USER MOD reduce.3.24.130724 H: found=0, std=0, add=1059, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1057 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 33 TYR OH : rot -23:sc= -0.321 USER MOD Set 1.2: A 128 GLN : amide:sc= 0.263 K(o=0.7,f=-1.5) USER MOD Set 1.3: A 130 HIS : no HE2:sc= 0.756 K(o=0.7,f=-3.7!) USER MOD Set 2.1: A 111 SER OG : rot -78:sc= 0.304 USER MOD Set 2.2: A 112 LYS NZ :NH3+ -173:sc= 0.124 (180deg=0) USER MOD Set 3.1: A 54 GLN : amide:sc= -1.41 K(o=-0.36,f=-5.5!) USER MOD Set 3.2: A 102 TYR OH : rot 34:sc= 1.05 USER MOD Set 4.1: A 43 ASN : amide:sc= -4.27! K(o=-2.4!,f=0.34) USER MOD Set 4.2: A 44 ASN : amide:sc= 0.592 K(o=-2.4,f=-9.8!) USER MOD Set 4.3: A 110 LYS NZ :NH3+ -139:sc= 1.26 (180deg=0) USER MOD Set 5.1: A 19 SER OG : rot -170:sc= -0.539 USER MOD Set 5.2: A 22 GLN : amide:sc= -0.225 X(o=-0.76,f=-0.69) USER MOD Set 6.1: A 5 SER OG : rot -163:sc= 0.167 USER MOD Set 6.2: A 139 ASN : amide:sc= -0.614 K(o=-0.45,f=-4.6!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 24:sc= -0.808 USER MOD Single : A 14 ASN : amide:sc= 0.044 X(o=0.044,f=0) USER MOD Single : A 20 MET CE :methyl 179:sc= -2.24 (180deg=-2.29) USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=-0.05) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 TYR OH : rot 79:sc= -2.56! USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc= -4.46! C(o=-4.5!,f=-3.4!) USER MOD Single : A 53 THR OG1 : rot 60:sc= 1.19 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc= -0.133 K(o=-0.13,f=-3.2!) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 TYR OH : rot 180:sc= -0.0704 USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 81 ASN : amide:sc= -0.0288 K(o=-0.029,f=-1.2) USER MOD Single : A 82 GLN : amide:sc= 0.309 K(o=0.31,f=-6!) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot 130:sc= -0.111 USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 SER OG : rot -114:sc= 0.139 USER MOD Single : A 94 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 THR OG1 : rot 180:sc= -0.022 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 SER OG : rot -124:sc= 0.961 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot -57:sc= 1.04 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 180:sc= -0.312 USER MOD Single : A 129 LYS NZ :NH3+ 139:sc= -0.568 (180deg=-2.56!) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 134 SER OG : rot -58:sc= 0.115 USER MOD Single : A 136 HIS : no HD1:sc= -0.172 X(o=-0.17,f=-0.03) USER MOD Single : A 137 LYS NZ :NH3+ 159:sc= -0.0334 (180deg=-0.299) USER MOD Single : A 140 THR OG1 : rot 180:sc= -0.28 USER MOD Single : A 145 SER OG : rot 180:sc= 0 USER MOD Single : A 148 SER OG : rot 180:sc= 0 USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -26.810 22.539 -18.473 1.00 0.00 N ATOM 2 CA GLY A 1 -26.635 22.074 -17.109 1.00 0.00 C ATOM 3 C GLY A 1 -25.520 21.055 -16.982 1.00 0.00 C ATOM 4 O GLY A 1 -25.766 19.894 -16.656 1.00 0.00 O ATOM 0 H1 GLY A 1 -27.583 23.233 -18.506 1.00 0.00 H new ATOM 0 H2 GLY A 1 -25.930 22.984 -18.804 1.00 0.00 H new ATOM 0 H3 GLY A 1 -27.042 21.733 -19.088 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -26.420 22.925 -16.463 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -27.567 21.633 -16.756 1.00 0.00 H new ATOM 8 N SER A 2 -24.291 21.489 -17.243 1.00 0.00 N ATOM 9 CA SER A 2 -23.135 20.604 -17.161 1.00 0.00 C ATOM 10 C SER A 2 -22.730 20.372 -15.709 1.00 0.00 C ATOM 11 O SER A 2 -22.994 21.203 -14.839 1.00 0.00 O ATOM 12 CB SER A 2 -21.959 21.194 -17.943 1.00 0.00 C ATOM 13 OG SER A 2 -21.530 22.418 -17.372 1.00 0.00 O ATOM 0 H SER A 2 -24.070 22.448 -17.513 1.00 0.00 H new ATOM 0 HA SER A 2 -23.410 19.645 -17.600 1.00 0.00 H new ATOM 0 HB2 SER A 2 -21.132 20.484 -17.953 1.00 0.00 H new ATOM 0 HB3 SER A 2 -22.252 21.356 -18.980 1.00 0.00 H new ATOM 0 HG SER A 2 -20.777 22.774 -17.888 1.00 0.00 H new ATOM 19 N SER A 3 -22.087 19.237 -15.454 1.00 0.00 N ATOM 20 CA SER A 3 -21.648 18.893 -14.107 1.00 0.00 C ATOM 21 C SER A 3 -20.253 18.274 -14.132 1.00 0.00 C ATOM 22 O SER A 3 -19.900 17.549 -15.061 1.00 0.00 O ATOM 23 CB SER A 3 -22.637 17.924 -13.458 1.00 0.00 C ATOM 24 OG SER A 3 -22.334 17.728 -12.087 1.00 0.00 O ATOM 0 H SER A 3 -21.859 18.540 -16.163 1.00 0.00 H new ATOM 0 HA SER A 3 -21.609 19.810 -13.518 1.00 0.00 H new ATOM 0 HB2 SER A 3 -23.650 18.313 -13.558 1.00 0.00 H new ATOM 0 HB3 SER A 3 -22.610 16.968 -13.980 1.00 0.00 H new ATOM 0 HG SER A 3 -22.982 17.106 -11.695 1.00 0.00 H new ATOM 30 N GLY A 4 -19.464 18.566 -13.102 1.00 0.00 N ATOM 31 CA GLY A 4 -18.118 18.031 -13.024 1.00 0.00 C ATOM 32 C GLY A 4 -17.557 18.075 -11.617 1.00 0.00 C ATOM 33 O GLY A 4 -17.352 19.152 -11.056 1.00 0.00 O ATOM 0 H GLY A 4 -19.734 19.164 -12.321 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -18.119 17.001 -13.379 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -17.466 18.597 -13.689 1.00 0.00 H new ATOM 37 N SER A 5 -17.310 16.902 -11.043 1.00 0.00 N ATOM 38 CA SER A 5 -16.775 16.810 -9.689 1.00 0.00 C ATOM 39 C SER A 5 -15.717 15.715 -9.596 1.00 0.00 C ATOM 40 O SER A 5 -15.790 14.705 -10.296 1.00 0.00 O ATOM 41 CB SER A 5 -17.900 16.534 -8.691 1.00 0.00 C ATOM 42 OG SER A 5 -18.705 17.684 -8.498 1.00 0.00 O ATOM 0 H SER A 5 -17.472 16.002 -11.494 1.00 0.00 H new ATOM 0 HA SER A 5 -16.308 17.764 -9.444 1.00 0.00 H new ATOM 0 HB2 SER A 5 -18.517 15.711 -9.052 1.00 0.00 H new ATOM 0 HB3 SER A 5 -17.475 16.219 -7.738 1.00 0.00 H new ATOM 0 HG SER A 5 -19.237 17.578 -7.682 1.00 0.00 H new ATOM 48 N SER A 6 -14.733 15.924 -8.727 1.00 0.00 N ATOM 49 CA SER A 6 -13.657 14.957 -8.544 1.00 0.00 C ATOM 50 C SER A 6 -12.964 15.163 -7.200 1.00 0.00 C ATOM 51 O SER A 6 -12.636 16.287 -6.825 1.00 0.00 O ATOM 52 CB SER A 6 -12.638 15.075 -9.679 1.00 0.00 C ATOM 53 OG SER A 6 -11.491 14.286 -9.419 1.00 0.00 O ATOM 0 H SER A 6 -14.659 16.754 -8.139 1.00 0.00 H new ATOM 0 HA SER A 6 -14.093 13.958 -8.559 1.00 0.00 H new ATOM 0 HB2 SER A 6 -13.095 14.759 -10.617 1.00 0.00 H new ATOM 0 HB3 SER A 6 -12.346 16.118 -9.802 1.00 0.00 H new ATOM 0 HG SER A 6 -10.856 14.378 -10.160 1.00 0.00 H new ATOM 59 N GLY A 7 -12.746 14.067 -6.480 1.00 0.00 N ATOM 60 CA GLY A 7 -12.094 14.147 -5.186 1.00 0.00 C ATOM 61 C GLY A 7 -10.670 13.629 -5.221 1.00 0.00 C ATOM 62 O GLY A 7 -9.730 14.389 -5.453 1.00 0.00 O ATOM 0 H GLY A 7 -13.009 13.125 -6.770 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -12.092 15.183 -4.847 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -12.668 13.574 -4.457 1.00 0.00 H new ATOM 66 N VAL A 8 -10.509 12.330 -4.987 1.00 0.00 N ATOM 67 CA VAL A 8 -9.189 11.710 -4.992 1.00 0.00 C ATOM 68 C VAL A 8 -8.957 10.923 -6.276 1.00 0.00 C ATOM 69 O VAL A 8 -9.691 9.983 -6.583 1.00 0.00 O ATOM 70 CB VAL A 8 -9.006 10.770 -3.786 1.00 0.00 C ATOM 71 CG1 VAL A 8 -7.697 10.004 -3.900 1.00 0.00 C ATOM 72 CG2 VAL A 8 -9.062 11.556 -2.485 1.00 0.00 C ATOM 0 H VAL A 8 -11.276 11.687 -4.792 1.00 0.00 H new ATOM 0 HA VAL A 8 -8.460 12.517 -4.927 1.00 0.00 H new ATOM 0 HB VAL A 8 -9.822 10.048 -3.783 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -7.585 9.345 -3.039 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -7.702 9.410 -4.814 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -6.865 10.708 -3.929 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -8.931 10.876 -1.643 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -8.267 12.302 -2.476 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -10.028 12.054 -2.402 1.00 0.00 H new ATOM 82 N LYS A 9 -7.930 11.312 -7.025 1.00 0.00 N ATOM 83 CA LYS A 9 -7.598 10.642 -8.277 1.00 0.00 C ATOM 84 C LYS A 9 -7.195 9.192 -8.027 1.00 0.00 C ATOM 85 O LYS A 9 -6.770 8.835 -6.928 1.00 0.00 O ATOM 86 CB LYS A 9 -6.464 11.382 -8.990 1.00 0.00 C ATOM 87 CG LYS A 9 -6.891 12.707 -9.598 1.00 0.00 C ATOM 88 CD LYS A 9 -5.912 13.173 -10.663 1.00 0.00 C ATOM 89 CE LYS A 9 -6.072 12.381 -11.952 1.00 0.00 C ATOM 90 NZ LYS A 9 -5.109 12.824 -12.998 1.00 0.00 N ATOM 0 H LYS A 9 -7.313 12.088 -6.786 1.00 0.00 H new ATOM 0 HA LYS A 9 -8.484 10.651 -8.911 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -5.656 11.561 -8.281 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -6.063 10.743 -9.777 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -7.884 12.604 -10.035 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -6.964 13.461 -8.814 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -6.069 14.233 -10.864 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -4.892 13.066 -10.293 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -5.924 11.321 -11.748 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -7.090 12.495 -12.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -5.250 12.260 -13.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -5.267 13.829 -13.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -4.137 12.692 -12.653 1.00 0.00 H new ATOM 104 N PHE A 10 -7.329 8.360 -9.055 1.00 0.00 N ATOM 105 CA PHE A 10 -6.977 6.949 -8.947 1.00 0.00 C ATOM 106 C PHE A 10 -5.740 6.631 -9.782 1.00 0.00 C ATOM 107 O PHE A 10 -5.405 7.358 -10.718 1.00 0.00 O ATOM 108 CB PHE A 10 -8.149 6.074 -9.398 1.00 0.00 C ATOM 109 CG PHE A 10 -9.417 6.331 -8.635 1.00 0.00 C ATOM 110 CD1 PHE A 10 -9.492 6.061 -7.278 1.00 0.00 C ATOM 111 CD2 PHE A 10 -10.534 6.844 -9.275 1.00 0.00 C ATOM 112 CE1 PHE A 10 -10.658 6.296 -6.574 1.00 0.00 C ATOM 113 CE2 PHE A 10 -11.703 7.082 -8.576 1.00 0.00 C ATOM 114 CZ PHE A 10 -11.764 6.809 -7.224 1.00 0.00 C ATOM 0 H PHE A 10 -7.679 8.639 -9.972 1.00 0.00 H new ATOM 0 HA PHE A 10 -6.753 6.735 -7.902 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -8.332 6.244 -10.459 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -7.873 5.025 -9.286 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -8.630 5.662 -6.765 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -10.491 7.060 -10.332 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -10.704 6.079 -5.517 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -12.567 7.481 -9.087 1.00 0.00 H new ATOM 0 HZ PHE A 10 -12.675 6.996 -6.675 1.00 0.00 H new ATOM 124 N LEU A 11 -5.065 5.540 -9.436 1.00 0.00 N ATOM 125 CA LEU A 11 -3.864 5.124 -10.153 1.00 0.00 C ATOM 126 C LEU A 11 -2.955 6.317 -10.430 1.00 0.00 C ATOM 127 O LEU A 11 -2.308 6.390 -11.475 1.00 0.00 O ATOM 128 CB LEU A 11 -4.242 4.440 -11.468 1.00 0.00 C ATOM 129 CG LEU A 11 -4.858 3.046 -11.347 1.00 0.00 C ATOM 130 CD1 LEU A 11 -5.113 2.454 -12.724 1.00 0.00 C ATOM 131 CD2 LEU A 11 -3.956 2.133 -10.530 1.00 0.00 C ATOM 0 H LEU A 11 -5.329 4.928 -8.664 1.00 0.00 H new ATOM 0 HA LEU A 11 -3.323 4.416 -9.525 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -4.946 5.081 -11.999 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -3.348 4.368 -12.087 1.00 0.00 H new ATOM 0 HG LEU A 11 -5.814 3.136 -10.830 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -5.552 1.462 -12.618 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -5.799 3.097 -13.275 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -4.171 2.378 -13.268 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -4.411 1.145 -10.454 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -2.985 2.049 -11.018 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -3.825 2.550 -9.531 1.00 0.00 H new ATOM 143 N THR A 12 -2.909 7.252 -9.485 1.00 0.00 N ATOM 144 CA THR A 12 -2.078 8.441 -9.626 1.00 0.00 C ATOM 145 C THR A 12 -1.348 8.759 -8.326 1.00 0.00 C ATOM 146 O THR A 12 -1.941 8.737 -7.248 1.00 0.00 O ATOM 147 CB THR A 12 -2.916 9.664 -10.044 1.00 0.00 C ATOM 148 OG1 THR A 12 -4.018 9.834 -9.146 1.00 0.00 O ATOM 149 CG2 THR A 12 -3.433 9.506 -11.466 1.00 0.00 C ATOM 0 H THR A 12 -3.438 7.208 -8.614 1.00 0.00 H new ATOM 0 HA THR A 12 -1.347 8.226 -10.406 1.00 0.00 H new ATOM 0 HB THR A 12 -2.276 10.545 -10.003 1.00 0.00 H new ATOM 0 HG1 THR A 12 -3.804 9.420 -8.284 1.00 0.00 H new ATOM 0 HG21 THR A 12 -4.022 10.382 -11.738 1.00 0.00 H new ATOM 0 HG22 THR A 12 -2.591 9.408 -12.151 1.00 0.00 H new ATOM 0 HG23 THR A 12 -4.058 8.615 -11.529 1.00 0.00 H new ATOM 157 N VAL A 13 -0.057 9.055 -8.436 1.00 0.00 N ATOM 158 CA VAL A 13 0.754 9.380 -7.269 1.00 0.00 C ATOM 159 C VAL A 13 0.393 10.753 -6.713 1.00 0.00 C ATOM 160 O VAL A 13 0.630 11.776 -7.354 1.00 0.00 O ATOM 161 CB VAL A 13 2.257 9.355 -7.605 1.00 0.00 C ATOM 162 CG1 VAL A 13 3.078 9.850 -6.424 1.00 0.00 C ATOM 163 CG2 VAL A 13 2.688 7.954 -8.013 1.00 0.00 C ATOM 0 H VAL A 13 0.450 9.076 -9.321 1.00 0.00 H new ATOM 0 HA VAL A 13 0.544 8.619 -6.517 1.00 0.00 H new ATOM 0 HB VAL A 13 2.434 10.026 -8.446 1.00 0.00 H new ATOM 0 HG11 VAL A 13 4.137 9.825 -6.681 1.00 0.00 H new ATOM 0 HG12 VAL A 13 2.788 10.872 -6.182 1.00 0.00 H new ATOM 0 HG13 VAL A 13 2.899 9.208 -5.562 1.00 0.00 H new ATOM 0 HG21 VAL A 13 3.753 7.954 -8.247 1.00 0.00 H new ATOM 0 HG22 VAL A 13 2.497 7.261 -7.193 1.00 0.00 H new ATOM 0 HG23 VAL A 13 2.124 7.641 -8.891 1.00 0.00 H new ATOM 173 N ASN A 14 -0.183 10.767 -5.515 1.00 0.00 N ATOM 174 CA ASN A 14 -0.578 12.015 -4.871 1.00 0.00 C ATOM 175 C ASN A 14 0.570 12.589 -4.047 1.00 0.00 C ATOM 176 O ASN A 14 0.985 12.001 -3.048 1.00 0.00 O ATOM 177 CB ASN A 14 -1.799 11.788 -3.977 1.00 0.00 C ATOM 178 CG ASN A 14 -2.829 10.883 -4.625 1.00 0.00 C ATOM 179 OD1 ASN A 14 -3.642 11.329 -5.435 1.00 0.00 O ATOM 180 ND2 ASN A 14 -2.800 9.604 -4.270 1.00 0.00 N ATOM 0 H ASN A 14 -0.387 9.929 -4.971 1.00 0.00 H new ATOM 0 HA ASN A 14 -0.836 12.732 -5.651 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -1.478 11.350 -3.032 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -2.259 12.748 -3.743 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -3.469 8.948 -4.672 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -2.109 9.278 -3.595 1.00 0.00 H new ATOM 187 N ASP A 15 1.079 13.740 -4.472 1.00 0.00 N ATOM 188 CA ASP A 15 2.178 14.396 -3.773 1.00 0.00 C ATOM 189 C ASP A 15 2.010 14.274 -2.261 1.00 0.00 C ATOM 190 O ASP A 15 2.916 13.823 -1.561 1.00 0.00 O ATOM 191 CB ASP A 15 2.258 15.870 -4.172 1.00 0.00 C ATOM 192 CG ASP A 15 2.485 16.055 -5.660 1.00 0.00 C ATOM 193 OD1 ASP A 15 1.524 15.871 -6.434 1.00 0.00 O ATOM 194 OD2 ASP A 15 3.626 16.383 -6.050 1.00 0.00 O ATOM 0 H ASP A 15 0.748 14.239 -5.298 1.00 0.00 H new ATOM 0 HA ASP A 15 3.105 13.900 -4.059 1.00 0.00 H new ATOM 0 HB2 ASP A 15 1.335 16.372 -3.883 1.00 0.00 H new ATOM 0 HB3 ASP A 15 3.068 16.349 -3.621 1.00 0.00 H new ATOM 199 N ASP A 16 0.846 14.679 -1.766 1.00 0.00 N ATOM 200 CA ASP A 16 0.558 14.616 -0.338 1.00 0.00 C ATOM 201 C ASP A 16 1.196 13.380 0.290 1.00 0.00 C ATOM 202 O ASP A 16 0.690 12.267 0.145 1.00 0.00 O ATOM 203 CB ASP A 16 -0.952 14.602 -0.100 1.00 0.00 C ATOM 204 CG ASP A 16 -1.570 15.982 -0.220 1.00 0.00 C ATOM 205 OD1 ASP A 16 -1.529 16.556 -1.328 1.00 0.00 O ATOM 206 OD2 ASP A 16 -2.095 16.487 0.794 1.00 0.00 O ATOM 0 H ASP A 16 0.086 15.055 -2.333 1.00 0.00 H new ATOM 0 HA ASP A 16 0.983 15.502 0.133 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -1.424 13.932 -0.819 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -1.157 14.200 0.892 1.00 0.00 H new ATOM 211 N ILE A 17 2.309 13.585 0.987 1.00 0.00 N ATOM 212 CA ILE A 17 3.015 12.487 1.637 1.00 0.00 C ATOM 213 C ILE A 17 2.349 12.110 2.956 1.00 0.00 C ATOM 214 O ILE A 17 2.032 12.975 3.773 1.00 0.00 O ATOM 215 CB ILE A 17 4.489 12.846 1.902 1.00 0.00 C ATOM 216 CG1 ILE A 17 4.582 14.073 2.812 1.00 0.00 C ATOM 217 CG2 ILE A 17 5.218 13.095 0.591 1.00 0.00 C ATOM 218 CD1 ILE A 17 6.003 14.507 3.096 1.00 0.00 C ATOM 0 H ILE A 17 2.741 14.500 1.116 1.00 0.00 H new ATOM 0 HA ILE A 17 2.973 11.637 0.956 1.00 0.00 H new ATOM 0 HB ILE A 17 4.967 12.006 2.406 1.00 0.00 H new ATOM 0 HG12 ILE A 17 4.043 14.900 2.350 1.00 0.00 H new ATOM 0 HG13 ILE A 17 4.082 13.855 3.755 1.00 0.00 H new ATOM 0 HG21 ILE A 17 6.258 13.348 0.796 1.00 0.00 H new ATOM 0 HG22 ILE A 17 5.177 12.196 -0.025 1.00 0.00 H new ATOM 0 HG23 ILE A 17 4.742 13.920 0.061 1.00 0.00 H new ATOM 0 HD11 ILE A 17 5.993 15.381 3.747 1.00 0.00 H new ATOM 0 HD12 ILE A 17 6.540 13.695 3.587 1.00 0.00 H new ATOM 0 HD13 ILE A 17 6.501 14.757 2.159 1.00 0.00 H new ATOM 230 N LEU A 18 2.142 10.813 3.157 1.00 0.00 N ATOM 231 CA LEU A 18 1.516 10.320 4.379 1.00 0.00 C ATOM 232 C LEU A 18 1.981 8.902 4.694 1.00 0.00 C ATOM 233 O LEU A 18 2.249 8.110 3.790 1.00 0.00 O ATOM 234 CB LEU A 18 -0.008 10.351 4.243 1.00 0.00 C ATOM 235 CG LEU A 18 -0.655 11.736 4.261 1.00 0.00 C ATOM 236 CD1 LEU A 18 -2.158 11.626 4.055 1.00 0.00 C ATOM 237 CD2 LEU A 18 -0.345 12.452 5.567 1.00 0.00 C ATOM 0 H LEU A 18 2.398 10.085 2.490 1.00 0.00 H new ATOM 0 HA LEU A 18 1.815 10.972 5.200 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.280 9.857 3.310 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -0.437 9.761 5.053 1.00 0.00 H new ATOM 0 HG LEU A 18 -0.239 12.321 3.441 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -2.601 12.622 4.071 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -2.360 11.154 3.093 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -2.591 11.023 4.853 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -0.813 13.436 5.562 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -0.733 11.869 6.402 1.00 0.00 H new ATOM 0 HD23 LEU A 18 0.734 12.564 5.673 1.00 0.00 H new ATOM 249 N SER A 19 2.071 8.587 5.983 1.00 0.00 N ATOM 250 CA SER A 19 2.505 7.264 6.418 1.00 0.00 C ATOM 251 C SER A 19 1.537 6.189 5.934 1.00 0.00 C ATOM 252 O SER A 19 0.480 6.493 5.382 1.00 0.00 O ATOM 253 CB SER A 19 2.617 7.217 7.943 1.00 0.00 C ATOM 254 OG SER A 19 1.343 7.343 8.551 1.00 0.00 O ATOM 0 H SER A 19 1.849 9.229 6.744 1.00 0.00 H new ATOM 0 HA SER A 19 3.485 7.068 5.983 1.00 0.00 H new ATOM 0 HB2 SER A 19 3.078 6.278 8.248 1.00 0.00 H new ATOM 0 HB3 SER A 19 3.269 8.019 8.288 1.00 0.00 H new ATOM 0 HG SER A 19 1.452 7.469 9.517 1.00 0.00 H new ATOM 260 N MET A 20 1.908 4.930 6.145 1.00 0.00 N ATOM 261 CA MET A 20 1.073 3.808 5.731 1.00 0.00 C ATOM 262 C MET A 20 -0.296 3.874 6.401 1.00 0.00 C ATOM 263 O MET A 20 -1.337 3.799 5.748 1.00 0.00 O ATOM 264 CB MET A 20 1.757 2.483 6.072 1.00 0.00 C ATOM 265 CG MET A 20 1.498 1.386 5.052 1.00 0.00 C ATOM 266 SD MET A 20 0.034 0.407 5.441 1.00 0.00 S ATOM 267 CE MET A 20 -0.395 -0.220 3.819 1.00 0.00 C ATOM 0 H MET A 20 2.781 4.661 6.600 1.00 0.00 H new ATOM 0 HA MET A 20 0.933 3.869 4.652 1.00 0.00 H new ATOM 0 HB2 MET A 20 2.832 2.648 6.151 1.00 0.00 H new ATOM 0 HB3 MET A 20 1.413 2.147 7.050 1.00 0.00 H new ATOM 0 HG2 MET A 20 1.379 1.833 4.065 1.00 0.00 H new ATOM 0 HG3 MET A 20 2.367 0.729 5.002 1.00 0.00 H new ATOM 0 HE1 MET A 20 -1.274 -0.860 3.897 1.00 0.00 H new ATOM 0 HE2 MET A 20 -0.612 0.614 3.152 1.00 0.00 H new ATOM 0 HE3 MET A 20 0.439 -0.796 3.419 1.00 0.00 H new ATOM 277 N PRO A 21 -0.298 4.018 7.735 1.00 0.00 N ATOM 278 CA PRO A 21 -1.532 4.097 8.521 1.00 0.00 C ATOM 279 C PRO A 21 -2.289 5.399 8.282 1.00 0.00 C ATOM 280 O PRO A 21 -3.402 5.579 8.775 1.00 0.00 O ATOM 281 CB PRO A 21 -1.037 4.024 9.967 1.00 0.00 C ATOM 282 CG PRO A 21 0.362 4.535 9.915 1.00 0.00 C ATOM 283 CD PRO A 21 0.906 4.114 8.577 1.00 0.00 C ATOM 0 HA PRO A 21 -2.235 3.307 8.257 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -1.656 4.631 10.628 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -1.072 3.003 10.346 1.00 0.00 H new ATOM 0 HG2 PRO A 21 0.386 5.619 10.023 1.00 0.00 H new ATOM 0 HG3 PRO A 21 0.959 4.121 10.727 1.00 0.00 H new ATOM 0 HD2 PRO A 21 1.614 4.843 8.184 1.00 0.00 H new ATOM 0 HD3 PRO A 21 1.431 3.161 8.638 1.00 0.00 H new ATOM 291 N GLN A 22 -1.678 6.302 7.522 1.00 0.00 N ATOM 292 CA GLN A 22 -2.296 7.588 7.218 1.00 0.00 C ATOM 293 C GLN A 22 -2.857 7.601 5.800 1.00 0.00 C ATOM 294 O GLN A 22 -3.890 8.215 5.537 1.00 0.00 O ATOM 295 CB GLN A 22 -1.280 8.718 7.388 1.00 0.00 C ATOM 296 CG GLN A 22 -1.191 9.248 8.810 1.00 0.00 C ATOM 297 CD GLN A 22 -0.676 10.672 8.872 1.00 0.00 C ATOM 298 OE1 GLN A 22 -1.423 11.602 9.179 1.00 0.00 O ATOM 299 NE2 GLN A 22 0.607 10.852 8.579 1.00 0.00 N ATOM 0 H GLN A 22 -0.757 6.167 7.106 1.00 0.00 H new ATOM 0 HA GLN A 22 -3.119 7.741 7.916 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -0.297 8.361 7.080 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -1.545 9.537 6.720 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -2.177 9.202 9.273 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -0.534 8.603 9.394 1.00 0.00 H new ATOM 0 HE21 GLN A 22 1.190 10.053 8.330 1.00 0.00 H new ATOM 0 HE22 GLN A 22 1.009 11.789 8.603 1.00 0.00 H new ATOM 308 N ALA A 23 -2.168 6.919 4.890 1.00 0.00 N ATOM 309 CA ALA A 23 -2.598 6.851 3.499 1.00 0.00 C ATOM 310 C ALA A 23 -3.811 5.941 3.344 1.00 0.00 C ATOM 311 O ALA A 23 -4.904 6.398 3.009 1.00 0.00 O ATOM 312 CB ALA A 23 -1.457 6.368 2.617 1.00 0.00 C ATOM 0 H ALA A 23 -1.310 6.406 5.092 1.00 0.00 H new ATOM 0 HA ALA A 23 -2.886 7.854 3.184 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -1.792 6.322 1.581 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -0.618 7.059 2.696 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -1.142 5.376 2.941 1.00 0.00 H new ATOM 318 N ARG A 24 -3.612 4.650 3.589 1.00 0.00 N ATOM 319 CA ARG A 24 -4.689 3.675 3.474 1.00 0.00 C ATOM 320 C ARG A 24 -5.958 4.184 4.152 1.00 0.00 C ATOM 321 O ARG A 24 -7.069 3.886 3.715 1.00 0.00 O ATOM 322 CB ARG A 24 -4.267 2.341 4.093 1.00 0.00 C ATOM 323 CG ARG A 24 -4.113 2.393 5.604 1.00 0.00 C ATOM 324 CD ARG A 24 -3.537 1.096 6.151 1.00 0.00 C ATOM 325 NE ARG A 24 -4.582 0.137 6.498 1.00 0.00 N ATOM 326 CZ ARG A 24 -4.340 -1.128 6.823 1.00 0.00 C ATOM 327 NH1 ARG A 24 -3.095 -1.584 6.846 1.00 0.00 N ATOM 328 NH2 ARG A 24 -5.345 -1.940 7.127 1.00 0.00 N ATOM 0 H ARG A 24 -2.714 4.255 3.869 1.00 0.00 H new ATOM 0 HA ARG A 24 -4.898 3.526 2.415 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -5.006 1.582 3.837 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -3.322 2.028 3.650 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -3.463 3.224 5.876 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -5.083 2.584 6.063 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -2.871 0.654 5.410 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -2.934 1.311 7.033 1.00 0.00 H new ATOM 0 HE ARG A 24 -5.551 0.456 6.490 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -2.320 -0.963 6.614 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -2.912 -2.556 7.096 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -6.304 -1.593 7.111 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -5.158 -2.911 7.376 1.00 0.00 H new ATOM 342 N ASN A 25 -5.783 4.953 5.222 1.00 0.00 N ATOM 343 CA ASN A 25 -6.914 5.503 5.961 1.00 0.00 C ATOM 344 C ASN A 25 -7.643 6.557 5.134 1.00 0.00 C ATOM 345 O ASN A 25 -8.873 6.590 5.095 1.00 0.00 O ATOM 346 CB ASN A 25 -6.438 6.112 7.281 1.00 0.00 C ATOM 347 CG ASN A 25 -7.313 7.265 7.734 1.00 0.00 C ATOM 348 OD1 ASN A 25 -8.503 7.091 7.996 1.00 0.00 O ATOM 349 ND2 ASN A 25 -6.725 8.452 7.827 1.00 0.00 N ATOM 0 H ASN A 25 -4.870 5.209 5.596 1.00 0.00 H new ATOM 0 HA ASN A 25 -7.609 4.690 6.173 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -6.430 5.341 8.052 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -5.412 6.461 7.168 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -7.263 9.266 8.126 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -5.735 8.550 7.600 1.00 0.00 H new ATOM 356 N PHE A 26 -6.875 7.418 4.474 1.00 0.00 N ATOM 357 CA PHE A 26 -7.448 8.475 3.648 1.00 0.00 C ATOM 358 C PHE A 26 -8.216 7.887 2.468 1.00 0.00 C ATOM 359 O PHE A 26 -9.428 8.069 2.349 1.00 0.00 O ATOM 360 CB PHE A 26 -6.346 9.408 3.140 1.00 0.00 C ATOM 361 CG PHE A 26 -6.843 10.463 2.194 1.00 0.00 C ATOM 362 CD1 PHE A 26 -7.964 11.217 2.504 1.00 0.00 C ATOM 363 CD2 PHE A 26 -6.191 10.701 0.995 1.00 0.00 C ATOM 364 CE1 PHE A 26 -8.424 12.190 1.635 1.00 0.00 C ATOM 365 CE2 PHE A 26 -6.646 11.672 0.123 1.00 0.00 C ATOM 366 CZ PHE A 26 -7.764 12.417 0.443 1.00 0.00 C ATOM 0 H PHE A 26 -5.855 7.405 4.495 1.00 0.00 H new ATOM 0 HA PHE A 26 -8.143 9.046 4.263 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -5.869 9.891 3.992 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -5.580 8.815 2.640 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -8.484 11.043 3.434 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -5.317 10.121 0.739 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -9.298 12.771 1.888 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -6.128 11.848 -0.808 1.00 0.00 H new ATOM 0 HZ PHE A 26 -8.122 13.176 -0.237 1.00 0.00 H new ATOM 376 N CYS A 27 -7.502 7.181 1.598 1.00 0.00 N ATOM 377 CA CYS A 27 -8.115 6.567 0.426 1.00 0.00 C ATOM 378 C CYS A 27 -9.422 5.871 0.797 1.00 0.00 C ATOM 379 O CYS A 27 -10.396 5.917 0.046 1.00 0.00 O ATOM 380 CB CYS A 27 -7.152 5.562 -0.210 1.00 0.00 C ATOM 381 SG CYS A 27 -5.603 6.300 -0.820 1.00 0.00 S ATOM 0 H CYS A 27 -6.498 7.020 1.682 1.00 0.00 H new ATOM 0 HA CYS A 27 -8.336 7.355 -0.294 1.00 0.00 H new ATOM 0 HB2 CYS A 27 -6.911 4.792 0.523 1.00 0.00 H new ATOM 0 HB3 CYS A 27 -7.657 5.066 -1.039 1.00 0.00 H new ATOM 386 N ALA A 28 -9.434 5.228 1.960 1.00 0.00 N ATOM 387 CA ALA A 28 -10.620 4.525 2.432 1.00 0.00 C ATOM 388 C ALA A 28 -11.757 5.500 2.720 1.00 0.00 C ATOM 389 O ALA A 28 -12.869 5.339 2.216 1.00 0.00 O ATOM 390 CB ALA A 28 -10.292 3.711 3.675 1.00 0.00 C ATOM 0 H ALA A 28 -8.635 5.180 2.593 1.00 0.00 H new ATOM 0 HA ALA A 28 -10.948 3.847 1.644 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -11.187 3.191 4.016 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -9.517 2.982 3.438 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -9.936 4.376 4.462 1.00 0.00 H new ATOM 396 N SER A 29 -11.472 6.511 3.534 1.00 0.00 N ATOM 397 CA SER A 29 -12.472 7.509 3.893 1.00 0.00 C ATOM 398 C SER A 29 -12.997 8.223 2.651 1.00 0.00 C ATOM 399 O SER A 29 -14.179 8.555 2.566 1.00 0.00 O ATOM 400 CB SER A 29 -11.880 8.528 4.869 1.00 0.00 C ATOM 401 OG SER A 29 -12.757 9.625 5.056 1.00 0.00 O ATOM 0 H SER A 29 -10.556 6.661 3.958 1.00 0.00 H new ATOM 0 HA SER A 29 -13.304 6.996 4.375 1.00 0.00 H new ATOM 0 HB2 SER A 29 -11.685 8.047 5.828 1.00 0.00 H new ATOM 0 HB3 SER A 29 -10.922 8.885 4.490 1.00 0.00 H new ATOM 0 HG SER A 29 -12.356 10.261 5.685 1.00 0.00 H new ATOM 407 N ALA A 30 -12.109 8.456 1.690 1.00 0.00 N ATOM 408 CA ALA A 30 -12.482 9.128 0.452 1.00 0.00 C ATOM 409 C ALA A 30 -13.345 8.226 -0.424 1.00 0.00 C ATOM 410 O ALA A 30 -14.286 8.687 -1.069 1.00 0.00 O ATOM 411 CB ALA A 30 -11.238 9.568 -0.305 1.00 0.00 C ATOM 0 H ALA A 30 -11.126 8.189 1.745 1.00 0.00 H new ATOM 0 HA ALA A 30 -13.069 10.010 0.709 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -11.532 10.069 -1.228 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -10.660 10.256 0.313 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -10.629 8.696 -0.543 1.00 0.00 H new ATOM 417 N GLY A 31 -13.018 6.937 -0.442 1.00 0.00 N ATOM 418 CA GLY A 31 -13.774 5.992 -1.243 1.00 0.00 C ATOM 419 C GLY A 31 -12.884 5.136 -2.122 1.00 0.00 C ATOM 420 O GLY A 31 -13.150 4.968 -3.311 1.00 0.00 O ATOM 0 H GLY A 31 -12.244 6.531 0.083 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -14.358 5.348 -0.585 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -14.483 6.535 -1.868 1.00 0.00 H new ATOM 424 N GLY A 32 -11.820 4.594 -1.536 1.00 0.00 N ATOM 425 CA GLY A 32 -10.903 3.759 -2.290 1.00 0.00 C ATOM 426 C GLY A 32 -9.884 3.070 -1.403 1.00 0.00 C ATOM 427 O GLY A 32 -9.831 3.319 -0.198 1.00 0.00 O ATOM 0 H GLY A 32 -11.577 4.718 -0.553 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -11.469 3.007 -2.840 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -10.384 4.370 -3.028 1.00 0.00 H new ATOM 431 N TYR A 33 -9.075 2.202 -1.999 1.00 0.00 N ATOM 432 CA TYR A 33 -8.055 1.472 -1.255 1.00 0.00 C ATOM 433 C TYR A 33 -6.737 1.442 -2.023 1.00 0.00 C ATOM 434 O TYR A 33 -6.723 1.412 -3.254 1.00 0.00 O ATOM 435 CB TYR A 33 -8.525 0.045 -0.970 1.00 0.00 C ATOM 436 CG TYR A 33 -9.043 -0.677 -2.193 1.00 0.00 C ATOM 437 CD1 TYR A 33 -8.171 -1.151 -3.166 1.00 0.00 C ATOM 438 CD2 TYR A 33 -10.404 -0.888 -2.376 1.00 0.00 C ATOM 439 CE1 TYR A 33 -8.639 -1.810 -4.285 1.00 0.00 C ATOM 440 CE2 TYR A 33 -10.882 -1.548 -3.491 1.00 0.00 C ATOM 441 CZ TYR A 33 -9.996 -2.007 -4.443 1.00 0.00 C ATOM 442 OH TYR A 33 -10.466 -2.665 -5.556 1.00 0.00 O ATOM 0 H TYR A 33 -9.105 1.986 -2.995 1.00 0.00 H new ATOM 0 HA TYR A 33 -7.892 1.989 -0.309 1.00 0.00 H new ATOM 0 HB2 TYR A 33 -7.697 -0.523 -0.546 1.00 0.00 H new ATOM 0 HB3 TYR A 33 -9.311 0.074 -0.215 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -7.108 -1.001 -3.044 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -11.101 -0.529 -1.633 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -7.947 -2.169 -5.033 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -11.943 -1.704 -3.617 1.00 0.00 H new ATOM 0 HH TYR A 33 -9.808 -2.597 -6.279 1.00 0.00 H new ATOM 452 N LEU A 34 -5.631 1.449 -1.287 1.00 0.00 N ATOM 453 CA LEU A 34 -4.306 1.421 -1.896 1.00 0.00 C ATOM 454 C LEU A 34 -4.291 0.516 -3.124 1.00 0.00 C ATOM 455 O LEU A 34 -4.955 -0.520 -3.152 1.00 0.00 O ATOM 456 CB LEU A 34 -3.266 0.943 -0.882 1.00 0.00 C ATOM 457 CG LEU A 34 -2.827 1.968 0.163 1.00 0.00 C ATOM 458 CD1 LEU A 34 -2.166 1.276 1.345 1.00 0.00 C ATOM 459 CD2 LEU A 34 -1.883 2.990 -0.455 1.00 0.00 C ATOM 0 H LEU A 34 -5.626 1.474 -0.267 1.00 0.00 H new ATOM 0 HA LEU A 34 -4.056 2.434 -2.211 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -3.668 0.073 -0.362 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -2.383 0.609 -1.427 1.00 0.00 H new ATOM 0 HG LEU A 34 -3.712 2.492 0.523 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -1.860 2.022 2.079 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -2.873 0.584 1.804 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -1.291 0.725 1.001 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -1.581 3.712 0.304 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -1.001 2.482 -0.844 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.391 3.509 -1.268 1.00 0.00 H new ATOM 471 N ALA A 35 -3.525 0.912 -4.135 1.00 0.00 N ATOM 472 CA ALA A 35 -3.419 0.134 -5.363 1.00 0.00 C ATOM 473 C ALA A 35 -2.400 -0.990 -5.215 1.00 0.00 C ATOM 474 O ALA A 35 -1.221 -0.742 -4.962 1.00 0.00 O ATOM 475 CB ALA A 35 -3.046 1.037 -6.530 1.00 0.00 C ATOM 0 H ALA A 35 -2.969 1.767 -4.128 1.00 0.00 H new ATOM 0 HA ALA A 35 -4.391 -0.317 -5.563 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -2.970 0.442 -7.440 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -3.813 1.801 -6.658 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -2.087 1.515 -6.328 1.00 0.00 H new ATOM 481 N ASP A 36 -2.861 -2.226 -5.373 1.00 0.00 N ATOM 482 CA ASP A 36 -1.989 -3.388 -5.257 1.00 0.00 C ATOM 483 C ASP A 36 -0.922 -3.378 -6.348 1.00 0.00 C ATOM 484 O ASP A 36 -1.022 -2.630 -7.320 1.00 0.00 O ATOM 485 CB ASP A 36 -2.808 -4.677 -5.339 1.00 0.00 C ATOM 486 CG ASP A 36 -3.709 -4.714 -6.557 1.00 0.00 C ATOM 487 OD1 ASP A 36 -4.829 -4.166 -6.483 1.00 0.00 O ATOM 488 OD2 ASP A 36 -3.296 -5.291 -7.585 1.00 0.00 O ATOM 0 H ASP A 36 -3.834 -2.449 -5.582 1.00 0.00 H new ATOM 0 HA ASP A 36 -1.492 -3.343 -4.288 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -2.133 -5.532 -5.364 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -3.415 -4.776 -4.439 1.00 0.00 H new ATOM 493 N ASP A 37 0.098 -4.213 -6.178 1.00 0.00 N ATOM 494 CA ASP A 37 1.183 -4.300 -7.148 1.00 0.00 C ATOM 495 C ASP A 37 1.471 -5.753 -7.512 1.00 0.00 C ATOM 496 O ASP A 37 2.603 -6.223 -7.388 1.00 0.00 O ATOM 497 CB ASP A 37 2.447 -3.641 -6.592 1.00 0.00 C ATOM 498 CG ASP A 37 3.358 -3.121 -7.687 1.00 0.00 C ATOM 499 OD1 ASP A 37 4.105 -3.932 -8.271 1.00 0.00 O ATOM 500 OD2 ASP A 37 3.324 -1.902 -7.959 1.00 0.00 O ATOM 0 H ASP A 37 0.196 -4.838 -5.378 1.00 0.00 H new ATOM 0 HA ASP A 37 0.874 -3.772 -8.050 1.00 0.00 H new ATOM 0 HB2 ASP A 37 2.165 -2.817 -5.936 1.00 0.00 H new ATOM 0 HB3 ASP A 37 2.991 -4.362 -5.982 1.00 0.00 H new ATOM 505 N LEU A 38 0.440 -6.461 -7.959 1.00 0.00 N ATOM 506 CA LEU A 38 0.582 -7.862 -8.340 1.00 0.00 C ATOM 507 C LEU A 38 0.134 -8.083 -9.781 1.00 0.00 C ATOM 508 O LEU A 38 -1.053 -8.001 -10.093 1.00 0.00 O ATOM 509 CB LEU A 38 -0.233 -8.752 -7.399 1.00 0.00 C ATOM 510 CG LEU A 38 -1.728 -8.442 -7.310 1.00 0.00 C ATOM 511 CD1 LEU A 38 -2.503 -9.252 -8.338 1.00 0.00 C ATOM 512 CD2 LEU A 38 -2.248 -8.721 -5.907 1.00 0.00 C ATOM 0 H LEU A 38 -0.503 -6.088 -8.067 1.00 0.00 H new ATOM 0 HA LEU A 38 1.636 -8.129 -8.262 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -0.115 -9.788 -7.718 1.00 0.00 H new ATOM 0 HB3 LEU A 38 0.194 -8.676 -6.399 1.00 0.00 H new ATOM 0 HG LEU A 38 -1.874 -7.384 -7.526 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -3.565 -9.018 -8.260 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -2.149 -9.004 -9.339 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -2.351 -10.315 -8.153 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.313 -8.495 -5.862 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -2.089 -9.771 -5.662 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -1.714 -8.097 -5.190 1.00 0.00 H new ATOM 524 N GLY A 39 1.094 -8.364 -10.657 1.00 0.00 N ATOM 525 CA GLY A 39 0.779 -8.594 -12.055 1.00 0.00 C ATOM 526 C GLY A 39 1.820 -8.010 -12.988 1.00 0.00 C ATOM 527 O GLY A 39 2.007 -6.794 -13.037 1.00 0.00 O ATOM 0 H GLY A 39 2.084 -8.436 -10.423 1.00 0.00 H new ATOM 0 HA2 GLY A 39 0.696 -9.666 -12.234 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -0.193 -8.157 -12.282 1.00 0.00 H new ATOM 531 N ASP A 40 2.502 -8.877 -13.729 1.00 0.00 N ATOM 532 CA ASP A 40 3.531 -8.439 -14.665 1.00 0.00 C ATOM 533 C ASP A 40 3.154 -7.106 -15.303 1.00 0.00 C ATOM 534 O ASP A 40 4.013 -6.257 -15.543 1.00 0.00 O ATOM 535 CB ASP A 40 3.746 -9.495 -15.750 1.00 0.00 C ATOM 536 CG ASP A 40 3.917 -10.888 -15.177 1.00 0.00 C ATOM 537 OD1 ASP A 40 4.420 -11.003 -14.039 1.00 0.00 O ATOM 538 OD2 ASP A 40 3.550 -11.863 -15.865 1.00 0.00 O ATOM 0 H ASP A 40 2.361 -9.887 -13.700 1.00 0.00 H new ATOM 0 HA ASP A 40 4.459 -8.305 -14.110 1.00 0.00 H new ATOM 0 HB2 ASP A 40 2.896 -9.488 -16.433 1.00 0.00 H new ATOM 0 HB3 ASP A 40 4.628 -9.236 -16.336 1.00 0.00 H new ATOM 543 N ASP A 41 1.866 -6.929 -15.575 1.00 0.00 N ATOM 544 CA ASP A 41 1.375 -5.699 -16.186 1.00 0.00 C ATOM 545 C ASP A 41 1.128 -4.629 -15.127 1.00 0.00 C ATOM 546 O ASP A 41 1.465 -3.460 -15.320 1.00 0.00 O ATOM 547 CB ASP A 41 0.088 -5.970 -16.966 1.00 0.00 C ATOM 548 CG ASP A 41 -0.151 -4.949 -18.061 1.00 0.00 C ATOM 549 OD1 ASP A 41 0.828 -4.312 -18.503 1.00 0.00 O ATOM 550 OD2 ASP A 41 -1.318 -4.787 -18.476 1.00 0.00 O ATOM 0 H ASP A 41 1.143 -7.622 -15.382 1.00 0.00 H new ATOM 0 HA ASP A 41 2.137 -5.334 -16.875 1.00 0.00 H new ATOM 0 HB2 ASP A 41 0.136 -6.966 -17.406 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -0.758 -5.966 -16.278 1.00 0.00 H new ATOM 555 N LYS A 42 0.536 -5.035 -14.009 1.00 0.00 N ATOM 556 CA LYS A 42 0.243 -4.112 -12.919 1.00 0.00 C ATOM 557 C LYS A 42 1.496 -3.348 -12.502 1.00 0.00 C ATOM 558 O LYS A 42 1.455 -2.135 -12.297 1.00 0.00 O ATOM 559 CB LYS A 42 -0.327 -4.872 -11.720 1.00 0.00 C ATOM 560 CG LYS A 42 -1.247 -4.033 -10.849 1.00 0.00 C ATOM 561 CD LYS A 42 -2.565 -3.745 -11.547 1.00 0.00 C ATOM 562 CE LYS A 42 -3.250 -2.520 -10.961 1.00 0.00 C ATOM 563 NZ LYS A 42 -4.718 -2.532 -11.211 1.00 0.00 N ATOM 0 H LYS A 42 0.249 -5.998 -13.834 1.00 0.00 H new ATOM 0 HA LYS A 42 -0.498 -3.395 -13.272 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -0.875 -5.743 -12.080 1.00 0.00 H new ATOM 0 HB3 LYS A 42 0.497 -5.244 -11.111 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -1.437 -4.555 -9.911 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -0.755 -3.094 -10.597 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -2.388 -3.590 -12.611 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -3.223 -4.609 -11.456 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -3.065 -2.479 -9.888 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -2.815 -1.619 -11.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -5.148 -1.681 -10.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -4.896 -2.545 -12.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -5.137 -3.379 -10.776 1.00 0.00 H new ATOM 577 N ASN A 43 2.608 -4.065 -12.378 1.00 0.00 N ATOM 578 CA ASN A 43 3.872 -3.454 -11.986 1.00 0.00 C ATOM 579 C ASN A 43 4.438 -2.601 -13.117 1.00 0.00 C ATOM 580 O ASN A 43 4.792 -1.440 -12.915 1.00 0.00 O ATOM 581 CB ASN A 43 4.883 -4.532 -11.591 1.00 0.00 C ATOM 582 CG ASN A 43 6.295 -3.990 -11.485 1.00 0.00 C ATOM 583 OD1 ASN A 43 6.859 -3.904 -10.394 1.00 0.00 O ATOM 584 ND2 ASN A 43 6.874 -3.621 -12.622 1.00 0.00 N ATOM 0 H ASN A 43 2.659 -5.070 -12.543 1.00 0.00 H new ATOM 0 HA ASN A 43 3.684 -2.809 -11.127 1.00 0.00 H new ATOM 0 HB2 ASN A 43 4.591 -4.967 -10.635 1.00 0.00 H new ATOM 0 HB3 ASN A 43 4.860 -5.335 -12.327 1.00 0.00 H new ATOM 0 HD21 ASN A 43 7.824 -3.249 -12.613 1.00 0.00 H new ATOM 0 HD22 ASN A 43 6.369 -3.710 -13.504 1.00 0.00 H new ATOM 591 N ASN A 44 4.520 -3.186 -14.308 1.00 0.00 N ATOM 592 CA ASN A 44 5.042 -2.480 -15.472 1.00 0.00 C ATOM 593 C ASN A 44 4.339 -1.138 -15.655 1.00 0.00 C ATOM 594 O ASN A 44 4.956 -0.151 -16.057 1.00 0.00 O ATOM 595 CB ASN A 44 4.874 -3.333 -16.730 1.00 0.00 C ATOM 596 CG ASN A 44 6.032 -4.289 -16.941 1.00 0.00 C ATOM 597 OD1 ASN A 44 7.169 -3.995 -16.569 1.00 0.00 O ATOM 598 ND2 ASN A 44 5.748 -5.439 -17.540 1.00 0.00 N ATOM 0 H ASN A 44 4.232 -4.147 -14.492 1.00 0.00 H new ATOM 0 HA ASN A 44 6.103 -2.294 -15.307 1.00 0.00 H new ATOM 0 HB2 ASN A 44 3.946 -3.901 -16.659 1.00 0.00 H new ATOM 0 HB3 ASN A 44 4.783 -2.680 -17.598 1.00 0.00 H new ATOM 0 HD21 ASN A 44 6.487 -6.122 -17.709 1.00 0.00 H new ATOM 0 HD22 ASN A 44 4.791 -5.640 -17.831 1.00 0.00 H new ATOM 605 N PHE A 45 3.045 -1.109 -15.358 1.00 0.00 N ATOM 606 CA PHE A 45 2.256 0.110 -15.490 1.00 0.00 C ATOM 607 C PHE A 45 2.700 1.158 -14.473 1.00 0.00 C ATOM 608 O PHE A 45 2.744 2.351 -14.773 1.00 0.00 O ATOM 609 CB PHE A 45 0.769 -0.196 -15.307 1.00 0.00 C ATOM 610 CG PHE A 45 -0.040 0.994 -14.876 1.00 0.00 C ATOM 611 CD1 PHE A 45 -0.359 1.995 -15.779 1.00 0.00 C ATOM 612 CD2 PHE A 45 -0.480 1.112 -13.567 1.00 0.00 C ATOM 613 CE1 PHE A 45 -1.104 3.092 -15.385 1.00 0.00 C ATOM 614 CE2 PHE A 45 -1.225 2.205 -13.168 1.00 0.00 C ATOM 615 CZ PHE A 45 -1.536 3.197 -14.078 1.00 0.00 C ATOM 0 H PHE A 45 2.519 -1.917 -15.024 1.00 0.00 H new ATOM 0 HA PHE A 45 2.416 0.509 -16.491 1.00 0.00 H new ATOM 0 HB2 PHE A 45 0.367 -0.578 -16.245 1.00 0.00 H new ATOM 0 HB3 PHE A 45 0.658 -0.988 -14.567 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.022 1.918 -16.802 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -0.238 0.341 -12.851 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.347 3.865 -16.099 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -1.564 2.284 -12.146 1.00 0.00 H new ATOM 0 HZ PHE A 45 -2.116 4.053 -13.767 1.00 0.00 H new ATOM 625 N TYR A 46 3.028 0.702 -13.269 1.00 0.00 N ATOM 626 CA TYR A 46 3.465 1.599 -12.205 1.00 0.00 C ATOM 627 C TYR A 46 4.891 2.082 -12.452 1.00 0.00 C ATOM 628 O TYR A 46 5.152 3.284 -12.497 1.00 0.00 O ATOM 629 CB TYR A 46 3.380 0.896 -10.849 1.00 0.00 C ATOM 630 CG TYR A 46 1.964 0.650 -10.382 1.00 0.00 C ATOM 631 CD1 TYR A 46 1.035 1.683 -10.343 1.00 0.00 C ATOM 632 CD2 TYR A 46 1.553 -0.615 -9.980 1.00 0.00 C ATOM 633 CE1 TYR A 46 -0.260 1.464 -9.916 1.00 0.00 C ATOM 634 CE2 TYR A 46 0.260 -0.844 -9.553 1.00 0.00 C ATOM 635 CZ TYR A 46 -0.643 0.198 -9.522 1.00 0.00 C ATOM 636 OH TYR A 46 -1.933 -0.025 -9.097 1.00 0.00 O ATOM 0 H TYR A 46 3.000 -0.283 -13.005 1.00 0.00 H new ATOM 0 HA TYR A 46 2.803 2.465 -12.199 1.00 0.00 H new ATOM 0 HB2 TYR A 46 3.904 -0.058 -10.910 1.00 0.00 H new ATOM 0 HB3 TYR A 46 3.900 1.498 -10.104 1.00 0.00 H new ATOM 0 HD1 TYR A 46 1.331 2.675 -10.652 1.00 0.00 H new ATOM 0 HD2 TYR A 46 2.257 -1.433 -10.002 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -0.969 2.279 -9.891 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -0.043 -1.834 -9.245 1.00 0.00 H new ATOM 0 HH TYR A 46 -2.526 -0.097 -9.874 1.00 0.00 H new ATOM 646 N SER A 47 5.810 1.135 -12.613 1.00 0.00 N ATOM 647 CA SER A 47 7.211 1.462 -12.852 1.00 0.00 C ATOM 648 C SER A 47 7.337 2.727 -13.695 1.00 0.00 C ATOM 649 O SER A 47 8.279 3.503 -13.534 1.00 0.00 O ATOM 650 CB SER A 47 7.916 0.298 -13.550 1.00 0.00 C ATOM 651 OG SER A 47 9.311 0.529 -13.645 1.00 0.00 O ATOM 0 H SER A 47 5.610 0.135 -12.582 1.00 0.00 H new ATOM 0 HA SER A 47 7.687 1.640 -11.888 1.00 0.00 H new ATOM 0 HB2 SER A 47 7.734 -0.625 -12.999 1.00 0.00 H new ATOM 0 HB3 SER A 47 7.498 0.161 -14.547 1.00 0.00 H new ATOM 0 HG SER A 47 9.738 -0.230 -14.094 1.00 0.00 H new ATOM 657 N SER A 48 6.380 2.928 -14.596 1.00 0.00 N ATOM 658 CA SER A 48 6.385 4.097 -15.468 1.00 0.00 C ATOM 659 C SER A 48 6.100 5.368 -14.674 1.00 0.00 C ATOM 660 O SER A 48 6.916 6.290 -14.645 1.00 0.00 O ATOM 661 CB SER A 48 5.347 3.933 -16.580 1.00 0.00 C ATOM 662 OG SER A 48 5.708 2.887 -17.465 1.00 0.00 O ATOM 0 H SER A 48 5.592 2.297 -14.741 1.00 0.00 H new ATOM 0 HA SER A 48 7.376 4.183 -15.915 1.00 0.00 H new ATOM 0 HB2 SER A 48 4.371 3.723 -16.142 1.00 0.00 H new ATOM 0 HB3 SER A 48 5.253 4.867 -17.135 1.00 0.00 H new ATOM 0 HG SER A 48 5.028 2.802 -18.165 1.00 0.00 H new ATOM 668 N ILE A 49 4.938 5.410 -14.033 1.00 0.00 N ATOM 669 CA ILE A 49 4.545 6.567 -13.238 1.00 0.00 C ATOM 670 C ILE A 49 5.363 6.654 -11.954 1.00 0.00 C ATOM 671 O ILE A 49 5.324 7.662 -11.249 1.00 0.00 O ATOM 672 CB ILE A 49 3.048 6.522 -12.878 1.00 0.00 C ATOM 673 CG1 ILE A 49 2.759 5.337 -11.953 1.00 0.00 C ATOM 674 CG2 ILE A 49 2.203 6.434 -14.140 1.00 0.00 C ATOM 675 CD1 ILE A 49 1.526 5.525 -11.098 1.00 0.00 C ATOM 0 H ILE A 49 4.251 4.656 -14.048 1.00 0.00 H new ATOM 0 HA ILE A 49 4.736 7.449 -13.849 1.00 0.00 H new ATOM 0 HB ILE A 49 2.787 7.441 -12.353 1.00 0.00 H new ATOM 0 HG12 ILE A 49 2.640 4.437 -12.556 1.00 0.00 H new ATOM 0 HG13 ILE A 49 3.620 5.174 -11.304 1.00 0.00 H new ATOM 0 HG21 ILE A 49 1.148 6.403 -13.870 1.00 0.00 H new ATOM 0 HG22 ILE A 49 2.392 7.306 -14.766 1.00 0.00 H new ATOM 0 HG23 ILE A 49 2.463 5.530 -14.690 1.00 0.00 H new ATOM 0 HD11 ILE A 49 1.383 4.647 -10.468 1.00 0.00 H new ATOM 0 HD12 ILE A 49 1.650 6.406 -10.469 1.00 0.00 H new ATOM 0 HD13 ILE A 49 0.655 5.657 -11.740 1.00 0.00 H new ATOM 687 N ALA A 50 6.103 5.592 -11.657 1.00 0.00 N ATOM 688 CA ALA A 50 6.934 5.550 -10.460 1.00 0.00 C ATOM 689 C ALA A 50 8.352 6.023 -10.758 1.00 0.00 C ATOM 690 O ALA A 50 9.290 5.703 -10.029 1.00 0.00 O ATOM 691 CB ALA A 50 6.956 4.142 -9.882 1.00 0.00 C ATOM 0 H ALA A 50 6.144 4.748 -12.229 1.00 0.00 H new ATOM 0 HA ALA A 50 6.501 6.227 -9.724 1.00 0.00 H new ATOM 0 HB1 ALA A 50 7.580 4.125 -8.989 1.00 0.00 H new ATOM 0 HB2 ALA A 50 5.942 3.840 -9.622 1.00 0.00 H new ATOM 0 HB3 ALA A 50 7.362 3.452 -10.621 1.00 0.00 H new ATOM 697 N ALA A 51 8.501 6.788 -11.835 1.00 0.00 N ATOM 698 CA ALA A 51 9.805 7.307 -12.229 1.00 0.00 C ATOM 699 C ALA A 51 10.500 7.992 -11.057 1.00 0.00 C ATOM 700 O ALA A 51 10.103 9.078 -10.637 1.00 0.00 O ATOM 701 CB ALA A 51 9.658 8.272 -13.396 1.00 0.00 C ATOM 0 H ALA A 51 7.735 7.062 -12.450 1.00 0.00 H new ATOM 0 HA ALA A 51 10.424 6.466 -12.543 1.00 0.00 H new ATOM 0 HB1 ALA A 51 10.639 8.652 -13.680 1.00 0.00 H new ATOM 0 HB2 ALA A 51 9.211 7.753 -14.244 1.00 0.00 H new ATOM 0 HB3 ALA A 51 9.018 9.104 -13.102 1.00 0.00 H new ATOM 707 N ASN A 52 11.539 7.349 -10.534 1.00 0.00 N ATOM 708 CA ASN A 52 12.289 7.897 -9.409 1.00 0.00 C ATOM 709 C ASN A 52 11.347 8.376 -8.309 1.00 0.00 C ATOM 710 O ASN A 52 11.656 9.315 -7.575 1.00 0.00 O ATOM 711 CB ASN A 52 13.176 9.053 -9.875 1.00 0.00 C ATOM 712 CG ASN A 52 12.374 10.291 -10.227 1.00 0.00 C ATOM 713 OD1 ASN A 52 12.014 11.081 -9.354 1.00 0.00 O ATOM 714 ND2 ASN A 52 12.090 10.466 -11.513 1.00 0.00 N ATOM 0 H ASN A 52 11.881 6.449 -10.871 1.00 0.00 H new ATOM 0 HA ASN A 52 12.919 7.105 -9.004 1.00 0.00 H new ATOM 0 HB2 ASN A 52 13.891 9.298 -9.090 1.00 0.00 H new ATOM 0 HB3 ASN A 52 13.753 8.737 -10.745 1.00 0.00 H new ATOM 0 HD21 ASN A 52 11.553 11.281 -11.810 1.00 0.00 H new ATOM 0 HD22 ASN A 52 12.409 9.786 -12.203 1.00 0.00 H new ATOM 721 N THR A 53 10.194 7.722 -8.199 1.00 0.00 N ATOM 722 CA THR A 53 9.206 8.081 -7.189 1.00 0.00 C ATOM 723 C THR A 53 8.908 6.903 -6.268 1.00 0.00 C ATOM 724 O THR A 53 8.698 5.781 -6.730 1.00 0.00 O ATOM 725 CB THR A 53 7.891 8.558 -7.834 1.00 0.00 C ATOM 726 OG1 THR A 53 8.160 9.589 -8.791 1.00 0.00 O ATOM 727 CG2 THR A 53 6.927 9.078 -6.778 1.00 0.00 C ATOM 0 H THR A 53 9.922 6.942 -8.797 1.00 0.00 H new ATOM 0 HA THR A 53 9.633 8.897 -6.605 1.00 0.00 H new ATOM 0 HB THR A 53 7.430 7.708 -8.337 1.00 0.00 H new ATOM 0 HG1 THR A 53 8.752 9.240 -9.490 1.00 0.00 H new ATOM 0 HG21 THR A 53 6.006 9.409 -7.258 1.00 0.00 H new ATOM 0 HG22 THR A 53 6.701 8.282 -6.068 1.00 0.00 H new ATOM 0 HG23 THR A 53 7.383 9.916 -6.250 1.00 0.00 H new ATOM 735 N GLN A 54 8.892 7.165 -4.966 1.00 0.00 N ATOM 736 CA GLN A 54 8.621 6.125 -3.981 1.00 0.00 C ATOM 737 C GLN A 54 7.282 6.366 -3.290 1.00 0.00 C ATOM 738 O GLN A 54 7.084 7.390 -2.636 1.00 0.00 O ATOM 739 CB GLN A 54 9.742 6.072 -2.941 1.00 0.00 C ATOM 740 CG GLN A 54 11.113 5.803 -3.539 1.00 0.00 C ATOM 741 CD GLN A 54 12.230 5.949 -2.525 1.00 0.00 C ATOM 742 OE1 GLN A 54 12.429 5.081 -1.674 1.00 0.00 O ATOM 743 NE2 GLN A 54 12.969 7.049 -2.610 1.00 0.00 N ATOM 0 H GLN A 54 9.063 8.088 -4.568 1.00 0.00 H new ATOM 0 HA GLN A 54 8.574 5.169 -4.503 1.00 0.00 H new ATOM 0 HB2 GLN A 54 9.770 7.018 -2.400 1.00 0.00 H new ATOM 0 HB3 GLN A 54 9.514 5.295 -2.212 1.00 0.00 H new ATOM 0 HG2 GLN A 54 11.133 4.795 -3.954 1.00 0.00 H new ATOM 0 HG3 GLN A 54 11.286 6.491 -4.366 1.00 0.00 H new ATOM 0 HE21 GLN A 54 12.770 7.743 -3.331 1.00 0.00 H new ATOM 0 HE22 GLN A 54 13.736 7.200 -1.955 1.00 0.00 H new ATOM 752 N PHE A 55 6.365 5.416 -3.440 1.00 0.00 N ATOM 753 CA PHE A 55 5.044 5.525 -2.832 1.00 0.00 C ATOM 754 C PHE A 55 4.625 4.200 -2.202 1.00 0.00 C ATOM 755 O PHE A 55 5.098 3.135 -2.597 1.00 0.00 O ATOM 756 CB PHE A 55 4.013 5.955 -3.877 1.00 0.00 C ATOM 757 CG PHE A 55 3.747 4.909 -4.923 1.00 0.00 C ATOM 758 CD1 PHE A 55 4.710 4.595 -5.868 1.00 0.00 C ATOM 759 CD2 PHE A 55 2.534 4.240 -4.960 1.00 0.00 C ATOM 760 CE1 PHE A 55 4.468 3.634 -6.831 1.00 0.00 C ATOM 761 CE2 PHE A 55 2.286 3.278 -5.921 1.00 0.00 C ATOM 762 CZ PHE A 55 3.255 2.974 -6.857 1.00 0.00 C ATOM 0 H PHE A 55 6.512 4.562 -3.978 1.00 0.00 H new ATOM 0 HA PHE A 55 5.093 6.280 -2.048 1.00 0.00 H new ATOM 0 HB2 PHE A 55 3.078 6.200 -3.374 1.00 0.00 H new ATOM 0 HB3 PHE A 55 4.360 6.866 -4.365 1.00 0.00 H new ATOM 0 HD1 PHE A 55 5.661 5.107 -5.852 1.00 0.00 H new ATOM 0 HD2 PHE A 55 1.774 4.473 -4.229 1.00 0.00 H new ATOM 0 HE1 PHE A 55 5.227 3.399 -7.563 1.00 0.00 H new ATOM 0 HE2 PHE A 55 1.336 2.765 -5.940 1.00 0.00 H new ATOM 0 HZ PHE A 55 3.065 2.222 -7.608 1.00 0.00 H new ATOM 772 N TRP A 56 3.734 4.276 -1.219 1.00 0.00 N ATOM 773 CA TRP A 56 3.251 3.083 -0.533 1.00 0.00 C ATOM 774 C TRP A 56 2.398 2.228 -1.463 1.00 0.00 C ATOM 775 O TRP A 56 1.981 2.681 -2.529 1.00 0.00 O ATOM 776 CB TRP A 56 2.442 3.475 0.705 1.00 0.00 C ATOM 777 CG TRP A 56 3.263 4.152 1.761 1.00 0.00 C ATOM 778 CD1 TRP A 56 3.167 5.453 2.165 1.00 0.00 C ATOM 779 CD2 TRP A 56 4.306 3.563 2.545 1.00 0.00 C ATOM 780 NE1 TRP A 56 4.087 5.708 3.153 1.00 0.00 N ATOM 781 CE2 TRP A 56 4.797 4.564 3.405 1.00 0.00 C ATOM 782 CE3 TRP A 56 4.870 2.286 2.607 1.00 0.00 C ATOM 783 CZ2 TRP A 56 5.826 4.327 4.313 1.00 0.00 C ATOM 784 CZ3 TRP A 56 5.892 2.052 3.508 1.00 0.00 C ATOM 785 CH2 TRP A 56 6.361 3.068 4.351 1.00 0.00 C ATOM 0 H TRP A 56 3.332 5.150 -0.880 1.00 0.00 H new ATOM 0 HA TRP A 56 4.116 2.497 -0.223 1.00 0.00 H new ATOM 0 HB2 TRP A 56 1.631 4.138 0.405 1.00 0.00 H new ATOM 0 HB3 TRP A 56 1.983 2.581 1.129 1.00 0.00 H new ATOM 0 HD1 TRP A 56 2.470 6.175 1.766 1.00 0.00 H new ATOM 0 HE1 TRP A 56 4.220 6.604 3.623 1.00 0.00 H new ATOM 0 HE3 TRP A 56 4.514 1.496 1.963 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 6.189 5.109 4.964 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 6.336 1.069 3.563 1.00 0.00 H new ATOM 0 HH2 TRP A 56 7.161 2.853 5.045 1.00 0.00 H new ATOM 796 N ILE A 57 2.141 0.991 -1.052 1.00 0.00 N ATOM 797 CA ILE A 57 1.336 0.074 -1.849 1.00 0.00 C ATOM 798 C ILE A 57 0.408 -0.754 -0.966 1.00 0.00 C ATOM 799 O ILE A 57 0.413 -0.617 0.257 1.00 0.00 O ATOM 800 CB ILE A 57 2.220 -0.877 -2.678 1.00 0.00 C ATOM 801 CG1 ILE A 57 3.261 -1.551 -1.782 1.00 0.00 C ATOM 802 CG2 ILE A 57 2.897 -0.118 -3.809 1.00 0.00 C ATOM 803 CD1 ILE A 57 3.961 -2.718 -2.443 1.00 0.00 C ATOM 0 H ILE A 57 2.478 0.601 -0.172 1.00 0.00 H new ATOM 0 HA ILE A 57 0.740 0.686 -2.526 1.00 0.00 H new ATOM 0 HB ILE A 57 1.588 -1.651 -3.113 1.00 0.00 H new ATOM 0 HG12 ILE A 57 4.005 -0.812 -1.484 1.00 0.00 H new ATOM 0 HG13 ILE A 57 2.774 -1.898 -0.871 1.00 0.00 H new ATOM 0 HG21 ILE A 57 3.518 -0.803 -4.386 1.00 0.00 H new ATOM 0 HG22 ILE A 57 2.139 0.319 -4.459 1.00 0.00 H new ATOM 0 HG23 ILE A 57 3.520 0.674 -3.394 1.00 0.00 H new ATOM 0 HD11 ILE A 57 4.685 -3.148 -1.751 1.00 0.00 H new ATOM 0 HD12 ILE A 57 3.226 -3.476 -2.716 1.00 0.00 H new ATOM 0 HD13 ILE A 57 4.477 -2.373 -3.339 1.00 0.00 H new ATOM 815 N GLY A 58 -0.386 -1.615 -1.594 1.00 0.00 N ATOM 816 CA GLY A 58 -1.307 -2.454 -0.849 1.00 0.00 C ATOM 817 C GLY A 58 -0.595 -3.518 -0.037 1.00 0.00 C ATOM 818 O GLY A 58 -1.220 -4.234 0.746 1.00 0.00 O ATOM 0 H GLY A 58 -0.408 -1.747 -2.605 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -1.903 -1.831 -0.182 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -1.999 -2.933 -1.542 1.00 0.00 H new ATOM 822 N LEU A 59 0.716 -3.624 -0.224 1.00 0.00 N ATOM 823 CA LEU A 59 1.514 -4.609 0.497 1.00 0.00 C ATOM 824 C LEU A 59 1.883 -4.100 1.887 1.00 0.00 C ATOM 825 O LEU A 59 2.468 -3.027 2.031 1.00 0.00 O ATOM 826 CB LEU A 59 2.783 -4.941 -0.290 1.00 0.00 C ATOM 827 CG LEU A 59 3.363 -6.339 -0.070 1.00 0.00 C ATOM 828 CD1 LEU A 59 2.318 -7.403 -0.365 1.00 0.00 C ATOM 829 CD2 LEU A 59 4.597 -6.546 -0.937 1.00 0.00 C ATOM 0 H LEU A 59 1.249 -3.040 -0.869 1.00 0.00 H new ATOM 0 HA LEU A 59 0.916 -5.513 0.609 1.00 0.00 H new ATOM 0 HB2 LEU A 59 2.570 -4.821 -1.352 1.00 0.00 H new ATOM 0 HB3 LEU A 59 3.548 -4.208 -0.034 1.00 0.00 H new ATOM 0 HG LEU A 59 3.658 -6.429 0.975 1.00 0.00 H new ATOM 0 HD11 LEU A 59 2.749 -8.391 -0.203 1.00 0.00 H new ATOM 0 HD12 LEU A 59 1.463 -7.267 0.297 1.00 0.00 H new ATOM 0 HD13 LEU A 59 1.992 -7.315 -1.401 1.00 0.00 H new ATOM 0 HD21 LEU A 59 4.997 -7.546 -0.768 1.00 0.00 H new ATOM 0 HD22 LEU A 59 4.326 -6.436 -1.987 1.00 0.00 H new ATOM 0 HD23 LEU A 59 5.353 -5.804 -0.678 1.00 0.00 H new ATOM 841 N PHE A 60 1.539 -4.879 2.907 1.00 0.00 N ATOM 842 CA PHE A 60 1.835 -4.508 4.286 1.00 0.00 C ATOM 843 C PHE A 60 1.907 -5.744 5.178 1.00 0.00 C ATOM 844 O PHE A 60 1.122 -6.680 5.027 1.00 0.00 O ATOM 845 CB PHE A 60 0.772 -3.544 4.816 1.00 0.00 C ATOM 846 CG PHE A 60 -0.556 -4.197 5.071 1.00 0.00 C ATOM 847 CD1 PHE A 60 -0.744 -5.005 6.181 1.00 0.00 C ATOM 848 CD2 PHE A 60 -1.617 -4.002 4.201 1.00 0.00 C ATOM 849 CE1 PHE A 60 -1.965 -5.607 6.417 1.00 0.00 C ATOM 850 CE2 PHE A 60 -2.840 -4.602 4.432 1.00 0.00 C ATOM 851 CZ PHE A 60 -3.015 -5.405 5.542 1.00 0.00 C ATOM 0 H PHE A 60 1.055 -5.771 2.805 1.00 0.00 H new ATOM 0 HA PHE A 60 2.806 -4.013 4.303 1.00 0.00 H new ATOM 0 HB2 PHE A 60 1.130 -3.094 5.742 1.00 0.00 H new ATOM 0 HB3 PHE A 60 0.638 -2.734 4.099 1.00 0.00 H new ATOM 0 HD1 PHE A 60 0.073 -5.166 6.869 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -1.486 -3.374 3.332 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -2.099 -6.235 7.285 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -3.658 -4.443 3.745 1.00 0.00 H new ATOM 0 HZ PHE A 60 -3.970 -5.874 5.726 1.00 0.00 H new ATOM 861 N LYS A 61 2.856 -5.740 6.109 1.00 0.00 N ATOM 862 CA LYS A 61 3.033 -6.858 7.027 1.00 0.00 C ATOM 863 C LYS A 61 2.001 -6.809 8.149 1.00 0.00 C ATOM 864 O LYS A 61 1.658 -5.736 8.643 1.00 0.00 O ATOM 865 CB LYS A 61 4.444 -6.843 7.617 1.00 0.00 C ATOM 866 CG LYS A 61 4.671 -7.903 8.680 1.00 0.00 C ATOM 867 CD LYS A 61 6.139 -8.006 9.061 1.00 0.00 C ATOM 868 CE LYS A 61 6.922 -8.826 8.048 1.00 0.00 C ATOM 869 NZ LYS A 61 8.391 -8.717 8.263 1.00 0.00 N ATOM 0 H LYS A 61 3.515 -4.974 6.247 1.00 0.00 H new ATOM 0 HA LYS A 61 2.891 -7.782 6.466 1.00 0.00 H new ATOM 0 HB2 LYS A 61 5.166 -6.986 6.813 1.00 0.00 H new ATOM 0 HB3 LYS A 61 4.638 -5.861 8.048 1.00 0.00 H new ATOM 0 HG2 LYS A 61 4.081 -7.665 9.565 1.00 0.00 H new ATOM 0 HG3 LYS A 61 4.321 -8.868 8.313 1.00 0.00 H new ATOM 0 HD2 LYS A 61 6.569 -7.007 9.132 1.00 0.00 H new ATOM 0 HD3 LYS A 61 6.229 -8.462 10.047 1.00 0.00 H new ATOM 0 HE2 LYS A 61 6.621 -9.871 8.117 1.00 0.00 H new ATOM 0 HE3 LYS A 61 6.676 -8.490 7.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 8.889 -9.290 7.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 8.682 -7.723 8.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 8.629 -9.062 9.215 1.00 0.00 H new ATOM 883 N ASN A 62 1.510 -7.978 8.548 1.00 0.00 N ATOM 884 CA ASN A 62 0.518 -8.068 9.613 1.00 0.00 C ATOM 885 C ASN A 62 1.139 -8.627 10.889 1.00 0.00 C ATOM 886 O ASN A 62 2.272 -9.109 10.881 1.00 0.00 O ATOM 887 CB ASN A 62 -0.654 -8.949 9.174 1.00 0.00 C ATOM 888 CG ASN A 62 -1.950 -8.574 9.866 1.00 0.00 C ATOM 889 OD1 ASN A 62 -2.033 -7.545 10.537 1.00 0.00 O ATOM 890 ND2 ASN A 62 -2.969 -9.409 9.706 1.00 0.00 N ATOM 0 H ASN A 62 1.783 -8.876 8.150 1.00 0.00 H new ATOM 0 HA ASN A 62 0.151 -7.063 9.819 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -0.784 -8.865 8.095 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -0.420 -9.992 9.387 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -3.866 -9.209 10.148 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -2.855 -10.250 9.141 1.00 0.00 H new ATOM 897 N SER A 63 0.389 -8.560 11.985 1.00 0.00 N ATOM 898 CA SER A 63 0.867 -9.057 13.270 1.00 0.00 C ATOM 899 C SER A 63 1.399 -10.481 13.138 1.00 0.00 C ATOM 900 O SER A 63 2.470 -10.805 13.651 1.00 0.00 O ATOM 901 CB SER A 63 -0.258 -9.014 14.307 1.00 0.00 C ATOM 902 OG SER A 63 -1.420 -9.666 13.825 1.00 0.00 O ATOM 0 H SER A 63 -0.552 -8.166 12.009 1.00 0.00 H new ATOM 0 HA SER A 63 1.682 -8.413 13.601 1.00 0.00 H new ATOM 0 HB2 SER A 63 0.074 -9.491 15.229 1.00 0.00 H new ATOM 0 HB3 SER A 63 -0.493 -7.978 14.551 1.00 0.00 H new ATOM 0 HG SER A 63 -2.124 -9.627 14.506 1.00 0.00 H new ATOM 908 N ASP A 64 0.642 -11.326 12.447 1.00 0.00 N ATOM 909 CA ASP A 64 1.036 -12.716 12.247 1.00 0.00 C ATOM 910 C ASP A 64 2.444 -12.803 11.664 1.00 0.00 C ATOM 911 O ASP A 64 3.143 -13.797 11.851 1.00 0.00 O ATOM 912 CB ASP A 64 0.044 -13.422 11.321 1.00 0.00 C ATOM 913 CG ASP A 64 -1.124 -14.024 12.077 1.00 0.00 C ATOM 914 OD1 ASP A 64 -0.893 -14.937 12.896 1.00 0.00 O ATOM 915 OD2 ASP A 64 -2.270 -13.582 11.848 1.00 0.00 O ATOM 0 H ASP A 64 -0.247 -11.073 12.016 1.00 0.00 H new ATOM 0 HA ASP A 64 1.032 -13.212 13.218 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -0.331 -12.711 10.585 1.00 0.00 H new ATOM 0 HB3 ASP A 64 0.561 -14.208 10.771 1.00 0.00 H new ATOM 920 N GLY A 65 2.852 -11.753 10.957 1.00 0.00 N ATOM 921 CA GLY A 65 4.173 -11.732 10.357 1.00 0.00 C ATOM 922 C GLY A 65 4.135 -11.972 8.861 1.00 0.00 C ATOM 923 O GLY A 65 5.177 -12.096 8.219 1.00 0.00 O ATOM 0 H GLY A 65 2.292 -10.917 10.789 1.00 0.00 H new ATOM 0 HA2 GLY A 65 4.643 -10.769 10.555 1.00 0.00 H new ATOM 0 HA3 GLY A 65 4.795 -12.493 10.828 1.00 0.00 H new ATOM 927 N GLN A 66 2.929 -12.040 8.305 1.00 0.00 N ATOM 928 CA GLN A 66 2.760 -12.269 6.875 1.00 0.00 C ATOM 929 C GLN A 66 2.355 -10.984 6.161 1.00 0.00 C ATOM 930 O GLN A 66 1.890 -10.033 6.790 1.00 0.00 O ATOM 931 CB GLN A 66 1.709 -13.354 6.632 1.00 0.00 C ATOM 932 CG GLN A 66 1.812 -14.527 7.593 1.00 0.00 C ATOM 933 CD GLN A 66 1.119 -15.771 7.073 1.00 0.00 C ATOM 934 OE1 GLN A 66 -0.018 -16.063 7.445 1.00 0.00 O ATOM 935 NE2 GLN A 66 1.802 -16.511 6.207 1.00 0.00 N ATOM 0 H GLN A 66 2.056 -11.940 8.823 1.00 0.00 H new ATOM 0 HA GLN A 66 3.716 -12.601 6.471 1.00 0.00 H new ATOM 0 HB2 GLN A 66 0.716 -12.912 6.717 1.00 0.00 H new ATOM 0 HB3 GLN A 66 1.808 -13.722 5.611 1.00 0.00 H new ATOM 0 HG2 GLN A 66 2.863 -14.751 7.775 1.00 0.00 H new ATOM 0 HG3 GLN A 66 1.375 -14.246 8.551 1.00 0.00 H new ATOM 0 HE21 GLN A 66 2.742 -16.231 5.927 1.00 0.00 H new ATOM 0 HE22 GLN A 66 1.387 -17.359 5.822 1.00 0.00 H new ATOM 944 N PHE A 67 2.536 -10.961 4.845 1.00 0.00 N ATOM 945 CA PHE A 67 2.191 -9.792 4.045 1.00 0.00 C ATOM 946 C PHE A 67 0.820 -9.962 3.396 1.00 0.00 C ATOM 947 O PHE A 67 0.545 -10.979 2.759 1.00 0.00 O ATOM 948 CB PHE A 67 3.251 -9.552 2.969 1.00 0.00 C ATOM 949 CG PHE A 67 4.533 -8.982 3.506 1.00 0.00 C ATOM 950 CD1 PHE A 67 4.639 -7.630 3.792 1.00 0.00 C ATOM 951 CD2 PHE A 67 5.631 -9.797 3.725 1.00 0.00 C ATOM 952 CE1 PHE A 67 5.817 -7.103 4.285 1.00 0.00 C ATOM 953 CE2 PHE A 67 6.812 -9.276 4.219 1.00 0.00 C ATOM 954 CZ PHE A 67 6.904 -7.927 4.500 1.00 0.00 C ATOM 0 H PHE A 67 2.920 -11.740 4.309 1.00 0.00 H new ATOM 0 HA PHE A 67 2.155 -8.928 4.708 1.00 0.00 H new ATOM 0 HB2 PHE A 67 3.465 -10.494 2.465 1.00 0.00 H new ATOM 0 HB3 PHE A 67 2.847 -8.873 2.218 1.00 0.00 H new ATOM 0 HD1 PHE A 67 3.791 -6.981 3.628 1.00 0.00 H new ATOM 0 HD2 PHE A 67 5.564 -10.853 3.507 1.00 0.00 H new ATOM 0 HE1 PHE A 67 5.888 -6.047 4.502 1.00 0.00 H new ATOM 0 HE2 PHE A 67 7.661 -9.922 4.385 1.00 0.00 H new ATOM 0 HZ PHE A 67 7.825 -7.517 4.887 1.00 0.00 H new ATOM 964 N TYR A 68 -0.035 -8.959 3.564 1.00 0.00 N ATOM 965 CA TYR A 68 -1.378 -8.998 2.997 1.00 0.00 C ATOM 966 C TYR A 68 -1.579 -7.867 1.993 1.00 0.00 C ATOM 967 O TYR A 68 -0.676 -7.065 1.757 1.00 0.00 O ATOM 968 CB TYR A 68 -2.426 -8.901 4.108 1.00 0.00 C ATOM 969 CG TYR A 68 -2.441 -10.098 5.032 1.00 0.00 C ATOM 970 CD1 TYR A 68 -1.419 -10.304 5.950 1.00 0.00 C ATOM 971 CD2 TYR A 68 -3.478 -11.021 4.988 1.00 0.00 C ATOM 972 CE1 TYR A 68 -1.428 -11.396 6.796 1.00 0.00 C ATOM 973 CE2 TYR A 68 -3.496 -12.116 5.831 1.00 0.00 C ATOM 974 CZ TYR A 68 -2.469 -12.299 6.733 1.00 0.00 C ATOM 975 OH TYR A 68 -2.483 -13.388 7.574 1.00 0.00 O ATOM 0 H TYR A 68 0.178 -8.110 4.088 1.00 0.00 H new ATOM 0 HA TYR A 68 -1.497 -9.948 2.475 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -2.239 -8.002 4.695 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -3.412 -8.788 3.657 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -0.603 -9.598 6.003 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -4.284 -10.881 4.283 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -0.625 -11.542 7.503 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -4.310 -12.824 5.784 1.00 0.00 H new ATOM 0 HH TYR A 68 -3.285 -13.924 7.402 1.00 0.00 H new ATOM 985 N TRP A 69 -2.769 -7.810 1.407 1.00 0.00 N ATOM 986 CA TRP A 69 -3.090 -6.778 0.428 1.00 0.00 C ATOM 987 C TRP A 69 -4.196 -5.863 0.945 1.00 0.00 C ATOM 988 O TRP A 69 -5.286 -6.323 1.286 1.00 0.00 O ATOM 989 CB TRP A 69 -3.515 -7.415 -0.896 1.00 0.00 C ATOM 990 CG TRP A 69 -2.366 -7.956 -1.690 1.00 0.00 C ATOM 991 CD1 TRP A 69 -2.150 -9.260 -2.036 1.00 0.00 C ATOM 992 CD2 TRP A 69 -1.274 -7.209 -2.236 1.00 0.00 C ATOM 993 NE1 TRP A 69 -0.990 -9.368 -2.764 1.00 0.00 N ATOM 994 CE2 TRP A 69 -0.434 -8.123 -2.901 1.00 0.00 C ATOM 995 CE3 TRP A 69 -0.925 -5.856 -2.230 1.00 0.00 C ATOM 996 CZ2 TRP A 69 0.732 -7.727 -3.551 1.00 0.00 C ATOM 997 CZ3 TRP A 69 0.233 -5.463 -2.875 1.00 0.00 C ATOM 998 CH2 TRP A 69 1.050 -6.396 -3.529 1.00 0.00 C ATOM 0 H TRP A 69 -3.528 -8.466 1.593 1.00 0.00 H new ATOM 0 HA TRP A 69 -2.195 -6.178 0.263 1.00 0.00 H new ATOM 0 HB2 TRP A 69 -4.219 -8.222 -0.693 1.00 0.00 H new ATOM 0 HB3 TRP A 69 -4.044 -6.673 -1.495 1.00 0.00 H new ATOM 0 HD1 TRP A 69 -2.796 -10.085 -1.775 1.00 0.00 H new ATOM 0 HE1 TRP A 69 -0.605 -10.234 -3.141 1.00 0.00 H new ATOM 0 HE3 TRP A 69 -1.549 -5.130 -1.730 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 1.363 -8.445 -4.055 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 0.513 -4.420 -2.875 1.00 0.00 H new ATOM 0 HH2 TRP A 69 1.948 -6.058 -4.025 1.00 0.00 H new ATOM 1009 N ASP A 70 -3.909 -4.567 0.999 1.00 0.00 N ATOM 1010 CA ASP A 70 -4.880 -3.588 1.473 1.00 0.00 C ATOM 1011 C ASP A 70 -6.027 -3.435 0.479 1.00 0.00 C ATOM 1012 O ASP A 70 -5.826 -2.991 -0.652 1.00 0.00 O ATOM 1013 CB ASP A 70 -4.203 -2.236 1.702 1.00 0.00 C ATOM 1014 CG ASP A 70 -4.929 -1.392 2.731 1.00 0.00 C ATOM 1015 OD1 ASP A 70 -6.149 -1.179 2.570 1.00 0.00 O ATOM 1016 OD2 ASP A 70 -4.277 -0.946 3.698 1.00 0.00 O ATOM 0 H ASP A 70 -3.012 -4.170 0.720 1.00 0.00 H new ATOM 0 HA ASP A 70 -5.288 -3.946 2.418 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -3.176 -2.398 2.029 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -4.155 -1.692 0.758 1.00 0.00 H new ATOM 1021 N ARG A 71 -7.229 -3.806 0.907 1.00 0.00 N ATOM 1022 CA ARG A 71 -8.407 -3.712 0.054 1.00 0.00 C ATOM 1023 C ARG A 71 -9.470 -2.823 0.691 1.00 0.00 C ATOM 1024 O ARG A 71 -10.667 -3.027 0.491 1.00 0.00 O ATOM 1025 CB ARG A 71 -8.983 -5.104 -0.211 1.00 0.00 C ATOM 1026 CG ARG A 71 -8.015 -6.041 -0.916 1.00 0.00 C ATOM 1027 CD ARG A 71 -8.020 -5.818 -2.420 1.00 0.00 C ATOM 1028 NE ARG A 71 -7.283 -6.860 -3.130 1.00 0.00 N ATOM 1029 CZ ARG A 71 -6.843 -6.729 -4.376 1.00 0.00 C ATOM 1030 NH1 ARG A 71 -7.063 -5.607 -5.046 1.00 0.00 N ATOM 1031 NH2 ARG A 71 -6.179 -7.723 -4.954 1.00 0.00 N ATOM 0 H ARG A 71 -7.413 -4.175 1.840 1.00 0.00 H new ATOM 0 HA ARG A 71 -8.104 -3.265 -0.893 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -9.282 -5.551 0.737 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -9.885 -5.006 -0.815 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -7.009 -5.886 -0.527 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -8.285 -7.075 -0.699 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -9.049 -5.793 -2.779 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -7.580 -4.846 -2.644 1.00 0.00 H new ATOM 0 HE ARG A 71 -7.096 -7.736 -2.642 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -7.572 -4.841 -4.605 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -6.724 -5.510 -6.003 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -6.007 -8.588 -4.441 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -5.841 -7.622 -5.911 1.00 0.00 H new ATOM 1045 N GLY A 72 -9.024 -1.834 1.460 1.00 0.00 N ATOM 1046 CA GLY A 72 -9.950 -0.929 2.116 1.00 0.00 C ATOM 1047 C GLY A 72 -9.752 -0.884 3.618 1.00 0.00 C ATOM 1048 O GLY A 72 -8.683 -1.231 4.119 1.00 0.00 O ATOM 0 H GLY A 72 -8.038 -1.643 1.640 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -9.825 0.073 1.706 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -10.972 -1.238 1.897 1.00 0.00 H new ATOM 1052 N GLN A 73 -10.784 -0.455 4.337 1.00 0.00 N ATOM 1053 CA GLN A 73 -10.717 -0.364 5.790 1.00 0.00 C ATOM 1054 C GLN A 73 -11.349 -1.589 6.442 1.00 0.00 C ATOM 1055 O GLN A 73 -10.692 -2.321 7.181 1.00 0.00 O ATOM 1056 CB GLN A 73 -11.418 0.906 6.276 1.00 0.00 C ATOM 1057 CG GLN A 73 -11.248 1.163 7.765 1.00 0.00 C ATOM 1058 CD GLN A 73 -12.007 2.388 8.236 1.00 0.00 C ATOM 1059 OE1 GLN A 73 -13.237 2.386 8.292 1.00 0.00 O ATOM 1060 NE2 GLN A 73 -11.276 3.442 8.577 1.00 0.00 N ATOM 0 H GLN A 73 -11.676 -0.165 3.937 1.00 0.00 H new ATOM 0 HA GLN A 73 -9.666 -0.323 6.078 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -11.029 1.760 5.722 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -12.481 0.834 6.047 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -11.591 0.291 8.322 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -10.189 1.288 7.990 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -10.259 3.399 8.515 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -11.731 4.295 8.901 1.00 0.00 H new ATOM 1069 N GLY A 74 -12.631 -1.807 6.163 1.00 0.00 N ATOM 1070 CA GLY A 74 -13.331 -2.945 6.730 1.00 0.00 C ATOM 1071 C GLY A 74 -13.327 -4.147 5.807 1.00 0.00 C ATOM 1072 O GLY A 74 -13.959 -5.163 6.098 1.00 0.00 O ATOM 0 H GLY A 74 -13.197 -1.216 5.554 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -12.867 -3.217 7.678 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -14.361 -2.662 6.949 1.00 0.00 H new ATOM 1076 N ILE A 75 -12.614 -4.033 4.692 1.00 0.00 N ATOM 1077 CA ILE A 75 -12.532 -5.119 3.724 1.00 0.00 C ATOM 1078 C ILE A 75 -11.507 -6.163 4.155 1.00 0.00 C ATOM 1079 O ILE A 75 -10.463 -5.829 4.713 1.00 0.00 O ATOM 1080 CB ILE A 75 -12.159 -4.598 2.323 1.00 0.00 C ATOM 1081 CG1 ILE A 75 -13.012 -3.379 1.965 1.00 0.00 C ATOM 1082 CG2 ILE A 75 -12.333 -5.697 1.285 1.00 0.00 C ATOM 1083 CD1 ILE A 75 -14.497 -3.607 2.144 1.00 0.00 C ATOM 0 H ILE A 75 -12.085 -3.199 4.437 1.00 0.00 H new ATOM 0 HA ILE A 75 -13.520 -5.578 3.681 1.00 0.00 H new ATOM 0 HB ILE A 75 -11.112 -4.296 2.331 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -12.705 -2.536 2.584 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -12.818 -3.101 0.929 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -12.066 -5.313 0.300 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -11.687 -6.539 1.534 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -13.372 -6.028 1.276 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -15.040 -2.702 1.872 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -14.819 -4.429 1.504 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -14.704 -3.855 3.185 1.00 0.00 H new ATOM 1095 N ASN A 76 -11.813 -7.429 3.890 1.00 0.00 N ATOM 1096 CA ASN A 76 -10.918 -8.523 4.250 1.00 0.00 C ATOM 1097 C ASN A 76 -9.646 -8.484 3.408 1.00 0.00 C ATOM 1098 O ASN A 76 -9.683 -8.551 2.179 1.00 0.00 O ATOM 1099 CB ASN A 76 -11.623 -9.868 4.067 1.00 0.00 C ATOM 1100 CG ASN A 76 -12.784 -10.047 5.027 1.00 0.00 C ATOM 1101 OD1 ASN A 76 -12.974 -9.248 5.944 1.00 0.00 O ATOM 1102 ND2 ASN A 76 -13.566 -11.100 4.819 1.00 0.00 N ATOM 0 H ASN A 76 -12.673 -7.723 3.428 1.00 0.00 H new ATOM 0 HA ASN A 76 -10.643 -8.405 5.298 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -11.986 -9.948 3.042 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -10.905 -10.675 4.215 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -14.362 -11.273 5.432 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -13.370 -11.736 4.046 1.00 0.00 H new ATOM 1109 N PRO A 77 -8.492 -8.374 4.083 1.00 0.00 N ATOM 1110 CA PRO A 77 -7.187 -8.325 3.417 1.00 0.00 C ATOM 1111 C PRO A 77 -6.806 -9.662 2.790 1.00 0.00 C ATOM 1112 O PRO A 77 -7.116 -10.723 3.331 1.00 0.00 O ATOM 1113 CB PRO A 77 -6.223 -7.974 4.553 1.00 0.00 C ATOM 1114 CG PRO A 77 -6.899 -8.460 5.788 1.00 0.00 C ATOM 1115 CD PRO A 77 -8.373 -8.290 5.548 1.00 0.00 C ATOM 0 HA PRO A 77 -7.176 -7.611 2.593 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -5.256 -8.457 4.415 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -6.039 -6.901 4.599 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -6.653 -9.504 5.982 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -6.577 -7.889 6.659 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -8.953 -9.068 6.044 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -8.734 -7.334 5.926 1.00 0.00 H new ATOM 1123 N ASP A 78 -6.133 -9.603 1.646 1.00 0.00 N ATOM 1124 CA ASP A 78 -5.708 -10.809 0.946 1.00 0.00 C ATOM 1125 C ASP A 78 -4.284 -11.192 1.338 1.00 0.00 C ATOM 1126 O ASP A 78 -3.415 -10.331 1.480 1.00 0.00 O ATOM 1127 CB ASP A 78 -5.796 -10.604 -0.567 1.00 0.00 C ATOM 1128 CG ASP A 78 -6.070 -11.896 -1.312 1.00 0.00 C ATOM 1129 OD1 ASP A 78 -5.207 -12.797 -1.273 1.00 0.00 O ATOM 1130 OD2 ASP A 78 -7.148 -12.005 -1.934 1.00 0.00 O ATOM 0 H ASP A 78 -5.870 -8.733 1.184 1.00 0.00 H new ATOM 0 HA ASP A 78 -6.376 -11.621 1.234 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -6.586 -9.886 -0.788 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -4.862 -10.172 -0.927 1.00 0.00 H new ATOM 1135 N LEU A 79 -4.053 -12.489 1.511 1.00 0.00 N ATOM 1136 CA LEU A 79 -2.734 -12.987 1.888 1.00 0.00 C ATOM 1137 C LEU A 79 -1.855 -13.186 0.657 1.00 0.00 C ATOM 1138 O LEU A 79 -2.173 -13.987 -0.223 1.00 0.00 O ATOM 1139 CB LEU A 79 -2.864 -14.304 2.654 1.00 0.00 C ATOM 1140 CG LEU A 79 -1.610 -14.782 3.386 1.00 0.00 C ATOM 1141 CD1 LEU A 79 -0.408 -14.763 2.454 1.00 0.00 C ATOM 1142 CD2 LEU A 79 -1.348 -13.920 4.613 1.00 0.00 C ATOM 0 H LEU A 79 -4.761 -13.214 1.396 1.00 0.00 H new ATOM 0 HA LEU A 79 -2.263 -12.244 2.532 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -3.668 -14.199 3.383 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.169 -15.080 1.952 1.00 0.00 H new ATOM 0 HG LEU A 79 -1.773 -15.808 3.715 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.475 -15.106 2.992 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.595 -15.422 1.606 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -0.242 -13.747 2.095 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.452 -14.274 5.122 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -1.205 -12.884 4.306 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.199 -13.984 5.291 1.00 0.00 H new ATOM 1154 N LEU A 80 -0.748 -12.454 0.603 1.00 0.00 N ATOM 1155 CA LEU A 80 0.180 -12.552 -0.519 1.00 0.00 C ATOM 1156 C LEU A 80 0.504 -14.009 -0.832 1.00 0.00 C ATOM 1157 O LEU A 80 1.382 -14.607 -0.210 1.00 0.00 O ATOM 1158 CB LEU A 80 1.467 -11.785 -0.211 1.00 0.00 C ATOM 1159 CG LEU A 80 2.552 -11.835 -1.287 1.00 0.00 C ATOM 1160 CD1 LEU A 80 2.346 -10.724 -2.304 1.00 0.00 C ATOM 1161 CD2 LEU A 80 3.933 -11.734 -0.657 1.00 0.00 C ATOM 0 H LEU A 80 -0.471 -11.786 1.322 1.00 0.00 H new ATOM 0 HA LEU A 80 -0.298 -12.110 -1.393 1.00 0.00 H new ATOM 0 HB2 LEU A 80 1.210 -10.741 -0.031 1.00 0.00 H new ATOM 0 HB3 LEU A 80 1.885 -12.175 0.717 1.00 0.00 H new ATOM 0 HG LEU A 80 2.480 -12.792 -1.804 1.00 0.00 H new ATOM 0 HD11 LEU A 80 3.127 -10.775 -3.062 1.00 0.00 H new ATOM 0 HD12 LEU A 80 1.372 -10.841 -2.779 1.00 0.00 H new ATOM 0 HD13 LEU A 80 2.391 -9.758 -1.801 1.00 0.00 H new ATOM 0 HD21 LEU A 80 4.693 -11.771 -1.438 1.00 0.00 H new ATOM 0 HD22 LEU A 80 4.017 -10.793 -0.114 1.00 0.00 H new ATOM 0 HD23 LEU A 80 4.080 -12.565 0.032 1.00 0.00 H new ATOM 1173 N ASN A 81 -0.208 -14.574 -1.802 1.00 0.00 N ATOM 1174 CA ASN A 81 0.006 -15.961 -2.198 1.00 0.00 C ATOM 1175 C ASN A 81 0.276 -16.062 -3.696 1.00 0.00 C ATOM 1176 O ASN A 81 -0.147 -17.016 -4.349 1.00 0.00 O ATOM 1177 CB ASN A 81 -1.211 -16.812 -1.830 1.00 0.00 C ATOM 1178 CG ASN A 81 -0.840 -18.250 -1.525 1.00 0.00 C ATOM 1179 OD1 ASN A 81 0.267 -18.695 -1.829 1.00 0.00 O ATOM 1180 ND2 ASN A 81 -1.767 -18.986 -0.923 1.00 0.00 N ATOM 0 H ASN A 81 -0.938 -14.093 -2.328 1.00 0.00 H new ATOM 0 HA ASN A 81 0.878 -16.336 -1.662 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -1.707 -16.376 -0.963 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -1.927 -16.791 -2.651 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -1.575 -19.961 -0.694 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -2.671 -18.576 -0.689 1.00 0.00 H new ATOM 1187 N GLN A 82 0.984 -15.074 -4.233 1.00 0.00 N ATOM 1188 CA GLN A 82 1.310 -15.052 -5.654 1.00 0.00 C ATOM 1189 C GLN A 82 2.713 -15.597 -5.898 1.00 0.00 C ATOM 1190 O GLN A 82 3.642 -15.359 -5.125 1.00 0.00 O ATOM 1191 CB GLN A 82 1.201 -13.628 -6.202 1.00 0.00 C ATOM 1192 CG GLN A 82 2.132 -12.640 -5.519 1.00 0.00 C ATOM 1193 CD GLN A 82 1.761 -11.197 -5.801 1.00 0.00 C ATOM 1194 OE1 GLN A 82 0.652 -10.758 -5.495 1.00 0.00 O ATOM 1195 NE2 GLN A 82 2.688 -10.451 -6.389 1.00 0.00 N ATOM 0 H GLN A 82 1.343 -14.278 -3.706 1.00 0.00 H new ATOM 0 HA GLN A 82 0.596 -15.690 -6.175 1.00 0.00 H new ATOM 0 HB2 GLN A 82 1.419 -13.641 -7.270 1.00 0.00 H new ATOM 0 HB3 GLN A 82 0.173 -13.283 -6.091 1.00 0.00 H new ATOM 0 HG2 GLN A 82 2.112 -12.812 -4.443 1.00 0.00 H new ATOM 0 HG3 GLN A 82 3.154 -12.820 -5.852 1.00 0.00 H new ATOM 0 HE21 GLN A 82 3.594 -10.856 -6.625 1.00 0.00 H new ATOM 0 HE22 GLN A 82 2.494 -9.473 -6.605 1.00 0.00 H new ATOM 1204 N PRO A 83 2.874 -16.348 -6.998 1.00 0.00 N ATOM 1205 CA PRO A 83 4.161 -16.942 -7.370 1.00 0.00 C ATOM 1206 C PRO A 83 5.176 -15.896 -7.817 1.00 0.00 C ATOM 1207 O PRO A 83 6.380 -16.058 -7.613 1.00 0.00 O ATOM 1208 CB PRO A 83 3.801 -17.869 -8.534 1.00 0.00 C ATOM 1209 CG PRO A 83 2.562 -17.281 -9.117 1.00 0.00 C ATOM 1210 CD PRO A 83 1.811 -16.672 -7.965 1.00 0.00 C ATOM 0 HA PRO A 83 4.631 -17.453 -6.530 1.00 0.00 H new ATOM 0 HB2 PRO A 83 4.604 -17.910 -9.270 1.00 0.00 H new ATOM 0 HB3 PRO A 83 3.631 -18.889 -8.190 1.00 0.00 H new ATOM 0 HG2 PRO A 83 2.803 -16.528 -9.867 1.00 0.00 H new ATOM 0 HG3 PRO A 83 1.963 -18.045 -9.613 1.00 0.00 H new ATOM 0 HD2 PRO A 83 1.260 -15.782 -8.270 1.00 0.00 H new ATOM 0 HD3 PRO A 83 1.085 -17.368 -7.546 1.00 0.00 H new ATOM 1218 N ILE A 84 4.683 -14.822 -8.426 1.00 0.00 N ATOM 1219 CA ILE A 84 5.548 -13.749 -8.899 1.00 0.00 C ATOM 1220 C ILE A 84 5.624 -12.615 -7.882 1.00 0.00 C ATOM 1221 O ILE A 84 4.601 -12.136 -7.391 1.00 0.00 O ATOM 1222 CB ILE A 84 5.058 -13.184 -10.246 1.00 0.00 C ATOM 1223 CG1 ILE A 84 5.043 -14.283 -11.309 1.00 0.00 C ATOM 1224 CG2 ILE A 84 5.940 -12.025 -10.686 1.00 0.00 C ATOM 1225 CD1 ILE A 84 4.463 -13.836 -12.633 1.00 0.00 C ATOM 0 H ILE A 84 3.690 -14.673 -8.603 1.00 0.00 H new ATOM 0 HA ILE A 84 6.540 -14.179 -9.034 1.00 0.00 H new ATOM 0 HB ILE A 84 4.041 -12.813 -10.120 1.00 0.00 H new ATOM 0 HG12 ILE A 84 6.062 -14.637 -11.469 1.00 0.00 H new ATOM 0 HG13 ILE A 84 4.466 -15.130 -10.936 1.00 0.00 H new ATOM 0 HG21 ILE A 84 5.581 -11.636 -11.639 1.00 0.00 H new ATOM 0 HG22 ILE A 84 5.904 -11.235 -9.936 1.00 0.00 H new ATOM 0 HG23 ILE A 84 6.967 -12.372 -10.799 1.00 0.00 H new ATOM 0 HD11 ILE A 84 4.484 -14.667 -13.339 1.00 0.00 H new ATOM 0 HD12 ILE A 84 3.433 -13.510 -12.488 1.00 0.00 H new ATOM 0 HD13 ILE A 84 5.053 -13.009 -13.028 1.00 0.00 H new ATOM 1237 N THR A 85 6.843 -12.187 -7.571 1.00 0.00 N ATOM 1238 CA THR A 85 7.054 -11.109 -6.613 1.00 0.00 C ATOM 1239 C THR A 85 8.092 -10.116 -7.122 1.00 0.00 C ATOM 1240 O THR A 85 8.782 -10.375 -8.108 1.00 0.00 O ATOM 1241 CB THR A 85 7.508 -11.653 -5.245 1.00 0.00 C ATOM 1242 OG1 THR A 85 8.576 -12.590 -5.421 1.00 0.00 O ATOM 1243 CG2 THR A 85 6.352 -12.324 -4.519 1.00 0.00 C ATOM 0 H THR A 85 7.700 -12.571 -7.969 1.00 0.00 H new ATOM 0 HA THR A 85 6.097 -10.601 -6.494 1.00 0.00 H new ATOM 0 HB THR A 85 7.857 -10.814 -4.642 1.00 0.00 H new ATOM 0 HG1 THR A 85 8.860 -12.930 -4.547 1.00 0.00 H new ATOM 0 HG21 THR A 85 6.697 -12.700 -3.556 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.552 -11.600 -4.361 1.00 0.00 H new ATOM 0 HG23 THR A 85 5.977 -13.153 -5.119 1.00 0.00 H new ATOM 1251 N TYR A 86 8.198 -8.978 -6.444 1.00 0.00 N ATOM 1252 CA TYR A 86 9.152 -7.945 -6.830 1.00 0.00 C ATOM 1253 C TYR A 86 10.092 -7.613 -5.675 1.00 0.00 C ATOM 1254 O TYR A 86 10.823 -6.624 -5.720 1.00 0.00 O ATOM 1255 CB TYR A 86 8.414 -6.683 -7.281 1.00 0.00 C ATOM 1256 CG TYR A 86 7.409 -6.931 -8.383 1.00 0.00 C ATOM 1257 CD1 TYR A 86 7.825 -7.188 -9.684 1.00 0.00 C ATOM 1258 CD2 TYR A 86 6.044 -6.907 -8.124 1.00 0.00 C ATOM 1259 CE1 TYR A 86 6.910 -7.414 -10.694 1.00 0.00 C ATOM 1260 CE2 TYR A 86 5.123 -7.134 -9.128 1.00 0.00 C ATOM 1261 CZ TYR A 86 5.561 -7.386 -10.411 1.00 0.00 C ATOM 1262 OH TYR A 86 4.646 -7.611 -11.414 1.00 0.00 O ATOM 0 H TYR A 86 7.635 -8.748 -5.625 1.00 0.00 H new ATOM 0 HA TYR A 86 9.746 -8.326 -7.660 1.00 0.00 H new ATOM 0 HB2 TYR A 86 7.901 -6.246 -6.424 1.00 0.00 H new ATOM 0 HB3 TYR A 86 9.143 -5.949 -7.624 1.00 0.00 H new ATOM 0 HD1 TYR A 86 8.881 -7.211 -9.909 1.00 0.00 H new ATOM 0 HD2 TYR A 86 5.697 -6.707 -7.121 1.00 0.00 H new ATOM 0 HE1 TYR A 86 7.250 -7.612 -11.700 1.00 0.00 H new ATOM 0 HE2 TYR A 86 4.066 -7.114 -8.909 1.00 0.00 H new ATOM 0 HH TYR A 86 4.001 -8.289 -11.122 1.00 0.00 H new ATOM 1272 N TRP A 87 10.066 -8.447 -4.641 1.00 0.00 N ATOM 1273 CA TRP A 87 10.915 -8.243 -3.474 1.00 0.00 C ATOM 1274 C TRP A 87 12.316 -7.808 -3.889 1.00 0.00 C ATOM 1275 O TRP A 87 12.910 -8.383 -4.801 1.00 0.00 O ATOM 1276 CB TRP A 87 10.991 -9.525 -2.643 1.00 0.00 C ATOM 1277 CG TRP A 87 9.731 -9.818 -1.886 1.00 0.00 C ATOM 1278 CD1 TRP A 87 9.003 -10.973 -1.923 1.00 0.00 C ATOM 1279 CD2 TRP A 87 9.051 -8.941 -0.982 1.00 0.00 C ATOM 1280 NE1 TRP A 87 7.910 -10.866 -1.097 1.00 0.00 N ATOM 1281 CE2 TRP A 87 7.917 -9.630 -0.507 1.00 0.00 C ATOM 1282 CE3 TRP A 87 9.289 -7.642 -0.526 1.00 0.00 C ATOM 1283 CZ2 TRP A 87 7.027 -9.062 0.400 1.00 0.00 C ATOM 1284 CZ3 TRP A 87 8.404 -7.079 0.374 1.00 0.00 C ATOM 1285 CH2 TRP A 87 7.285 -7.788 0.829 1.00 0.00 C ATOM 0 H TRP A 87 9.466 -9.270 -4.588 1.00 0.00 H new ATOM 0 HA TRP A 87 10.474 -7.451 -2.869 1.00 0.00 H new ATOM 0 HB2 TRP A 87 11.214 -10.364 -3.302 1.00 0.00 H new ATOM 0 HB3 TRP A 87 11.819 -9.444 -1.939 1.00 0.00 H new ATOM 0 HD1 TRP A 87 9.250 -11.842 -2.514 1.00 0.00 H new ATOM 0 HE1 TRP A 87 7.207 -11.590 -0.947 1.00 0.00 H new ATOM 0 HE3 TRP A 87 10.149 -7.088 -0.871 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 6.164 -9.607 0.753 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 8.578 -6.075 0.733 1.00 0.00 H new ATOM 0 HH2 TRP A 87 6.612 -7.320 1.532 1.00 0.00 H new ATOM 1296 N ALA A 88 12.839 -6.789 -3.214 1.00 0.00 N ATOM 1297 CA ALA A 88 14.172 -6.279 -3.513 1.00 0.00 C ATOM 1298 C ALA A 88 15.250 -7.226 -2.997 1.00 0.00 C ATOM 1299 O ALA A 88 14.950 -8.305 -2.489 1.00 0.00 O ATOM 1300 CB ALA A 88 14.353 -4.893 -2.912 1.00 0.00 C ATOM 0 H ALA A 88 12.360 -6.301 -2.457 1.00 0.00 H new ATOM 0 HA ALA A 88 14.274 -6.210 -4.596 1.00 0.00 H new ATOM 0 HB1 ALA A 88 15.352 -4.524 -3.143 1.00 0.00 H new ATOM 0 HB2 ALA A 88 13.610 -4.215 -3.331 1.00 0.00 H new ATOM 0 HB3 ALA A 88 14.226 -4.946 -1.831 1.00 0.00 H new ATOM 1306 N ASN A 89 16.507 -6.814 -3.131 1.00 0.00 N ATOM 1307 CA ASN A 89 17.630 -7.627 -2.680 1.00 0.00 C ATOM 1308 C ASN A 89 17.551 -7.877 -1.177 1.00 0.00 C ATOM 1309 O ASN A 89 17.576 -6.941 -0.379 1.00 0.00 O ATOM 1310 CB ASN A 89 18.954 -6.941 -3.025 1.00 0.00 C ATOM 1311 CG ASN A 89 20.086 -7.932 -3.214 1.00 0.00 C ATOM 1312 OD1 ASN A 89 20.958 -8.066 -2.356 1.00 0.00 O ATOM 1313 ND2 ASN A 89 20.077 -8.632 -4.342 1.00 0.00 N ATOM 0 H ASN A 89 16.773 -5.922 -3.548 1.00 0.00 H new ATOM 0 HA ASN A 89 17.581 -8.587 -3.194 1.00 0.00 H new ATOM 0 HB2 ASN A 89 18.830 -6.356 -3.937 1.00 0.00 H new ATOM 0 HB3 ASN A 89 19.216 -6.242 -2.231 1.00 0.00 H new ATOM 0 HD21 ASN A 89 20.813 -9.314 -4.525 1.00 0.00 H new ATOM 0 HD22 ASN A 89 19.334 -8.488 -5.026 1.00 0.00 H new ATOM 1320 N GLY A 90 17.455 -9.148 -0.798 1.00 0.00 N ATOM 1321 CA GLY A 90 17.374 -9.500 0.607 1.00 0.00 C ATOM 1322 C GLY A 90 16.017 -9.187 1.206 1.00 0.00 C ATOM 1323 O GLY A 90 15.863 -9.154 2.426 1.00 0.00 O ATOM 0 H GLY A 90 17.432 -9.940 -1.440 1.00 0.00 H new ATOM 0 HA2 GLY A 90 17.583 -10.563 0.725 1.00 0.00 H new ATOM 0 HA3 GLY A 90 18.144 -8.961 1.158 1.00 0.00 H new ATOM 1327 N GLU A 91 15.031 -8.956 0.344 1.00 0.00 N ATOM 1328 CA GLU A 91 13.681 -8.642 0.796 1.00 0.00 C ATOM 1329 C GLU A 91 12.774 -9.865 0.692 1.00 0.00 C ATOM 1330 O GLU A 91 12.986 -10.758 -0.128 1.00 0.00 O ATOM 1331 CB GLU A 91 13.099 -7.491 -0.026 1.00 0.00 C ATOM 1332 CG GLU A 91 13.411 -6.117 0.544 1.00 0.00 C ATOM 1333 CD GLU A 91 12.354 -5.636 1.519 1.00 0.00 C ATOM 1334 OE1 GLU A 91 11.189 -5.478 1.100 1.00 0.00 O ATOM 1335 OE2 GLU A 91 12.692 -5.418 2.701 1.00 0.00 O ATOM 0 H GLU A 91 15.142 -8.980 -0.670 1.00 0.00 H new ATOM 0 HA GLU A 91 13.737 -8.340 1.842 1.00 0.00 H new ATOM 0 HB2 GLU A 91 13.487 -7.550 -1.043 1.00 0.00 H new ATOM 0 HB3 GLU A 91 12.018 -7.612 -0.090 1.00 0.00 H new ATOM 0 HG2 GLU A 91 14.377 -6.148 1.047 1.00 0.00 H new ATOM 0 HG3 GLU A 91 13.500 -5.401 -0.273 1.00 0.00 H new ATOM 1342 N PRO A 92 11.739 -9.908 1.544 1.00 0.00 N ATOM 1343 CA PRO A 92 11.477 -8.850 2.525 1.00 0.00 C ATOM 1344 C PRO A 92 12.518 -8.822 3.639 1.00 0.00 C ATOM 1345 O PRO A 92 13.061 -9.859 4.020 1.00 0.00 O ATOM 1346 CB PRO A 92 10.102 -9.221 3.087 1.00 0.00 C ATOM 1347 CG PRO A 92 9.994 -10.693 2.883 1.00 0.00 C ATOM 1348 CD PRO A 92 10.744 -10.992 1.615 1.00 0.00 C ATOM 0 HA PRO A 92 11.516 -7.858 2.075 1.00 0.00 H new ATOM 0 HB2 PRO A 92 10.022 -8.961 4.142 1.00 0.00 H new ATOM 0 HB3 PRO A 92 9.305 -8.690 2.567 1.00 0.00 H new ATOM 0 HG2 PRO A 92 10.421 -11.236 3.726 1.00 0.00 H new ATOM 0 HG3 PRO A 92 8.951 -11.000 2.801 1.00 0.00 H new ATOM 0 HD2 PRO A 92 11.219 -11.972 1.651 1.00 0.00 H new ATOM 0 HD3 PRO A 92 10.084 -10.989 0.747 1.00 0.00 H new ATOM 1356 N SER A 93 12.791 -7.629 4.157 1.00 0.00 N ATOM 1357 CA SER A 93 13.770 -7.465 5.225 1.00 0.00 C ATOM 1358 C SER A 93 13.267 -8.090 6.523 1.00 0.00 C ATOM 1359 O SER A 93 12.082 -8.010 6.844 1.00 0.00 O ATOM 1360 CB SER A 93 14.075 -5.982 5.444 1.00 0.00 C ATOM 1361 OG SER A 93 15.364 -5.804 6.005 1.00 0.00 O ATOM 0 H SER A 93 12.348 -6.762 3.854 1.00 0.00 H new ATOM 0 HA SER A 93 14.685 -7.976 4.927 1.00 0.00 H new ATOM 0 HB2 SER A 93 14.012 -5.450 4.495 1.00 0.00 H new ATOM 0 HB3 SER A 93 13.324 -5.547 6.104 1.00 0.00 H new ATOM 0 HG SER A 93 15.279 -5.435 6.909 1.00 0.00 H new ATOM 1367 N ASN A 94 14.178 -8.711 7.265 1.00 0.00 N ATOM 1368 CA ASN A 94 13.828 -9.350 8.529 1.00 0.00 C ATOM 1369 C ASN A 94 14.040 -8.394 9.699 1.00 0.00 C ATOM 1370 O ASN A 94 14.728 -8.723 10.665 1.00 0.00 O ATOM 1371 CB ASN A 94 14.662 -10.616 8.732 1.00 0.00 C ATOM 1372 CG ASN A 94 14.045 -11.829 8.064 1.00 0.00 C ATOM 1373 OD1 ASN A 94 13.909 -11.876 6.841 1.00 0.00 O ATOM 1374 ND2 ASN A 94 13.666 -12.818 8.866 1.00 0.00 N ATOM 0 H ASN A 94 15.164 -8.785 7.013 1.00 0.00 H new ATOM 0 HA ASN A 94 12.773 -9.620 8.491 1.00 0.00 H new ATOM 0 HB2 ASN A 94 15.664 -10.455 8.333 1.00 0.00 H new ATOM 0 HB3 ASN A 94 14.771 -10.809 9.799 1.00 0.00 H new ATOM 0 HD21 ASN A 94 13.243 -13.659 8.474 1.00 0.00 H new ATOM 0 HD22 ASN A 94 13.798 -12.736 9.874 1.00 0.00 H new ATOM 1381 N ASP A 95 13.443 -7.211 9.604 1.00 0.00 N ATOM 1382 CA ASP A 95 13.565 -6.207 10.656 1.00 0.00 C ATOM 1383 C ASP A 95 12.222 -5.971 11.340 1.00 0.00 C ATOM 1384 O ASP A 95 11.173 -5.913 10.698 1.00 0.00 O ATOM 1385 CB ASP A 95 14.095 -4.894 10.078 1.00 0.00 C ATOM 1386 CG ASP A 95 15.603 -4.895 9.925 1.00 0.00 C ATOM 1387 OD1 ASP A 95 16.301 -5.130 10.934 1.00 0.00 O ATOM 1388 OD2 ASP A 95 16.086 -4.661 8.797 1.00 0.00 O ATOM 0 H ASP A 95 12.870 -6.923 8.810 1.00 0.00 H new ATOM 0 HA ASP A 95 14.270 -6.579 11.399 1.00 0.00 H new ATOM 0 HB2 ASP A 95 13.634 -4.716 9.106 1.00 0.00 H new ATOM 0 HB3 ASP A 95 13.799 -4.069 10.727 1.00 0.00 H new ATOM 1393 N PRO A 96 12.253 -5.833 12.673 1.00 0.00 N ATOM 1394 CA PRO A 96 11.047 -5.602 13.474 1.00 0.00 C ATOM 1395 C PRO A 96 10.457 -4.215 13.245 1.00 0.00 C ATOM 1396 O PRO A 96 9.241 -4.027 13.307 1.00 0.00 O ATOM 1397 CB PRO A 96 11.545 -5.741 14.914 1.00 0.00 C ATOM 1398 CG PRO A 96 12.996 -5.411 14.847 1.00 0.00 C ATOM 1399 CD PRO A 96 13.468 -5.891 13.503 1.00 0.00 C ATOM 0 HA PRO A 96 10.247 -6.297 13.217 1.00 0.00 H new ATOM 0 HB2 PRO A 96 11.015 -5.063 15.583 1.00 0.00 H new ATOM 0 HB3 PRO A 96 11.386 -6.751 15.292 1.00 0.00 H new ATOM 0 HG2 PRO A 96 13.158 -4.339 14.957 1.00 0.00 H new ATOM 0 HG3 PRO A 96 13.545 -5.901 15.651 1.00 0.00 H new ATOM 0 HD2 PRO A 96 14.258 -5.255 13.104 1.00 0.00 H new ATOM 0 HD3 PRO A 96 13.870 -6.903 13.556 1.00 0.00 H new ATOM 1407 N THR A 97 11.325 -3.243 12.981 1.00 0.00 N ATOM 1408 CA THR A 97 10.890 -1.873 12.745 1.00 0.00 C ATOM 1409 C THR A 97 10.159 -1.750 11.413 1.00 0.00 C ATOM 1410 O THR A 97 9.078 -1.166 11.339 1.00 0.00 O ATOM 1411 CB THR A 97 12.081 -0.896 12.755 1.00 0.00 C ATOM 1412 OG1 THR A 97 13.075 -1.325 11.819 1.00 0.00 O ATOM 1413 CG2 THR A 97 12.692 -0.803 14.145 1.00 0.00 C ATOM 0 H THR A 97 12.334 -3.380 12.925 1.00 0.00 H new ATOM 0 HA THR A 97 10.209 -1.614 13.556 1.00 0.00 H new ATOM 0 HB THR A 97 11.716 0.090 12.469 1.00 0.00 H new ATOM 0 HG1 THR A 97 13.828 -0.697 11.831 1.00 0.00 H new ATOM 0 HG21 THR A 97 13.531 -0.108 14.128 1.00 0.00 H new ATOM 0 HG22 THR A 97 11.940 -0.447 14.850 1.00 0.00 H new ATOM 0 HG23 THR A 97 13.043 -1.787 14.455 1.00 0.00 H new ATOM 1421 N ARG A 98 10.755 -2.305 10.362 1.00 0.00 N ATOM 1422 CA ARG A 98 10.160 -2.257 9.032 1.00 0.00 C ATOM 1423 C ARG A 98 9.145 -3.381 8.850 1.00 0.00 C ATOM 1424 O ARG A 98 9.500 -4.559 8.871 1.00 0.00 O ATOM 1425 CB ARG A 98 11.247 -2.357 7.960 1.00 0.00 C ATOM 1426 CG ARG A 98 12.454 -1.474 8.232 1.00 0.00 C ATOM 1427 CD ARG A 98 13.694 -1.993 7.522 1.00 0.00 C ATOM 1428 NE ARG A 98 13.726 -1.598 6.116 1.00 0.00 N ATOM 1429 CZ ARG A 98 14.831 -1.593 5.379 1.00 0.00 C ATOM 1430 NH1 ARG A 98 15.989 -1.959 5.911 1.00 0.00 N ATOM 1431 NH2 ARG A 98 14.779 -1.221 4.106 1.00 0.00 N ATOM 0 H ARG A 98 11.650 -2.793 10.406 1.00 0.00 H new ATOM 0 HA ARG A 98 9.643 -1.303 8.927 1.00 0.00 H new ATOM 0 HB2 ARG A 98 11.576 -3.393 7.883 1.00 0.00 H new ATOM 0 HB3 ARG A 98 10.819 -2.086 6.995 1.00 0.00 H new ATOM 0 HG2 ARG A 98 12.244 -0.457 7.903 1.00 0.00 H new ATOM 0 HG3 ARG A 98 12.639 -1.430 9.305 1.00 0.00 H new ATOM 0 HD2 ARG A 98 14.584 -1.615 8.025 1.00 0.00 H new ATOM 0 HD3 ARG A 98 13.724 -3.080 7.594 1.00 0.00 H new ATOM 0 HE ARG A 98 12.852 -1.310 5.676 1.00 0.00 H new ATOM 0 HH11 ARG A 98 16.033 -2.246 6.889 1.00 0.00 H new ATOM 0 HH12 ARG A 98 16.836 -1.954 5.342 1.00 0.00 H new ATOM 0 HH21 ARG A 98 13.890 -0.939 3.693 1.00 0.00 H new ATOM 0 HH22 ARG A 98 15.628 -1.217 3.541 1.00 0.00 H new ATOM 1445 N GLN A 99 7.882 -3.008 8.672 1.00 0.00 N ATOM 1446 CA GLN A 99 6.816 -3.986 8.487 1.00 0.00 C ATOM 1447 C GLN A 99 6.070 -3.738 7.180 1.00 0.00 C ATOM 1448 O GLN A 99 5.696 -4.678 6.479 1.00 0.00 O ATOM 1449 CB GLN A 99 5.839 -3.935 9.663 1.00 0.00 C ATOM 1450 CG GLN A 99 6.516 -3.726 11.008 1.00 0.00 C ATOM 1451 CD GLN A 99 5.741 -4.347 12.154 1.00 0.00 C ATOM 1452 OE1 GLN A 99 5.989 -5.490 12.539 1.00 0.00 O ATOM 1453 NE2 GLN A 99 4.797 -3.595 12.706 1.00 0.00 N ATOM 0 H GLN A 99 7.572 -2.037 8.652 1.00 0.00 H new ATOM 0 HA GLN A 99 7.270 -4.976 8.443 1.00 0.00 H new ATOM 0 HB2 GLN A 99 5.124 -3.129 9.496 1.00 0.00 H new ATOM 0 HB3 GLN A 99 5.270 -4.864 9.692 1.00 0.00 H new ATOM 0 HG2 GLN A 99 7.518 -4.155 10.977 1.00 0.00 H new ATOM 0 HG3 GLN A 99 6.632 -2.658 11.190 1.00 0.00 H new ATOM 0 HE21 GLN A 99 4.625 -2.653 12.355 1.00 0.00 H new ATOM 0 HE22 GLN A 99 4.243 -3.959 13.481 1.00 0.00 H new ATOM 1462 N CYS A 100 5.857 -2.466 6.858 1.00 0.00 N ATOM 1463 CA CYS A 100 5.156 -2.094 5.636 1.00 0.00 C ATOM 1464 C CYS A 100 6.097 -2.131 4.435 1.00 0.00 C ATOM 1465 O CYS A 100 7.305 -2.312 4.585 1.00 0.00 O ATOM 1466 CB CYS A 100 4.547 -0.697 5.778 1.00 0.00 C ATOM 1467 SG CYS A 100 3.278 -0.568 7.078 1.00 0.00 S ATOM 0 H CYS A 100 6.160 -1.676 7.427 1.00 0.00 H new ATOM 0 HA CYS A 100 4.357 -2.817 5.471 1.00 0.00 H new ATOM 0 HB2 CYS A 100 5.344 0.015 5.991 1.00 0.00 H new ATOM 0 HB3 CYS A 100 4.106 -0.406 4.825 1.00 0.00 H new ATOM 1472 N VAL A 101 5.534 -1.957 3.244 1.00 0.00 N ATOM 1473 CA VAL A 101 6.323 -1.969 2.017 1.00 0.00 C ATOM 1474 C VAL A 101 5.919 -0.825 1.093 1.00 0.00 C ATOM 1475 O VAL A 101 4.742 -0.480 0.994 1.00 0.00 O ATOM 1476 CB VAL A 101 6.167 -3.303 1.263 1.00 0.00 C ATOM 1477 CG1 VAL A 101 7.093 -3.346 0.057 1.00 0.00 C ATOM 1478 CG2 VAL A 101 6.436 -4.476 2.194 1.00 0.00 C ATOM 0 H VAL A 101 4.535 -1.806 3.102 1.00 0.00 H new ATOM 0 HA VAL A 101 7.366 -1.845 2.309 1.00 0.00 H new ATOM 0 HB VAL A 101 5.140 -3.380 0.906 1.00 0.00 H new ATOM 0 HG11 VAL A 101 6.969 -4.296 -0.463 1.00 0.00 H new ATOM 0 HG12 VAL A 101 6.848 -2.527 -0.619 1.00 0.00 H new ATOM 0 HG13 VAL A 101 8.127 -3.246 0.388 1.00 0.00 H new ATOM 0 HG21 VAL A 101 6.321 -5.410 1.645 1.00 0.00 H new ATOM 0 HG22 VAL A 101 7.452 -4.406 2.583 1.00 0.00 H new ATOM 0 HG23 VAL A 101 5.728 -4.453 3.022 1.00 0.00 H new ATOM 1488 N TYR A 102 6.903 -0.242 0.418 1.00 0.00 N ATOM 1489 CA TYR A 102 6.651 0.865 -0.497 1.00 0.00 C ATOM 1490 C TYR A 102 7.419 0.678 -1.802 1.00 0.00 C ATOM 1491 O TYR A 102 8.594 0.309 -1.797 1.00 0.00 O ATOM 1492 CB TYR A 102 7.045 2.192 0.154 1.00 0.00 C ATOM 1493 CG TYR A 102 8.529 2.474 0.104 1.00 0.00 C ATOM 1494 CD1 TYR A 102 9.135 2.904 -1.070 1.00 0.00 C ATOM 1495 CD2 TYR A 102 9.326 2.310 1.231 1.00 0.00 C ATOM 1496 CE1 TYR A 102 10.492 3.163 -1.121 1.00 0.00 C ATOM 1497 CE2 TYR A 102 10.683 2.567 1.189 1.00 0.00 C ATOM 1498 CZ TYR A 102 11.261 2.993 0.012 1.00 0.00 C ATOM 1499 OH TYR A 102 12.612 3.249 -0.034 1.00 0.00 O ATOM 0 H TYR A 102 7.883 -0.517 0.487 1.00 0.00 H new ATOM 0 HA TYR A 102 5.585 0.881 -0.723 1.00 0.00 H new ATOM 0 HB2 TYR A 102 6.513 3.003 -0.343 1.00 0.00 H new ATOM 0 HB3 TYR A 102 6.719 2.187 1.194 1.00 0.00 H new ATOM 0 HD1 TYR A 102 8.535 3.038 -1.958 1.00 0.00 H new ATOM 0 HD2 TYR A 102 8.877 1.976 2.155 1.00 0.00 H new ATOM 0 HE1 TYR A 102 10.947 3.496 -2.042 1.00 0.00 H new ATOM 0 HE2 TYR A 102 11.288 2.435 2.074 1.00 0.00 H new ATOM 0 HH TYR A 102 12.783 3.994 -0.648 1.00 0.00 H new ATOM 1509 N PHE A 103 6.747 0.937 -2.918 1.00 0.00 N ATOM 1510 CA PHE A 103 7.364 0.798 -4.232 1.00 0.00 C ATOM 1511 C PHE A 103 8.566 1.728 -4.369 1.00 0.00 C ATOM 1512 O PHE A 103 8.447 2.942 -4.208 1.00 0.00 O ATOM 1513 CB PHE A 103 6.344 1.099 -5.333 1.00 0.00 C ATOM 1514 CG PHE A 103 6.849 0.801 -6.715 1.00 0.00 C ATOM 1515 CD1 PHE A 103 7.919 1.507 -7.244 1.00 0.00 C ATOM 1516 CD2 PHE A 103 6.254 -0.183 -7.487 1.00 0.00 C ATOM 1517 CE1 PHE A 103 8.386 1.235 -8.516 1.00 0.00 C ATOM 1518 CE2 PHE A 103 6.718 -0.460 -8.760 1.00 0.00 C ATOM 1519 CZ PHE A 103 7.784 0.251 -9.275 1.00 0.00 C ATOM 0 H PHE A 103 5.775 1.244 -2.939 1.00 0.00 H new ATOM 0 HA PHE A 103 7.708 -0.231 -4.337 1.00 0.00 H new ATOM 0 HB2 PHE A 103 5.442 0.515 -5.151 1.00 0.00 H new ATOM 0 HB3 PHE A 103 6.060 2.150 -5.277 1.00 0.00 H new ATOM 0 HD1 PHE A 103 8.393 2.278 -6.655 1.00 0.00 H new ATOM 0 HD2 PHE A 103 5.418 -0.740 -7.090 1.00 0.00 H new ATOM 0 HE1 PHE A 103 9.221 1.791 -8.916 1.00 0.00 H new ATOM 0 HE2 PHE A 103 6.247 -1.232 -9.351 1.00 0.00 H new ATOM 0 HZ PHE A 103 8.146 0.038 -10.270 1.00 0.00 H new ATOM 1529 N ASP A 104 9.724 1.148 -4.667 1.00 0.00 N ATOM 1530 CA ASP A 104 10.949 1.923 -4.827 1.00 0.00 C ATOM 1531 C ASP A 104 11.180 2.278 -6.292 1.00 0.00 C ATOM 1532 O ASP A 104 11.666 1.460 -7.071 1.00 0.00 O ATOM 1533 CB ASP A 104 12.146 1.142 -4.284 1.00 0.00 C ATOM 1534 CG ASP A 104 13.381 2.007 -4.131 1.00 0.00 C ATOM 1535 OD1 ASP A 104 13.409 3.111 -4.716 1.00 0.00 O ATOM 1536 OD2 ASP A 104 14.320 1.582 -3.426 1.00 0.00 O ATOM 0 H ASP A 104 9.840 0.144 -4.803 1.00 0.00 H new ATOM 0 HA ASP A 104 10.841 2.848 -4.260 1.00 0.00 H new ATOM 0 HB2 ASP A 104 11.886 0.711 -3.317 1.00 0.00 H new ATOM 0 HB3 ASP A 104 12.368 0.312 -4.954 1.00 0.00 H new ATOM 1541 N GLY A 105 10.826 3.506 -6.661 1.00 0.00 N ATOM 1542 CA GLY A 105 11.001 3.948 -8.032 1.00 0.00 C ATOM 1543 C GLY A 105 12.437 4.324 -8.341 1.00 0.00 C ATOM 1544 O GLY A 105 12.872 4.249 -9.490 1.00 0.00 O ATOM 0 H GLY A 105 10.421 4.202 -6.035 1.00 0.00 H new ATOM 0 HA2 GLY A 105 10.682 3.156 -8.709 1.00 0.00 H new ATOM 0 HA3 GLY A 105 10.356 4.806 -8.219 1.00 0.00 H new ATOM 1548 N ARG A 106 13.174 4.733 -7.314 1.00 0.00 N ATOM 1549 CA ARG A 106 14.568 5.126 -7.481 1.00 0.00 C ATOM 1550 C ARG A 106 15.495 3.926 -7.309 1.00 0.00 C ATOM 1551 O ARG A 106 16.696 4.084 -7.092 1.00 0.00 O ATOM 1552 CB ARG A 106 14.937 6.218 -6.476 1.00 0.00 C ATOM 1553 CG ARG A 106 14.146 7.503 -6.654 1.00 0.00 C ATOM 1554 CD ARG A 106 14.470 8.513 -5.565 1.00 0.00 C ATOM 1555 NE ARG A 106 13.947 9.840 -5.875 1.00 0.00 N ATOM 1556 CZ ARG A 106 14.428 10.961 -5.349 1.00 0.00 C ATOM 1557 NH1 ARG A 106 15.437 10.915 -4.491 1.00 0.00 N ATOM 1558 NH2 ARG A 106 13.898 12.132 -5.681 1.00 0.00 N ATOM 0 H ARG A 106 12.829 4.801 -6.357 1.00 0.00 H new ATOM 0 HA ARG A 106 14.691 5.516 -8.491 1.00 0.00 H new ATOM 0 HB2 ARG A 106 14.777 5.840 -5.466 1.00 0.00 H new ATOM 0 HB3 ARG A 106 16.000 6.440 -6.568 1.00 0.00 H new ATOM 0 HG2 ARG A 106 14.367 7.935 -7.630 1.00 0.00 H new ATOM 0 HG3 ARG A 106 13.079 7.280 -6.639 1.00 0.00 H new ATOM 0 HD2 ARG A 106 14.052 8.171 -4.618 1.00 0.00 H new ATOM 0 HD3 ARG A 106 15.551 8.571 -5.434 1.00 0.00 H new ATOM 0 HE ARG A 106 13.170 9.910 -6.532 1.00 0.00 H new ATOM 0 HH11 ARG A 106 15.846 10.017 -4.233 1.00 0.00 H new ATOM 0 HH12 ARG A 106 15.804 11.777 -4.089 1.00 0.00 H new ATOM 0 HH21 ARG A 106 13.121 12.171 -6.340 1.00 0.00 H new ATOM 0 HH22 ARG A 106 14.268 12.992 -5.277 1.00 0.00 H new ATOM 1572 N SER A 107 14.929 2.728 -7.408 1.00 0.00 N ATOM 1573 CA SER A 107 15.703 1.501 -7.259 1.00 0.00 C ATOM 1574 C SER A 107 16.508 1.211 -8.522 1.00 0.00 C ATOM 1575 O SER A 107 16.244 1.773 -9.584 1.00 0.00 O ATOM 1576 CB SER A 107 14.778 0.323 -6.948 1.00 0.00 C ATOM 1577 OG SER A 107 15.364 -0.904 -7.347 1.00 0.00 O ATOM 0 H SER A 107 13.936 2.580 -7.591 1.00 0.00 H new ATOM 0 HA SER A 107 16.397 1.637 -6.429 1.00 0.00 H new ATOM 0 HB2 SER A 107 14.564 0.297 -5.880 1.00 0.00 H new ATOM 0 HB3 SER A 107 13.826 0.459 -7.461 1.00 0.00 H new ATOM 0 HG SER A 107 14.762 -1.368 -7.966 1.00 0.00 H new ATOM 1583 N GLY A 108 17.494 0.327 -8.398 1.00 0.00 N ATOM 1584 CA GLY A 108 18.324 -0.024 -9.536 1.00 0.00 C ATOM 1585 C GLY A 108 17.574 -0.841 -10.570 1.00 0.00 C ATOM 1586 O GLY A 108 17.912 -0.817 -11.753 1.00 0.00 O ATOM 0 H GLY A 108 17.733 -0.152 -7.530 1.00 0.00 H new ATOM 0 HA2 GLY A 108 18.702 0.887 -10.001 1.00 0.00 H new ATOM 0 HA3 GLY A 108 19.190 -0.588 -9.190 1.00 0.00 H new ATOM 1590 N ASP A 109 16.555 -1.567 -10.123 1.00 0.00 N ATOM 1591 CA ASP A 109 15.756 -2.395 -11.018 1.00 0.00 C ATOM 1592 C ASP A 109 14.293 -2.409 -10.585 1.00 0.00 C ATOM 1593 O ASP A 109 13.978 -2.175 -9.418 1.00 0.00 O ATOM 1594 CB ASP A 109 16.304 -3.823 -11.052 1.00 0.00 C ATOM 1595 CG ASP A 109 16.049 -4.510 -12.379 1.00 0.00 C ATOM 1596 OD1 ASP A 109 14.867 -4.738 -12.710 1.00 0.00 O ATOM 1597 OD2 ASP A 109 17.031 -4.820 -13.085 1.00 0.00 O ATOM 0 H ASP A 109 16.263 -1.599 -9.146 1.00 0.00 H new ATOM 0 HA ASP A 109 15.816 -1.967 -12.019 1.00 0.00 H new ATOM 0 HB2 ASP A 109 17.376 -3.802 -10.857 1.00 0.00 H new ATOM 0 HB3 ASP A 109 15.846 -4.404 -10.252 1.00 0.00 H new ATOM 1602 N LYS A 110 13.403 -2.683 -11.533 1.00 0.00 N ATOM 1603 CA LYS A 110 11.974 -2.727 -11.251 1.00 0.00 C ATOM 1604 C LYS A 110 11.604 -4.009 -10.512 1.00 0.00 C ATOM 1605 O LYS A 110 10.633 -4.044 -9.757 1.00 0.00 O ATOM 1606 CB LYS A 110 11.173 -2.627 -12.551 1.00 0.00 C ATOM 1607 CG LYS A 110 11.590 -3.642 -13.602 1.00 0.00 C ATOM 1608 CD LYS A 110 10.424 -4.029 -14.496 1.00 0.00 C ATOM 1609 CE LYS A 110 9.620 -5.174 -13.899 1.00 0.00 C ATOM 1610 NZ LYS A 110 8.415 -5.490 -14.714 1.00 0.00 N ATOM 0 H LYS A 110 13.647 -2.878 -12.504 1.00 0.00 H new ATOM 0 HA LYS A 110 11.729 -1.877 -10.614 1.00 0.00 H new ATOM 0 HB2 LYS A 110 10.115 -2.762 -12.327 1.00 0.00 H new ATOM 0 HB3 LYS A 110 11.286 -1.624 -12.962 1.00 0.00 H new ATOM 0 HG2 LYS A 110 12.394 -3.228 -14.210 1.00 0.00 H new ATOM 0 HG3 LYS A 110 11.986 -4.532 -13.113 1.00 0.00 H new ATOM 0 HD2 LYS A 110 9.775 -3.166 -14.644 1.00 0.00 H new ATOM 0 HD3 LYS A 110 10.798 -4.319 -15.478 1.00 0.00 H new ATOM 0 HE2 LYS A 110 10.250 -6.060 -13.824 1.00 0.00 H new ATOM 0 HE3 LYS A 110 9.315 -4.914 -12.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 7.610 -5.680 -14.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 8.190 -4.682 -15.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 8.602 -6.329 -15.299 1.00 0.00 H new ATOM 1624 N SER A 111 12.387 -5.061 -10.733 1.00 0.00 N ATOM 1625 CA SER A 111 12.140 -6.346 -10.090 1.00 0.00 C ATOM 1626 C SER A 111 12.466 -6.279 -8.601 1.00 0.00 C ATOM 1627 O SER A 111 12.049 -7.137 -7.822 1.00 0.00 O ATOM 1628 CB SER A 111 12.972 -7.442 -10.757 1.00 0.00 C ATOM 1629 OG SER A 111 14.348 -7.104 -10.766 1.00 0.00 O ATOM 0 H SER A 111 13.197 -5.048 -11.352 1.00 0.00 H new ATOM 0 HA SER A 111 11.082 -6.584 -10.203 1.00 0.00 H new ATOM 0 HB2 SER A 111 12.829 -8.384 -10.228 1.00 0.00 H new ATOM 0 HB3 SER A 111 12.625 -7.595 -11.779 1.00 0.00 H new ATOM 0 HG SER A 111 14.522 -6.460 -11.484 1.00 0.00 H new ATOM 1635 N LYS A 112 13.216 -5.253 -8.211 1.00 0.00 N ATOM 1636 CA LYS A 112 13.598 -5.071 -6.816 1.00 0.00 C ATOM 1637 C LYS A 112 13.068 -3.748 -6.275 1.00 0.00 C ATOM 1638 O LYS A 112 13.767 -3.035 -5.555 1.00 0.00 O ATOM 1639 CB LYS A 112 15.121 -5.119 -6.673 1.00 0.00 C ATOM 1640 CG LYS A 112 15.725 -6.462 -7.047 1.00 0.00 C ATOM 1641 CD LYS A 112 17.188 -6.326 -7.437 1.00 0.00 C ATOM 1642 CE LYS A 112 17.682 -7.554 -8.185 1.00 0.00 C ATOM 1643 NZ LYS A 112 17.286 -7.525 -9.621 1.00 0.00 N ATOM 0 H LYS A 112 13.571 -4.535 -8.842 1.00 0.00 H new ATOM 0 HA LYS A 112 13.159 -5.883 -6.236 1.00 0.00 H new ATOM 0 HB2 LYS A 112 15.561 -4.345 -7.301 1.00 0.00 H new ATOM 0 HB3 LYS A 112 15.388 -4.884 -5.643 1.00 0.00 H new ATOM 0 HG2 LYS A 112 15.634 -7.150 -6.206 1.00 0.00 H new ATOM 0 HG3 LYS A 112 15.165 -6.896 -7.876 1.00 0.00 H new ATOM 0 HD2 LYS A 112 17.319 -5.442 -8.061 1.00 0.00 H new ATOM 0 HD3 LYS A 112 17.792 -6.177 -6.542 1.00 0.00 H new ATOM 0 HE2 LYS A 112 18.768 -7.613 -8.109 1.00 0.00 H new ATOM 0 HE3 LYS A 112 17.280 -8.452 -7.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 17.537 -8.430 -10.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 16.260 -7.375 -9.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 17.785 -6.750 -10.103 1.00 0.00 H new ATOM 1657 N VAL A 113 11.826 -3.425 -6.624 1.00 0.00 N ATOM 1658 CA VAL A 113 11.201 -2.189 -6.171 1.00 0.00 C ATOM 1659 C VAL A 113 10.531 -2.377 -4.815 1.00 0.00 C ATOM 1660 O VAL A 113 10.370 -1.423 -4.053 1.00 0.00 O ATOM 1661 CB VAL A 113 10.155 -1.685 -7.183 1.00 0.00 C ATOM 1662 CG1 VAL A 113 10.826 -1.274 -8.485 1.00 0.00 C ATOM 1663 CG2 VAL A 113 9.098 -2.750 -7.431 1.00 0.00 C ATOM 0 H VAL A 113 11.233 -4.003 -7.219 1.00 0.00 H new ATOM 0 HA VAL A 113 11.995 -1.448 -6.081 1.00 0.00 H new ATOM 0 HB VAL A 113 9.662 -0.808 -6.764 1.00 0.00 H new ATOM 0 HG11 VAL A 113 10.071 -0.921 -9.188 1.00 0.00 H new ATOM 0 HG12 VAL A 113 11.542 -0.475 -8.289 1.00 0.00 H new ATOM 0 HG13 VAL A 113 11.347 -2.131 -8.912 1.00 0.00 H new ATOM 0 HG21 VAL A 113 8.367 -2.377 -8.148 1.00 0.00 H new ATOM 0 HG22 VAL A 113 9.572 -3.647 -7.829 1.00 0.00 H new ATOM 0 HG23 VAL A 113 8.596 -2.990 -6.494 1.00 0.00 H new ATOM 1673 N TRP A 114 10.142 -3.612 -4.520 1.00 0.00 N ATOM 1674 CA TRP A 114 9.488 -3.926 -3.254 1.00 0.00 C ATOM 1675 C TRP A 114 10.470 -3.816 -2.093 1.00 0.00 C ATOM 1676 O TRP A 114 11.312 -4.692 -1.893 1.00 0.00 O ATOM 1677 CB TRP A 114 8.889 -5.332 -3.301 1.00 0.00 C ATOM 1678 CG TRP A 114 7.541 -5.382 -3.955 1.00 0.00 C ATOM 1679 CD1 TRP A 114 6.952 -4.397 -4.695 1.00 0.00 C ATOM 1680 CD2 TRP A 114 6.614 -6.473 -3.925 1.00 0.00 C ATOM 1681 NE1 TRP A 114 5.715 -4.810 -5.127 1.00 0.00 N ATOM 1682 CE2 TRP A 114 5.484 -6.080 -4.669 1.00 0.00 C ATOM 1683 CE3 TRP A 114 6.629 -7.743 -3.343 1.00 0.00 C ATOM 1684 CZ2 TRP A 114 4.382 -6.912 -4.844 1.00 0.00 C ATOM 1685 CZ3 TRP A 114 5.534 -8.569 -3.518 1.00 0.00 C ATOM 1686 CH2 TRP A 114 4.424 -8.151 -4.264 1.00 0.00 C ATOM 0 H TRP A 114 10.268 -4.412 -5.140 1.00 0.00 H new ATOM 0 HA TRP A 114 8.687 -3.203 -3.098 1.00 0.00 H new ATOM 0 HB2 TRP A 114 9.570 -5.992 -3.838 1.00 0.00 H new ATOM 0 HB3 TRP A 114 8.807 -5.718 -2.285 1.00 0.00 H new ATOM 0 HD1 TRP A 114 7.394 -3.435 -4.909 1.00 0.00 H new ATOM 0 HE1 TRP A 114 5.072 -4.260 -5.697 1.00 0.00 H new ATOM 0 HE3 TRP A 114 7.481 -8.074 -2.767 1.00 0.00 H new ATOM 0 HZ2 TRP A 114 3.524 -6.591 -5.417 1.00 0.00 H new ATOM 0 HZ3 TRP A 114 5.534 -9.553 -3.072 1.00 0.00 H new ATOM 0 HH2 TRP A 114 3.585 -8.820 -4.384 1.00 0.00 H new ATOM 1697 N THR A 115 10.357 -2.735 -1.328 1.00 0.00 N ATOM 1698 CA THR A 115 11.236 -2.511 -0.187 1.00 0.00 C ATOM 1699 C THR A 115 10.433 -2.251 1.083 1.00 0.00 C ATOM 1700 O THR A 115 9.534 -1.409 1.101 1.00 0.00 O ATOM 1701 CB THR A 115 12.184 -1.322 -0.433 1.00 0.00 C ATOM 1702 OG1 THR A 115 13.108 -1.641 -1.479 1.00 0.00 O ATOM 1703 CG2 THR A 115 12.948 -0.968 0.834 1.00 0.00 C ATOM 0 H THR A 115 9.665 -2.001 -1.478 1.00 0.00 H new ATOM 0 HA THR A 115 11.827 -3.418 -0.061 1.00 0.00 H new ATOM 0 HB THR A 115 11.583 -0.462 -0.729 1.00 0.00 H new ATOM 0 HG1 THR A 115 13.706 -0.880 -1.631 1.00 0.00 H new ATOM 0 HG21 THR A 115 13.611 -0.126 0.636 1.00 0.00 H new ATOM 0 HG22 THR A 115 12.243 -0.698 1.620 1.00 0.00 H new ATOM 0 HG23 THR A 115 13.538 -1.826 1.155 1.00 0.00 H new ATOM 1711 N THR A 116 10.762 -2.980 2.145 1.00 0.00 N ATOM 1712 CA THR A 116 10.071 -2.828 3.419 1.00 0.00 C ATOM 1713 C THR A 116 10.641 -1.662 4.219 1.00 0.00 C ATOM 1714 O THR A 116 11.849 -1.425 4.214 1.00 0.00 O ATOM 1715 CB THR A 116 10.167 -4.112 4.266 1.00 0.00 C ATOM 1716 OG1 THR A 116 11.534 -4.380 4.595 1.00 0.00 O ATOM 1717 CG2 THR A 116 9.577 -5.298 3.519 1.00 0.00 C ATOM 0 H THR A 116 11.503 -3.681 2.148 1.00 0.00 H new ATOM 0 HA THR A 116 9.024 -2.629 3.189 1.00 0.00 H new ATOM 0 HB THR A 116 9.597 -3.961 5.182 1.00 0.00 H new ATOM 0 HG1 THR A 116 12.060 -4.456 3.772 1.00 0.00 H new ATOM 0 HG21 THR A 116 9.656 -6.193 4.136 1.00 0.00 H new ATOM 0 HG22 THR A 116 8.528 -5.102 3.296 1.00 0.00 H new ATOM 0 HG23 THR A 116 10.123 -5.450 2.588 1.00 0.00 H new ATOM 1725 N ASP A 117 9.764 -0.937 4.905 1.00 0.00 N ATOM 1726 CA ASP A 117 10.180 0.204 5.712 1.00 0.00 C ATOM 1727 C ASP A 117 9.134 0.530 6.773 1.00 0.00 C ATOM 1728 O ASP A 117 7.994 0.070 6.699 1.00 0.00 O ATOM 1729 CB ASP A 117 10.420 1.424 4.821 1.00 0.00 C ATOM 1730 CG ASP A 117 11.854 1.517 4.339 1.00 0.00 C ATOM 1731 OD1 ASP A 117 12.196 0.822 3.358 1.00 0.00 O ATOM 1732 OD2 ASP A 117 12.634 2.284 4.941 1.00 0.00 O ATOM 0 H ASP A 117 8.761 -1.119 4.918 1.00 0.00 H new ATOM 0 HA ASP A 117 11.111 -0.058 6.215 1.00 0.00 H new ATOM 0 HB2 ASP A 117 9.753 1.378 3.960 1.00 0.00 H new ATOM 0 HB3 ASP A 117 10.166 2.329 5.373 1.00 0.00 H new ATOM 1737 N THR A 118 9.529 1.328 7.761 1.00 0.00 N ATOM 1738 CA THR A 118 8.627 1.714 8.838 1.00 0.00 C ATOM 1739 C THR A 118 7.327 2.290 8.287 1.00 0.00 C ATOM 1740 O THR A 118 7.316 2.927 7.234 1.00 0.00 O ATOM 1741 CB THR A 118 9.279 2.750 9.773 1.00 0.00 C ATOM 1742 OG1 THR A 118 8.429 2.998 10.898 1.00 0.00 O ATOM 1743 CG2 THR A 118 9.545 4.053 9.034 1.00 0.00 C ATOM 0 H THR A 118 10.468 1.719 7.837 1.00 0.00 H new ATOM 0 HA THR A 118 8.408 0.810 9.406 1.00 0.00 H new ATOM 0 HB THR A 118 10.230 2.347 10.120 1.00 0.00 H new ATOM 0 HG1 THR A 118 8.851 3.656 11.488 1.00 0.00 H new ATOM 0 HG21 THR A 118 10.006 4.770 9.714 1.00 0.00 H new ATOM 0 HG22 THR A 118 10.216 3.865 8.196 1.00 0.00 H new ATOM 0 HG23 THR A 118 8.604 4.459 8.662 1.00 0.00 H new ATOM 1751 N CYS A 119 6.233 2.063 9.006 1.00 0.00 N ATOM 1752 CA CYS A 119 4.927 2.560 8.590 1.00 0.00 C ATOM 1753 C CYS A 119 4.679 3.962 9.137 1.00 0.00 C ATOM 1754 O CYS A 119 3.536 4.359 9.363 1.00 0.00 O ATOM 1755 CB CYS A 119 3.823 1.613 9.064 1.00 0.00 C ATOM 1756 SG CYS A 119 4.198 -0.152 8.811 1.00 0.00 S ATOM 0 H CYS A 119 6.225 1.538 9.880 1.00 0.00 H new ATOM 0 HA CYS A 119 4.914 2.606 7.501 1.00 0.00 H new ATOM 0 HB2 CYS A 119 3.641 1.786 10.125 1.00 0.00 H new ATOM 0 HB3 CYS A 119 2.900 1.856 8.538 1.00 0.00 H new ATOM 1761 N ALA A 120 5.758 4.709 9.349 1.00 0.00 N ATOM 1762 CA ALA A 120 5.658 6.067 9.867 1.00 0.00 C ATOM 1763 C ALA A 120 6.286 7.070 8.905 1.00 0.00 C ATOM 1764 O ALA A 120 6.074 8.277 9.024 1.00 0.00 O ATOM 1765 CB ALA A 120 6.318 6.160 11.235 1.00 0.00 C ATOM 0 H ALA A 120 6.712 4.396 9.170 1.00 0.00 H new ATOM 0 HA ALA A 120 4.601 6.314 9.968 1.00 0.00 H new ATOM 0 HB1 ALA A 120 6.236 7.180 11.610 1.00 0.00 H new ATOM 0 HB2 ALA A 120 5.821 5.478 11.926 1.00 0.00 H new ATOM 0 HB3 ALA A 120 7.370 5.888 11.151 1.00 0.00 H new ATOM 1771 N THR A 121 7.062 6.562 7.952 1.00 0.00 N ATOM 1772 CA THR A 121 7.723 7.413 6.971 1.00 0.00 C ATOM 1773 C THR A 121 6.710 8.061 6.034 1.00 0.00 C ATOM 1774 O THR A 121 5.945 7.385 5.346 1.00 0.00 O ATOM 1775 CB THR A 121 8.744 6.619 6.135 1.00 0.00 C ATOM 1776 OG1 THR A 121 9.793 6.130 6.979 1.00 0.00 O ATOM 1777 CG2 THR A 121 9.335 7.487 5.034 1.00 0.00 C ATOM 0 H THR A 121 7.248 5.565 7.839 1.00 0.00 H new ATOM 0 HA THR A 121 8.247 8.189 7.528 1.00 0.00 H new ATOM 0 HB THR A 121 8.227 5.778 5.674 1.00 0.00 H new ATOM 0 HG1 THR A 121 10.437 5.625 6.441 1.00 0.00 H new ATOM 0 HG21 THR A 121 10.053 6.904 4.457 1.00 0.00 H new ATOM 0 HG22 THR A 121 8.538 7.834 4.377 1.00 0.00 H new ATOM 0 HG23 THR A 121 9.838 8.346 5.478 1.00 0.00 H new ATOM 1785 N PRO A 122 6.704 9.402 6.003 1.00 0.00 N ATOM 1786 CA PRO A 122 5.790 10.170 5.152 1.00 0.00 C ATOM 1787 C PRO A 122 6.129 10.040 3.672 1.00 0.00 C ATOM 1788 O PRO A 122 7.102 10.624 3.195 1.00 0.00 O ATOM 1789 CB PRO A 122 5.994 11.612 5.623 1.00 0.00 C ATOM 1790 CG PRO A 122 7.369 11.632 6.195 1.00 0.00 C ATOM 1791 CD PRO A 122 7.588 10.271 6.796 1.00 0.00 C ATOM 0 HA PRO A 122 4.761 9.820 5.239 1.00 0.00 H new ATOM 0 HB2 PRO A 122 5.899 12.316 4.796 1.00 0.00 H new ATOM 0 HB3 PRO A 122 5.251 11.894 6.369 1.00 0.00 H new ATOM 0 HG2 PRO A 122 8.110 11.841 5.423 1.00 0.00 H new ATOM 0 HG3 PRO A 122 7.466 12.412 6.950 1.00 0.00 H new ATOM 0 HD2 PRO A 122 8.630 9.961 6.720 1.00 0.00 H new ATOM 0 HD3 PRO A 122 7.326 10.252 7.854 1.00 0.00 H new ATOM 1799 N ARG A 123 5.321 9.271 2.949 1.00 0.00 N ATOM 1800 CA ARG A 123 5.538 9.065 1.522 1.00 0.00 C ATOM 1801 C ARG A 123 4.212 9.058 0.767 1.00 0.00 C ATOM 1802 O ARG A 123 3.143 8.853 1.342 1.00 0.00 O ATOM 1803 CB ARG A 123 6.280 7.749 1.282 1.00 0.00 C ATOM 1804 CG ARG A 123 7.793 7.884 1.341 1.00 0.00 C ATOM 1805 CD ARG A 123 8.482 6.556 1.069 1.00 0.00 C ATOM 1806 NE ARG A 123 9.877 6.564 1.501 1.00 0.00 N ATOM 1807 CZ ARG A 123 10.838 7.228 0.868 1.00 0.00 C ATOM 1808 NH1 ARG A 123 10.556 7.933 -0.219 1.00 0.00 N ATOM 1809 NH2 ARG A 123 12.084 7.187 1.322 1.00 0.00 N ATOM 0 H ARG A 123 4.511 8.781 3.328 1.00 0.00 H new ATOM 0 HA ARG A 123 6.145 9.890 1.149 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.959 7.020 2.026 1.00 0.00 H new ATOM 0 HB3 ARG A 123 5.997 7.354 0.306 1.00 0.00 H new ATOM 0 HG2 ARG A 123 8.122 8.622 0.610 1.00 0.00 H new ATOM 0 HG3 ARG A 123 8.088 8.254 2.323 1.00 0.00 H new ATOM 0 HD2 ARG A 123 7.948 5.758 1.585 1.00 0.00 H new ATOM 0 HD3 ARG A 123 8.434 6.335 0.003 1.00 0.00 H new ATOM 0 HE ARG A 123 10.127 6.031 2.334 1.00 0.00 H new ATOM 0 HH11 ARG A 123 9.599 7.967 -0.571 1.00 0.00 H new ATOM 0 HH12 ARG A 123 11.296 8.442 -0.703 1.00 0.00 H new ATOM 0 HH21 ARG A 123 12.305 6.645 2.158 1.00 0.00 H new ATOM 0 HH22 ARG A 123 12.821 7.697 0.835 1.00 0.00 H new ATOM 1823 N PRO A 124 4.281 9.287 -0.553 1.00 0.00 N ATOM 1824 CA PRO A 124 3.096 9.312 -1.416 1.00 0.00 C ATOM 1825 C PRO A 124 2.476 7.930 -1.589 1.00 0.00 C ATOM 1826 O PRO A 124 3.109 6.914 -1.303 1.00 0.00 O ATOM 1827 CB PRO A 124 3.640 9.825 -2.751 1.00 0.00 C ATOM 1828 CG PRO A 124 5.082 9.453 -2.741 1.00 0.00 C ATOM 1829 CD PRO A 124 5.522 9.538 -1.305 1.00 0.00 C ATOM 0 HA PRO A 124 2.301 9.930 -0.999 1.00 0.00 H new ATOM 0 HB2 PRO A 124 3.119 9.368 -3.592 1.00 0.00 H new ATOM 0 HB3 PRO A 124 3.510 10.903 -2.843 1.00 0.00 H new ATOM 0 HG2 PRO A 124 5.228 8.447 -3.135 1.00 0.00 H new ATOM 0 HG3 PRO A 124 5.664 10.129 -3.368 1.00 0.00 H new ATOM 0 HD2 PRO A 124 6.288 8.798 -1.075 1.00 0.00 H new ATOM 0 HD3 PRO A 124 5.943 10.516 -1.071 1.00 0.00 H new ATOM 1837 N PHE A 125 1.233 7.899 -2.059 1.00 0.00 N ATOM 1838 CA PHE A 125 0.526 6.641 -2.270 1.00 0.00 C ATOM 1839 C PHE A 125 -0.421 6.742 -3.462 1.00 0.00 C ATOM 1840 O PHE A 125 -0.478 7.770 -4.137 1.00 0.00 O ATOM 1841 CB PHE A 125 -0.257 6.254 -1.013 1.00 0.00 C ATOM 1842 CG PHE A 125 -1.014 7.399 -0.404 1.00 0.00 C ATOM 1843 CD1 PHE A 125 -0.341 8.461 0.178 1.00 0.00 C ATOM 1844 CD2 PHE A 125 -2.400 7.413 -0.412 1.00 0.00 C ATOM 1845 CE1 PHE A 125 -1.036 9.515 0.741 1.00 0.00 C ATOM 1846 CE2 PHE A 125 -3.100 8.464 0.148 1.00 0.00 C ATOM 1847 CZ PHE A 125 -2.417 9.517 0.725 1.00 0.00 C ATOM 0 H PHE A 125 0.695 8.731 -2.301 1.00 0.00 H new ATOM 0 HA PHE A 125 1.266 5.869 -2.481 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -0.957 5.457 -1.262 1.00 0.00 H new ATOM 0 HB3 PHE A 125 0.435 5.851 -0.273 1.00 0.00 H new ATOM 0 HD1 PHE A 125 0.739 8.465 0.192 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -2.939 6.592 -0.862 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -0.500 10.336 1.193 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -4.180 8.462 0.135 1.00 0.00 H new ATOM 0 HZ PHE A 125 -2.962 10.340 1.163 1.00 0.00 H new ATOM 1857 N ILE A 126 -1.161 5.668 -3.714 1.00 0.00 N ATOM 1858 CA ILE A 126 -2.106 5.636 -4.824 1.00 0.00 C ATOM 1859 C ILE A 126 -3.392 4.917 -4.431 1.00 0.00 C ATOM 1860 O ILE A 126 -3.369 3.749 -4.041 1.00 0.00 O ATOM 1861 CB ILE A 126 -1.500 4.942 -6.059 1.00 0.00 C ATOM 1862 CG1 ILE A 126 -0.235 5.673 -6.513 1.00 0.00 C ATOM 1863 CG2 ILE A 126 -2.519 4.885 -7.187 1.00 0.00 C ATOM 1864 CD1 ILE A 126 0.377 5.098 -7.771 1.00 0.00 C ATOM 0 H ILE A 126 -1.125 4.809 -3.165 1.00 0.00 H new ATOM 0 HA ILE A 126 -2.334 6.672 -5.074 1.00 0.00 H new ATOM 0 HB ILE A 126 -1.229 3.922 -5.788 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -0.473 6.723 -6.682 1.00 0.00 H new ATOM 0 HG13 ILE A 126 0.503 5.638 -5.711 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -2.076 4.392 -8.053 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -3.394 4.325 -6.859 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -2.817 5.897 -7.459 1.00 0.00 H new ATOM 0 HD11 ILE A 126 1.270 5.666 -8.034 1.00 0.00 H new ATOM 0 HD12 ILE A 126 0.647 4.056 -7.601 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -0.344 5.158 -8.586 1.00 0.00 H new ATOM 1876 N CYS A 127 -4.513 5.622 -4.536 1.00 0.00 N ATOM 1877 CA CYS A 127 -5.810 5.052 -4.193 1.00 0.00 C ATOM 1878 C CYS A 127 -6.427 4.340 -5.394 1.00 0.00 C ATOM 1879 O CYS A 127 -6.300 4.796 -6.530 1.00 0.00 O ATOM 1880 CB CYS A 127 -6.756 6.146 -3.695 1.00 0.00 C ATOM 1881 SG CYS A 127 -5.998 7.298 -2.505 1.00 0.00 S ATOM 0 H CYS A 127 -4.549 6.590 -4.856 1.00 0.00 H new ATOM 0 HA CYS A 127 -5.658 4.322 -3.398 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -7.121 6.713 -4.551 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -7.623 5.678 -3.229 1.00 0.00 H new ATOM 1886 N GLN A 128 -7.093 3.220 -5.133 1.00 0.00 N ATOM 1887 CA GLN A 128 -7.728 2.445 -6.193 1.00 0.00 C ATOM 1888 C GLN A 128 -9.189 2.161 -5.858 1.00 0.00 C ATOM 1889 O GLN A 128 -9.510 1.728 -4.751 1.00 0.00 O ATOM 1890 CB GLN A 128 -6.978 1.131 -6.413 1.00 0.00 C ATOM 1891 CG GLN A 128 -7.581 0.261 -7.504 1.00 0.00 C ATOM 1892 CD GLN A 128 -7.208 -1.201 -7.357 1.00 0.00 C ATOM 1893 OE1 GLN A 128 -8.075 -2.066 -7.230 1.00 0.00 O ATOM 1894 NE2 GLN A 128 -5.911 -1.486 -7.374 1.00 0.00 N ATOM 0 H GLN A 128 -7.207 2.829 -4.198 1.00 0.00 H new ATOM 0 HA GLN A 128 -7.692 3.033 -7.110 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -5.942 1.352 -6.668 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -6.964 0.570 -5.479 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -8.666 0.359 -7.483 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -7.247 0.621 -8.477 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -5.226 -0.738 -7.481 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -5.600 -2.453 -7.280 1.00 0.00 H new ATOM 1903 N LYS A 129 -10.070 2.406 -6.822 1.00 0.00 N ATOM 1904 CA LYS A 129 -11.497 2.176 -6.631 1.00 0.00 C ATOM 1905 C LYS A 129 -11.868 0.739 -6.981 1.00 0.00 C ATOM 1906 O LYS A 129 -11.297 0.145 -7.897 1.00 0.00 O ATOM 1907 CB LYS A 129 -12.311 3.148 -7.489 1.00 0.00 C ATOM 1908 CG LYS A 129 -12.019 3.038 -8.975 1.00 0.00 C ATOM 1909 CD LYS A 129 -12.741 4.115 -9.766 1.00 0.00 C ATOM 1910 CE LYS A 129 -14.195 3.746 -10.013 1.00 0.00 C ATOM 1911 NZ LYS A 129 -15.045 4.013 -8.820 1.00 0.00 N ATOM 0 H LYS A 129 -9.821 2.764 -7.744 1.00 0.00 H new ATOM 0 HA LYS A 129 -11.729 2.347 -5.580 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -13.373 2.966 -7.321 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -12.107 4.167 -7.162 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -10.945 3.120 -9.143 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -12.323 2.055 -9.335 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -12.691 5.060 -9.225 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -12.236 4.267 -10.720 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -14.574 4.313 -10.863 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -14.262 2.691 -10.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -15.951 4.424 -9.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -15.222 3.122 -8.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -14.557 4.680 -8.188 1.00 0.00 H new ATOM 1925 N HIS A 130 -12.828 0.184 -6.248 1.00 0.00 N ATOM 1926 CA HIS A 130 -13.277 -1.184 -6.483 1.00 0.00 C ATOM 1927 C HIS A 130 -13.911 -1.318 -7.865 1.00 0.00 C ATOM 1928 O HIS A 130 -14.427 -0.346 -8.418 1.00 0.00 O ATOM 1929 CB HIS A 130 -14.276 -1.608 -5.407 1.00 0.00 C ATOM 1930 CG HIS A 130 -14.417 -3.093 -5.271 1.00 0.00 C ATOM 1931 ND1 HIS A 130 -15.637 -3.729 -5.191 1.00 0.00 N ATOM 1932 CD2 HIS A 130 -13.481 -4.068 -5.204 1.00 0.00 C ATOM 1933 CE1 HIS A 130 -15.446 -5.031 -5.078 1.00 0.00 C ATOM 1934 NE2 HIS A 130 -14.146 -5.263 -5.084 1.00 0.00 N ATOM 0 H HIS A 130 -13.310 0.661 -5.486 1.00 0.00 H new ATOM 0 HA HIS A 130 -12.407 -1.839 -6.437 1.00 0.00 H new ATOM 0 HB2 HIS A 130 -13.964 -1.192 -4.449 1.00 0.00 H new ATOM 0 HB3 HIS A 130 -15.251 -1.179 -5.639 1.00 0.00 H new ATOM 0 HD1 HIS A 130 -16.546 -3.266 -5.215 1.00 0.00 H new ATOM 0 HD2 HIS A 130 -12.410 -3.931 -5.239 1.00 0.00 H new ATOM 0 HE1 HIS A 130 -16.221 -5.779 -4.995 1.00 0.00 H new ATOM 1943 N ARG A 131 -13.867 -2.526 -8.416 1.00 0.00 N ATOM 1944 CA ARG A 131 -14.436 -2.786 -9.733 1.00 0.00 C ATOM 1945 C ARG A 131 -15.745 -3.560 -9.617 1.00 0.00 C ATOM 1946 O ARG A 131 -15.810 -4.743 -9.951 1.00 0.00 O ATOM 1947 CB ARG A 131 -13.443 -3.568 -10.595 1.00 0.00 C ATOM 1948 CG ARG A 131 -12.959 -4.857 -9.950 1.00 0.00 C ATOM 1949 CD ARG A 131 -11.801 -5.467 -10.724 1.00 0.00 C ATOM 1950 NE ARG A 131 -10.648 -4.573 -10.778 1.00 0.00 N ATOM 1951 CZ ARG A 131 -10.480 -3.645 -11.713 1.00 0.00 C ATOM 1952 NH1 ARG A 131 -11.387 -3.489 -12.668 1.00 0.00 N ATOM 1953 NH2 ARG A 131 -9.403 -2.869 -11.695 1.00 0.00 N ATOM 0 H ARG A 131 -13.443 -3.340 -7.971 1.00 0.00 H new ATOM 0 HA ARG A 131 -14.643 -1.827 -10.208 1.00 0.00 H new ATOM 0 HB2 ARG A 131 -13.911 -3.804 -11.551 1.00 0.00 H new ATOM 0 HB3 ARG A 131 -12.583 -2.934 -10.809 1.00 0.00 H new ATOM 0 HG2 ARG A 131 -12.648 -4.657 -8.925 1.00 0.00 H new ATOM 0 HG3 ARG A 131 -13.781 -5.571 -9.900 1.00 0.00 H new ATOM 0 HD2 ARG A 131 -11.509 -6.408 -10.258 1.00 0.00 H new ATOM 0 HD3 ARG A 131 -12.126 -5.701 -11.738 1.00 0.00 H new ATOM 0 HE ARG A 131 -9.932 -4.666 -10.058 1.00 0.00 H new ATOM 0 HH11 ARG A 131 -12.216 -4.083 -12.686 1.00 0.00 H new ATOM 0 HH12 ARG A 131 -11.255 -2.775 -13.385 1.00 0.00 H new ATOM 0 HH21 ARG A 131 -8.703 -2.985 -10.962 1.00 0.00 H new ATOM 0 HH22 ARG A 131 -9.276 -2.157 -12.414 1.00 0.00 H new ATOM 1967 N TYR A 132 -16.785 -2.885 -9.141 1.00 0.00 N ATOM 1968 CA TYR A 132 -18.093 -3.510 -8.978 1.00 0.00 C ATOM 1969 C TYR A 132 -19.202 -2.595 -9.489 1.00 0.00 C ATOM 1970 O TYR A 132 -19.087 -1.370 -9.432 1.00 0.00 O ATOM 1971 CB TYR A 132 -18.337 -3.854 -7.508 1.00 0.00 C ATOM 1972 CG TYR A 132 -18.529 -2.641 -6.626 1.00 0.00 C ATOM 1973 CD1 TYR A 132 -17.515 -1.702 -6.472 1.00 0.00 C ATOM 1974 CD2 TYR A 132 -19.722 -2.434 -5.946 1.00 0.00 C ATOM 1975 CE1 TYR A 132 -17.686 -0.593 -5.667 1.00 0.00 C ATOM 1976 CE2 TYR A 132 -19.902 -1.326 -5.140 1.00 0.00 C ATOM 1977 CZ TYR A 132 -18.881 -0.409 -5.003 1.00 0.00 C ATOM 1978 OH TYR A 132 -19.056 0.694 -4.200 1.00 0.00 O ATOM 0 H TYR A 132 -16.748 -1.905 -8.861 1.00 0.00 H new ATOM 0 HA TYR A 132 -18.105 -4.428 -9.566 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -19.219 -4.490 -7.434 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -17.493 -4.434 -7.135 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -16.578 -1.842 -6.991 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -20.523 -3.151 -6.049 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -16.888 0.127 -5.558 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -20.837 -1.179 -4.620 1.00 0.00 H new ATOM 0 HH TYR A 132 -19.953 0.673 -3.807 1.00 0.00 H new ATOM 1988 N ASP A 133 -20.275 -3.198 -9.988 1.00 0.00 N ATOM 1989 CA ASP A 133 -21.406 -2.440 -10.507 1.00 0.00 C ATOM 1990 C ASP A 133 -21.772 -1.297 -9.566 1.00 0.00 C ATOM 1991 O ASP A 133 -21.437 -1.323 -8.382 1.00 0.00 O ATOM 1992 CB ASP A 133 -22.613 -3.357 -10.709 1.00 0.00 C ATOM 1993 CG ASP A 133 -23.906 -2.584 -10.881 1.00 0.00 C ATOM 1994 OD1 ASP A 133 -24.057 -1.906 -11.919 1.00 0.00 O ATOM 1995 OD2 ASP A 133 -24.766 -2.656 -9.978 1.00 0.00 O ATOM 0 H ASP A 133 -20.385 -4.211 -10.044 1.00 0.00 H new ATOM 0 HA ASP A 133 -21.117 -2.016 -11.469 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -22.448 -3.982 -11.586 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -22.704 -4.026 -9.853 1.00 0.00 H new ATOM 2000 N SER A 134 -22.462 -0.294 -10.101 1.00 0.00 N ATOM 2001 CA SER A 134 -22.869 0.862 -9.310 1.00 0.00 C ATOM 2002 C SER A 134 -21.652 1.597 -8.757 1.00 0.00 C ATOM 2003 O SER A 134 -21.592 1.913 -7.568 1.00 0.00 O ATOM 2004 CB SER A 134 -23.780 0.424 -8.162 1.00 0.00 C ATOM 2005 OG SER A 134 -24.436 1.537 -7.579 1.00 0.00 O ATOM 0 H SER A 134 -22.751 -0.259 -11.079 1.00 0.00 H new ATOM 0 HA SER A 134 -23.418 1.543 -9.961 1.00 0.00 H new ATOM 0 HB2 SER A 134 -24.520 -0.286 -8.531 1.00 0.00 H new ATOM 0 HB3 SER A 134 -23.192 -0.094 -7.404 1.00 0.00 H new ATOM 0 HG SER A 134 -23.769 2.176 -7.252 1.00 0.00 H new ATOM 2011 N ASP A 135 -20.686 1.867 -9.627 1.00 0.00 N ATOM 2012 CA ASP A 135 -19.470 2.567 -9.227 1.00 0.00 C ATOM 2013 C ASP A 135 -19.802 3.914 -8.594 1.00 0.00 C ATOM 2014 O ASP A 135 -20.142 4.872 -9.290 1.00 0.00 O ATOM 2015 CB ASP A 135 -18.552 2.768 -10.434 1.00 0.00 C ATOM 2016 CG ASP A 135 -17.821 1.499 -10.824 1.00 0.00 C ATOM 2017 OD1 ASP A 135 -18.482 0.446 -10.939 1.00 0.00 O ATOM 2018 OD2 ASP A 135 -16.588 1.558 -11.013 1.00 0.00 O ATOM 0 H ASP A 135 -20.721 1.612 -10.614 1.00 0.00 H new ATOM 0 HA ASP A 135 -18.955 1.956 -8.486 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -19.142 3.119 -11.281 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -17.825 3.548 -10.208 1.00 0.00 H new ATOM 2023 N HIS A 136 -19.702 3.981 -7.270 1.00 0.00 N ATOM 2024 CA HIS A 136 -19.992 5.212 -6.543 1.00 0.00 C ATOM 2025 C HIS A 136 -18.886 6.241 -6.753 1.00 0.00 C ATOM 2026 O HIS A 136 -17.738 5.887 -7.024 1.00 0.00 O ATOM 2027 CB HIS A 136 -20.157 4.920 -5.051 1.00 0.00 C ATOM 2028 CG HIS A 136 -21.545 4.503 -4.672 1.00 0.00 C ATOM 2029 ND1 HIS A 136 -21.883 4.074 -3.406 1.00 0.00 N ATOM 2030 CD2 HIS A 136 -22.684 4.453 -5.401 1.00 0.00 C ATOM 2031 CE1 HIS A 136 -23.169 3.776 -3.373 1.00 0.00 C ATOM 2032 NE2 HIS A 136 -23.679 3.998 -4.571 1.00 0.00 N ATOM 0 H HIS A 136 -19.423 3.198 -6.679 1.00 0.00 H new ATOM 0 HA HIS A 136 -20.924 5.623 -6.931 1.00 0.00 H new ATOM 0 HB2 HIS A 136 -19.459 4.134 -4.764 1.00 0.00 H new ATOM 0 HB3 HIS A 136 -19.886 5.810 -4.483 1.00 0.00 H new ATOM 0 HD2 HIS A 136 -22.791 4.721 -6.442 1.00 0.00 H new ATOM 0 HE1 HIS A 136 -23.712 3.413 -2.513 1.00 0.00 H new ATOM 0 HE2 HIS A 136 -24.653 3.855 -4.836 1.00 0.00 H new ATOM 2041 N LYS A 137 -19.238 7.516 -6.627 1.00 0.00 N ATOM 2042 CA LYS A 137 -18.276 8.597 -6.802 1.00 0.00 C ATOM 2043 C LYS A 137 -18.597 9.766 -5.876 1.00 0.00 C ATOM 2044 O LYS A 137 -19.743 10.199 -5.759 1.00 0.00 O ATOM 2045 CB LYS A 137 -18.269 9.071 -8.257 1.00 0.00 C ATOM 2046 CG LYS A 137 -17.130 10.021 -8.582 1.00 0.00 C ATOM 2047 CD LYS A 137 -17.069 10.331 -10.068 1.00 0.00 C ATOM 2048 CE LYS A 137 -15.699 10.853 -10.473 1.00 0.00 C ATOM 2049 NZ LYS A 137 -14.654 9.797 -10.383 1.00 0.00 N ATOM 0 H LYS A 137 -20.184 7.826 -6.404 1.00 0.00 H new ATOM 0 HA LYS A 137 -17.288 8.215 -6.547 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -18.205 8.203 -8.913 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -19.216 9.565 -8.474 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -17.256 10.947 -8.021 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -16.185 9.581 -8.262 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -17.300 9.431 -10.638 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -17.830 11.071 -10.318 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -15.743 11.234 -11.493 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -15.425 11.690 -9.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -13.844 10.059 -10.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -14.340 9.702 -9.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -15.047 8.891 -10.710 1.00 0.00 H new ATOM 2063 N PRO A 138 -17.562 10.292 -5.204 1.00 0.00 N ATOM 2064 CA PRO A 138 -17.709 11.419 -4.280 1.00 0.00 C ATOM 2065 C PRO A 138 -18.029 12.724 -5.002 1.00 0.00 C ATOM 2066 O PRO A 138 -17.573 12.952 -6.121 1.00 0.00 O ATOM 2067 CB PRO A 138 -16.339 11.505 -3.603 1.00 0.00 C ATOM 2068 CG PRO A 138 -15.394 10.900 -4.583 1.00 0.00 C ATOM 2069 CD PRO A 138 -16.168 9.826 -5.296 1.00 0.00 C ATOM 0 HA PRO A 138 -18.535 11.269 -3.584 1.00 0.00 H new ATOM 0 HB2 PRO A 138 -16.071 12.538 -3.381 1.00 0.00 H new ATOM 0 HB3 PRO A 138 -16.330 10.963 -2.657 1.00 0.00 H new ATOM 0 HG2 PRO A 138 -15.028 11.649 -5.285 1.00 0.00 H new ATOM 0 HG3 PRO A 138 -14.522 10.483 -4.078 1.00 0.00 H new ATOM 0 HD2 PRO A 138 -15.847 9.720 -6.332 1.00 0.00 H new ATOM 0 HD3 PRO A 138 -16.037 8.854 -4.821 1.00 0.00 H new ATOM 2077 N ASN A 139 -18.815 13.577 -4.353 1.00 0.00 N ATOM 2078 CA ASN A 139 -19.195 14.859 -4.935 1.00 0.00 C ATOM 2079 C ASN A 139 -18.613 16.016 -4.129 1.00 0.00 C ATOM 2080 O ASN A 139 -19.275 16.573 -3.253 1.00 0.00 O ATOM 2081 CB ASN A 139 -20.719 14.982 -4.997 1.00 0.00 C ATOM 2082 CG ASN A 139 -21.169 16.251 -5.697 1.00 0.00 C ATOM 2083 OD1 ASN A 139 -20.386 17.184 -5.877 1.00 0.00 O ATOM 2084 ND2 ASN A 139 -22.435 16.291 -6.093 1.00 0.00 N ATOM 0 H ASN A 139 -19.201 13.404 -3.425 1.00 0.00 H new ATOM 0 HA ASN A 139 -18.791 14.905 -5.947 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -21.130 14.117 -5.519 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -21.124 14.966 -3.985 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -22.795 17.119 -6.568 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -23.048 15.494 -5.923 1.00 0.00 H new ATOM 2091 N THR A 140 -17.369 16.374 -4.432 1.00 0.00 N ATOM 2092 CA THR A 140 -16.696 17.464 -3.736 1.00 0.00 C ATOM 2093 C THR A 140 -16.074 18.445 -4.723 1.00 0.00 C ATOM 2094 O THR A 140 -16.078 18.210 -5.932 1.00 0.00 O ATOM 2095 CB THR A 140 -15.599 16.936 -2.793 1.00 0.00 C ATOM 2096 OG1 THR A 140 -14.892 18.032 -2.202 1.00 0.00 O ATOM 2097 CG2 THR A 140 -14.623 16.043 -3.544 1.00 0.00 C ATOM 0 H THR A 140 -16.807 15.925 -5.155 1.00 0.00 H new ATOM 0 HA THR A 140 -17.454 17.979 -3.146 1.00 0.00 H new ATOM 0 HB THR A 140 -16.077 16.347 -2.010 1.00 0.00 H new ATOM 0 HG1 THR A 140 -14.197 17.688 -1.602 1.00 0.00 H new ATOM 0 HG21 THR A 140 -13.857 15.682 -2.857 1.00 0.00 H new ATOM 0 HG22 THR A 140 -15.159 15.194 -3.968 1.00 0.00 H new ATOM 0 HG23 THR A 140 -14.152 16.612 -4.346 1.00 0.00 H new ATOM 2105 N ILE A 141 -15.539 19.543 -4.200 1.00 0.00 N ATOM 2106 CA ILE A 141 -14.911 20.558 -5.036 1.00 0.00 C ATOM 2107 C ILE A 141 -13.490 20.155 -5.417 1.00 0.00 C ATOM 2108 O ILE A 141 -12.641 19.942 -4.553 1.00 0.00 O ATOM 2109 CB ILE A 141 -14.872 21.925 -4.328 1.00 0.00 C ATOM 2110 CG1 ILE A 141 -16.293 22.425 -4.059 1.00 0.00 C ATOM 2111 CG2 ILE A 141 -14.100 22.934 -5.166 1.00 0.00 C ATOM 2112 CD1 ILE A 141 -16.861 21.948 -2.740 1.00 0.00 C ATOM 0 H ILE A 141 -15.528 19.752 -3.202 1.00 0.00 H new ATOM 0 HA ILE A 141 -15.517 20.642 -5.938 1.00 0.00 H new ATOM 0 HB ILE A 141 -14.361 21.808 -3.373 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -16.295 23.515 -4.074 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -16.945 22.094 -4.867 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -14.081 23.895 -4.652 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -13.079 22.581 -5.312 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -14.586 23.050 -6.135 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -17.870 22.340 -2.615 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -16.891 20.858 -2.730 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -16.231 22.301 -1.924 1.00 0.00 H new ATOM 2124 N GLY A 142 -13.238 20.054 -6.719 1.00 0.00 N ATOM 2125 CA GLY A 142 -11.919 19.679 -7.192 1.00 0.00 C ATOM 2126 C GLY A 142 -11.571 20.329 -8.517 1.00 0.00 C ATOM 2127 O GLY A 142 -12.410 20.414 -9.414 1.00 0.00 O ATOM 0 H GLY A 142 -13.924 20.225 -7.454 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -11.175 19.961 -6.446 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -11.869 18.595 -7.298 1.00 0.00 H new ATOM 2131 N ASP A 143 -10.332 20.791 -8.639 1.00 0.00 N ATOM 2132 CA ASP A 143 -9.875 21.439 -9.864 1.00 0.00 C ATOM 2133 C ASP A 143 -8.355 21.566 -9.877 1.00 0.00 C ATOM 2134 O ASP A 143 -7.785 22.390 -9.162 1.00 0.00 O ATOM 2135 CB ASP A 143 -10.516 22.820 -10.006 1.00 0.00 C ATOM 2136 CG ASP A 143 -10.632 23.544 -8.679 1.00 0.00 C ATOM 2137 OD1 ASP A 143 -9.807 23.272 -7.781 1.00 0.00 O ATOM 2138 OD2 ASP A 143 -11.546 24.382 -8.539 1.00 0.00 O ATOM 0 H ASP A 143 -9.626 20.729 -7.906 1.00 0.00 H new ATOM 0 HA ASP A 143 -10.177 20.819 -10.708 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -9.924 23.423 -10.695 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -11.507 22.714 -10.446 1.00 0.00 H new ATOM 2143 N ALA A 144 -7.704 20.744 -10.693 1.00 0.00 N ATOM 2144 CA ALA A 144 -6.250 20.765 -10.799 1.00 0.00 C ATOM 2145 C ALA A 144 -5.808 21.034 -12.234 1.00 0.00 C ATOM 2146 O ALA A 144 -6.561 20.798 -13.179 1.00 0.00 O ATOM 2147 CB ALA A 144 -5.665 19.452 -10.302 1.00 0.00 C ATOM 0 H ALA A 144 -8.160 20.055 -11.291 1.00 0.00 H new ATOM 0 HA ALA A 144 -5.877 21.576 -10.173 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -4.579 19.482 -10.387 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -5.943 19.301 -9.259 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -6.053 18.630 -10.903 1.00 0.00 H new ATOM 2153 N SER A 145 -4.585 21.528 -12.389 1.00 0.00 N ATOM 2154 CA SER A 145 -4.045 21.833 -13.708 1.00 0.00 C ATOM 2155 C SER A 145 -3.288 20.636 -14.276 1.00 0.00 C ATOM 2156 O SER A 145 -3.501 20.239 -15.421 1.00 0.00 O ATOM 2157 CB SER A 145 -3.118 23.048 -13.635 1.00 0.00 C ATOM 2158 OG SER A 145 -2.663 23.422 -14.924 1.00 0.00 O ATOM 0 H SER A 145 -3.949 21.726 -11.617 1.00 0.00 H new ATOM 0 HA SER A 145 -4.880 22.061 -14.371 1.00 0.00 H new ATOM 0 HB2 SER A 145 -3.645 23.884 -13.175 1.00 0.00 H new ATOM 0 HB3 SER A 145 -2.264 22.820 -12.997 1.00 0.00 H new ATOM 0 HG SER A 145 -2.074 24.202 -14.849 1.00 0.00 H new ATOM 2164 N GLY A 146 -2.403 20.065 -13.465 1.00 0.00 N ATOM 2165 CA GLY A 146 -1.627 18.919 -13.902 1.00 0.00 C ATOM 2166 C GLY A 146 -0.184 19.274 -14.198 1.00 0.00 C ATOM 2167 O GLY A 146 0.107 20.203 -14.952 1.00 0.00 O ATOM 0 H GLY A 146 -2.209 20.376 -12.513 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -1.658 18.149 -13.132 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -2.084 18.494 -14.796 1.00 0.00 H new ATOM 2171 N PRO A 147 0.750 18.524 -13.595 1.00 0.00 N ATOM 2172 CA PRO A 147 2.187 18.747 -13.782 1.00 0.00 C ATOM 2173 C PRO A 147 2.654 18.374 -15.184 1.00 0.00 C ATOM 2174 O PRO A 147 3.484 19.063 -15.776 1.00 0.00 O ATOM 2175 CB PRO A 147 2.827 17.824 -12.742 1.00 0.00 C ATOM 2176 CG PRO A 147 1.821 16.749 -12.518 1.00 0.00 C ATOM 2177 CD PRO A 147 0.475 17.400 -12.684 1.00 0.00 C ATOM 0 HA PRO A 147 2.455 19.797 -13.663 1.00 0.00 H new ATOM 0 HB2 PRO A 147 3.770 17.414 -13.104 1.00 0.00 H new ATOM 0 HB3 PRO A 147 3.046 18.360 -11.818 1.00 0.00 H new ATOM 0 HG2 PRO A 147 1.952 15.937 -13.233 1.00 0.00 H new ATOM 0 HG3 PRO A 147 1.926 16.318 -11.522 1.00 0.00 H new ATOM 0 HD2 PRO A 147 -0.256 16.710 -13.106 1.00 0.00 H new ATOM 0 HD3 PRO A 147 0.075 17.744 -11.730 1.00 0.00 H new ATOM 2185 N SER A 148 2.114 17.279 -15.711 1.00 0.00 N ATOM 2186 CA SER A 148 2.479 16.813 -17.044 1.00 0.00 C ATOM 2187 C SER A 148 1.567 17.426 -18.102 1.00 0.00 C ATOM 2188 O SER A 148 0.421 17.778 -17.822 1.00 0.00 O ATOM 2189 CB SER A 148 2.403 15.286 -17.111 1.00 0.00 C ATOM 2190 OG SER A 148 3.519 14.692 -16.473 1.00 0.00 O ATOM 0 H SER A 148 1.423 16.699 -15.236 1.00 0.00 H new ATOM 0 HA SER A 148 3.503 17.128 -17.245 1.00 0.00 H new ATOM 0 HB2 SER A 148 1.484 14.943 -16.636 1.00 0.00 H new ATOM 0 HB3 SER A 148 2.362 14.966 -18.152 1.00 0.00 H new ATOM 0 HG SER A 148 3.446 13.716 -16.528 1.00 0.00 H new ATOM 2196 N SER A 149 2.084 17.551 -19.320 1.00 0.00 N ATOM 2197 CA SER A 149 1.319 18.125 -20.421 1.00 0.00 C ATOM 2198 C SER A 149 0.448 17.065 -21.087 1.00 0.00 C ATOM 2199 O SER A 149 0.937 16.016 -21.505 1.00 0.00 O ATOM 2200 CB SER A 149 2.260 18.750 -21.452 1.00 0.00 C ATOM 2201 OG SER A 149 1.536 19.279 -22.549 1.00 0.00 O ATOM 0 H SER A 149 3.030 17.262 -19.570 1.00 0.00 H new ATOM 0 HA SER A 149 0.670 18.901 -20.015 1.00 0.00 H new ATOM 0 HB2 SER A 149 2.845 19.541 -20.983 1.00 0.00 H new ATOM 0 HB3 SER A 149 2.966 17.999 -21.807 1.00 0.00 H new ATOM 0 HG SER A 149 2.160 19.674 -23.193 1.00 0.00 H new ATOM 2207 N GLY A 150 -0.848 17.348 -21.184 1.00 0.00 N ATOM 2208 CA GLY A 150 -1.768 16.410 -21.800 1.00 0.00 C ATOM 2209 C GLY A 150 -2.282 16.898 -23.140 1.00 0.00 C ATOM 2210 O GLY A 150 -1.503 17.131 -24.064 1.00 0.00 O ATOM 0 H GLY A 150 -1.277 18.210 -20.847 1.00 0.00 H new ATOM 0 HA2 GLY A 150 -1.269 15.450 -21.933 1.00 0.00 H new ATOM 0 HA3 GLY A 150 -2.611 16.240 -21.131 1.00 0.00 H new TER 2214 GLY A 150