367 2.044 0.134 1.00 0.00 C ATOM 464 OD1 ASN A 54 -17.337 1.579 0.729 1.00 0.00 O ATOM 465 ND2 ASN A 54 -15.581 1.300 -0.628 1.00 0.00 N ATOM 0 H ASN A 54 -15.206 3.779 -2.237 1.00 0.00 H new ATOM 0 HA ASN A 54 -17.759 4.195 -0.830 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -14.931 3.631 0.171 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -16.313 3.889 1.218 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -15.771 0.304 -0.737 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -14.785 1.723 -1.106 1.00 0.00 H new ATOM 472 N SER A 55 -15.782 6.502 -1.529 1.00 0.00 N ATOM 473 CA SER A 55 -15.552 7.947 -1.470 1.00 0.00 C ATOM 474 C SER A 55 -14.716 8.359 -0.251 1.00 0.00 C ATOM 475 O SER A 55 -14.848 9.479 0.247 1.00 0.00 O ATOM 476 CB SER A 55 -16.890 8.688 -1.468 1.00 0.00 C ATOM 477 OG SER A 55 -17.700 8.277 -2.559 1.00 0.00 O ATOM 0 H SER A 55 -15.396 6.057 -2.362 1.00 0.00 H new ATOM 0 HA SER A 55 -14.980 8.221 -2.357 1.00 0.00 H new ATOM 0 HB2 SER A 55 -17.413 8.499 -0.531 1.00 0.00 H new ATOM 0 HB3 SER A 55 -16.715 9.762 -1.525 1.00 0.00 H new ATOM 0 HG SER A 55 -18.551 8.763 -2.536 1.00 0.00 H new ATOM 483 N ARG A 56 -13.848 7.468 0.221 1.00 0.00 N ATOM 484 CA ARG A 56 -12.998 7.777 1.366 1.00 0.00 C ATOM 485 C ARG A 56 -11.748 6.901 1.361 1.00 0.00 C ATOM 486 O ARG A 56 -11.745 5.814 0.782 1.00 0.00 O ATOM 487 CB ARG A 56 -13.786 7.600 2.677 1.00 0.00 C ATOM 488 CG ARG A 56 -14.008 6.153 3.105 1.00 0.00 C ATOM 489 CD ARG A 56 -13.042 5.753 4.213 1.00 0.00 C ATOM 490 NE ARG A 56 -13.202 4.356 4.619 1.00 0.00 N ATOM 491 CZ ARG A 56 -12.654 3.828 5.713 1.00 0.00 C ATOM 492 NH1 ARG A 56 -11.908 4.575 6.519 1.00 0.00 N ATOM 493 NH2 ARG A 56 -12.847 2.547 5.993 1.00 0.00 N ATOM 0 H ARG A 56 -13.716 6.534 -0.168 1.00 0.00 H new ATOM 0 HA ARG A 56 -12.680 8.817 1.293 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -13.257 8.122 3.475 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -14.757 8.084 2.568 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -15.034 6.026 3.450 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -13.876 5.493 2.248 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -12.019 5.915 3.874 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -13.198 6.399 5.077 1.00 0.00 H new ATOM 0 HE ARG A 56 -13.769 3.748 4.027 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -11.752 5.559 6.302 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -11.492 4.164 7.355 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -13.413 1.969 5.372 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -12.429 2.139 6.829 1.00 0.00 H new ATOM 507 N TYR A 57 -10.690 7.396 1.992 1.00 0.00 N ATOM 508 CA TYR A 57 -9.438 6.661 2.113 1.00 0.00 C ATOM 509 C TYR A 57 -9.556 5.592 3.191 1.00 0.00 C ATOM 510 O TYR A 57 -10.006 5.871 4.303 1.00 0.00 O ATOM 511 CB TYR A 57 -8.289 7.611 2.455 1.00 0.00 C ATOM 512 CG TYR A 57 -7.894 8.529 1.321 1.00 0.00 C ATOM 513 CD1 TYR A 57 -7.127 8.058 0.263 1.00 0.00 C ATOM 514 CD2 TYR A 57 -8.277 9.862 1.309 1.00 0.00 C ATOM 515 CE1 TYR A 57 -6.758 8.889 -0.774 1.00 0.00 C ATOM 516 CE2 TYR A 57 -7.912 10.699 0.273 1.00 0.00 C ATOM 517 CZ TYR A 57 -7.151 10.207 -0.766 1.00 0.00 C ATOM 518 OH TYR A 57 -6.789 11.034 -1.805 1.00 0.00 O ATOM 0 H TYR A 57 -10.676 8.316 2.433 1.00 0.00 H new ATOM 0 HA TYR A 57 -9.229 6.183 1.156 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -8.575 8.215 3.316 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -7.421 7.023 2.752 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -6.815 7.024 0.252 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -8.870 10.252 2.123 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -6.162 8.506 -1.590 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -8.221 11.734 0.277 1.00 0.00 H new ATOM 0 HH TYR A 57 -6.705 10.508 -2.628 1.00 0.00 H new ATOM 528 N PRO A 58 -9.136 4.359 2.882 1.00 0.00 N ATOM 529 CA PRO A 58 -9.293 3.224 3.791 1.00 0.00 C ATOM 530 C PRO A 58 -8.346 3.289 4.983 1.00 0.00 C ATOM 531 O PRO A 58 -7.227 3.795 4.886 1.00 0.00 O ATOM 532 CB PRO A 58 -8.954 2.027 2.906 1.00 0.00 C ATOM 533 CG PRO A 58 -7.992 2.570 1.909 1.00 0.00 C ATOM 534 CD PRO A 58 -8.455 3.974 1.629 1.00 0.00 C ATOM 0 HA PRO A 58 -10.290 3.188 4.230 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -8.512 1.216 3.485 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -9.844 1.625 2.422 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -6.975 2.563 2.300 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -7.988 1.969 1.000 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -7.619 4.637 1.405 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -9.131 4.013 0.775 1.00 0.00 H new ATOM 542 N THR A 59 -8.817 2.783 6.109 1.00 0.00 N ATOM 543 CA THR A 59 -8.011 2.673 7.306 1.00 0.00 C ATOM 544 C THR A 59 -7.007 1.526 7.173 1.00 0.00 C ATOM 545 O THR A 59 -7.032 0.800 6.175 1.00 0.00 O ATOM 546 CB THR A 59 -8.920 2.468 8.525 1.00 0.00 C ATOM 547 OG1 THR A 59 -10.240 2.120 8.074 1.00 0.00 O ATOM 548 CG2 THR A 59 -8.983 3.730 9.371 1.00 0.00 C ATOM 0 H THR A 59 -9.771 2.437 6.217 1.00 0.00 H new ATOM 0 HA THR A 59 -7.447 3.596 7.443 1.00 0.00 H new ATOM 0 HB THR A 59 -8.512 1.665 9.139 1.00 0.00 H new ATOM 0 HG1 THR A 59 -10.394 1.163 8.220 1.00 0.00 H new ATOM 0 HG21 THR A 59 -9.633 3.561 10.229 1.00 0.00 H new ATOM 0 HG22 THR A 59 -7.982 3.985 9.719 1.00 0.00 H new ATOM 0 HG23 THR A 59 -9.379 4.550 8.772 1.00 0.00 H new ATOM 556 N THR A 60 -6.154 1.355 8.183 1.00 0.00 N ATOM 557 CA THR A 60 -5.010 0.444 8.100 1.00 0.00 C ATOM 558 C THR A 60 -5.396 -0.956 7.603 1.00 0.00 C ATOM 559 O THR A 60 -4.723 -1.520 6.737 1.00 0.00 O ATOM 560 CB THR A 60 -4.280 0.334 9.466 1.00 0.00 C ATOM 561 OG1 THR A 60 -3.195 -0.596 9.378 1.00 0.00 O ATOM 562 CG2 THR A 60 -5.225 -0.092 10.581 1.00 0.00 C ATOM 0 H THR A 60 -6.234 1.840 9.077 1.00 0.00 H new ATOM 0 HA THR A 60 -4.334 0.878 7.363 1.00 0.00 H new ATOM 0 HB THR A 60 -3.896 1.325 9.707 1.00 0.00 H new ATOM 0 HG1 THR A 60 -2.380 -0.123 9.109 1.00 0.00 H new ATOM 0 HG21 THR A 60 -4.675 -0.157 11.520 1.00 0.00 H new ATOM 0 HG22 THR A 60 -6.025 0.641 10.680 1.00 0.00 H new ATOM 0 HG23 THR A 60 -5.653 -1.066 10.343 1.00 0.00 H new ATOM 570 N GLU A 61 -6.484 -1.502 8.122 1.00 0.00 N ATOM 571 CA GLU A 61 -6.921 -2.835 7.731 1.00 0.00 C ATOM 572 C GLU A 61 -7.607 -2.802 6.368 1.00 0.00 C ATOM 573 O GLU A 61 -7.344 -3.639 5.504 1.00 0.00 O ATOM 574 CB GLU A 61 -7.869 -3.407 8.785 1.00 0.00 C ATOM 575 CG GLU A 61 -8.410 -4.784 8.443 1.00 0.00 C ATOM 576 CD GLU A 61 -9.362 -5.309 9.495 1.00 0.00 C ATOM 577 OE1 GLU A 61 -8.923 -6.094 10.359 1.00 0.00 O ATOM 578 OE2 GLU A 61 -10.553 -4.931 9.468 1.00 0.00 O ATOM 0 H GLU A 61 -7.080 -1.046 8.813 1.00 0.00 H new ATOM 0 HA GLU A 61 -6.043 -3.477 7.657 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -7.346 -3.460 9.740 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -8.706 -2.721 8.917 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -8.923 -4.741 7.482 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -7.579 -5.480 8.330 1.00 0.00 H new ATOM 585 N GLN A 62 -8.463 -1.809 6.178 1.00 0.00 N ATOM 586 CA GLN A 62 -9.314 -1.731 4.996 1.00 0.00 C ATOM 587 C GLN A 62 -8.503 -1.587 3.714 1.00 0.00 C ATOM 588 O GLN A 62 -8.868 -2.146 2.685 1.00 0.00 O ATOM 589 CB GLN A 62 -10.303 -0.566 5.123 1.00 0.00 C ATOM 590 CG GLN A 62 -11.502 -0.852 6.022 1.00 0.00 C ATOM 591 CD GLN A 62 -11.113 -1.260 7.430 1.00 0.00 C ATOM 592 OE1 GLN A 62 -10.935 -0.418 8.308 1.00 0.00 O ATOM 593 NE2 GLN A 62 -10.996 -2.558 7.659 1.00 0.00 N ATOM 0 H GLN A 62 -8.588 -1.038 6.834 1.00 0.00 H new ATOM 0 HA GLN A 62 -9.866 -2.669 4.935 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -9.773 0.304 5.511 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -10.664 -0.302 4.129 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -12.132 0.036 6.070 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -12.102 -1.644 5.574 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -11.152 -3.225 6.903 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -10.750 -2.891 8.591 1.00 0.00 H new ATOM 602 N GLY A 63 -7.408 -0.845 3.777 1.00 0.00 N ATOM 603 CA GLY A 63 -6.595 -0.637 2.591 1.00 0.00 C ATOM 604 C GLY A 63 -5.782 -1.861 2.222 1.00 0.00 C ATOM 605 O GLY A 63 -5.725 -2.256 1.060 1.00 0.00 O ATOM 0 H GLY A 63 -7.067 -0.385 4.621 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -7.240 -0.368 1.755 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -5.923 0.205 2.758 1.00 0.00 H new ATOM 609 N LEU A 64 -5.163 -2.461 3.225 1.00 0.00 N ATOM 610 CA LEU A 64 -4.292 -3.611 3.026 1.00 0.00 C ATOM 611 C LEU A 64 -5.075 -4.855 2.611 1.00 0.00 C ATOM 612 O LEU A 64 -4.674 -5.570 1.693 1.00 0.00 O ATOM 613 CB LEU A 64 -3.532 -3.882 4.321 1.00 0.00 C ATOM 614 CG LEU A 64 -2.011 -3.724 4.258 1.00 0.00 C ATOM 615 CD1 LEU A 64 -1.602 -2.486 3.470 1.00 0.00 C ATOM 616 CD2 LEU A 64 -1.465 -3.643 5.669 1.00 0.00 C ATOM 0 H LEU A 64 -5.249 -2.167 4.198 1.00 0.00 H new ATOM 0 HA LEU A 64 -3.598 -3.382 2.217 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -3.915 -3.210 5.090 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -3.758 -4.898 4.644 1.00 0.00 H new ATOM 0 HG LEU A 64 -1.597 -4.590 3.741 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -0.515 -2.411 3.449 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -1.980 -2.562 2.450 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -2.018 -1.598 3.946 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -0.381 -3.530 5.634 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -1.903 -2.785 6.180 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -1.718 -4.555 6.210 1.00 0.00 H new ATOM 628 N GLN A 65 -6.192 -5.109 3.282 1.00 0.00 N ATOM 629 CA GLN A 65 -6.978 -6.313 3.024 1.00 0.00 C ATOM 630 C GLN A 65 -7.696 -6.240 1.682 1.00 0.00 C ATOM 631 O GLN A 65 -7.966 -7.268 1.067 1.00 0.00 O ATOM 632 CB GLN A 65 -8.000 -6.546 4.139 1.00 0.00 C ATOM 633 CG GLN A 65 -7.383 -6.894 5.486 1.00 0.00 C ATOM 634 CD GLN A 65 -6.595 -8.190 5.460 1.00 0.00 C ATOM 635 OE1 GLN A 65 -7.145 -9.271 5.669 1.00 0.00 O ATOM 636 NE2 GLN A 65 -5.297 -8.091 5.225 1.00 0.00 N ATOM 0 H GLN A 65 -6.574 -4.501 4.006 1.00 0.00 H new ATOM 0 HA GLN A 65 -6.280 -7.149 2.996 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -8.609 -5.649 4.252 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -8.671 -7.352 3.840 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -6.726 -6.082 5.799 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -8.173 -6.971 6.233 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -4.878 -7.177 5.056 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -4.716 -8.929 5.213 1.00 0.00 H new ATOM 645 N ALA A 66 -7.971 -5.023 1.218 1.00 0.00 N ATOM 646 CA ALA A 66 -8.792 -4.808 0.025 1.00 0.00 C ATOM 647 C ALA A 66 -8.195 -5.454 -1.224 1.00 0.00 C ATOM 648 O ALA A 66 -8.908 -5.729 -2.189 1.00 0.00 O ATOM 649 CB ALA A 66 -8.997 -3.319 -0.206 1.00 0.00 C ATOM 0 H ALA A 66 -7.635 -4.164 1.653 1.00 0.00 H new ATOM 0 HA ALA A 66 -9.753 -5.290 0.207 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -9.609 -3.170 -1.096 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -9.499 -2.883 0.657 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -8.030 -2.836 -0.346 1.00 0.00 H new ATOM 655 N LEU A 67 -6.893 -5.706 -1.207 1.00 0.00 N ATOM 656 CA LEU A 67 -6.231 -6.291 -2.364 1.00 0.00 C ATOM 657 C LEU A 67 -6.386 -7.809 -2.373 1.00 0.00 C ATOM 658 O LEU A 67 -6.100 -8.450 -3.372 1.00 0.00 O ATOM 659 CB LEU A 67 -4.743 -5.949 -2.377 1.00 0.00 C ATOM 660 CG LEU A 67 -4.146 -5.575 -3.739 1.00 0.00 C ATOM 661 CD1 LEU A 67 -4.805 -4.329 -4.307 1.00 0.00 C ATOM 662 CD2 LEU A 67 -2.649 -5.364 -3.612 1.00 0.00 C ATOM 0 H LEU A 67 -6.280 -5.517 -0.414 1.00 0.00 H new ATOM 0 HA LEU A 67 -6.706 -5.872 -3.251 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -4.576 -5.119 -1.690 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -4.192 -6.803 -1.984 1.00 0.00 H new ATOM 0 HG LEU A 67 -4.335 -6.398 -4.428 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -4.360 -4.090 -5.273 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -5.873 -4.508 -4.434 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -4.656 -3.494 -3.622 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -2.235 -5.099 -4.585 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -2.454 -4.559 -2.903 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -2.181 -6.282 -3.257 1.00 0.00 H new ATOM 674 N VAL A 68 -6.827 -8.390 -1.266 1.00 0.00 N ATOM 675 CA VAL A 68 -6.950 -9.843 -1.192 1.00 0.00 C ATOM 676 C VAL A 68 -8.392 -10.272 -0.905 1.00 0.00 C ATOM 677 O VAL A 68 -8.823 -11.349 -1.327 1.00 0.00 O ATOM 678 CB VAL A 68 -5.975 -10.450 -0.145 1.00 0.00 C ATOM 679 CG1 VAL A 68 -6.296 -9.988 1.266 1.00 0.00 C ATOM 680 CG2 VAL A 68 -5.968 -11.970 -0.221 1.00 0.00 C ATOM 0 H VAL A 68 -7.102 -7.891 -0.420 1.00 0.00 H new ATOM 0 HA VAL A 68 -6.672 -10.235 -2.171 1.00 0.00 H new ATOM 0 HB VAL A 68 -4.977 -10.086 -0.391 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -5.590 -10.436 1.965 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -6.220 -8.902 1.319 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -7.309 -10.294 1.527 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -5.277 -12.368 0.522 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -6.971 -12.349 -0.024 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -5.651 -12.283 -1.216 1.00 0.00 H new ATOM 690 N SER A 69 -9.138 -9.430 -0.202 1.00 0.00 N ATOM 691 CA SER A 69 -10.535 -9.709 0.093 1.00 0.00 C ATOM 692 C SER A 69 -11.273 -8.409 0.391 1.00 0.00 C ATOM 693 O SER A 69 -10.650 -7.381 0.653 1.00 0.00 O ATOM 694 CB SER A 69 -10.643 -10.668 1.284 1.00 0.00 C ATOM 695 OG SER A 69 -11.983 -11.086 1.486 1.00 0.00 O ATOM 0 H SER A 69 -8.797 -8.546 0.175 1.00 0.00 H new ATOM 0 HA SER A 69 -10.993 -10.182 -0.776 1.00 0.00 H new ATOM 0 HB2 SER A 69 -10.010 -11.538 1.112 1.00 0.00 H new ATOM 0 HB3 SER A 69 -10.273 -10.177 2.184 1.00 0.00 H new ATOM 0 HG SER A 69 -12.023 -11.698 2.250 1.00 0.00 H new ATOM 701 N ALA A 70 -12.595 -8.450 0.333 1.00 0.00 N ATOM 702 CA ALA A 70 -13.400 -7.283 0.649 1.00 0.00 C ATOM 703 C ALA A 70 -13.415 -7.043 2.155 1.00 0.00 C ATOM 704 O ALA A 70 -13.802 -7.928 2.924 1.00 0.00 O ATOM 705 CB ALA A 70 -14.818 -7.460 0.131 1.00 0.00 C ATOM 0 H ALA A 70 -13.131 -9.277 0.071 1.00 0.00 H new ATOM 0 HA ALA A 70 -12.958 -6.415 0.160 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -15.408 -6.577 0.376 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -14.796 -7.593 -0.951 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -15.268 -8.337 0.596 1.00 0.00 H new ATOM 711 N PRO A 71 -12.979 -5.852 2.597 1.00 0.00 N ATOM 712 CA PRO A 71 -12.992 -5.482 4.015 1.00 0.00 C ATOM 713 C PRO A 71 -14.399 -5.508 4.600 1.00 0.00 C ATOM 714 O PRO A 71 -15.355 -5.033 3.979 1.00 0.00 O ATOM 715 CB PRO A 71 -12.440 -4.053 4.027 1.00 0.00 C ATOM 716 CG PRO A 71 -11.695 -3.915 2.747 1.00 0.00 C ATOM 717 CD PRO A 71 -12.414 -4.783 1.758 1.00 0.00 C ATOM 0 HA PRO A 71 -12.410 -6.178 4.619 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -13.244 -3.320 4.096 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -11.786 -3.890 4.884 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -11.677 -2.877 2.415 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -10.658 -4.231 2.862 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -13.192 -4.232 1.230 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -11.736 -5.180 1.003 1.00 0.00 H new ATOM 725 N SER A 72 -14.511 -6.061 5.797 1.00 0.00 N ATOM 726 CA SER A 72 -15.786 -6.177 6.480 1.00 0.00 C ATOM 727 C SER A 72 -16.148 -4.872 7.185 1.00 0.00 C ATOM 728 O SER A 72 -17.327 -4.548 7.339 1.00 0.00 O ATOM 729 CB SER A 72 -15.729 -7.323 7.489 1.00 0.00 C ATOM 730 OG SER A 72 -15.424 -8.551 6.843 1.00 0.00 O ATOM 0 H SER A 72 -13.722 -6.441 6.320 1.00 0.00 H new ATOM 0 HA SER A 72 -16.558 -6.387 5.739 1.00 0.00 H new ATOM 0 HB2 SER A 72 -14.975 -7.109 8.247 1.00 0.00 H new ATOM 0 HB3 SER A 72 -16.685 -7.407 8.005 1.00 0.00 H new ATOM 0 HG SER A 72 -15.391 -9.271 7.507 1.00 0.00 H new ATOM 736 N ALA A 73 -15.128 -4.131 7.602 1.00 0.00 N ATOM 737 CA ALA A 73 -15.329 -2.874 8.309 1.00 0.00 C ATOM 738 C ALA A 73 -16.004 -1.844 7.415 1.00 0.00 C ATOM 739 O ALA A 73 -15.549 -1.586 6.302 1.00 0.00 O ATOM 740 CB ALA A 73 -14.002 -2.334 8.819 1.00 0.00 C ATOM 0 H ALA A 73 -14.149 -4.382 7.461 1.00 0.00 H new ATOM 0 HA ALA A 73 -15.983 -3.068 9.159 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -14.170 -1.394 9.345 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.553 -3.056 9.501 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.331 -2.164 7.977 1.00 0.00 H new ATOM 746 N GLU A 74 -17.094 -1.271 7.910 1.00 0.00 N ATOM 747 CA GLU A 74 -17.826 -0.241 7.187 1.00 0.00 C ATOM 748 C GLU A 74 -16.982 1.029 7.074 1.00 0.00 C ATOM 749 O GLU A 74 -16.311 1.412 8.035 1.00 0.00 O ATOM 750 CB GLU A 74 -19.138 0.059 7.913 1.00 0.00 C ATOM 751 CG GLU A 74 -20.029 1.060 7.201 1.00 0.00 C ATOM 752 CD GLU A 74 -21.272 1.389 7.991 1.00 0.00 C ATOM 753 OE1 GLU A 74 -22.177 0.535 8.061 1.00 0.00 O ATOM 754 OE2 GLU A 74 -21.351 2.505 8.541 1.00 0.00 O ATOM 0 H GLU A 74 -17.493 -1.506 8.819 1.00 0.00 H new ATOM 0 HA GLU A 74 -18.047 -0.599 6.181 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -19.689 -0.872 8.043 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -18.910 0.437 8.910 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -19.467 1.975 7.016 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -20.315 0.660 6.228 1.00 0.00 H new ATOM 761 N PRO A 75 -16.995 1.703 5.910 1.00 0.00 N ATOM 762 CA PRO A 75 -17.766 1.281 4.731 1.00 0.00 C ATOM 763 C PRO A 75 -17.240 -0.013 4.114 1.00 0.00 C ATOM 764 O PRO A 75 -16.040 -0.170 3.881 1.00 0.00 O ATOM 765 CB PRO A 75 -17.604 2.448 3.747 1.00 0.00 C ATOM 766 CG PRO A 75 -17.073 3.582 4.558 1.00 0.00 C ATOM 767 CD PRO A 75 -16.275 2.955 5.660 1.00 0.00 C ATOM 0 HA PRO A 75 -18.803 1.068 4.990 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -16.919 2.188 2.940 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -18.557 2.708 3.286 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -16.452 4.240 3.951 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -17.884 4.190 4.959 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -15.243 2.775 5.360 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -16.243 3.588 6.547 1.00 0.00 H new ATOM 775 N HIS A 76 -18.155 -0.934 3.854 1.00 0.00 N ATOM 776 CA HIS A 76 -17.807 -2.232 3.302 1.00 0.00 C ATOM 777 C HIS A 76 -17.613 -2.114 1.794 1.00 0.00 C ATOM 778 O HIS A 76 -18.459 -1.553 1.097 1.00 0.00 O ATOM 779 CB HIS A 76 -18.920 -3.240 3.620 1.00 0.00 C ATOM 780 CG HIS A 76 -18.554 -4.676 3.376 1.00 0.00 C ATOM 781 ND1 HIS A 76 -18.565 -5.629 4.369 1.00 0.00 N ATOM 782 CD2 HIS A 76 -18.191 -5.325 2.244 1.00 0.00 C ATOM 783 CE1 HIS A 76 -18.222 -6.797 3.860 1.00 0.00 C ATOM 784 NE2 HIS A 76 -17.991 -6.643 2.571 1.00 0.00 N ATOM 0 H HIS A 76 -19.153 -0.803 4.019 1.00 0.00 H new ATOM 0 HA HIS A 76 -16.876 -2.581 3.749 1.00 0.00 H new ATOM 0 HB2 HIS A 76 -19.208 -3.125 4.665 1.00 0.00 H new ATOM 0 HB3 HIS A 76 -19.796 -2.995 3.019 1.00 0.00 H new ATOM 0 HD2 HIS A 76 -18.079 -4.886 1.264 1.00 0.00 H new ATOM 0 HE1 HIS A 76 -18.144 -7.724 4.408 1.00 0.00 H new ATOM 0 HE2 HIS A 76 -17.710 -7.380 1.925 1.00 0.00 H new ATOM 793 N ALA A 77 -16.494 -2.632 1.302 1.00 0.00 N ATOM 794 CA ALA A 77 -16.198 -2.591 -0.124 1.00 0.00 C ATOM 795 C ALA A 77 -17.194 -3.434 -0.911 1.00 0.00 C ATOM 796 O ALA A 77 -17.353 -4.627 -0.656 1.00 0.00 O ATOM 797 CB ALA A 77 -14.779 -3.072 -0.384 1.00 0.00 C ATOM 0 H ALA A 77 -15.777 -3.085 1.869 1.00 0.00 H new ATOM 0 HA ALA A 77 -16.286 -1.558 -0.459 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -14.573 -3.036 -1.454 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -14.074 -2.429 0.143 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -14.671 -4.097 -0.028 1.00 0.00 H new ATOM 803 N ARG A 78 -17.867 -2.803 -1.860 1.00 0.00 N ATOM 804 CA ARG A 78 -18.863 -3.480 -2.676 1.00 0.00 C ATOM 805 C ARG A 78 -18.371 -3.592 -4.113 1.00 0.00 C ATOM 806 O ARG A 78 -17.496 -2.834 -4.531 1.00 0.00 O ATOM 807 CB ARG A 78 -20.192 -2.721 -2.636 1.00 0.00 C ATOM 808 CG ARG A 78 -20.790 -2.602 -1.240 1.00 0.00 C ATOM 809 CD ARG A 78 -21.256 -3.951 -0.711 1.00 0.00 C ATOM 810 NE ARG A 78 -22.356 -4.498 -1.506 1.00 0.00 N ATOM 811 CZ ARG A 78 -22.885 -5.708 -1.322 1.00 0.00 C ATOM 812 NH1 ARG A 78 -22.413 -6.519 -0.382 1.00 0.00 N ATOM 813 NH2 ARG A 78 -23.891 -6.113 -2.083 1.00 0.00 N ATOM 0 H ARG A 78 -17.740 -1.816 -2.085 1.00 0.00 H new ATOM 0 HA ARG A 78 -19.020 -4.481 -2.274 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -20.041 -1.721 -3.043 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -20.907 -3.225 -3.286 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -20.048 -2.181 -0.561 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -21.631 -1.909 -1.262 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -20.421 -4.651 -0.716 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -21.575 -3.844 0.326 1.00 0.00 H new ATOM 0 HE ARG A 78 -22.743 -3.916 -2.249 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -21.638 -6.218 0.209 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -22.826 -7.442 -0.251 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -24.260 -5.499 -2.809 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -24.296 -7.039 -1.943 1.00 0.00 H new ATOM 827 N ASN A 79 -18.935 -4.543 -4.857 1.00 0.00 N ATOM 828 CA ASN A 79 -18.552 -4.790 -6.253 1.00 0.00 C ATOM 829 C ASN A 79 -17.082 -5.178 -6.345 1.00 0.00 C ATOM 830 O ASN A 79 -16.396 -4.882 -7.326 1.00 0.00 O ATOM 831 CB ASN A 79 -18.844 -3.571 -7.136 1.00 0.00 C ATOM 832 CG ASN A 79 -20.321 -3.236 -7.190 1.00 0.00 C ATOM 833 OD1 ASN A 79 -21.065 -3.790 -7.999 1.00 0.00 O ATOM 834 ND2 ASN A 79 -20.755 -2.322 -6.337 1.00 0.00 N ATOM 0 H ASN A 79 -19.668 -5.164 -4.514 1.00 0.00 H new ATOM 0 HA ASN A 79 -19.154 -5.620 -6.621 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -18.293 -2.711 -6.756 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -18.481 -3.762 -8.146 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -21.739 -2.053 -6.334 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -20.106 -1.886 -5.682 1.00 0.00 H new ATOM 841 N TYR A 80 -16.615 -5.847 -5.304 1.00 0.00 N ATOM 842 CA TYR A 80 -15.241 -6.312 -5.223 1.00 0.00 C ATOM 843 C TYR A 80 -15.017 -7.477 -6.179 1.00 0.00 C ATOM 844 O TYR A 80 -15.927 -8.272 -6.423 1.00 0.00 O ATOM 845 CB TYR A 80 -14.931 -6.746 -3.785 1.00 0.00 C ATOM 846 CG TYR A 80 -15.894 -7.786 -3.244 1.00 0.00 C ATOM 847 CD1 TYR A 80 -17.080 -7.405 -2.628 1.00 0.00 C ATOM 848 CD2 TYR A 80 -15.621 -9.145 -3.355 1.00 0.00 C ATOM 849 CE1 TYR A 80 -17.964 -8.345 -2.138 1.00 0.00 C ATOM 850 CE2 TYR A 80 -16.502 -10.091 -2.868 1.00 0.00 C ATOM 851 CZ TYR A 80 -17.670 -9.685 -2.262 1.00 0.00 C ATOM 852 OH TYR A 80 -18.551 -10.625 -1.776 1.00 0.00 O ATOM 0 H TYR A 80 -17.180 -6.084 -4.489 1.00 0.00 H new ATOM 0 HA TYR A 80 -14.574 -5.498 -5.507 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -13.918 -7.146 -3.745 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -14.954 -5.870 -3.137 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -17.314 -6.355 -2.531 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -14.706 -9.466 -3.830 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -18.881 -8.032 -1.660 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -16.276 -11.143 -2.962 1.00 0.00 H new ATOM 0 HH TYR A 80 -18.196 -11.523 -1.943 1.00 0.00 H new ATOM 862 N PRO A 81 -13.810 -7.584 -6.746 1.00 0.00 N ATOM 863 CA PRO A 81 -13.457 -8.709 -7.606 1.00 0.00 C ATOM 864 C PRO A 81 -13.284 -9.988 -6.799 1.00 0.00 C ATOM 865 O PRO A 81 -12.704 -9.973 -5.710 1.00 0.00 O ATOM 866 CB PRO A 81 -12.127 -8.278 -8.226 1.00 0.00 C ATOM 867 CG PRO A 81 -11.541 -7.317 -7.250 1.00 0.00 C ATOM 868 CD PRO A 81 -12.704 -6.619 -6.601 1.00 0.00 C ATOM 0 HA PRO A 81 -14.226 -8.929 -8.347 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -11.469 -9.133 -8.382 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -12.278 -7.810 -9.199 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -10.935 -7.837 -6.508 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -10.888 -6.602 -7.751 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -12.503 -6.393 -5.554 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -12.930 -5.673 -7.093 1.00 0.00 H new ATOM 876 N GLU A 82 -13.793 -11.089 -7.330 1.00 0.00 N ATOM 877 CA GLU A 82 -13.699 -12.375 -6.658 1.00 0.00 C ATOM 878 C GLU A 82 -12.249 -12.825 -6.572 1.00 0.00 C ATOM 879 O GLU A 82 -11.553 -12.908 -7.586 1.00 0.00 O ATOM 880 CB GLU A 82 -14.545 -13.418 -7.382 1.00 0.00 C ATOM 881 CG GLU A 82 -16.016 -13.049 -7.448 1.00 0.00 C ATOM 882 CD GLU A 82 -16.856 -14.131 -8.085 1.00 0.00 C ATOM 883 OE1 GLU A 82 -17.173 -14.015 -9.284 1.00 0.00 O ATOM 884 OE2 GLU A 82 -17.199 -15.111 -7.388 1.00 0.00 O ATOM 0 H GLU A 82 -14.277 -11.117 -8.227 1.00 0.00 H new ATOM 0 HA GLU A 82 -14.084 -12.265 -5.644 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -14.163 -13.548 -8.395 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -14.439 -14.378 -6.876 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -16.384 -12.854 -6.441 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -16.130 -12.124 -8.014 1.00 0.00 H new ATOM 891 N GLY A 83 -11.797 -13.104 -5.360 1.00 0.00 N ATOM 892 CA GLY A 83 -10.414 -13.476 -5.154 1.00 0.00 C ATOM 893 C GLY A 83 -9.541 -12.261 -4.923 1.00 0.00 C ATOM 894 O GLY A 83 -8.316 -12.370 -4.827 1.00 0.00 O ATOM 0 H GLY A 83 -12.365 -13.079 -4.513 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -10.340 -14.146 -4.298 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -10.051 -14.026 -6.022 1.00 0.00 H new ATOM 898 N GLY A 84 -10.177 -11.097 -4.844 1.00 0.00 N ATOM 899 CA GLY A 84 -9.459 -9.866 -4.606 1.00 0.00 C ATOM 900 C GLY A 84 -8.642 -9.434 -5.804 1.00 0.00 C ATOM 901 O GLY A 84 -8.992 -9.732 -6.947 1.00 0.00 O ATOM 0 H GLY A 84 -11.186 -10.988 -4.942 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -10.168 -9.079 -4.350 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -8.800 -9.993 -3.747 1.00 0.00 H new ATOM 905 N TYR A 85 -7.552 -8.737 -5.536 1.00 0.00 N ATOM 906 CA TYR A 85 -6.658 -8.254 -6.573 1.00 0.00 C ATOM 907 C TYR A 85 -5.433 -9.153 -6.661 1.00 0.00 C ATOM 908 O TYR A 85 -4.915 -9.426 -7.744 1.00 0.00 O ATOM 909 CB TYR A 85 -6.243 -6.814 -6.265 1.00 0.00 C ATOM 910 CG TYR A 85 -7.363 -5.814 -6.463 1.00 0.00 C ATOM 911 CD1 TYR A 85 -8.358 -5.649 -5.506 1.00 0.00 C ATOM 912 CD2 TYR A 85 -7.430 -5.046 -7.617 1.00 0.00 C ATOM 913 CE1 TYR A 85 -9.388 -4.749 -5.697 1.00 0.00 C ATOM 914 CE2 TYR A 85 -8.453 -4.141 -7.811 1.00 0.00 C ATOM 915 CZ TYR A 85 -9.431 -3.999 -6.851 1.00 0.00 C ATOM 916 OH TYR A 85 -10.459 -3.107 -7.049 1.00 0.00 O ATOM 0 H TYR A 85 -7.261 -8.489 -4.590 1.00 0.00 H new ATOM 0 HA TYR A 85 -7.173 -8.274 -7.533 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -5.892 -6.757 -5.235 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -5.403 -6.540 -6.904 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -8.325 -6.234 -4.599 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -6.669 -5.159 -8.375 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -10.155 -4.634 -4.946 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -8.487 -3.546 -8.712 1.00 0.00 H new ATOM 0 HH TYR A 85 -10.770 -2.769 -6.183 1.00 0.00 H new ATOM 926 N ILE A 86 -4.986 -9.606 -5.505 1.00 0.00 N ATOM 927 CA ILE A 86 -3.899 -10.557 -5.402 1.00 0.00 C ATOM 928 C ILE A 86 -4.323 -11.673 -4.447 1.00 0.00 C ATOM 929 O ILE A 86 -4.949 -11.415 -3.421 1.00 0.00 O ATOM 930 CB ILE A 86 -2.594 -9.870 -4.922 1.00 0.00 C ATOM 931 CG1 ILE A 86 -1.456 -10.888 -4.800 1.00 0.00 C ATOM 932 CG2 ILE A 86 -2.814 -9.141 -3.601 1.00 0.00 C ATOM 933 CD1 ILE A 86 -0.121 -10.272 -4.439 1.00 0.00 C ATOM 0 H ILE A 86 -5.371 -9.321 -4.605 1.00 0.00 H new ATOM 0 HA ILE A 86 -3.686 -10.978 -6.385 1.00 0.00 H new ATOM 0 HB ILE A 86 -2.309 -9.130 -5.670 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -1.721 -11.626 -4.043 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -1.356 -11.422 -5.745 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -1.883 -8.668 -3.287 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -3.583 -8.379 -3.730 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -3.133 -9.854 -2.841 1.00 0.00 H new ATOM 0 HD11 ILE A 86 0.634 -11.055 -4.371 1.00 0.00 H new ATOM 0 HD12 ILE A 86 0.168 -9.554 -5.207 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.203 -9.763 -3.479 1.00 0.00 H new ATOM 945 N ARG A 87 -4.014 -12.914 -4.814 1.00 0.00 N ATOM 946 CA ARG A 87 -4.522 -14.084 -4.096 1.00 0.00 C ATOM 947 C ARG A 87 -3.953 -14.185 -2.687 1.00 0.00 C ATOM 948 O ARG A 87 -4.532 -14.845 -1.823 1.00 0.00 O ATOM 949 CB ARG A 87 -4.222 -15.371 -4.866 1.00 0.00 C ATOM 950 CG ARG A 87 -4.824 -15.397 -6.260 1.00 0.00 C ATOM 951 CD ARG A 87 -4.816 -16.797 -6.852 1.00 0.00 C ATOM 952 NE ARG A 87 -3.470 -17.361 -6.949 1.00 0.00 N ATOM 953 CZ ARG A 87 -3.225 -18.650 -7.182 1.00 0.00 C ATOM 954 NH1 ARG A 87 -4.234 -19.499 -7.356 1.00 0.00 N ATOM 955 NH2 ARG A 87 -1.974 -19.086 -7.252 1.00 0.00 N ATOM 0 H ARG A 87 -3.412 -13.138 -5.607 1.00 0.00 H new ATOM 0 HA ARG A 87 -5.601 -13.956 -4.015 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -3.142 -15.496 -4.943 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -4.601 -16.221 -4.299 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -5.848 -15.025 -6.221 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -4.265 -14.724 -6.910 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -5.436 -17.450 -6.238 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -5.267 -16.770 -7.844 1.00 0.00 H new ATOM 0 HE ARG A 87 -2.675 -16.733 -6.832 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -5.196 -19.164 -7.311 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -4.046 -20.485 -7.534 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -1.199 -18.434 -7.127 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -1.787 -20.073 -7.430 1.00 0.00 H new ATOM 969 N ARG A 88 -2.818 -13.547 -2.460 1.00 0.00 N ATOM 970 CA ARG A 88 -2.166 -13.587 -1.161 1.00 0.00 C ATOM 971 C ARG A 88 -1.810 -12.177 -0.716 1.00 0.00 C ATOM 972 O ARG A 88 -1.654 -11.288 -1.548 1.00 0.00 O ATOM 973 CB ARG A 88 -0.889 -14.430 -1.231 1.00 0.00 C ATOM 974 CG ARG A 88 -1.109 -15.851 -1.721 1.00 0.00 C ATOM 975 CD ARG A 88 0.178 -16.661 -1.676 1.00 0.00 C ATOM 976 NE ARG A 88 1.218 -16.115 -2.550 1.00 0.00 N ATOM 977 CZ ARG A 88 2.485 -15.921 -2.172 1.00 0.00 C ATOM 978 NH1 ARG A 88 2.858 -16.155 -0.920 1.00 0.00 N ATOM 979 NH2 ARG A 88 3.377 -15.483 -3.045 1.00 0.00 N ATOM 0 H ARG A 88 -2.326 -12.993 -3.161 1.00 0.00 H new ATOM 0 HA ARG A 88 -2.853 -14.036 -0.444 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -0.176 -13.936 -1.891 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -0.435 -14.465 -0.241 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -1.867 -16.336 -1.106 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -1.492 -15.830 -2.741 1.00 0.00 H new ATOM 0 HD2 ARG A 88 0.549 -16.691 -0.651 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -0.034 -17.689 -1.968 1.00 0.00 H new ATOM 0 HE ARG A 88 0.960 -15.868 -3.505 1.00 0.00 H new ATOM 0 HH11 ARG A 88 2.176 -16.486 -0.238 1.00 0.00 H new ATOM 0 HH12 ARG A 88 3.827 -16.004 -0.640 1.00 0.00 H new ATOM 0 HH21 ARG A 88 3.098 -15.293 -4.008 1.00 0.00 H new ATOM 0 HH22 ARG A 88 4.344 -15.335 -2.756 1.00 0.00 H new ATOM 993 N LEU A 89 -1.697 -11.978 0.594 1.00 0.00 N ATOM 994 CA LEU A 89 -1.192 -10.722 1.137 1.00 0.00 C ATOM 995 C LEU A 89 0.166 -10.408 0.525 1.00 0.00 C ATOM 996 O LEU A 89 1.074 -11.241 0.565 1.00 0.00 O ATOM 997 CB LEU A 89 -1.045 -10.810 2.661 1.00 0.00 C ATOM 998 CG LEU A 89 -2.284 -10.467 3.493 1.00 0.00 C ATOM 999 CD1 LEU A 89 -2.603 -8.988 3.366 1.00 0.00 C ATOM 1000 CD2 LEU A 89 -3.475 -11.318 3.080 1.00 0.00 C ATOM 0 H LEU A 89 -1.949 -12.671 1.299 1.00 0.00 H new ATOM 0 HA LEU A 89 -1.903 -9.933 0.894 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -0.735 -11.824 2.915 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -0.237 -10.144 2.964 1.00 0.00 H new ATOM 0 HG LEU A 89 -2.070 -10.689 4.538 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -3.486 -8.754 3.961 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -1.757 -8.401 3.725 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -2.795 -8.746 2.321 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -4.340 -11.052 3.688 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -3.702 -11.141 2.029 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -3.238 -12.372 3.227 1.00 0.00 H new ATOM 1012 N PRO A 90 0.317 -9.211 -0.062 1.00 0.00 N ATOM 1013 CA PRO A 90 1.551 -8.815 -0.740 1.00 0.00 C ATOM 1014 C PRO A 90 2.759 -8.871 0.187 1.00 0.00 C ATOM 1015 O PRO A 90 2.684 -8.463 1.349 1.00 0.00 O ATOM 1016 CB PRO A 90 1.282 -7.374 -1.196 1.00 0.00 C ATOM 1017 CG PRO A 90 0.110 -6.918 -0.394 1.00 0.00 C ATOM 1018 CD PRO A 90 -0.698 -8.148 -0.101 1.00 0.00 C ATOM 0 HA PRO A 90 1.792 -9.486 -1.564 1.00 0.00 H new ATOM 0 HB2 PRO A 90 2.150 -6.738 -1.021 1.00 0.00 H new ATOM 0 HB3 PRO A 90 1.067 -7.333 -2.264 1.00 0.00 H new ATOM 0 HG2 PRO A 90 0.433 -6.435 0.528 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -0.480 -6.187 -0.947 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -1.231 -8.064 0.846 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -1.446 -8.333 -0.872 1.00 0.00 H new ATOM 1026 N GLN A 91 3.862 -9.395 -0.326 1.00 0.00 N ATOM 1027 CA GLN A 91 5.080 -9.528 0.452 1.00 0.00 C ATOM 1028 C GLN A 91 6.300 -9.159 -0.367 1.00 0.00 C ATOM 1029 O GLN A 91 6.423 -9.531 -1.537 1.00 0.00 O ATOM 1030 CB GLN A 91 5.247 -10.954 0.975 1.00 0.00 C ATOM 1031 CG GLN A 91 4.371 -11.277 2.168 1.00 0.00 C ATOM 1032 CD GLN A 91 4.659 -12.644 2.748 1.00 0.00 C ATOM 1033 OE1 GLN A 91 5.782 -13.145 2.677 1.00 0.00 O ATOM 1034 NE2 GLN A 91 3.649 -13.254 3.341 1.00 0.00 N ATOM 0 H GLN A 91 3.936 -9.736 -1.284 1.00 0.00 H new ATOM 0 HA GLN A 91 4.994 -8.842 1.295 1.00 0.00 H new ATOM 0 HB2 GLN A 91 5.021 -11.654 0.171 1.00 0.00 H new ATOM 0 HB3 GLN A 91 6.290 -11.110 1.250 1.00 0.00 H new ATOM 0 HG2 GLN A 91 4.520 -10.521 2.939 1.00 0.00 H new ATOM 0 HG3 GLN A 91 3.324 -11.226 1.870 1.00 0.00 H new ATOM 0 HE21 GLN A 91 2.734 -12.806 3.379 1.00 0.00 H new ATOM 0 HE22 GLN A 91 3.784 -14.174 3.761 1.00 0.00 H new ATOM 1043 N ASP A 92 7.199 -8.434 0.276 1.00 0.00 N ATOM 1044 CA ASP A 92 8.493 -8.093 -0.293 1.00 0.00 C ATOM 1045 C ASP A 92 9.299 -9.356 -0.541 1.00 0.00 C ATOM 1046 O ASP A 92 9.089 -10.371 0.127 1.00 0.00 O ATOM 1047 CB ASP A 92 9.265 -7.192 0.668 1.00 0.00 C ATOM 1048 CG ASP A 92 8.497 -5.950 1.038 1.00 0.00 C ATOM 1049 OD1 ASP A 92 7.815 -5.966 2.081 1.00 0.00 O ATOM 1050 OD2 ASP A 92 8.573 -4.956 0.297 1.00 0.00 O ATOM 0 H ASP A 92 7.051 -8.062 1.214 1.00 0.00 H new ATOM 0 HA ASP A 92 8.332 -7.570 -1.236 1.00 0.00 H new ATOM 0 HB2 ASP A 92 9.503 -7.751 1.573 1.00 0.00 H new ATOM 0 HB3 ASP A 92 10.213 -6.907 0.211 1.00 0.00 H new ATOM 1055 N PRO A 93 10.230 -9.313 -1.507 1.00 0.00 N ATOM 1056 CA PRO A 93 11.110 -10.445 -1.827 1.00 0.00 C ATOM 1057 C PRO A 93 11.918 -10.925 -0.619 1.00 0.00 C ATOM 1058 O PRO A 93 12.449 -12.033 -0.617 1.00 0.00 O ATOM 1059 CB PRO A 93 12.050 -9.888 -2.907 1.00 0.00 C ATOM 1060 CG PRO A 93 11.905 -8.407 -2.834 1.00 0.00 C ATOM 1061 CD PRO A 93 10.499 -8.157 -2.378 1.00 0.00 C ATOM 0 HA PRO A 93 10.537 -11.314 -2.149 1.00 0.00 H new ATOM 0 HB2 PRO A 93 13.081 -10.191 -2.724 1.00 0.00 H new ATOM 0 HB3 PRO A 93 11.778 -10.261 -3.894 1.00 0.00 H new ATOM 0 HG2 PRO A 93 12.624 -7.977 -2.137 1.00 0.00 H new ATOM 0 HG3 PRO A 93 12.089 -7.948 -3.805 1.00 0.00 H new ATOM 0 HD2 PRO A 93 10.410 -7.214 -1.838 1.00 0.00 H new ATOM 0 HD3 PRO A 93 9.804 -8.111 -3.216 1.00 0.00 H new ATOM 1069 N TRP A 94 12.033 -10.071 0.394 1.00 0.00 N ATOM 1070 CA TRP A 94 12.724 -10.434 1.626 1.00 0.00 C ATOM 1071 C TRP A 94 11.805 -11.228 2.551 1.00 0.00 C ATOM 1072 O TRP A 94 12.253 -11.819 3.533 1.00 0.00 O ATOM 1073 CB TRP A 94 13.238 -9.181 2.337 1.00 0.00 C ATOM 1074 CG TRP A 94 14.035 -8.284 1.441 1.00 0.00 C ATOM 1075 CD1 TRP A 94 15.275 -8.528 0.920 1.00 0.00 C ATOM 1076 CD2 TRP A 94 13.645 -6.996 0.961 1.00 0.00 C ATOM 1077 NE1 TRP A 94 15.671 -7.471 0.137 1.00 0.00 N ATOM 1078 CE2 TRP A 94 14.689 -6.516 0.151 1.00 0.00 C ATOM 1079 CE3 TRP A 94 12.510 -6.199 1.139 1.00 0.00 C ATOM 1080 CZ2 TRP A 94 14.630 -5.279 -0.482 1.00 0.00 C ATOM 1081 CZ3 TRP A 94 12.455 -4.971 0.512 1.00 0.00 C ATOM 1082 CH2 TRP A 94 13.509 -4.522 -0.290 1.00 0.00 C ATOM 0 H TRP A 94 11.656 -9.123 0.385 1.00 0.00 H new ATOM 0 HA TRP A 94 13.575 -11.064 1.366 1.00 0.00 H new ATOM 0 HB2 TRP A 94 12.391 -8.625 2.738 1.00 0.00 H new ATOM 0 HB3 TRP A 94 13.854 -9.479 3.185 1.00 0.00 H new ATOM 0 HD1 TRP A 94 15.857 -9.420 1.098 1.00 0.00 H new ATOM 0 HE1 TRP A 94 16.553 -7.408 -0.372 1.00 0.00 H new ATOM 0 HE3 TRP A 94 11.691 -6.538 1.756 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 15.441 -4.929 -1.103 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 11.584 -4.346 0.643 1.00 0.00 H new ATOM 0 HH2 TRP A 94 13.435 -3.556 -0.768 1.00 0.00 H new ATOM 1093 N GLY A 95 10.518 -11.229 2.235 1.00 0.00 N ATOM 1094 CA GLY A 95 9.547 -11.946 3.039 1.00 0.00 C ATOM 1095 C GLY A 95 8.863 -11.047 4.046 1.00 0.00 C ATOM 1096 O GLY A 95 8.475 -11.492 5.125 1.00 0.00 O ATOM 0 H GLY A 95 10.126 -10.742 1.429 1.00 0.00 H new ATOM 0 HA2 GLY A 95 8.798 -12.394 2.387 1.00 0.00 H new ATOM 0 HA3 GLY A 95 10.044 -12.763 3.562 1.00 0.00 H new ATOM 1100 N SER A 96 8.716 -9.780 3.697 1.00 0.00 N ATOM 1101 CA SER A 96 8.136 -8.806 4.605 1.00 0.00 C ATOM 1102 C SER A 96 6.693 -8.485 4.216 1.00 0.00 C ATOM 1103 O SER A 96 6.323 -8.554 3.045 1.00 0.00 O ATOM 1104 CB SER A 96 8.988 -7.537 4.608 1.00 0.00 C ATOM 1105 OG SER A 96 10.347 -7.846 4.887 1.00 0.00 O ATOM 0 H SER A 96 8.991 -9.402 2.790 1.00 0.00 H new ATOM 0 HA SER A 96 8.121 -9.229 5.609 1.00 0.00 H new ATOM 0 HB2 SER A 96 8.914 -7.041 3.640 1.00 0.00 H new ATOM 0 HB3 SER A 96 8.608 -6.839 5.354 1.00 0.00 H new ATOM 0 HG SER A 96 10.809 -7.039 5.195 1.00 0.00 H new ATOM 1111 N ASP A 97 5.888 -8.158 5.218 1.00 0.00 N ATOM 1112 CA ASP A 97 4.484 -7.809 5.020 1.00 0.00 C ATOM 1113 C ASP A 97 4.320 -6.291 5.036 1.00 0.00 C ATOM 1114 O ASP A 97 5.011 -5.602 5.783 1.00 0.00 O ATOM 1115 CB ASP A 97 3.635 -8.467 6.121 1.00 0.00 C ATOM 1116 CG ASP A 97 2.209 -7.966 6.168 1.00 0.00 C ATOM 1117 OD1 ASP A 97 1.405 -8.364 5.299 1.00 0.00 O ATOM 1118 OD2 ASP A 97 1.875 -7.201 7.096 1.00 0.00 O ATOM 0 H ASP A 97 6.188 -8.127 6.192 1.00 0.00 H new ATOM 0 HA ASP A 97 4.145 -8.177 4.052 1.00 0.00 H new ATOM 0 HB2 ASP A 97 3.627 -9.546 5.966 1.00 0.00 H new ATOM 0 HB3 ASP A 97 4.106 -8.287 7.087 1.00 0.00 H new ATOM 1123 N TYR A 98 3.418 -5.782 4.200 1.00 0.00 N ATOM 1124 CA TYR A 98 3.234 -4.338 4.038 1.00 0.00 C ATOM 1125 C TYR A 98 2.320 -3.752 5.104 1.00 0.00 C ATOM 1126 O TYR A 98 1.409 -4.422 5.585 1.00 0.00 O ATOM 1127 CB TYR A 98 2.660 -4.037 2.653 1.00 0.00 C ATOM 1128 CG TYR A 98 3.653 -4.266 1.540 1.00 0.00 C ATOM 1129 CD1 TYR A 98 3.692 -5.476 0.859 1.00 0.00 C ATOM 1130 CD2 TYR A 98 4.566 -3.283 1.182 1.00 0.00 C ATOM 1131 CE1 TYR A 98 4.613 -5.701 -0.144 1.00 0.00 C ATOM 1132 CE2 TYR A 98 5.485 -3.498 0.175 1.00 0.00 C ATOM 1133 CZ TYR A 98 5.504 -4.708 -0.484 1.00 0.00 C ATOM 1134 OH TYR A 98 6.433 -4.935 -1.469 1.00 0.00 O ATOM 0 H TYR A 98 2.799 -6.350 3.621 1.00 0.00 H new ATOM 0 HA TYR A 98 4.214 -3.873 4.147 1.00 0.00 H new ATOM 0 HB2 TYR A 98 1.784 -4.663 2.485 1.00 0.00 H new ATOM 0 HB3 TYR A 98 2.322 -3.001 2.623 1.00 0.00 H new ATOM 0 HD1 TYR A 98 2.990 -6.254 1.119 1.00 0.00 H new ATOM 0 HD2 TYR A 98 4.557 -2.335 1.700 1.00 0.00 H new ATOM 0 HE1 TYR A 98 4.635 -6.650 -0.659 1.00 0.00 H new ATOM 0 HE2 TYR A 98 6.186 -2.722 -0.095 1.00 0.00 H new ATOM 0 HH TYR A 98 7.306 -5.112 -1.061 1.00 0.00 H new ATOM 1144 N GLN A 99 2.574 -2.498 5.467 1.00 0.00 N ATOM 1145 CA GLN A 99 1.750 -1.793 6.443 1.00 0.00 C ATOM 1146 C GLN A 99 1.095 -0.570 5.819 1.00 0.00 C ATOM 1147 O GLN A 99 1.610 0.011 4.862 1.00 0.00 O ATOM 1148 CB GLN A 99 2.574 -1.335 7.658 1.00 0.00 C ATOM 1149 CG GLN A 99 3.081 -2.455 8.551 1.00 0.00 C ATOM 1150 CD GLN A 99 4.140 -3.294 7.889 1.00 0.00 C ATOM 1151 OE1 GLN A 99 4.919 -2.803 7.074 1.00 0.00 O ATOM 1152 NE2 GLN A 99 4.163 -4.570 8.221 1.00 0.00 N ATOM 0 H GLN A 99 3.349 -1.947 5.097 1.00 0.00 H new ATOM 0 HA GLN A 99 0.987 -2.498 6.772 1.00 0.00 H new ATOM 0 HB2 GLN A 99 3.429 -0.760 7.302 1.00 0.00 H new ATOM 0 HB3 GLN A 99 1.963 -0.660 8.258 1.00 0.00 H new ATOM 0 HG2 GLN A 99 3.484 -2.027 9.469 1.00 0.00 H new ATOM 0 HG3 GLN A 99 2.244 -3.093 8.837 1.00 0.00 H new ATOM 0 HE21 GLN A 99 3.496 -4.932 8.903 1.00 0.00 H new ATOM 0 HE22 GLN A 99 4.848 -5.195 7.796 1.00 0.00 H new ATOM 1161 N LEU A 100 -0.046 -0.193 6.373 1.00 0.00 N ATOM 1162 CA LEU A 100 -0.708 1.053 6.026 1.00 0.00 C ATOM 1163 C LEU A 100 -1.095 1.779 7.298 1.00 0.00 C ATOM 1164 O LEU A 100 -1.519 1.147 8.265 1.00 0.00 O ATOM 1165 CB LEU A 100 -1.971 0.808 5.200 1.00 0.00 C ATOM 1166 CG LEU A 100 -2.890 2.029 5.087 1.00 0.00 C ATOM 1167 CD1 LEU A 100 -2.353 3.032 4.084 1.00 0.00 C ATOM 1168 CD2 LEU A 100 -4.299 1.614 4.726 1.00 0.00 C ATOM 0 H LEU A 100 -0.539 -0.743 7.076 1.00 0.00 H new ATOM 0 HA LEU A 100 -0.016 1.649 5.431 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -1.681 0.490 4.198 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -2.530 -0.014 5.646 1.00 0.00 H new ATOM 0 HG LEU A 100 -2.916 2.513 6.063 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -3.027 3.886 4.027 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -1.366 3.369 4.400 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -2.279 2.562 3.103 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -4.931 2.499 4.652 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -4.291 1.093 3.769 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -4.692 0.951 5.497 1.00 0.00 H new ATOM 1180 N LEU A 101 -0.940 3.088 7.315 1.00 0.00 N ATOM 1181 CA LEU A 101 -1.373 3.858 8.461 1.00 0.00 C ATOM 1182 C LEU A 101 -2.124 5.111 8.020 1.00 0.00 C ATOM 1183 O LEU A 101 -1.576 5.962 7.321 1.00 0.00 O ATOM 1184 CB LEU A 101 -0.161 4.209 9.342 1.00 0.00 C ATOM 1185 CG LEU A 101 -0.470 4.707 10.763 1.00 0.00 C ATOM 1186 CD1 LEU A 101 -0.940 6.151 10.751 1.00 0.00 C ATOM 1187 CD2 LEU A 101 -1.514 3.818 11.423 1.00 0.00 C ATOM 0 H LEU A 101 -0.524 3.633 6.560 1.00 0.00 H new ATOM 0 HA LEU A 101 -2.064 3.257 9.052 1.00 0.00 H new ATOM 0 HB2 LEU A 101 0.472 3.325 9.420 1.00 0.00 H new ATOM 0 HB3 LEU A 101 0.422 4.975 8.831 1.00 0.00 H new ATOM 0 HG LEU A 101 0.452 4.657 11.342 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -1.150 6.474 11.771 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -0.162 6.783 10.324 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -1.846 6.234 10.150 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -1.721 4.185 12.428 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -2.431 3.835 10.834 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -1.139 2.796 11.480 1.00 0.00 H new ATOM 1199 N SER A 102 -3.401 5.173 8.371 1.00 0.00 N ATOM 1200 CA SER A 102 -4.193 6.384 8.216 1.00 0.00 C ATOM 1201 C SER A 102 -4.432 7.013 9.595 1.00 0.00 C ATOM 1202 O SER A 102 -4.804 6.302 10.532 1.00 0.00 O ATOM 1203 CB SER A 102 -5.525 6.054 7.533 1.00 0.00 C ATOM 1204 OG SER A 102 -6.201 7.231 7.121 1.00 0.00 O ATOM 0 H SER A 102 -3.915 4.388 8.770 1.00 0.00 H new ATOM 0 HA SER A 102 -3.656 7.097 7.590 1.00 0.00 H new ATOM 0 HB2 SER A 102 -5.344 5.415 6.669 1.00 0.00 H new ATOM 0 HB3 SER A 102 -6.158 5.490 8.219 1.00 0.00 H new ATOM 0 HG SER A 102 -5.592 7.791 6.596 1.00 0.00 H new ATOM 1210 N PRO A 103 -4.223 8.336 9.761 1.00 0.00 N ATOM 1211 CA PRO A 103 -3.749 9.236 8.704 1.00 0.00 C ATOM 1212 C PRO A 103 -2.275 9.018 8.391 1.00 0.00 C ATOM 1213 O PRO A 103 -1.454 8.827 9.288 1.00 0.00 O ATOM 1214 CB PRO A 103 -3.967 10.644 9.284 1.00 0.00 C ATOM 1215 CG PRO A 103 -4.761 10.449 10.533 1.00 0.00 C ATOM 1216 CD PRO A 103 -4.439 9.065 11.014 1.00 0.00 C ATOM 0 HA PRO A 103 -4.278 9.069 7.766 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -3.015 11.131 9.497 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -4.499 11.280 8.577 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -4.498 11.194 11.283 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -5.828 10.556 10.338 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -3.553 9.052 11.649 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -5.255 8.638 11.597 1.00 0.00 H new ATOM 1224 N GLY A 104 -1.953 9.067 7.113 1.00 0.00 N ATOM 1225 CA GLY A 104 -0.624 8.714 6.663 1.00 0.00 C ATOM 1226 C GLY A 104 0.444 9.698 7.087 1.00 0.00 C ATOM 1227 O GLY A 104 0.178 10.886 7.262 1.00 0.00 O ATOM 0 H GLY A 104 -2.593 9.348 6.370 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -0.370 7.727 7.049 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -0.626 8.640 5.576 1.00 0.00 H new ATOM 1231 N GLN A 105 1.657 9.193 7.253 1.00 0.00 N ATOM 1232 CA GLN A 105 2.807 10.031 7.566 1.00 0.00 C ATOM 1233 C GLN A 105 3.101 10.981 6.407 1.00 0.00 C ATOM 1234 O GLN A 105 3.666 12.057 6.595 1.00 0.00 O ATOM 1235 CB GLN A 105 4.032 9.153 7.845 1.00 0.00 C ATOM 1236 CG GLN A 105 5.239 9.916 8.371 1.00 0.00 C ATOM 1237 CD GLN A 105 6.483 9.054 8.454 1.00 0.00 C ATOM 1238 OE1 GLN A 105 6.403 7.838 8.628 1.00 0.00 O ATOM 1239 NE2 GLN A 105 7.645 9.679 8.339 1.00 0.00 N ATOM 0 H GLN A 105 1.872 8.199 7.176 1.00 0.00 H new ATOM 0 HA GLN A 105 2.580 10.621 8.454 1.00 0.00 H new ATOM 0 HB2 GLN A 105 3.758 8.385 8.569 1.00 0.00 H new ATOM 0 HB3 GLN A 105 4.313 8.639 6.926 1.00 0.00 H new ATOM 0 HG2 GLN A 105 5.436 10.769 7.722 1.00 0.00 H new ATOM 0 HG3 GLN A 105 5.010 10.313 9.360 1.00 0.00 H new ATOM 0 HE21 GLN A 105 7.669 10.689 8.195 1.00 0.00 H new ATOM 0 HE22 GLN A 105 8.516 9.151 8.394 1.00 0.00 H new ATOM 1248 N HIS A 106 2.715 10.571 5.204 1.00 0.00 N ATOM 1249 CA HIS A 106 2.971 11.362 4.005 1.00 0.00 C ATOM 1250 C HIS A 106 1.695 11.497 3.179 1.00 0.00 C ATOM 1251 O HIS A 106 1.709 11.325 1.959 1.00 0.00 O ATOM 1252 CB HIS A 106 4.068 10.711 3.155 1.00 0.00 C ATOM 1253 CG HIS A 106 5.253 10.233 3.940 1.00 0.00 C ATOM 1254 ND1 HIS A 106 5.440 8.912 4.279 1.00 0.00 N ATOM 1255 CD2 HIS A 106 6.321 10.901 4.433 1.00 0.00 C ATOM 1256 CE1 HIS A 106 6.570 8.786 4.946 1.00 0.00 C ATOM 1257 NE2 HIS A 106 7.126 9.979 5.053 1.00 0.00 N ATOM 0 H HIS A 106 2.223 9.694 5.033 1.00 0.00 H new ATOM 0 HA HIS A 106 3.305 12.353 4.314 1.00 0.00 H new ATOM 0 HB2 HIS A 106 3.640 9.867 2.615 1.00 0.00 H new ATOM 0 HB3 HIS A 106 4.407 11.429 2.408 1.00 0.00 H new ATOM 0 HD1 HIS A 106 4.803 8.149 4.050 1.00 0.00 H new ATOM 0 HD2 HIS A 106 6.506 11.962 4.353 1.00 0.00 H new ATOM 0 HE1 HIS A 106 6.973 7.864 5.338 1.00 0.00 H new ATOM 1266 N GLY A 107 0.594 11.789 3.857 1.00 0.00 N ATOM 1267 CA GLY A 107 -0.690 11.918 3.193 1.00 0.00 C ATOM 1268 C GLY A 107 -1.818 11.460 4.092 1.00 0.00 C ATOM 1269 O GLY A 107 -1.624 11.325 5.293 1.00 0.00 O ATOM 0 H GLY A 107 0.567 11.940 4.865 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -0.850 12.957 2.904 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -0.689 11.328 2.276 1.00 0.00 H new ATOM 1273 N GLN A 108 -3.000 11.244 3.537 1.00 0.00 N ATOM 1274 CA GLN A 108 -4.104 10.711 4.327 1.00 0.00 C ATOM 1275 C GLN A 108 -3.912 9.223 4.580 1.00 0.00 C ATOM 1276 O GLN A 108 -4.351 8.690 5.599 1.00 0.00 O ATOM 1277 CB GLN A 108 -5.449 10.980 3.657 1.00 0.00 C ATOM 1278 CG GLN A 108 -5.787 12.459 3.579 1.00 0.00 C ATOM 1279 CD GLN A 108 -5.639 13.176 4.916 1.00 0.00 C ATOM 1280 OE1 GLN A 108 -5.315 14.362 4.960 1.00 0.00 O ATOM 1281 NE2 GLN A 108 -5.863 12.462 6.013 1.00 0.00 N ATOM 0 H GLN A 108 -3.220 11.425 2.558 1.00 0.00 H new ATOM 0 HA GLN A 108 -4.106 11.226 5.288 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -5.438 10.562 2.650 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -6.234 10.462 4.208 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -5.139 12.936 2.844 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -6.811 12.574 3.223 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -6.130 11.481 5.937 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -5.768 12.895 6.932 1.00 0.00 H new ATOM 1290 N VAL A 109 -3.247 8.565 3.647 1.00 0.00 N ATOM 1291 CA VAL A 109 -2.913 7.155 3.777 1.00 0.00 C ATOM 1292 C VAL A 109 -1.461 6.922 3.384 1.00 0.00 C ATOM 1293 O VAL A 109 -1.022 7.347 2.315 1.00 0.00 O ATOM 1294 CB VAL A 109 -3.831 6.263 2.914 1.00 0.00 C ATOM 1295 CG1 VAL A 109 -5.154 6.024 3.616 1.00 0.00 C ATOM 1296 CG2 VAL A 109 -4.059 6.886 1.545 1.00 0.00 C ATOM 0 H VAL A 109 -2.923 8.991 2.779 1.00 0.00 H new ATOM 0 HA VAL A 109 -3.062 6.881 4.821 1.00 0.00 H new ATOM 0 HB VAL A 109 -3.336 5.302 2.773 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -5.788 5.393 2.993 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -4.975 5.528 4.570 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -5.651 6.978 3.790 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -4.709 6.240 0.955 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -4.529 7.862 1.663 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -3.103 7.003 1.035 1.00 0.00 H new ATOM 1306 N ASP A 110 -0.711 6.275 4.261 1.00 0.00 N ATOM 1307 CA ASP A 110 0.698 6.024 4.005 1.00 0.00 C ATOM 1308 C ASP A 110 0.976 4.531 3.985 1.00 0.00 C ATOM 1309 O ASP A 110 0.751 3.835 4.976 1.00 0.00 O ATOM 1310 CB ASP A 110 1.565 6.707 5.065 1.00 0.00 C ATOM 1311 CG ASP A 110 3.025 6.775 4.667 1.00 0.00 C ATOM 1312 OD1 ASP A 110 3.871 6.193 5.366 1.00 0.00 O ATOM 1313 OD2 ASP A 110 3.331 7.437 3.653 1.00 0.00 O ATOM 0 H ASP A 110 -1.052 5.915 5.153 1.00 0.00 H new ATOM 0 HA ASP A 110 0.948 6.439 3.029 1.00 0.00 H new ATOM 0 HB2 ASP A 110 1.192 7.716 5.239 1.00 0.00 H new ATOM 0 HB3 ASP A 110 1.474 6.167 6.007 1.00 0.00 H new ATOM 1318 N ILE A 111 1.434 4.046 2.841 1.00 0.00 N ATOM 1319 CA ILE A 111 1.782 2.643 2.681 1.00 0.00 C ATOM 1320 C ILE A 111 3.293 2.482 2.633 1.00 0.00 C ATOM 1321 O ILE A 111 3.985 3.218 1.919 1.00 0.00 O ATOM 1322 CB ILE A 111 1.167 2.039 1.397 1.00 0.00 C ATOM 1323 CG1 ILE A 111 1.431 2.954 0.196 1.00 0.00 C ATOM 1324 CG2 ILE A 111 -0.323 1.800 1.577 1.00 0.00 C ATOM 1325 CD1 ILE A 111 0.908 2.411 -1.114 1.00 0.00 C ATOM 0 H ILE A 111 1.574 4.610 2.003 1.00 0.00 H new ATOM 0 HA ILE A 111 1.375 2.109 3.539 1.00 0.00 H new ATOM 0 HB ILE A 111 1.643 1.077 1.206 1.00 0.00 H new ATOM 0 HG12 ILE A 111 0.973 3.925 0.384 1.00 0.00 H new ATOM 0 HG13 ILE A 111 2.505 3.119 0.107 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -0.736 1.375 0.662 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -0.483 1.108 2.404 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -0.820 2.746 1.794 1.00 0.00 H new ATOM 0 HD11 ILE A 111 1.133 3.115 -1.915 1.00 0.00 H new ATOM 0 HD12 ILE A 111 1.384 1.454 -1.327 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -0.171 2.272 -1.046 1.00 0.00 H new ATOM 1337 N PHE A 112 3.805 1.538 3.403 1.00 0.00 N ATOM 1338 CA PHE A 112 5.239 1.334 3.499 1.00 0.00 C ATOM 1339 C PHE A 112 5.575 -0.120 3.800 1.00 0.00 C ATOM 1340 O PHE A 112 4.725 -0.891 4.253 1.00 0.00 O ATOM 1341 CB PHE A 112 5.833 2.246 4.581 1.00 0.00 C ATOM 1342 CG PHE A 112 5.246 2.042 5.954 1.00 0.00 C ATOM 1343 CD1 PHE A 112 4.110 2.732 6.347 1.00 0.00 C ATOM 1344 CD2 PHE A 112 5.836 1.167 6.855 1.00 0.00 C ATOM 1345 CE1 PHE A 112 3.574 2.553 7.608 1.00 0.00 C ATOM 1346 CE2 PHE A 112 5.304 0.984 8.116 1.00 0.00 C ATOM 1347 CZ PHE A 112 4.172 1.678 8.493 1.00 0.00 C ATOM 0 H PHE A 112 3.248 0.900 3.971 1.00 0.00 H new ATOM 0 HA PHE A 112 5.677 1.588 2.534 1.00 0.00 H new ATOM 0 HB2 PHE A 112 6.909 2.079 4.630 1.00 0.00 H new ATOM 0 HB3 PHE A 112 5.685 3.285 4.286 1.00 0.00 H new ATOM 0 HD1 PHE A 112 3.638 3.418 5.659 1.00 0.00 H new ATOM 0 HD2 PHE A 112 6.723 0.622 6.566 1.00 0.00 H new ATOM 0 HE1 PHE A 112 2.688 3.097 7.901 1.00 0.00 H new ATOM 0 HE2 PHE A 112 5.773 0.299 8.806 1.00 0.00 H new ATOM 0 HZ PHE A 112 3.755 1.537 9.479 1.00 0.00 H new ATOM 1357 N SER A 113 6.815 -0.480 3.523 1.00 0.00 N ATOM 1358 CA SER A 113 7.349 -1.781 3.873 1.00 0.00 C ATOM 1359 C SER A 113 8.481 -1.604 4.868 1.00 0.00 C ATOM 1360 O SER A 113 9.188 -0.594 4.834 1.00 0.00 O ATOM 1361 CB SER A 113 7.872 -2.495 2.629 1.00 0.00 C ATOM 1362 OG SER A 113 8.608 -3.651 2.983 1.00 0.00 O ATOM 0 H SER A 113 7.483 0.126 3.046 1.00 0.00 H new ATOM 0 HA SER A 113 6.555 -2.384 4.315 1.00 0.00 H new ATOM 0 HB2 SER A 113 7.037 -2.773 1.986 1.00 0.00 H new ATOM 0 HB3 SER A 113 8.504 -1.818 2.055 1.00 0.00 H new ATOM 0 HG SER A 113 8.029 -4.439 2.922 1.00 0.00 H new ATOM 1368 N LEU A 114 8.654 -2.592 5.740 1.00 0.00 N ATOM 1369 CA LEU A 114 9.720 -2.556 6.732 1.00 0.00 C ATOM 1370 C LEU A 114 11.063 -2.715 6.052 1.00 0.00 C ATOM 1371 O LEU A 114 12.077 -2.233 6.543 1.00 0.00 O ATOM 1372 CB LEU A 114 9.581 -3.674 7.779 1.00 0.00 C ATOM 1373 CG LEU A 114 8.285 -3.712 8.595 1.00 0.00 C ATOM 1374 CD1 LEU A 114 7.698 -2.322 8.760 1.00 0.00 C ATOM 1375 CD2 LEU A 114 7.280 -4.668 7.974 1.00 0.00 C ATOM 0 H LEU A 114 8.069 -3.427 5.779 1.00 0.00 H new ATOM 0 HA LEU A 114 9.647 -1.593 7.237 1.00 0.00 H new ATOM 0 HB2 LEU A 114 9.686 -4.631 7.268 1.00 0.00 H new ATOM 0 HB3 LEU A 114 10.416 -3.591 8.475 1.00 0.00 H new ATOM 0 HG LEU A 114 8.527 -4.084 9.590 1.00 0.00 H new ATOM 0 HD11 LEU A 114 6.779 -2.382 9.343 1.00 0.00 H new ATOM 0 HD12 LEU A 114 8.415 -1.683 9.276 1.00 0.00 H new ATOM 0 HD13 LEU A 114 7.478 -1.901 7.779 1.00 0.00 H new ATOM 0 HD21 LEU A 114 6.369 -4.677 8.572 1.00 0.00 H new ATOM 0 HD22 LEU A 114 7.046 -4.342 6.961 1.00 0.00 H new ATOM 0 HD23 LEU A 114 7.704 -5.672 7.943 1.00 0.00 H new ATOM 1387 N GLY A 115 11.051 -3.391 4.909 1.00 0.00 N ATOM 1388 CA GLY A 115 12.284 -3.730 4.246 1.00 0.00 C ATOM 1389 C GLY A 115 12.841 -5.040 4.764 1.00 0.00 C ATOM 1390 O GLY A 115 12.112 -5.818 5.384 1.00 0.00 O ATOM 0 H GLY A 115 10.206 -3.708 4.434 1.00 0.00 H new ATOM 0 HA2 GLY A 115 12.114 -3.803 3.172 1.00 0.00 H new ATOM 0 HA3 GLY A 115 13.014 -2.935 4.400 1.00 0.00 H new ATOM 1394 N PRO A 116 14.129 -5.312 4.531 1.00 0.00 N ATOM 1395 CA PRO A 116 14.766 -6.568 4.941 1.00 0.00 C ATOM 1396 C PRO A 116 14.903 -6.713 6.459 1.00 0.00 C ATOM 1397 O PRO A 116 14.889 -7.825 6.984 1.00 0.00 O ATOM 1398 CB PRO A 116 16.159 -6.502 4.295 1.00 0.00 C ATOM 1399 CG PRO A 116 16.097 -5.384 3.308 1.00 0.00 C ATOM 1400 CD PRO A 116 15.068 -4.427 3.829 1.00 0.00 C ATOM 0 HA PRO A 116 14.168 -7.425 4.630 1.00 0.00 H new ATOM 0 HB2 PRO A 116 16.929 -6.320 5.044 1.00 0.00 H new ATOM 0 HB3 PRO A 116 16.408 -7.443 3.805 1.00 0.00 H new ATOM 0 HG2 PRO A 116 17.067 -4.897 3.209 1.00 0.00 H new ATOM 0 HG3 PRO A 116 15.822 -5.752 2.319 1.00 0.00 H new ATOM 0 HD2 PRO A 116 15.506 -3.688 4.500 1.00 0.00 H new ATOM 0 HD3 PRO A 116 14.581 -3.878 3.023 1.00 0.00 H new ATOM 1408 N ASP A 117 15.009 -5.592 7.167 1.00 0.00 N ATOM 1409 CA ASP A 117 15.337 -5.627 8.595 1.00 0.00 C ATOM 1410 C ASP A 117 14.100 -5.831 9.473 1.00 0.00 C ATOM 1411 O ASP A 117 14.221 -6.092 10.670 1.00 0.00 O ATOM 1412 CB ASP A 117 16.069 -4.340 9.014 1.00 0.00 C ATOM 1413 CG ASP A 117 15.150 -3.137 9.169 1.00 0.00 C ATOM 1414 OD1 ASP A 117 14.045 -3.145 8.606 1.00 0.00 O ATOM 1415 OD2 ASP A 117 15.533 -2.179 9.870 1.00 0.00 O ATOM 0 H ASP A 117 14.875 -4.656 6.784 1.00 0.00 H new ATOM 0 HA ASP A 117 15.993 -6.484 8.746 1.00 0.00 H new ATOM 0 HB2 ASP A 117 16.584 -4.517 9.958 1.00 0.00 H new ATOM 0 HB3 ASP A 117 16.833 -4.109 8.272 1.00 0.00 H new ATOM 1420 N GLY A 118 12.915 -5.710 8.883 1.00 0.00 N ATOM 1421 CA GLY A 118 11.686 -5.875 9.644 1.00 0.00 C ATOM 1422 C GLY A 118 11.394 -4.693 10.560 1.00 0.00 C ATOM 1423 O GLY A 118 10.520 -4.773 11.425 1.00 0.00 O ATOM 0 H GLY A 118 12.782 -5.501 7.894 1.00 0.00 H new ATOM 0 HA2 GLY A 118 10.853 -6.009 8.954 1.00 0.00 H new ATOM 0 HA3 GLY A 118 11.754 -6.784 10.242 1.00 0.00 H new ATOM 1427 N VAL A 119 12.126 -3.600 10.369 1.00 0.00 N ATOM 1428 CA VAL A 119 11.959 -2.403 11.189 1.00 0.00 C ATOM 1429 C VAL A 119 11.494 -1.217 10.349 1.00 0.00 C ATOM 1430 O VAL A 119 12.179 -0.811 9.387 1.00 0.00 O ATOM 1431 CB VAL A 119 13.262 -2.029 11.931 1.00 0.00 C ATOM 1432 CG1 VAL A 119 13.119 -0.699 12.659 1.00 0.00 C ATOM 1433 CG2 VAL A 119 13.645 -3.125 12.907 1.00 0.00 C ATOM 0 H VAL A 119 12.845 -3.518 9.650 1.00 0.00 H new ATOM 0 HA VAL A 119 11.194 -2.637 11.929 1.00 0.00 H new ATOM 0 HB VAL A 119 14.054 -1.923 11.189 1.00 0.00 H new ATOM 0 HG11 VAL A 119 14.051 -0.463 13.172 1.00 0.00 H new ATOM 0 HG12 VAL A 119 12.891 0.087 11.939 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.312 -0.768 13.388 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.565 -2.848 13.423 1.00 0.00 H new ATOM 0 HG22 VAL A 119 12.846 -3.258 13.636 1.00 0.00 H new ATOM 0 HG23 VAL A 119 13.800 -4.058 12.364 1.00 0.00 H new ATOM 1443 N PRO A 120 10.319 -0.653 10.726 1.00 0.00 N ATOM 1444 CA PRO A 120 9.695 0.473 10.023 1.00 0.00 C ATOM 1445 C PRO A 120 10.372 1.812 10.293 1.00 0.00 C ATOM 1446 O PRO A 120 11.057 1.988 11.308 1.00 0.00 O ATOM 1447 CB PRO A 120 8.272 0.500 10.581 1.00 0.00 C ATOM 1448 CG PRO A 120 8.385 -0.093 11.942 1.00 0.00 C ATOM 1449 CD PRO A 120 9.502 -1.099 11.874 1.00 0.00 C ATOM 0 HA PRO A 120 9.760 0.337 8.943 1.00 0.00 H new ATOM 0 HB2 PRO A 120 7.883 1.517 10.624 1.00 0.00 H new ATOM 0 HB3 PRO A 120 7.591 -0.075 9.954 1.00 0.00 H new ATOM 0 HG2 PRO A 120 8.599 0.676 12.684 1.00 0.00 H new ATOM 0 HG3 PRO A 120 7.450 -0.570 12.237 1.00 0.00 H new ATOM 0 HD2 PRO A 120 10.083 -1.112 12.796 1.00 0.00 H new ATOM 0 HD3 PRO A 120 9.120 -2.109 11.723 1.00 0.00 H new ATOM 1457 N GLU A 121 10.155 2.753 9.370 1.00 0.00 N ATOM 1458 CA GLU A 121 10.662 4.119 9.482 1.00 0.00 C ATOM 1459 C GLU A 121 12.191 4.115 9.505 1.00 0.00 C ATOM 1460 O GLU A 121 12.837 5.033 10.015 1.00 0.00 O ATOM 1461 CB GLU A 121 10.089 4.800 10.731 1.00 0.00 C ATOM 1462 CG GLU A 121 10.200 6.315 10.712 1.00 0.00 C ATOM 1463 CD GLU A 121 9.725 6.943 12.002 1.00 0.00 C ATOM 1464 OE1 GLU A 121 8.516 7.226 12.123 1.00 0.00 O ATOM 1465 OE2 GLU A 121 10.563 7.159 12.901 1.00 0.00 O ATOM 0 H GLU A 121 9.619 2.585 8.519 1.00 0.00 H new ATOM 0 HA GLU A 121 10.339 4.690 8.611 1.00 0.00 H new ATOM 0 HB2 GLU A 121 9.040 4.524 10.834 1.00 0.00 H new ATOM 0 HB3 GLU A 121 10.607 4.419 11.611 1.00 0.00 H new ATOM 0 HG2 GLU A 121 11.237 6.599 10.533 1.00 0.00 H new ATOM 0 HG3 GLU A 121 9.614 6.709 9.882 1.00 0.00 H new ATOM 1472 N SER A 122 12.755 3.063 8.947 1.00 0.00 N ATOM 1473 CA SER A 122 14.188 2.897 8.860 1.00 0.00 C ATOM 1474 C SER A 122 14.703 3.349 7.494 1.00 0.00 C ATOM 1475 O SER A 122 13.918 3.754 6.634 1.00 0.00 O ATOM 1476 CB SER A 122 14.517 1.434 9.123 1.00 0.00 C ATOM 1477 OG SER A 122 13.381 0.627 8.860 1.00 0.00 O ATOM 0 H SER A 122 12.225 2.293 8.538 1.00 0.00 H new ATOM 0 HA SER A 122 14.683 3.518 9.606 1.00 0.00 H new ATOM 0 HB2 SER A 122 15.350 1.121 8.493 1.00 0.00 H new ATOM 0 HB3 SER A 122 14.834 1.304 10.158 1.00 0.00 H new ATOM 1483 N ASN A 123 16.012 3.294 7.294 1.00 0.00 N ATOM 1484 CA ASN A 123 16.605 3.719 6.028 1.00 0.00 C ATOM 1485 C ASN A 123 16.442 2.634 4.972 1.00 0.00 C ATOM 1486 O ASN A 123 16.349 2.916 3.776 1.00 0.00 O ATOM 1487 CB ASN A 123 18.088 4.047 6.211 1.00 0.00 C ATOM 1488 CG ASN A 123 18.317 5.154 7.221 1.00 0.00 C ATOM 1489 OD1 ASN A 123 18.472 4.896 8.417 1.00 0.00 O ATOM 1490 ND2 ASN A 123 18.341 6.390 6.754 1.00 0.00 N ATOM 0 H ASN A 123 16.683 2.962 7.986 1.00 0.00 H new ATOM 0 HA ASN A 123 16.085 4.617 5.695 1.00 0.00 H new ATOM 0 HB2 ASN A 123 18.618 3.151 6.533 1.00 0.00 H new ATOM 0 HB3 ASN A 123 18.513 4.341 5.251 1.00 0.00 H new ATOM 0 HD21 ASN A 123 18.492 7.173 7.390 1.00 0.00 H new ATOM 0 HD22 ASN A 123 18.209 6.561 5.757 1.00 0.00 H new ATOM 1497 N ASP A 124 16.392 1.390 5.431 1.00 0.00 N ATOM 1498 CA ASP A 124 16.230 0.238 4.548 1.00 0.00 C ATOM 1499 C ASP A 124 14.780 0.121 4.100 1.00 0.00 C ATOM 1500 O ASP A 124 14.459 -0.601 3.156 1.00 0.00 O ATOM 1501 CB ASP A 124 16.626 -1.043 5.280 1.00 0.00 C ATOM 1502 CG ASP A 124 15.621 -1.408 6.356 1.00 0.00 C ATOM 1503 OD1 ASP A 124 15.490 -0.680 7.353 1.00 0.00 O ATOM 1504 OD2 ASP A 124 14.920 -2.415 6.233 1.00 0.00 O ATOM 0 H ASP A 124 16.462 1.150 6.420 1.00 0.00 H new ATOM 0 HA ASP A 124 16.872 0.378 3.678 1.00 0.00 H new ATOM 0 HB2 ASP A 124 16.706 -1.861 4.564 1.00 0.00 H new ATOM 0 HB3 ASP A 124 17.611 -0.916 5.730 1.00 0.00 H new ATOM 1509 N ASP A 125 13.915 0.834 4.802 1.00 0.00 N ATOM 1510 CA ASP A 125 12.485 0.797 4.550 1.00 0.00 C ATOM 1511 C ASP A 125 12.149 1.369 3.183 1.00 0.00 C ATOM 1512 O ASP A 125 12.810 2.291 2.700 1.00 0.00 O ATOM 1513 CB ASP A 125 11.748 1.588 5.625 1.00 0.00 C ATOM 1514 CG ASP A 125 11.483 0.785 6.885 1.00 0.00 C ATOM 1515 OD1 ASP A 125 10.288 0.645 7.234 1.00 0.00 O ATOM 1516 OD2 ASP A 125 12.460 0.329 7.546 1.00 0.00 O ATOM 0 H ASP A 125 14.186 1.456 5.564 1.00 0.00 H new ATOM 0 HA ASP A 125 12.168 -0.246 4.574 1.00 0.00 H new ATOM 0 HB2 ASP A 125 12.333 2.471 5.882 1.00 0.00 H new ATOM 0 HB3 ASP A 125 10.799 1.940 5.221 1.00 0.00 H new ATOM 1521 N ILE A 126 11.129 0.814 2.556 1.00 0.00 N ATOM 1522 CA ILE A 126 10.650 1.320 1.284 1.00 0.00 C ATOM 1523 C ILE A 126 9.251 1.893 1.449 1.00 0.00 C ATOM 1524 O ILE A 126 8.314 1.185 1.820 1.00 0.00 O ATOM 1525 CB ILE A 126 10.651 0.224 0.201 1.00 0.00 C ATOM 1526 CG1 ILE A 126 12.082 -0.265 -0.037 1.00 0.00 C ATOM 1527 CG2 ILE A 126 10.039 0.743 -1.097 1.00 0.00 C ATOM 1528 CD1 ILE A 126 12.186 -1.378 -1.051 1.00 0.00 C ATOM 0 H ILE A 126 10.614 0.008 2.910 1.00 0.00 H new ATOM 0 HA ILE A 126 11.329 2.108 0.958 1.00 0.00 H new ATOM 0 HB ILE A 126 10.043 -0.612 0.547 1.00 0.00 H new ATOM 0 HG12 ILE A 126 12.692 0.575 -0.370 1.00 0.00 H new ATOM 0 HG13 ILE A 126 12.501 -0.608 0.909 1.00 0.00 H new ATOM 0 HG21 ILE A 126 10.051 -0.048 -1.847 1.00 0.00 H new ATOM 0 HG22 ILE A 126 9.011 1.055 -0.915 1.00 0.00 H new ATOM 0 HG23 ILE A 126 10.618 1.593 -1.458 1.00 0.00 H new ATOM 0 HD11 ILE A 126 13.230 -1.670 -1.165 1.00 0.00 H new ATOM 0 HD12 ILE A 126 11.604 -2.235 -0.711 1.00 0.00 H new ATOM 0 HD13 ILE A 126 11.799 -1.034 -2.010 1.00 0.00 H new ATOM 1540 N GLY A 127 9.124 3.181 1.191 1.00 0.00 N ATOM 1541 CA GLY A 127 7.862 3.855 1.361 1.00 0.00 C ATOM 1542 C GLY A 127 7.344 4.429 0.063 1.00 0.00 C ATOM 1543 O GLY A 127 8.100 4.601 -0.893 1.00 0.00 O ATOM 0 H GLY A 127 9.884 3.777 0.863 1.00 0.00 H new ATOM 0 HA2 GLY A 127 7.130 3.156 1.765 1.00 0.00 H new ATOM 0 HA3 GLY A 127 7.975 4.656 2.091 1.00 0.00 H new ATOM 1547 N ASN A 128 6.054 4.727 0.027 1.00 0.00 N ATOM 1548 CA ASN A 128 5.451 5.384 -1.129 1.00 0.00 C ATOM 1549 C ASN A 128 6.117 6.734 -1.363 1.00 0.00 C ATOM 1550 O ASN A 128 6.370 7.138 -2.497 1.00 0.00 O ATOM 1551 CB ASN A 128 3.940 5.568 -0.914 1.00 0.00 C ATOM 1552 CG ASN A 128 3.611 6.498 0.245 1.00 0.00 C ATOM 1553 OD1 ASN A 128 3.424 7.704 0.064 1.00 0.00 O ATOM 1554 ND2 ASN A 128 3.541 5.949 1.448 1.00 0.00 N ATOM 0 H ASN A 128 5.402 4.525 0.785 1.00 0.00 H new ATOM 0 HA ASN A 128 5.601 4.756 -2.007 1.00 0.00 H new ATOM 0 HB2 ASN A 128 3.495 5.963 -1.827 1.00 0.00 H new ATOM 0 HB3 ASN A 128 3.484 4.595 -0.732 1.00 0.00 H new ATOM 0 HD21 ASN A 128 3.327 6.527 2.261 1.00 0.00 H new ATOM 0 HD22 ASN A 128 3.701 4.948 1.562 1.00 0.00 H new ATOM 1561 N TRP A 129 6.442 7.399 -0.269 1.00 0.00 N ATOM 1562 CA TRP A 129 7.015 8.729 -0.313 1.00 0.00 C ATOM 1563 C TRP A 129 8.489 8.682 -0.701 1.00 0.00 C ATOM 1564 O TRP A 129 9.011 9.623 -1.294 1.00 0.00 O ATOM 1565 CB TRP A 129 6.843 9.388 1.052 1.00 0.00 C ATOM 1566 CG TRP A 129 7.310 10.809 1.113 1.00 0.00 C ATOM 1567 CD1 TRP A 129 6.627 11.914 0.697 1.00 0.00 C ATOM 1568 CD2 TRP A 129 8.553 11.280 1.644 1.00 0.00 C ATOM 1569 NE1 TRP A 129 7.371 13.041 0.929 1.00 0.00 N ATOM 1570 CE2 TRP A 129 8.556 12.679 1.509 1.00 0.00 C ATOM 1571 CE3 TRP A 129 9.663 10.655 2.217 1.00 0.00 C ATOM 1572 CZ2 TRP A 129 9.623 13.463 1.926 1.00 0.00 C ATOM 1573 CZ3 TRP A 129 10.724 11.436 2.632 1.00 0.00 C ATOM 1574 CH2 TRP A 129 10.697 12.827 2.484 1.00 0.00 C ATOM 0 H TRP A 129 6.316 7.031 0.674 1.00 0.00 H new ATOM 0 HA TRP A 129 6.496 9.314 -1.072 1.00 0.00 H new ATOM 0 HB2 TRP A 129 5.790 9.352 1.330 1.00 0.00 H new ATOM 0 HB3 TRP A 129 7.389 8.806 1.795 1.00 0.00 H new ATOM 0 HD1 TRP A 129 5.644 11.902 0.250 1.00 0.00 H new ATOM 0 HE1 TRP A 129 7.087 13.995 0.706 1.00 0.00 H new ATOM 0 HE3 TRP A 129 9.691 9.582 2.333 1.00 0.00 H new ATOM 0 HZ2 TRP A 129 9.605 14.537 1.814 1.00 0.00 H new ATOM 0 HZ3 TRP A 129 11.588 10.966 3.078 1.00 0.00 H new ATOM 0 HH2 TRP A 129 11.542 13.411 2.818 1.00 0.00 H new ATOM 1585 N THR A 130 9.155 7.584 -0.376 1.00 0.00 N ATOM 1586 CA THR A 130 10.582 7.470 -0.622 1.00 0.00 C ATOM 1587 C THR A 130 10.864 7.098 -2.076 1.00 0.00 C ATOM 1588 O THR A 130 11.901 7.464 -2.628 1.00 0.00 O ATOM 1589 CB THR A 130 11.236 6.438 0.320 1.00 0.00 C ATOM 1590 OG1 THR A 130 10.612 5.163 0.162 1.00 0.00 O ATOM 1591 CG2 THR A 130 11.126 6.884 1.772 1.00 0.00 C ATOM 0 H THR A 130 8.731 6.763 0.057 1.00 0.00 H new ATOM 0 HA THR A 130 11.020 8.447 -0.420 1.00 0.00 H new ATOM 0 HB THR A 130 12.291 6.360 0.057 1.00 0.00 H new ATOM 0 HG1 THR A 130 9.801 5.261 -0.379 1.00 0.00 H new ATOM 0 HG21 THR A 130 11.594 6.141 2.417 1.00 0.00 H new ATOM 0 HG22 THR A 130 11.630 7.842 1.897 1.00 0.00 H new ATOM 0 HG23 THR A 130 10.075 6.989 2.042 1.00 0.00 H new ATOM 1599 N ILE A 131 9.933 6.381 -2.701 1.00 0.00 N ATOM 1600 CA ILE A 131 10.109 5.960 -4.085 1.00 0.00 C ATOM 1601 C ILE A 131 9.641 7.043 -5.065 1.00 0.00 C ATOM 1602 O ILE A 131 10.188 7.175 -6.162 1.00 0.00 O ATOM 1603 CB ILE A 131 9.381 4.622 -4.380 1.00 0.00 C ATOM 1604 CG1 ILE A 131 9.649 4.164 -5.817 1.00 0.00 C ATOM 1605 CG2 ILE A 131 7.885 4.747 -4.136 1.00 0.00 C ATOM 1606 CD1 ILE A 131 11.105 3.851 -6.096 1.00 0.00 C ATOM 0 H ILE A 131 9.056 6.082 -2.274 1.00 0.00 H new ATOM 0 HA ILE A 131 11.178 5.802 -4.229 1.00 0.00 H new ATOM 0 HB ILE A 131 9.776 3.871 -3.696 1.00 0.00 H new ATOM 0 HG12 ILE A 131 9.050 3.277 -6.024 1.00 0.00 H new ATOM 0 HG13 ILE A 131 9.316 4.941 -6.505 1.00 0.00 H new ATOM 0 HG21 ILE A 131 7.400 3.795 -4.351 1.00 0.00 H new ATOM 0 HG22 ILE A 131 7.707 5.018 -3.095 1.00 0.00 H new ATOM 0 HG23 ILE A 131 7.473 5.518 -4.787 1.00 0.00 H new ATOM 0 HD11 ILE A 131 11.217 3.534 -7.133 1.00 0.00 H new ATOM 0 HD12 ILE A 131 11.708 4.742 -5.922 1.00 0.00 H new ATOM 0 HD13 ILE A 131 11.439 3.052 -5.434 1.00 0.00 H new ATOM 1618 N GLY A 132 8.638 7.821 -4.673 1.00 0.00 N ATOM 1619 CA GLY A 132 8.169 8.893 -5.534 1.00 0.00 C ATOM 1620 C GLY A 132 6.658 8.956 -5.637 1.00 0.00 C ATOM 1621 O GLY A 132 6.103 9.958 -6.087 1.00 0.00 O ATOM 0 H GLY A 132 8.145 7.731 -3.784 1.00 0.00 H new ATOM 0 HA2 GLY A 132 8.541 9.845 -5.155 1.00 0.00 H new ATOM 0 HA3 GLY A 132 8.590 8.761 -6.531 1.00 0.00 H new ATOM 1625 N PHE A 133 5.986 7.894 -5.217 1.00 0.00 N ATOM 1626 CA PHE A 133 4.528 7.856 -5.235 1.00 0.00 C ATOM 1627 C PHE A 133 3.967 8.465 -3.954 1.00 0.00 C ATOM 1628 O PHE A 133 3.218 7.825 -3.215 1.00 0.00 O ATOM 1629 CB PHE A 133 4.029 6.418 -5.415 1.00 0.00 C ATOM 1630 CG PHE A 133 4.336 5.842 -6.770 1.00 0.00 C ATOM 1631 CD1 PHE A 133 3.444 5.996 -7.820 1.00 0.00 C ATOM 1632 CD2 PHE A 133 5.517 5.153 -6.996 1.00 0.00 C ATOM 1633 CE1 PHE A 133 3.723 5.471 -9.067 1.00 0.00 C ATOM 1634 CE2 PHE A 133 5.801 4.626 -8.242 1.00 0.00 C ATOM 1635 CZ PHE A 133 4.904 4.787 -9.279 1.00 0.00 C ATOM 0 H PHE A 133 6.426 7.046 -4.859 1.00 0.00 H new ATOM 0 HA PHE A 133 4.176 8.446 -6.081 1.00 0.00 H new ATOM 0 HB2 PHE A 133 4.480 5.787 -4.650 1.00 0.00 H new ATOM 0 HB3 PHE A 133 2.951 6.393 -5.254 1.00 0.00 H new ATOM 0 HD1 PHE A 133 2.520 6.533 -7.661 1.00 0.00 H new ATOM 0 HD2 PHE A 133 6.224 5.026 -6.189 1.00 0.00 H new ATOM 0 HE1 PHE A 133 3.018 5.595 -9.876 1.00 0.00 H new ATOM 0 HE2 PHE A 133 6.724 4.089 -8.404 1.00 0.00 H new ATOM 0 HZ PHE A 133 5.125 4.379 -10.254 1.00 0.00 H new ATOM 1645 N HIS A 134 4.347 9.709 -3.700 1.00 0.00 N ATOM 1646 CA HIS A 134 3.931 10.412 -2.492 1.00 0.00 C ATOM 1647 C HIS A 134 2.473 10.847 -2.588 1.00 0.00 C ATOM 1648 O HIS A 134 1.929 11.002 -3.683 1.00 0.00 O ATOM 1649 CB HIS A 134 4.844 11.620 -2.209 1.00 0.00 C ATOM 1650 CG HIS A 134 4.926 12.644 -3.309 1.00 0.00 C ATOM 1651 ND1 HIS A 134 4.463 13.935 -3.169 1.00 0.00 N ATOM 1652 CD2 HIS A 134 5.459 12.576 -4.553 1.00 0.00 C ATOM 1653 CE1 HIS A 134 4.707 14.612 -4.276 1.00 0.00 C ATOM 1654 NE2 HIS A 134 5.310 13.810 -5.131 1.00 0.00 N ATOM 0 H HIS A 134 4.946 10.256 -4.318 1.00 0.00 H new ATOM 0 HA HIS A 134 4.024 9.718 -1.656 1.00 0.00 H new ATOM 0 HB2 HIS A 134 4.493 12.114 -1.303 1.00 0.00 H new ATOM 0 HB3 HIS A 134 5.849 11.253 -2.003 1.00 0.00 H new ATOM 0 HD2 HIS A 134 5.917 11.709 -5.006 1.00 0.00 H new ATOM 0 HE1 HIS A 134 4.455 15.647 -4.451 1.00 0.00 H new ATOM 0 HE2 HIS A 134 5.616 14.066 -6.070 1.00 0.00 H new ATOM 1663 N HIS A 135 1.844 11.037 -1.438 1.00 0.00 N ATOM 1664 CA HIS A 135 0.434 11.395 -1.387 1.00 0.00 C ATOM 1665 C HIS A 135 0.271 12.874 -1.057 1.00 0.00 C ATOM 1666 O HIS A 135 -0.035 13.237 0.080 1.00 0.00 O ATOM 1667 CB HIS A 135 -0.298 10.543 -0.344 1.00 0.00 C ATOM 1668 CG HIS A 135 -0.373 9.085 -0.678 1.00 0.00 C ATOM 1669 ND1 HIS A 135 0.678 8.211 -0.496 1.00 0.00 N ATOM 1670 CD2 HIS A 135 -1.392 8.342 -1.171 1.00 0.00 C ATOM 1671 CE1 HIS A 135 0.307 7.000 -0.863 1.00 0.00 C ATOM 1672 NE2 HIS A 135 -0.942 7.051 -1.276 1.00 0.00 N ATOM 0 H HIS A 135 2.289 10.949 -0.525 1.00 0.00 H new ATOM 0 HA HIS A 135 -0.003 11.203 -2.367 1.00 0.00 H new ATOM 0 HB2 HIS A 135 0.203 10.658 0.617 1.00 0.00 H new ATOM 0 HB3 HIS A 135 -1.311 10.928 -0.224 1.00 0.00 H new ATOM 0 HD2 HIS A 135 -2.377 8.700 -1.433 1.00 0.00 H new ATOM 0 HE1 HIS A 135 0.924 6.115 -0.830 1.00 0.00 H new ATOM 0 HE2 HIS A 135 -1.486 6.259 -1.618 1.00 0.00 H new ATOM 1681 N HIS A 136 0.480 13.729 -2.052 1.00 0.00 N ATOM 1682 CA HIS A 136 0.385 15.170 -1.845 1.00 0.00 C ATOM 1683 C HIS A 136 -1.074 15.622 -1.839 1.00 0.00 C ATOM 1684 O HIS A 136 -1.396 16.704 -1.349 1.00 0.00 O ATOM 1685 CB HIS A 136 1.171 15.927 -2.921 1.00 0.00 C ATOM 1686 CG HIS A 136 1.305 17.394 -2.644 1.00 0.00 C ATOM 1687 ND1 HIS A 136 0.647 18.365 -3.367 1.00 0.00 N ATOM 1688 CD2 HIS A 136 2.025 18.053 -1.707 1.00 0.00 C ATOM 1689 CE1 HIS A 136 0.956 19.553 -2.887 1.00 0.00 C ATOM 1690 NE2 HIS A 136 1.790 19.392 -1.880 1.00 0.00 N ATOM 0 H HIS A 136 0.715 13.452 -3.005 1.00 0.00 H new ATOM 0 HA HIS A 136 0.822 15.399 -0.873 1.00 0.00 H new ATOM 0 HB2 HIS A 136 2.166 15.490 -3.008 1.00 0.00 H new ATOM 0 HB3 HIS A 136 0.678 15.791 -3.883 1.00 0.00 H new ATOM 0 HD2 HIS A 136 2.666 17.607 -0.961 1.00 0.00 H new ATOM 0 HE1 HIS A 136 0.588 20.499 -3.257 1.00 0.00 H new ATOM 0 HE2 HIS A 136 2.195 20.142 -1.320 1.00 0.00 H new ATOM 1699 N HIS A 137 -1.951 14.792 -2.378 1.00 0.00 N ATOM 1700 CA HIS A 137 -3.374 15.097 -2.403 1.00 0.00 C ATOM 1701 C HIS A 137 -4.028 14.608 -1.114 1.00 0.00 C ATOM 1702 O HIS A 137 -4.539 13.491 -1.045 1.00 0.00 O ATOM 1703 CB HIS A 137 -4.026 14.446 -3.627 1.00 0.00 C ATOM 1704 CG HIS A 137 -5.433 14.885 -3.883 1.00 0.00 C ATOM 1705 ND1 HIS A 137 -5.751 16.096 -4.460 1.00 0.00 N ATOM 1706 CD2 HIS A 137 -6.611 14.257 -3.662 1.00 0.00 C ATOM 1707 CE1 HIS A 137 -7.060 16.195 -4.577 1.00 0.00 C ATOM 1708 NE2 HIS A 137 -7.606 15.093 -4.103 1.00 0.00 N ATOM 0 H HIS A 137 -1.703 13.900 -2.805 1.00 0.00 H new ATOM 0 HA HIS A 137 -3.513 16.176 -2.474 1.00 0.00 H new ATOM 0 HB2 HIS A 137 -3.423 14.669 -4.507 1.00 0.00 H new ATOM 0 HB3 HIS A 137 -4.013 13.364 -3.498 1.00 0.00 H new ATOM 0 HD2 HIS A 137 -6.743 13.280 -3.221 1.00 0.00 H new ATOM 0 HE1 HIS A 137 -7.595 17.037 -4.991 1.00 0.00 H new ATOM 0 HE2 HIS A 137 -8.606 14.894 -4.069 1.00 0.00 H new ATOM 1717 N HIS A 138 -3.998 15.447 -0.088 1.00 0.00 N ATOM 1718 CA HIS A 138 -4.524 15.077 1.219 1.00 0.00 C ATOM 1719 C HIS A 138 -5.427 16.175 1.769 1.00 0.00 C ATOM 1720 O HIS A 138 -5.050 17.347 1.792 1.00 0.00 O ATOM 1721 CB HIS A 138 -3.381 14.777 2.206 1.00 0.00 C ATOM 1722 CG HIS A 138 -2.349 15.862 2.315 1.00 0.00 C ATOM 1723 ND1 HIS A 138 -2.464 16.935 3.173 1.00 0.00 N ATOM 1724 CD2 HIS A 138 -1.174 16.033 1.666 1.00 0.00 C ATOM 1725 CE1 HIS A 138 -1.411 17.716 3.042 1.00 0.00 C ATOM 1726 NE2 HIS A 138 -0.613 17.192 2.136 1.00 0.00 N ATOM 0 H HIS A 138 -3.614 16.391 -0.136 1.00 0.00 H new ATOM 0 HA HIS A 138 -5.118 14.171 1.097 1.00 0.00 H new ATOM 0 HB2 HIS A 138 -3.808 14.599 3.193 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -2.888 13.854 1.901 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -0.756 15.378 0.916 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -1.233 18.632 3.586 1.00 0.00 H new ATOM 0 HE2 HIS A 138 0.278 17.585 1.833 1.00 0.00 H new ATOM 1735 N HIS A 139 -6.620 15.794 2.199 1.00 0.00 N ATOM 1736 CA HIS A 139 -7.562 16.746 2.769 1.00 0.00 C ATOM 1737 C HIS A 139 -7.585 16.620 4.286 1.00 0.00 C ATOM 1738 O HIS A 139 -8.289 15.775 4.838 1.00 0.00 O ATOM 1739 CB HIS A 139 -8.969 16.520 2.202 1.00 0.00 C ATOM 1740 CG HIS A 139 -9.987 17.501 2.707 1.00 0.00 C ATOM 1741 ND1 HIS A 139 -10.714 17.311 3.862 1.00 0.00 N ATOM 1742 CD2 HIS A 139 -10.387 18.692 2.208 1.00 0.00 C ATOM 1743 CE1 HIS A 139 -11.514 18.341 4.051 1.00 0.00 C ATOM 1744 NE2 HIS A 139 -11.336 19.195 3.063 1.00 0.00 N ATOM 0 H HIS A 139 -6.959 14.833 2.164 1.00 0.00 H new ATOM 0 HA HIS A 139 -7.237 17.752 2.502 1.00 0.00 H new ATOM 0 HB2 HIS A 139 -8.927 16.581 1.114 1.00 0.00 H new ATOM 0 HB3 HIS A 139 -9.294 15.510 2.453 1.00 0.00 H new ATOM 0 HD2 HIS A 139 -10.027 19.161 1.304 1.00 0.00 H new ATOM 0 HE1 HIS A 139 -12.200 18.464 4.876 1.00 0.00 H new ATOM 0 HE2 HIS A 139 -11.824 20.084 2.952 1.00 0.00 H new ATOM 1753 N LYS A 140 -6.809 17.456 4.954 1.00 0.00 N ATOM 1754 CA LYS A 140 -6.769 17.458 6.406 1.00 0.00 C ATOM 1755 C LYS A 140 -8.035 18.097 6.960 1.00 0.00 C ATOM 1756 O LYS A 140 -8.795 17.407 7.671 1.00 0.00 O ATOM 1757 CB LYS A 140 -5.536 18.210 6.904 1.00 0.00 C ATOM 1758 CG LYS A 140 -5.322 18.098 8.403 1.00 0.00 C ATOM 1759 CD LYS A 140 -4.087 18.862 8.844 1.00 0.00 C ATOM 1760 CE LYS A 140 -3.855 18.734 10.340 1.00 0.00 C ATOM 1761 NZ LYS A 140 -5.012 19.231 11.130 1.00 0.00 N ATOM 1762 OXT LYS A 140 -8.280 19.282 6.652 1.00 0.00 O ATOM 0 H LYS A 140 -6.197 18.143 4.513 1.00 0.00 H new ATOM 0 HA LYS A 140 -6.710 16.428 6.757 1.00 0.00 H new ATOM 0 HB2 LYS A 140 -4.655 17.827 6.390 1.00 0.00 H new ATOM 0 HB3 LYS A 140 -5.629 19.262 6.636 1.00 0.00 H new ATOM 0 HG2 LYS A 140 -6.197 18.484 8.927 1.00 0.00 H new ATOM 0 HG3 LYS A 140 -5.221 17.049 8.680 1.00 0.00 H new ATOM 0 HD2 LYS A 140 -3.216 18.488 8.307 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -4.196 19.914 8.581 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -3.668 17.689 10.589 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -2.961 19.293 10.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -4.734 19.332 12.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 -5.314 20.154 10.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -5.798 18.554 11.057 1.00 0.00 H new TER 1776 LYS A 140 HETATM 1777 CA CA A 201 14.073 -1.574 7.906 1.00 0.00 CA