USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 911 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 65 LYS NZ :NH3+ -123:sc= -0.319 (180deg=-2.16!) USER MOD Set 1.2: A 105 MET CE :methyl -134:sc= -6.01! (180deg=-8.79!) USER MOD Set 1.3: A 110 THR OG1 : rot -125:sc= -0.712 USER MOD Set 2.1: A 99 SER OG : rot -150:sc= 0.109 USER MOD Set 2.2: A 118 THR OG1 : rot -59:sc= 0.105 USER MOD Set 3.1: A 70 LYS NZ :NH3+ 161:sc= 0.495 (180deg=0) USER MOD Set 3.2: A 71 THR OG1 : rot 180:sc= -0.314! USER MOD Set 3.3: A 72 THR OG1 : rot 180:sc= 0.451 USER MOD Set 3.4: A 96 SER OG : rot 19:sc= 0.00838 USER MOD Set 4.1: A 77 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 79 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 41 ASN : amide:sc= -1.58 K(o=-1.6,f=-3.2!) USER MOD Set 5.2: A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -111:sc= 0.0464 (180deg=0) USER MOD Single : A 2 SER OG : rot 27:sc= 0.817 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -2.83! C(o=-2.8!,f=-3.5!) USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 180:sc= -0.179 USER MOD Single : A 20 THR OG1 : rot 180:sc= -0.0486 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -0.0245 X(o=-0.025,f=-0.16) USER MOD Single : A 34 ASN : amide:sc= -2.52! C(o=-2.5!,f=-3.3!) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ -158:sc= 1.47 (180deg=0.574) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot -13:sc= -0.801 USER MOD Single : A 57 GLN : amide:sc= -1.77 K(o=-1.8,f=-9.5!) USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 THR OG1 : rot 180:sc=-0.000583 USER MOD Single : A 64 TYR OH : rot 130:sc= -1.34 USER MOD Single : A 68 HIS : no HE2:sc= -7.7! C(o=-7.7!,f=-9.3!) USER MOD Single : A 83 ASN : amide:sc= -0.302 X(o=-0.3,f=0.083) USER MOD Single : A 84 ASN : amide:sc= -0.0783 X(o=-0.078,f=-0.078) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 TYR OH : rot 175:sc= 0.462 USER MOD Single : A 101 GLN : amide:sc= -1.04 K(o=-1,f=-6.6!) USER MOD Single : A 103 SER OG : rot 180:sc= -0.0884 USER MOD Single : A 106 THR OG1 : rot 160:sc= -0.208 USER MOD Single : A 108 ASN : amide:sc= -0.519 K(o=-0.52,f=-1.8) USER MOD Single : A 114 SER OG : rot 90:sc= 0.0137 USER MOD Single : A 115 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0.00788 USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -8.623 -45.396 7.440 1.00 0.00 N ATOM 2 CA GLY A 1 -8.398 -44.373 8.444 1.00 0.00 C ATOM 3 C GLY A 1 -7.022 -43.746 8.334 1.00 0.00 C ATOM 4 O GLY A 1 -6.099 -44.349 7.786 1.00 0.00 O ATOM 0 H1 GLY A 1 -9.333 -45.062 6.758 1.00 0.00 H new ATOM 0 H2 GLY A 1 -7.732 -45.596 6.942 1.00 0.00 H new ATOM 0 H3 GLY A 1 -8.965 -46.264 7.899 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -9.157 -43.597 8.344 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -8.517 -44.809 9.436 1.00 0.00 H new ATOM 8 N SER A 2 -6.884 -42.531 8.855 1.00 0.00 N ATOM 9 CA SER A 2 -5.612 -41.819 8.808 1.00 0.00 C ATOM 10 C SER A 2 -5.557 -40.733 9.878 1.00 0.00 C ATOM 11 O SER A 2 -6.575 -40.384 10.476 1.00 0.00 O ATOM 12 CB SER A 2 -5.401 -41.200 7.425 1.00 0.00 C ATOM 13 OG SER A 2 -4.878 -42.151 6.514 1.00 0.00 O ATOM 0 H SER A 2 -7.637 -42.019 9.314 1.00 0.00 H new ATOM 0 HA SER A 2 -4.815 -42.536 9.003 1.00 0.00 H new ATOM 0 HB2 SER A 2 -6.348 -40.813 7.048 1.00 0.00 H new ATOM 0 HB3 SER A 2 -4.719 -40.353 7.503 1.00 0.00 H new ATOM 0 HG SER A 2 -5.156 -43.051 6.785 1.00 0.00 H new ATOM 19 N SER A 3 -4.362 -40.202 10.113 1.00 0.00 N ATOM 20 CA SER A 3 -4.172 -39.158 11.113 1.00 0.00 C ATOM 21 C SER A 3 -2.751 -38.605 11.058 1.00 0.00 C ATOM 22 O SER A 3 -1.782 -39.358 10.977 1.00 0.00 O ATOM 23 CB SER A 3 -4.466 -39.703 12.512 1.00 0.00 C ATOM 24 OG SER A 3 -4.448 -38.666 13.478 1.00 0.00 O ATOM 0 H SER A 3 -3.510 -40.478 9.624 1.00 0.00 H new ATOM 0 HA SER A 3 -4.867 -38.348 10.893 1.00 0.00 H new ATOM 0 HB2 SER A 3 -5.440 -40.193 12.518 1.00 0.00 H new ATOM 0 HB3 SER A 3 -3.727 -40.460 12.773 1.00 0.00 H new ATOM 0 HG SER A 3 -4.640 -39.040 14.363 1.00 0.00 H new ATOM 30 N GLY A 4 -2.636 -37.281 11.104 1.00 0.00 N ATOM 31 CA GLY A 4 -1.331 -36.648 11.058 1.00 0.00 C ATOM 32 C GLY A 4 -1.033 -35.843 12.307 1.00 0.00 C ATOM 33 O GLY A 4 -1.735 -35.960 13.311 1.00 0.00 O ATOM 0 H GLY A 4 -3.423 -36.636 11.172 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -0.564 -37.412 10.930 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -1.278 -35.995 10.187 1.00 0.00 H new ATOM 37 N SER A 5 0.012 -35.024 12.246 1.00 0.00 N ATOM 38 CA SER A 5 0.405 -34.200 13.383 1.00 0.00 C ATOM 39 C SER A 5 1.530 -33.243 12.999 1.00 0.00 C ATOM 40 O SER A 5 2.375 -33.565 12.163 1.00 0.00 O ATOM 41 CB SER A 5 0.848 -35.083 14.551 1.00 0.00 C ATOM 42 OG SER A 5 1.977 -35.864 14.200 1.00 0.00 O ATOM 0 H SER A 5 0.602 -34.913 11.421 1.00 0.00 H new ATOM 0 HA SER A 5 -0.460 -33.611 13.689 1.00 0.00 H new ATOM 0 HB2 SER A 5 1.087 -34.459 15.412 1.00 0.00 H new ATOM 0 HB3 SER A 5 0.028 -35.737 14.848 1.00 0.00 H new ATOM 0 HG SER A 5 2.242 -36.418 14.964 1.00 0.00 H new ATOM 48 N SER A 6 1.533 -32.066 13.615 1.00 0.00 N ATOM 49 CA SER A 6 2.551 -31.060 13.335 1.00 0.00 C ATOM 50 C SER A 6 2.413 -29.869 14.279 1.00 0.00 C ATOM 51 O SER A 6 1.308 -29.398 14.544 1.00 0.00 O ATOM 52 CB SER A 6 2.447 -30.588 11.883 1.00 0.00 C ATOM 53 OG SER A 6 3.691 -30.096 11.416 1.00 0.00 O ATOM 0 H SER A 6 0.842 -31.785 14.311 1.00 0.00 H new ATOM 0 HA SER A 6 3.529 -31.516 13.493 1.00 0.00 H new ATOM 0 HB2 SER A 6 2.119 -31.414 11.252 1.00 0.00 H new ATOM 0 HB3 SER A 6 1.691 -29.807 11.805 1.00 0.00 H new ATOM 0 HG SER A 6 3.598 -29.802 10.486 1.00 0.00 H new ATOM 59 N GLY A 7 3.545 -29.388 14.784 1.00 0.00 N ATOM 60 CA GLY A 7 3.529 -28.257 15.694 1.00 0.00 C ATOM 61 C GLY A 7 4.923 -27.776 16.045 1.00 0.00 C ATOM 62 O GLY A 7 5.747 -28.546 16.535 1.00 0.00 O ATOM 0 H GLY A 7 4.472 -29.761 14.580 1.00 0.00 H new ATOM 0 HA2 GLY A 7 2.969 -27.439 15.242 1.00 0.00 H new ATOM 0 HA3 GLY A 7 3.004 -28.537 16.607 1.00 0.00 H new ATOM 66 N ASN A 8 5.187 -26.498 15.792 1.00 0.00 N ATOM 67 CA ASN A 8 6.493 -25.916 16.083 1.00 0.00 C ATOM 68 C ASN A 8 6.481 -24.409 15.844 1.00 0.00 C ATOM 69 O ASN A 8 6.253 -23.949 14.725 1.00 0.00 O ATOM 70 CB ASN A 8 7.571 -26.572 15.218 1.00 0.00 C ATOM 71 CG ASN A 8 8.177 -27.795 15.879 1.00 0.00 C ATOM 72 OD1 ASN A 8 7.919 -28.927 15.470 1.00 0.00 O ATOM 73 ND2 ASN A 8 8.987 -27.572 16.908 1.00 0.00 N ATOM 0 H ASN A 8 4.515 -25.846 15.387 1.00 0.00 H new ATOM 0 HA ASN A 8 6.719 -26.098 17.134 1.00 0.00 H new ATOM 0 HB2 ASN A 8 7.139 -26.857 14.259 1.00 0.00 H new ATOM 0 HB3 ASN A 8 8.358 -25.847 15.011 1.00 0.00 H new ATOM 0 HD21 ASN A 8 9.423 -28.356 17.393 1.00 0.00 H new ATOM 0 HD22 ASN A 8 9.173 -26.617 17.213 1.00 0.00 H new ATOM 80 N ARG A 9 6.730 -23.646 16.903 1.00 0.00 N ATOM 81 CA ARG A 9 6.748 -22.191 16.810 1.00 0.00 C ATOM 82 C ARG A 9 8.018 -21.622 17.435 1.00 0.00 C ATOM 83 O ARG A 9 8.483 -22.103 18.468 1.00 0.00 O ATOM 84 CB ARG A 9 5.517 -21.599 17.499 1.00 0.00 C ATOM 85 CG ARG A 9 4.265 -21.627 16.639 1.00 0.00 C ATOM 86 CD ARG A 9 3.008 -21.739 17.488 1.00 0.00 C ATOM 87 NE ARG A 9 2.668 -20.473 18.132 1.00 0.00 N ATOM 88 CZ ARG A 9 1.657 -20.330 18.982 1.00 0.00 C ATOM 89 NH1 ARG A 9 0.891 -21.368 19.288 1.00 0.00 N ATOM 90 NH2 ARG A 9 1.411 -19.146 19.528 1.00 0.00 N ATOM 0 H ARG A 9 6.922 -24.011 17.836 1.00 0.00 H new ATOM 0 HA ARG A 9 6.730 -21.919 15.755 1.00 0.00 H new ATOM 0 HB2 ARG A 9 5.327 -22.150 18.420 1.00 0.00 H new ATOM 0 HB3 ARG A 9 5.730 -20.568 17.782 1.00 0.00 H new ATOM 0 HG2 ARG A 9 4.217 -20.721 16.034 1.00 0.00 H new ATOM 0 HG3 ARG A 9 4.315 -22.469 15.949 1.00 0.00 H new ATOM 0 HD2 ARG A 9 2.176 -22.063 16.863 1.00 0.00 H new ATOM 0 HD3 ARG A 9 3.152 -22.506 18.249 1.00 0.00 H new ATOM 0 HE ARG A 9 3.238 -19.654 17.918 1.00 0.00 H new ATOM 0 HH11 ARG A 9 1.077 -22.280 18.870 1.00 0.00 H new ATOM 0 HH12 ARG A 9 0.116 -21.255 19.941 1.00 0.00 H new ATOM 0 HH21 ARG A 9 1.998 -18.345 19.295 1.00 0.00 H new ATOM 0 HH22 ARG A 9 0.635 -19.037 20.181 1.00 0.00 H new ATOM 104 N TYR A 10 8.574 -20.595 16.802 1.00 0.00 N ATOM 105 CA TYR A 10 9.791 -19.962 17.294 1.00 0.00 C ATOM 106 C TYR A 10 10.131 -18.722 16.472 1.00 0.00 C ATOM 107 O TYR A 10 10.035 -18.730 15.246 1.00 0.00 O ATOM 108 CB TYR A 10 10.958 -20.950 17.253 1.00 0.00 C ATOM 109 CG TYR A 10 12.103 -20.575 18.166 1.00 0.00 C ATOM 110 CD1 TYR A 10 13.139 -19.765 17.718 1.00 0.00 C ATOM 111 CD2 TYR A 10 12.148 -21.029 19.479 1.00 0.00 C ATOM 112 CE1 TYR A 10 14.187 -19.420 18.549 1.00 0.00 C ATOM 113 CE2 TYR A 10 13.191 -20.688 20.317 1.00 0.00 C ATOM 114 CZ TYR A 10 14.209 -19.883 19.847 1.00 0.00 C ATOM 115 OH TYR A 10 15.250 -19.541 20.679 1.00 0.00 O ATOM 0 H TYR A 10 8.201 -20.183 15.947 1.00 0.00 H new ATOM 0 HA TYR A 10 9.619 -19.656 18.326 1.00 0.00 H new ATOM 0 HB2 TYR A 10 10.594 -21.940 17.528 1.00 0.00 H new ATOM 0 HB3 TYR A 10 11.328 -21.020 16.230 1.00 0.00 H new ATOM 0 HD1 TYR A 10 13.125 -19.399 16.702 1.00 0.00 H new ATOM 0 HD2 TYR A 10 11.353 -21.659 19.850 1.00 0.00 H new ATOM 0 HE1 TYR A 10 14.985 -18.791 18.184 1.00 0.00 H new ATOM 0 HE2 TYR A 10 13.210 -21.049 21.335 1.00 0.00 H new ATOM 0 HH TYR A 10 15.112 -19.948 21.560 1.00 0.00 H new ATOM 125 N GLY A 11 10.531 -17.656 17.159 1.00 0.00 N ATOM 126 CA GLY A 11 10.880 -16.423 16.478 1.00 0.00 C ATOM 127 C GLY A 11 10.744 -15.207 17.373 1.00 0.00 C ATOM 128 O GLY A 11 9.723 -14.519 17.370 1.00 0.00 O ATOM 0 H GLY A 11 10.619 -17.625 18.175 1.00 0.00 H new ATOM 0 HA2 GLY A 11 11.906 -16.490 16.115 1.00 0.00 H new ATOM 0 HA3 GLY A 11 10.240 -16.301 15.604 1.00 0.00 H new ATOM 132 N PRO A 12 11.792 -14.929 18.164 1.00 0.00 N ATOM 133 CA PRO A 12 11.808 -13.788 19.084 1.00 0.00 C ATOM 134 C PRO A 12 11.881 -12.453 18.351 1.00 0.00 C ATOM 135 O PRO A 12 11.697 -12.390 17.136 1.00 0.00 O ATOM 136 CB PRO A 12 13.077 -14.016 19.909 1.00 0.00 C ATOM 137 CG PRO A 12 13.959 -14.833 19.029 1.00 0.00 C ATOM 138 CD PRO A 12 13.041 -15.707 18.219 1.00 0.00 C ATOM 0 HA PRO A 12 10.898 -13.734 19.682 1.00 0.00 H new ATOM 0 HB2 PRO A 12 13.550 -13.071 20.177 1.00 0.00 H new ATOM 0 HB3 PRO A 12 12.855 -14.537 20.841 1.00 0.00 H new ATOM 0 HG2 PRO A 12 14.563 -14.196 18.382 1.00 0.00 H new ATOM 0 HG3 PRO A 12 14.650 -15.434 19.619 1.00 0.00 H new ATOM 0 HD2 PRO A 12 13.441 -15.896 17.223 1.00 0.00 H new ATOM 0 HD3 PRO A 12 12.890 -16.678 18.691 1.00 0.00 H new ATOM 146 N GLY A 13 12.153 -11.387 19.098 1.00 0.00 N ATOM 147 CA GLY A 13 12.246 -10.067 18.501 1.00 0.00 C ATOM 148 C GLY A 13 12.118 -8.957 19.525 1.00 0.00 C ATOM 149 O GLY A 13 11.011 -8.594 19.923 1.00 0.00 O ATOM 0 H GLY A 13 12.311 -11.414 20.105 1.00 0.00 H new ATOM 0 HA2 GLY A 13 13.201 -9.972 17.984 1.00 0.00 H new ATOM 0 HA3 GLY A 13 11.464 -9.956 17.749 1.00 0.00 H new ATOM 153 N VAL A 14 13.253 -8.417 19.955 1.00 0.00 N ATOM 154 CA VAL A 14 13.264 -7.342 20.941 1.00 0.00 C ATOM 155 C VAL A 14 13.967 -6.104 20.396 1.00 0.00 C ATOM 156 O VAL A 14 15.088 -6.185 19.894 1.00 0.00 O ATOM 157 CB VAL A 14 13.957 -7.782 22.244 1.00 0.00 C ATOM 158 CG1 VAL A 14 14.064 -6.614 23.212 1.00 0.00 C ATOM 159 CG2 VAL A 14 13.210 -8.945 22.879 1.00 0.00 C ATOM 0 H VAL A 14 14.178 -8.706 19.636 1.00 0.00 H new ATOM 0 HA VAL A 14 12.223 -7.100 21.157 1.00 0.00 H new ATOM 0 HB VAL A 14 14.966 -8.117 22.003 1.00 0.00 H new ATOM 0 HG11 VAL A 14 14.556 -6.944 24.127 1.00 0.00 H new ATOM 0 HG12 VAL A 14 14.647 -5.814 22.754 1.00 0.00 H new ATOM 0 HG13 VAL A 14 13.066 -6.246 23.449 1.00 0.00 H new ATOM 0 HG21 VAL A 14 13.714 -9.243 23.799 1.00 0.00 H new ATOM 0 HG22 VAL A 14 12.189 -8.640 23.107 1.00 0.00 H new ATOM 0 HG23 VAL A 14 13.191 -9.787 22.187 1.00 0.00 H new ATOM 169 N SER A 15 13.301 -4.959 20.499 1.00 0.00 N ATOM 170 CA SER A 15 13.861 -3.703 20.013 1.00 0.00 C ATOM 171 C SER A 15 12.977 -2.525 20.409 1.00 0.00 C ATOM 172 O SER A 15 11.749 -2.618 20.385 1.00 0.00 O ATOM 173 CB SER A 15 14.022 -3.746 18.492 1.00 0.00 C ATOM 174 OG SER A 15 12.766 -3.644 17.844 1.00 0.00 O ATOM 0 H SER A 15 12.373 -4.875 20.914 1.00 0.00 H new ATOM 0 HA SER A 15 14.841 -3.570 20.471 1.00 0.00 H new ATOM 0 HB2 SER A 15 14.669 -2.931 18.168 1.00 0.00 H new ATOM 0 HB3 SER A 15 14.511 -4.676 18.201 1.00 0.00 H new ATOM 0 HG SER A 15 12.896 -3.672 16.873 1.00 0.00 H new ATOM 180 N THR A 16 13.609 -1.414 20.775 1.00 0.00 N ATOM 181 CA THR A 16 12.882 -0.217 21.178 1.00 0.00 C ATOM 182 C THR A 16 12.835 0.804 20.047 1.00 0.00 C ATOM 183 O THR A 16 13.486 0.634 19.016 1.00 0.00 O ATOM 184 CB THR A 16 13.519 0.437 22.418 1.00 0.00 C ATOM 185 OG1 THR A 16 12.675 1.485 22.908 1.00 0.00 O ATOM 186 CG2 THR A 16 14.894 0.998 22.088 1.00 0.00 C ATOM 0 H THR A 16 14.624 -1.319 20.800 1.00 0.00 H new ATOM 0 HA THR A 16 11.868 -0.531 21.423 1.00 0.00 H new ATOM 0 HB THR A 16 13.631 -0.327 23.187 1.00 0.00 H new ATOM 0 HG1 THR A 16 13.087 1.894 23.698 1.00 0.00 H new ATOM 0 HG21 THR A 16 15.324 1.455 22.979 1.00 0.00 H new ATOM 0 HG22 THR A 16 15.543 0.192 21.744 1.00 0.00 H new ATOM 0 HG23 THR A 16 14.802 1.749 21.304 1.00 0.00 H new ATOM 194 N ASP A 17 12.060 1.865 20.246 1.00 0.00 N ATOM 195 CA ASP A 17 11.929 2.915 19.243 1.00 0.00 C ATOM 196 C ASP A 17 12.242 4.282 19.844 1.00 0.00 C ATOM 197 O ASP A 17 11.813 4.596 20.954 1.00 0.00 O ATOM 198 CB ASP A 17 10.518 2.914 18.654 1.00 0.00 C ATOM 199 CG ASP A 17 9.987 1.513 18.424 1.00 0.00 C ATOM 200 OD1 ASP A 17 10.301 0.925 17.368 1.00 0.00 O ATOM 201 OD2 ASP A 17 9.260 1.003 19.302 1.00 0.00 O ATOM 0 H ASP A 17 11.513 2.020 21.093 1.00 0.00 H new ATOM 0 HA ASP A 17 12.646 2.715 18.447 1.00 0.00 H new ATOM 0 HB2 ASP A 17 9.847 3.448 19.326 1.00 0.00 H new ATOM 0 HB3 ASP A 17 10.522 3.458 17.709 1.00 0.00 H new ATOM 206 N ASP A 18 12.993 5.090 19.103 1.00 0.00 N ATOM 207 CA ASP A 18 13.364 6.424 19.562 1.00 0.00 C ATOM 208 C ASP A 18 13.077 7.468 18.488 1.00 0.00 C ATOM 209 O ASP A 18 13.899 7.703 17.602 1.00 0.00 O ATOM 210 CB ASP A 18 14.844 6.461 19.945 1.00 0.00 C ATOM 211 CG ASP A 18 15.252 7.790 20.550 1.00 0.00 C ATOM 212 OD1 ASP A 18 14.973 8.836 19.926 1.00 0.00 O ATOM 213 OD2 ASP A 18 15.851 7.785 21.646 1.00 0.00 O ATOM 0 H ASP A 18 13.357 4.845 18.182 1.00 0.00 H new ATOM 0 HA ASP A 18 12.763 6.659 20.441 1.00 0.00 H new ATOM 0 HB2 ASP A 18 15.052 5.662 20.656 1.00 0.00 H new ATOM 0 HB3 ASP A 18 15.450 6.266 19.060 1.00 0.00 H new ATOM 218 N ILE A 19 11.905 8.089 18.571 1.00 0.00 N ATOM 219 CA ILE A 19 11.511 9.108 17.606 1.00 0.00 C ATOM 220 C ILE A 19 10.812 10.275 18.294 1.00 0.00 C ATOM 221 O ILE A 19 10.138 10.100 19.310 1.00 0.00 O ATOM 222 CB ILE A 19 10.577 8.528 16.527 1.00 0.00 C ATOM 223 CG1 ILE A 19 9.313 7.954 17.170 1.00 0.00 C ATOM 224 CG2 ILE A 19 11.299 7.461 15.719 1.00 0.00 C ATOM 225 CD1 ILE A 19 8.155 7.813 16.206 1.00 0.00 C ATOM 0 H ILE A 19 11.212 7.904 19.296 1.00 0.00 H new ATOM 0 HA ILE A 19 12.425 9.465 17.131 1.00 0.00 H new ATOM 0 HB ILE A 19 10.285 9.331 15.851 1.00 0.00 H new ATOM 0 HG12 ILE A 19 9.543 6.977 17.595 1.00 0.00 H new ATOM 0 HG13 ILE A 19 9.011 8.598 17.996 1.00 0.00 H new ATOM 0 HG21 ILE A 19 10.626 7.061 14.961 1.00 0.00 H new ATOM 0 HG22 ILE A 19 12.171 7.900 15.235 1.00 0.00 H new ATOM 0 HG23 ILE A 19 11.618 6.657 16.382 1.00 0.00 H new ATOM 0 HD11 ILE A 19 7.293 7.400 16.730 1.00 0.00 H new ATOM 0 HD12 ILE A 19 7.898 8.791 15.800 1.00 0.00 H new ATOM 0 HD13 ILE A 19 8.438 7.146 15.392 1.00 0.00 H new ATOM 237 N THR A 20 10.975 11.469 17.732 1.00 0.00 N ATOM 238 CA THR A 20 10.359 12.667 18.290 1.00 0.00 C ATOM 239 C THR A 20 10.162 13.734 17.220 1.00 0.00 C ATOM 240 O THR A 20 10.911 13.795 16.245 1.00 0.00 O ATOM 241 CB THR A 20 11.208 13.254 19.434 1.00 0.00 C ATOM 242 OG1 THR A 20 10.842 14.619 19.664 1.00 0.00 O ATOM 243 CG2 THR A 20 12.691 13.171 19.105 1.00 0.00 C ATOM 0 H THR A 20 11.528 11.632 16.891 1.00 0.00 H new ATOM 0 HA THR A 20 9.388 12.368 18.684 1.00 0.00 H new ATOM 0 HB THR A 20 11.018 12.670 20.334 1.00 0.00 H new ATOM 0 HG1 THR A 20 11.385 14.985 20.394 1.00 0.00 H new ATOM 0 HG21 THR A 20 13.270 13.591 19.927 1.00 0.00 H new ATOM 0 HG22 THR A 20 12.973 12.128 18.958 1.00 0.00 H new ATOM 0 HG23 THR A 20 12.894 13.734 18.194 1.00 0.00 H new ATOM 251 N VAL A 21 9.148 14.573 17.407 1.00 0.00 N ATOM 252 CA VAL A 21 8.853 15.639 16.457 1.00 0.00 C ATOM 253 C VAL A 21 8.672 16.975 17.169 1.00 0.00 C ATOM 254 O VAL A 21 7.632 17.232 17.775 1.00 0.00 O ATOM 255 CB VAL A 21 7.584 15.329 15.641 1.00 0.00 C ATOM 256 CG1 VAL A 21 7.281 16.463 14.674 1.00 0.00 C ATOM 257 CG2 VAL A 21 7.738 14.010 14.899 1.00 0.00 C ATOM 0 H VAL A 21 8.517 14.535 18.208 1.00 0.00 H new ATOM 0 HA VAL A 21 9.705 15.704 15.780 1.00 0.00 H new ATOM 0 HB VAL A 21 6.743 15.237 16.329 1.00 0.00 H new ATOM 0 HG11 VAL A 21 6.381 16.226 14.106 1.00 0.00 H new ATOM 0 HG12 VAL A 21 7.125 17.386 15.233 1.00 0.00 H new ATOM 0 HG13 VAL A 21 8.119 16.591 13.989 1.00 0.00 H new ATOM 0 HG21 VAL A 21 6.832 13.806 14.328 1.00 0.00 H new ATOM 0 HG22 VAL A 21 8.589 14.071 14.221 1.00 0.00 H new ATOM 0 HG23 VAL A 21 7.903 13.206 15.616 1.00 0.00 H new ATOM 267 N VAL A 22 9.693 17.823 17.093 1.00 0.00 N ATOM 268 CA VAL A 22 9.647 19.134 17.729 1.00 0.00 C ATOM 269 C VAL A 22 9.470 20.241 16.695 1.00 0.00 C ATOM 270 O VAL A 22 10.112 21.289 16.774 1.00 0.00 O ATOM 271 CB VAL A 22 10.924 19.408 18.544 1.00 0.00 C ATOM 272 CG1 VAL A 22 11.074 18.387 19.662 1.00 0.00 C ATOM 273 CG2 VAL A 22 12.146 19.401 17.638 1.00 0.00 C ATOM 0 H VAL A 22 10.562 17.625 16.597 1.00 0.00 H new ATOM 0 HA VAL A 22 8.790 19.129 18.402 1.00 0.00 H new ATOM 0 HB VAL A 22 10.840 20.396 18.996 1.00 0.00 H new ATOM 0 HG11 VAL A 22 11.982 18.597 20.227 1.00 0.00 H new ATOM 0 HG12 VAL A 22 10.212 18.445 20.326 1.00 0.00 H new ATOM 0 HG13 VAL A 22 11.136 17.386 19.235 1.00 0.00 H new ATOM 0 HG21 VAL A 22 13.040 19.596 18.231 1.00 0.00 H new ATOM 0 HG22 VAL A 22 12.236 18.428 17.156 1.00 0.00 H new ATOM 0 HG23 VAL A 22 12.039 20.174 16.877 1.00 0.00 H new ATOM 283 N THR A 23 8.595 20.001 15.723 1.00 0.00 N ATOM 284 CA THR A 23 8.334 20.977 14.672 1.00 0.00 C ATOM 285 C THR A 23 6.840 21.102 14.398 1.00 0.00 C ATOM 286 O THR A 23 6.055 20.225 14.762 1.00 0.00 O ATOM 287 CB THR A 23 9.055 20.600 13.364 1.00 0.00 C ATOM 288 OG1 THR A 23 10.454 20.423 13.609 1.00 0.00 O ATOM 289 CG2 THR A 23 8.852 21.673 12.306 1.00 0.00 C ATOM 0 H THR A 23 8.055 19.139 15.642 1.00 0.00 H new ATOM 0 HA THR A 23 8.717 21.934 15.026 1.00 0.00 H new ATOM 0 HB THR A 23 8.630 19.666 12.997 1.00 0.00 H new ATOM 0 HG1 THR A 23 10.905 20.182 12.773 1.00 0.00 H new ATOM 0 HG21 THR A 23 9.370 21.385 11.391 1.00 0.00 H new ATOM 0 HG22 THR A 23 7.787 21.784 12.100 1.00 0.00 H new ATOM 0 HG23 THR A 23 9.253 22.620 12.667 1.00 0.00 H new ATOM 297 N LEU A 24 6.451 22.197 13.753 1.00 0.00 N ATOM 298 CA LEU A 24 5.049 22.437 13.428 1.00 0.00 C ATOM 299 C LEU A 24 4.723 21.940 12.023 1.00 0.00 C ATOM 300 O LEU A 24 5.177 22.510 11.031 1.00 0.00 O ATOM 301 CB LEU A 24 4.727 23.928 13.542 1.00 0.00 C ATOM 302 CG LEU A 24 4.317 24.422 14.930 1.00 0.00 C ATOM 303 CD1 LEU A 24 4.386 25.939 14.998 1.00 0.00 C ATOM 304 CD2 LEU A 24 2.918 23.933 15.278 1.00 0.00 C ATOM 0 H LEU A 24 7.087 22.933 13.445 1.00 0.00 H new ATOM 0 HA LEU A 24 4.436 21.884 14.140 1.00 0.00 H new ATOM 0 HB2 LEU A 24 5.602 24.494 13.221 1.00 0.00 H new ATOM 0 HB3 LEU A 24 3.923 24.160 12.844 1.00 0.00 H new ATOM 0 HG LEU A 24 5.015 24.014 15.661 1.00 0.00 H new ATOM 0 HD11 LEU A 24 4.091 26.272 15.993 1.00 0.00 H new ATOM 0 HD12 LEU A 24 5.405 26.266 14.793 1.00 0.00 H new ATOM 0 HD13 LEU A 24 3.711 26.367 14.257 1.00 0.00 H new ATOM 0 HD21 LEU A 24 2.642 24.294 16.269 1.00 0.00 H new ATOM 0 HD22 LEU A 24 2.207 24.311 14.543 1.00 0.00 H new ATOM 0 HD23 LEU A 24 2.901 22.843 15.271 1.00 0.00 H new ATOM 316 N SER A 25 3.931 20.875 11.946 1.00 0.00 N ATOM 317 CA SER A 25 3.545 20.301 10.663 1.00 0.00 C ATOM 318 C SER A 25 2.029 20.325 10.491 1.00 0.00 C ATOM 319 O SER A 25 1.299 20.759 11.383 1.00 0.00 O ATOM 320 CB SER A 25 4.060 18.865 10.548 1.00 0.00 C ATOM 321 OG SER A 25 5.471 18.837 10.418 1.00 0.00 O ATOM 0 H SER A 25 3.544 20.393 12.757 1.00 0.00 H new ATOM 0 HA SER A 25 3.992 20.905 9.873 1.00 0.00 H new ATOM 0 HB2 SER A 25 3.762 18.297 11.429 1.00 0.00 H new ATOM 0 HB3 SER A 25 3.603 18.379 9.686 1.00 0.00 H new ATOM 0 HG SER A 25 5.775 17.908 10.348 1.00 0.00 H new ATOM 327 N ASP A 26 1.564 19.856 9.339 1.00 0.00 N ATOM 328 CA ASP A 26 0.135 19.822 9.049 1.00 0.00 C ATOM 329 C ASP A 26 -0.386 18.389 9.049 1.00 0.00 C ATOM 330 O ASP A 26 -1.551 18.140 9.361 1.00 0.00 O ATOM 331 CB ASP A 26 -0.149 20.481 7.698 1.00 0.00 C ATOM 332 CG ASP A 26 0.985 20.288 6.710 1.00 0.00 C ATOM 333 OD1 ASP A 26 1.674 19.249 6.793 1.00 0.00 O ATOM 334 OD2 ASP A 26 1.183 21.175 5.854 1.00 0.00 O ATOM 0 H ASP A 26 2.155 19.494 8.591 1.00 0.00 H new ATOM 0 HA ASP A 26 -0.382 20.377 9.831 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -1.066 20.066 7.280 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -0.321 21.547 7.846 1.00 0.00 H new ATOM 339 N VAL A 27 0.485 17.448 8.695 1.00 0.00 N ATOM 340 CA VAL A 27 0.113 16.039 8.654 1.00 0.00 C ATOM 341 C VAL A 27 -0.823 15.684 9.804 1.00 0.00 C ATOM 342 O VAL A 27 -0.839 16.336 10.848 1.00 0.00 O ATOM 343 CB VAL A 27 1.354 15.129 8.717 1.00 0.00 C ATOM 344 CG1 VAL A 27 2.052 15.083 7.366 1.00 0.00 C ATOM 345 CG2 VAL A 27 2.308 15.604 9.803 1.00 0.00 C ATOM 0 H VAL A 27 1.452 17.637 8.433 1.00 0.00 H new ATOM 0 HA VAL A 27 -0.401 15.875 7.707 1.00 0.00 H new ATOM 0 HB VAL A 27 1.030 14.119 8.966 1.00 0.00 H new ATOM 0 HG11 VAL A 27 2.926 14.435 7.430 1.00 0.00 H new ATOM 0 HG12 VAL A 27 1.365 14.693 6.615 1.00 0.00 H new ATOM 0 HG13 VAL A 27 2.365 16.088 7.084 1.00 0.00 H new ATOM 0 HG21 VAL A 27 3.179 14.950 9.834 1.00 0.00 H new ATOM 0 HG22 VAL A 27 2.627 16.623 9.586 1.00 0.00 H new ATOM 0 HG23 VAL A 27 1.802 15.580 10.768 1.00 0.00 H new ATOM 355 N PRO A 28 -1.623 14.624 9.610 1.00 0.00 N ATOM 356 CA PRO A 28 -2.576 14.157 10.620 1.00 0.00 C ATOM 357 C PRO A 28 -1.883 13.536 11.829 1.00 0.00 C ATOM 358 O PRO A 28 -0.912 12.794 11.686 1.00 0.00 O ATOM 359 CB PRO A 28 -3.395 13.101 9.874 1.00 0.00 C ATOM 360 CG PRO A 28 -2.493 12.617 8.791 1.00 0.00 C ATOM 361 CD PRO A 28 -1.657 13.801 8.390 1.00 0.00 C ATOM 0 HA PRO A 28 -3.174 14.974 11.024 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -3.690 12.287 10.537 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -4.311 13.527 9.465 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -1.866 11.797 9.142 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -3.067 12.239 7.945 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.656 13.500 8.081 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -2.100 14.341 7.553 1.00 0.00 H new ATOM 369 N SER A 29 -2.388 13.846 13.019 1.00 0.00 N ATOM 370 CA SER A 29 -1.815 13.321 14.252 1.00 0.00 C ATOM 371 C SER A 29 -2.799 12.391 14.956 1.00 0.00 C ATOM 372 O SER A 29 -2.968 12.454 16.173 1.00 0.00 O ATOM 373 CB SER A 29 -1.423 14.467 15.186 1.00 0.00 C ATOM 374 OG SER A 29 -0.153 14.994 14.842 1.00 0.00 O ATOM 0 H SER A 29 -3.193 14.458 13.155 1.00 0.00 H new ATOM 0 HA SER A 29 -0.923 12.750 13.994 1.00 0.00 H new ATOM 0 HB2 SER A 29 -2.174 15.256 15.134 1.00 0.00 H new ATOM 0 HB3 SER A 29 -1.406 14.111 16.216 1.00 0.00 H new ATOM 0 HG SER A 29 0.074 15.726 15.453 1.00 0.00 H new ATOM 380 N ALA A 30 -3.446 11.527 14.179 1.00 0.00 N ATOM 381 CA ALA A 30 -4.412 10.583 14.727 1.00 0.00 C ATOM 382 C ALA A 30 -4.491 9.322 13.872 1.00 0.00 C ATOM 383 O ALA A 30 -4.563 9.379 12.645 1.00 0.00 O ATOM 384 CB ALA A 30 -5.782 11.234 14.839 1.00 0.00 C ATOM 0 H ALA A 30 -3.318 11.462 13.169 1.00 0.00 H new ATOM 0 HA ALA A 30 -4.077 10.295 15.724 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -6.493 10.517 15.250 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -5.720 12.101 15.497 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -6.116 11.551 13.851 1.00 0.00 H new ATOM 390 N PRO A 31 -4.478 8.156 14.535 1.00 0.00 N ATOM 391 CA PRO A 31 -4.548 6.859 13.855 1.00 0.00 C ATOM 392 C PRO A 31 -5.917 6.603 13.234 1.00 0.00 C ATOM 393 O PRO A 31 -6.890 7.307 13.505 1.00 0.00 O ATOM 394 CB PRO A 31 -4.274 5.855 14.977 1.00 0.00 C ATOM 395 CG PRO A 31 -4.691 6.556 16.223 1.00 0.00 C ATOM 396 CD PRO A 31 -4.394 8.013 15.998 1.00 0.00 C ATOM 0 HA PRO A 31 -3.843 6.795 13.026 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -4.840 4.935 14.832 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -3.220 5.578 15.012 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -5.751 6.400 16.422 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -4.145 6.175 17.086 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -5.115 8.653 16.506 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -3.407 8.284 16.372 1.00 0.00 H new ATOM 404 N PRO A 32 -5.997 5.571 12.380 1.00 0.00 N ATOM 405 CA PRO A 32 -7.243 5.198 11.703 1.00 0.00 C ATOM 406 C PRO A 32 -8.270 4.610 12.664 1.00 0.00 C ATOM 407 O PRO A 32 -7.989 4.422 13.848 1.00 0.00 O ATOM 408 CB PRO A 32 -6.793 4.144 10.689 1.00 0.00 C ATOM 409 CG PRO A 32 -5.549 3.567 11.269 1.00 0.00 C ATOM 410 CD PRO A 32 -4.877 4.690 12.009 1.00 0.00 C ATOM 0 HA PRO A 32 -7.737 6.059 11.252 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -7.556 3.379 10.549 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -6.605 4.589 9.712 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -5.779 2.740 11.941 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -4.901 3.172 10.487 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -4.341 4.329 12.887 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -4.150 5.206 11.382 1.00 0.00 H new ATOM 418 N GLN A 33 -9.460 4.320 12.147 1.00 0.00 N ATOM 419 CA GLN A 33 -10.528 3.752 12.960 1.00 0.00 C ATOM 420 C GLN A 33 -10.858 2.333 12.511 1.00 0.00 C ATOM 421 O GLN A 33 -10.431 1.893 11.445 1.00 0.00 O ATOM 422 CB GLN A 33 -11.779 4.629 12.880 1.00 0.00 C ATOM 423 CG GLN A 33 -11.604 5.999 13.517 1.00 0.00 C ATOM 424 CD GLN A 33 -12.894 6.794 13.553 1.00 0.00 C ATOM 425 OE1 GLN A 33 -13.936 6.291 13.975 1.00 0.00 O ATOM 426 NE2 GLN A 33 -12.831 8.045 13.111 1.00 0.00 N ATOM 0 H GLN A 33 -9.708 4.469 11.169 1.00 0.00 H new ATOM 0 HA GLN A 33 -10.184 3.715 13.994 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -12.057 4.757 11.834 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -12.606 4.113 13.368 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -11.228 5.878 14.533 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -10.851 6.560 12.963 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -11.946 8.421 12.770 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -13.667 8.629 13.113 1.00 0.00 H new ATOM 435 N ASN A 34 -11.622 1.620 13.333 1.00 0.00 N ATOM 436 CA ASN A 34 -12.009 0.249 13.021 1.00 0.00 C ATOM 437 C ASN A 34 -10.809 -0.557 12.534 1.00 0.00 C ATOM 438 O ASN A 34 -10.863 -1.199 11.484 1.00 0.00 O ATOM 439 CB ASN A 34 -13.111 0.237 11.960 1.00 0.00 C ATOM 440 CG ASN A 34 -14.482 0.513 12.547 1.00 0.00 C ATOM 441 OD1 ASN A 34 -14.630 1.345 13.441 1.00 0.00 O ATOM 442 ND2 ASN A 34 -15.492 -0.187 12.044 1.00 0.00 N ATOM 0 H ASN A 34 -11.985 1.969 14.220 1.00 0.00 H new ATOM 0 HA ASN A 34 -12.388 -0.212 13.933 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -12.887 0.985 11.199 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -13.121 -0.732 11.461 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -16.438 -0.045 12.399 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -15.322 -0.867 11.303 1.00 0.00 H new ATOM 449 N VAL A 35 -9.726 -0.520 13.303 1.00 0.00 N ATOM 450 CA VAL A 35 -8.512 -1.248 12.951 1.00 0.00 C ATOM 451 C VAL A 35 -8.513 -2.645 13.561 1.00 0.00 C ATOM 452 O VAL A 35 -7.996 -2.855 14.659 1.00 0.00 O ATOM 453 CB VAL A 35 -7.251 -0.497 13.418 1.00 0.00 C ATOM 454 CG1 VAL A 35 -6.000 -1.291 13.077 1.00 0.00 C ATOM 455 CG2 VAL A 35 -7.198 0.891 12.797 1.00 0.00 C ATOM 0 H VAL A 35 -9.664 0.007 14.174 1.00 0.00 H new ATOM 0 HA VAL A 35 -8.496 -1.329 11.864 1.00 0.00 H new ATOM 0 HB VAL A 35 -7.296 -0.384 14.501 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -5.119 -0.745 13.414 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -6.038 -2.261 13.573 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -5.945 -1.438 11.998 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -6.301 1.408 13.138 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -7.176 0.803 11.711 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -8.079 1.458 13.097 1.00 0.00 H new ATOM 465 N SER A 36 -9.097 -3.598 12.842 1.00 0.00 N ATOM 466 CA SER A 36 -9.169 -4.976 13.314 1.00 0.00 C ATOM 467 C SER A 36 -8.644 -5.941 12.255 1.00 0.00 C ATOM 468 O SER A 36 -8.511 -5.583 11.084 1.00 0.00 O ATOM 469 CB SER A 36 -10.609 -5.338 13.681 1.00 0.00 C ATOM 470 OG SER A 36 -10.970 -4.786 14.936 1.00 0.00 O ATOM 0 H SER A 36 -9.527 -3.441 11.931 1.00 0.00 H new ATOM 0 HA SER A 36 -8.543 -5.063 14.202 1.00 0.00 H new ATOM 0 HB2 SER A 36 -11.287 -4.971 12.910 1.00 0.00 H new ATOM 0 HB3 SER A 36 -10.718 -6.422 13.712 1.00 0.00 H new ATOM 0 HG SER A 36 -11.895 -5.030 15.147 1.00 0.00 H new ATOM 476 N LEU A 37 -8.349 -7.166 12.675 1.00 0.00 N ATOM 477 CA LEU A 37 -7.839 -8.185 11.763 1.00 0.00 C ATOM 478 C LEU A 37 -8.765 -9.396 11.727 1.00 0.00 C ATOM 479 O LEU A 37 -9.036 -10.013 12.756 1.00 0.00 O ATOM 480 CB LEU A 37 -6.433 -8.616 12.185 1.00 0.00 C ATOM 481 CG LEU A 37 -5.333 -7.566 12.028 1.00 0.00 C ATOM 482 CD1 LEU A 37 -4.050 -8.033 12.698 1.00 0.00 C ATOM 483 CD2 LEU A 37 -5.089 -7.265 10.556 1.00 0.00 C ATOM 0 H LEU A 37 -8.454 -7.478 13.640 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.796 -7.754 10.763 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.467 -8.923 13.230 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -6.154 -9.495 11.603 1.00 0.00 H new ATOM 0 HG LEU A 37 -5.661 -6.648 12.517 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -3.278 -7.273 12.576 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -4.233 -8.197 13.760 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -3.718 -8.964 12.239 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -4.303 -6.516 10.463 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -4.783 -8.177 10.044 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -6.006 -6.886 10.105 1.00 0.00 H new ATOM 495 N GLU A 38 -9.245 -9.731 10.533 1.00 0.00 N ATOM 496 CA GLU A 38 -10.140 -10.870 10.363 1.00 0.00 C ATOM 497 C GLU A 38 -9.406 -12.050 9.733 1.00 0.00 C ATOM 498 O GLU A 38 -8.666 -11.888 8.762 1.00 0.00 O ATOM 499 CB GLU A 38 -11.339 -10.479 9.496 1.00 0.00 C ATOM 500 CG GLU A 38 -12.569 -11.339 9.735 1.00 0.00 C ATOM 501 CD GLU A 38 -13.016 -11.329 11.184 1.00 0.00 C ATOM 502 OE1 GLU A 38 -12.748 -10.327 11.880 1.00 0.00 O ATOM 503 OE2 GLU A 38 -13.632 -12.322 11.623 1.00 0.00 O ATOM 0 H GLU A 38 -9.029 -9.231 9.671 1.00 0.00 H new ATOM 0 HA GLU A 38 -10.496 -11.170 11.349 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -11.592 -9.436 9.689 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -11.056 -10.549 8.446 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -13.384 -10.983 9.105 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -12.355 -12.364 9.432 1.00 0.00 H new ATOM 510 N VAL A 39 -9.616 -13.237 10.293 1.00 0.00 N ATOM 511 CA VAL A 39 -8.975 -14.445 9.786 1.00 0.00 C ATOM 512 C VAL A 39 -9.893 -15.193 8.826 1.00 0.00 C ATOM 513 O VAL A 39 -10.813 -15.894 9.249 1.00 0.00 O ATOM 514 CB VAL A 39 -8.571 -15.389 10.934 1.00 0.00 C ATOM 515 CG1 VAL A 39 -7.917 -16.648 10.385 1.00 0.00 C ATOM 516 CG2 VAL A 39 -7.644 -14.678 11.908 1.00 0.00 C ATOM 0 H VAL A 39 -10.225 -13.388 11.097 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.078 -14.128 9.253 1.00 0.00 H new ATOM 0 HB VAL A 39 -9.471 -15.682 11.474 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -7.638 -17.303 11.211 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -8.618 -17.167 9.731 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -7.025 -16.378 9.819 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -7.369 -15.360 12.712 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -6.745 -14.354 11.384 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -8.153 -13.810 12.327 1.00 0.00 H new ATOM 526 N VAL A 40 -9.637 -15.040 7.531 1.00 0.00 N ATOM 527 CA VAL A 40 -10.439 -15.702 6.510 1.00 0.00 C ATOM 528 C VAL A 40 -9.981 -17.141 6.298 1.00 0.00 C ATOM 529 O VAL A 40 -10.794 -18.064 6.270 1.00 0.00 O ATOM 530 CB VAL A 40 -10.371 -14.950 5.167 1.00 0.00 C ATOM 531 CG1 VAL A 40 -11.211 -15.658 4.115 1.00 0.00 C ATOM 532 CG2 VAL A 40 -10.822 -13.508 5.341 1.00 0.00 C ATOM 0 H VAL A 40 -8.880 -14.463 7.164 1.00 0.00 H new ATOM 0 HA VAL A 40 -11.469 -15.700 6.867 1.00 0.00 H new ATOM 0 HB VAL A 40 -9.336 -14.944 4.826 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -11.151 -15.112 3.173 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -10.836 -16.671 3.972 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -12.249 -15.698 4.445 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -10.768 -12.992 4.383 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -11.849 -13.489 5.705 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -10.173 -13.008 6.060 1.00 0.00 H new ATOM 542 N ASN A 41 -8.673 -17.324 6.150 1.00 0.00 N ATOM 543 CA ASN A 41 -8.106 -18.651 5.941 1.00 0.00 C ATOM 544 C ASN A 41 -6.758 -18.783 6.644 1.00 0.00 C ATOM 545 O ASN A 41 -6.319 -17.871 7.344 1.00 0.00 O ATOM 546 CB ASN A 41 -7.943 -18.929 4.445 1.00 0.00 C ATOM 547 CG ASN A 41 -9.274 -19.126 3.746 1.00 0.00 C ATOM 548 OD1 ASN A 41 -10.276 -19.463 4.377 1.00 0.00 O ATOM 549 ND2 ASN A 41 -9.290 -18.915 2.435 1.00 0.00 N ATOM 0 H ASN A 41 -7.986 -16.570 6.171 1.00 0.00 H new ATOM 0 HA ASN A 41 -8.792 -19.383 6.367 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -7.411 -18.099 3.980 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -7.329 -19.819 4.308 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -10.157 -19.031 1.910 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -8.435 -18.637 1.953 1.00 0.00 H new ATOM 556 N SER A 42 -6.106 -19.926 6.452 1.00 0.00 N ATOM 557 CA SER A 42 -4.810 -20.179 7.069 1.00 0.00 C ATOM 558 C SER A 42 -3.685 -19.563 6.243 1.00 0.00 C ATOM 559 O SER A 42 -2.576 -19.362 6.738 1.00 0.00 O ATOM 560 CB SER A 42 -4.580 -21.684 7.222 1.00 0.00 C ATOM 561 OG SER A 42 -4.589 -22.332 5.962 1.00 0.00 O ATOM 0 H SER A 42 -6.455 -20.691 5.874 1.00 0.00 H new ATOM 0 HA SER A 42 -4.808 -19.716 8.056 1.00 0.00 H new ATOM 0 HB2 SER A 42 -3.626 -21.861 7.718 1.00 0.00 H new ATOM 0 HB3 SER A 42 -5.355 -22.110 7.859 1.00 0.00 H new ATOM 0 HG SER A 42 -4.438 -23.292 6.087 1.00 0.00 H new ATOM 567 N ARG A 43 -3.980 -19.265 4.982 1.00 0.00 N ATOM 568 CA ARG A 43 -2.994 -18.673 4.086 1.00 0.00 C ATOM 569 C ARG A 43 -3.450 -17.297 3.610 1.00 0.00 C ATOM 570 O ARG A 43 -2.663 -16.529 3.056 1.00 0.00 O ATOM 571 CB ARG A 43 -2.752 -19.587 2.884 1.00 0.00 C ATOM 572 CG ARG A 43 -3.879 -19.562 1.864 1.00 0.00 C ATOM 573 CD ARG A 43 -3.968 -20.874 1.100 1.00 0.00 C ATOM 574 NE ARG A 43 -4.588 -20.704 -0.211 1.00 0.00 N ATOM 575 CZ ARG A 43 -4.798 -21.703 -1.060 1.00 0.00 C ATOM 576 NH1 ARG A 43 -4.440 -22.938 -0.738 1.00 0.00 N ATOM 577 NH2 ARG A 43 -5.368 -21.468 -2.236 1.00 0.00 N ATOM 0 H ARG A 43 -4.894 -19.424 4.558 1.00 0.00 H new ATOM 0 HA ARG A 43 -2.061 -18.557 4.638 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -1.824 -19.292 2.395 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -2.615 -20.609 3.237 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -4.825 -19.369 2.370 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -3.719 -18.742 1.164 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -2.968 -21.290 0.977 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -4.543 -21.594 1.682 1.00 0.00 H new ATOM 0 HE ARG A 43 -4.876 -19.766 -0.490 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -4.002 -23.123 0.164 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -4.603 -23.703 -1.392 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -5.645 -20.519 -2.488 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -5.529 -22.236 -2.887 1.00 0.00 H new ATOM 591 N SER A 44 -4.725 -16.993 3.828 1.00 0.00 N ATOM 592 CA SER A 44 -5.287 -15.712 3.417 1.00 0.00 C ATOM 593 C SER A 44 -5.684 -14.878 4.632 1.00 0.00 C ATOM 594 O SER A 44 -5.874 -15.409 5.726 1.00 0.00 O ATOM 595 CB SER A 44 -6.502 -15.930 2.514 1.00 0.00 C ATOM 596 OG SER A 44 -6.294 -17.020 1.633 1.00 0.00 O ATOM 0 H SER A 44 -5.389 -17.617 4.287 1.00 0.00 H new ATOM 0 HA SER A 44 -4.523 -15.170 2.860 1.00 0.00 H new ATOM 0 HB2 SER A 44 -7.385 -16.116 3.126 1.00 0.00 H new ATOM 0 HB3 SER A 44 -6.698 -15.025 1.938 1.00 0.00 H new ATOM 0 HG SER A 44 -7.086 -17.140 1.068 1.00 0.00 H new ATOM 602 N ILE A 45 -5.807 -13.571 4.429 1.00 0.00 N ATOM 603 CA ILE A 45 -6.183 -12.664 5.507 1.00 0.00 C ATOM 604 C ILE A 45 -6.781 -11.374 4.956 1.00 0.00 C ATOM 605 O ILE A 45 -6.351 -10.870 3.918 1.00 0.00 O ATOM 606 CB ILE A 45 -4.975 -12.317 6.397 1.00 0.00 C ATOM 607 CG1 ILE A 45 -4.419 -13.581 7.055 1.00 0.00 C ATOM 608 CG2 ILE A 45 -5.371 -11.294 7.452 1.00 0.00 C ATOM 609 CD1 ILE A 45 -3.440 -13.300 8.174 1.00 0.00 C ATOM 0 H ILE A 45 -5.652 -13.116 3.529 1.00 0.00 H new ATOM 0 HA ILE A 45 -6.931 -13.181 6.108 1.00 0.00 H new ATOM 0 HB ILE A 45 -4.195 -11.882 5.772 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -5.247 -14.171 7.448 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -3.926 -14.189 6.296 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -4.507 -11.059 8.073 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -5.725 -10.386 6.964 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -6.166 -11.704 8.076 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -3.087 -14.242 8.594 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -2.593 -12.737 7.783 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -3.934 -12.718 8.952 1.00 0.00 H new ATOM 621 N LYS A 46 -7.775 -10.842 5.659 1.00 0.00 N ATOM 622 CA LYS A 46 -8.432 -9.608 5.243 1.00 0.00 C ATOM 623 C LYS A 46 -8.090 -8.464 6.192 1.00 0.00 C ATOM 624 O LYS A 46 -8.273 -8.573 7.404 1.00 0.00 O ATOM 625 CB LYS A 46 -9.949 -9.806 5.191 1.00 0.00 C ATOM 626 CG LYS A 46 -10.703 -8.597 4.666 1.00 0.00 C ATOM 627 CD LYS A 46 -10.778 -8.602 3.149 1.00 0.00 C ATOM 628 CE LYS A 46 -11.918 -7.730 2.644 1.00 0.00 C ATOM 629 NZ LYS A 46 -11.584 -6.281 2.721 1.00 0.00 N ATOM 0 H LYS A 46 -8.144 -11.246 6.520 1.00 0.00 H new ATOM 0 HA LYS A 46 -8.071 -9.351 4.247 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -10.173 -10.666 4.560 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -10.311 -10.043 6.192 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -11.711 -8.587 5.081 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -10.211 -7.685 5.004 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -9.835 -8.245 2.736 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -10.915 -9.623 2.794 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -12.148 -7.995 1.612 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -12.814 -7.928 3.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -12.461 -5.723 2.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -11.042 -6.095 3.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -11.015 -6.011 1.893 1.00 0.00 H new ATOM 643 N VAL A 47 -7.595 -7.365 5.631 1.00 0.00 N ATOM 644 CA VAL A 47 -7.230 -6.199 6.427 1.00 0.00 C ATOM 645 C VAL A 47 -7.977 -4.956 5.956 1.00 0.00 C ATOM 646 O VAL A 47 -7.820 -4.520 4.815 1.00 0.00 O ATOM 647 CB VAL A 47 -5.715 -5.928 6.365 1.00 0.00 C ATOM 648 CG1 VAL A 47 -5.359 -4.692 7.177 1.00 0.00 C ATOM 649 CG2 VAL A 47 -4.937 -7.140 6.855 1.00 0.00 C ATOM 0 H VAL A 47 -7.438 -7.258 4.629 1.00 0.00 H new ATOM 0 HA VAL A 47 -7.510 -6.419 7.457 1.00 0.00 H new ATOM 0 HB VAL A 47 -5.439 -5.743 5.327 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -4.285 -4.517 7.121 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -5.889 -3.828 6.776 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -5.648 -4.844 8.217 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -3.868 -6.931 6.804 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -5.216 -7.359 7.886 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -5.169 -8.000 6.226 1.00 0.00 H new ATOM 659 N SER A 48 -8.791 -4.390 6.841 1.00 0.00 N ATOM 660 CA SER A 48 -9.565 -3.198 6.515 1.00 0.00 C ATOM 661 C SER A 48 -9.244 -2.060 7.479 1.00 0.00 C ATOM 662 O SER A 48 -8.456 -2.225 8.410 1.00 0.00 O ATOM 663 CB SER A 48 -11.063 -3.510 6.557 1.00 0.00 C ATOM 664 OG SER A 48 -11.499 -3.740 7.885 1.00 0.00 O ATOM 0 H SER A 48 -8.932 -4.738 7.790 1.00 0.00 H new ATOM 0 HA SER A 48 -9.294 -2.884 5.507 1.00 0.00 H new ATOM 0 HB2 SER A 48 -11.623 -2.680 6.126 1.00 0.00 H new ATOM 0 HB3 SER A 48 -11.272 -4.387 5.945 1.00 0.00 H new ATOM 0 HG SER A 48 -12.459 -3.935 7.885 1.00 0.00 H new ATOM 670 N TRP A 49 -9.860 -0.907 7.249 1.00 0.00 N ATOM 671 CA TRP A 49 -9.640 0.260 8.096 1.00 0.00 C ATOM 672 C TRP A 49 -10.569 1.402 7.701 1.00 0.00 C ATOM 673 O TRP A 49 -11.260 1.331 6.684 1.00 0.00 O ATOM 674 CB TRP A 49 -8.183 0.715 8.005 1.00 0.00 C ATOM 675 CG TRP A 49 -7.758 1.068 6.611 1.00 0.00 C ATOM 676 CD1 TRP A 49 -7.927 2.268 5.982 1.00 0.00 C ATOM 677 CD2 TRP A 49 -7.095 0.212 5.675 1.00 0.00 C ATOM 678 NE1 TRP A 49 -7.409 2.210 4.711 1.00 0.00 N ATOM 679 CE2 TRP A 49 -6.892 0.960 4.498 1.00 0.00 C ATOM 680 CE3 TRP A 49 -6.650 -1.112 5.717 1.00 0.00 C ATOM 681 CZ2 TRP A 49 -6.266 0.425 3.376 1.00 0.00 C ATOM 682 CZ3 TRP A 49 -6.029 -1.642 4.601 1.00 0.00 C ATOM 683 CH2 TRP A 49 -5.841 -0.874 3.444 1.00 0.00 C ATOM 0 H TRP A 49 -10.516 -0.754 6.483 1.00 0.00 H new ATOM 0 HA TRP A 49 -9.860 -0.022 9.125 1.00 0.00 H new ATOM 0 HB2 TRP A 49 -8.039 1.581 8.652 1.00 0.00 H new ATOM 0 HB3 TRP A 49 -7.538 -0.077 8.385 1.00 0.00 H new ATOM 0 HD1 TRP A 49 -8.399 3.135 6.419 1.00 0.00 H new ATOM 0 HE1 TRP A 49 -7.409 2.974 4.035 1.00 0.00 H new ATOM 0 HE3 TRP A 49 -6.789 -1.711 6.605 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 -6.121 1.014 2.483 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 -5.683 -2.665 4.621 1.00 0.00 H new ATOM 0 HH2 TRP A 49 -5.351 -1.316 2.589 1.00 0.00 H new ATOM 694 N LEU A 50 -10.581 2.456 8.511 1.00 0.00 N ATOM 695 CA LEU A 50 -11.426 3.615 8.245 1.00 0.00 C ATOM 696 C LEU A 50 -10.645 4.912 8.431 1.00 0.00 C ATOM 697 O LEU A 50 -9.669 4.976 9.180 1.00 0.00 O ATOM 698 CB LEU A 50 -12.646 3.604 9.168 1.00 0.00 C ATOM 699 CG LEU A 50 -13.679 2.509 8.901 1.00 0.00 C ATOM 700 CD1 LEU A 50 -14.630 2.375 10.081 1.00 0.00 C ATOM 701 CD2 LEU A 50 -14.450 2.803 7.623 1.00 0.00 C ATOM 0 H LEU A 50 -10.016 2.531 9.357 1.00 0.00 H new ATOM 0 HA LEU A 50 -11.761 3.560 7.209 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -12.298 3.505 10.196 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -13.143 4.571 9.092 1.00 0.00 H new ATOM 0 HG LEU A 50 -13.153 1.563 8.774 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -15.359 1.591 9.874 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -14.065 2.117 10.977 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -15.149 3.320 10.239 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -15.181 2.013 7.449 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -14.965 3.759 7.720 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -13.757 2.848 6.782 1.00 0.00 H new ATOM 713 N PRO A 51 -11.083 5.972 7.735 1.00 0.00 N ATOM 714 CA PRO A 51 -10.441 7.288 7.809 1.00 0.00 C ATOM 715 C PRO A 51 -10.655 7.962 9.160 1.00 0.00 C ATOM 716 O PRO A 51 -11.604 7.665 9.886 1.00 0.00 O ATOM 717 CB PRO A 51 -11.132 8.083 6.699 1.00 0.00 C ATOM 718 CG PRO A 51 -12.459 7.427 6.534 1.00 0.00 C ATOM 719 CD PRO A 51 -12.239 5.968 6.824 1.00 0.00 C ATOM 0 HA PRO A 51 -9.359 7.221 7.693 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -11.240 9.133 6.972 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -10.557 8.052 5.773 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -13.193 7.854 7.217 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -12.842 7.571 5.524 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -13.115 5.514 7.288 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -12.032 5.404 5.914 1.00 0.00 H new ATOM 727 N PRO A 52 -9.753 8.893 9.507 1.00 0.00 N ATOM 728 CA PRO A 52 -9.823 9.629 10.773 1.00 0.00 C ATOM 729 C PRO A 52 -10.992 10.607 10.810 1.00 0.00 C ATOM 730 O PRO A 52 -11.652 10.863 9.803 1.00 0.00 O ATOM 731 CB PRO A 52 -8.492 10.385 10.818 1.00 0.00 C ATOM 732 CG PRO A 52 -8.091 10.529 9.390 1.00 0.00 C ATOM 733 CD PRO A 52 -8.596 9.298 8.691 1.00 0.00 C ATOM 0 HA PRO A 52 -9.981 8.965 11.623 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -8.605 11.357 11.298 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -7.743 9.834 11.386 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -8.521 11.430 8.953 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -7.008 10.615 9.296 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -8.885 9.510 7.662 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -7.837 8.517 8.654 1.00 0.00 H new ATOM 741 N PRO A 53 -11.257 11.169 11.999 1.00 0.00 N ATOM 742 CA PRO A 53 -12.347 12.129 12.196 1.00 0.00 C ATOM 743 C PRO A 53 -12.073 13.466 11.515 1.00 0.00 C ATOM 744 O PRO A 53 -10.920 13.873 11.369 1.00 0.00 O ATOM 745 CB PRO A 53 -12.396 12.303 13.716 1.00 0.00 C ATOM 746 CG PRO A 53 -11.020 11.971 14.180 1.00 0.00 C ATOM 747 CD PRO A 53 -10.512 10.911 13.243 1.00 0.00 C ATOM 0 HA PRO A 53 -13.283 11.777 11.763 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -12.671 13.322 13.989 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -13.136 11.642 14.167 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -10.378 12.851 14.158 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -11.031 11.610 15.208 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -9.436 10.992 13.091 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -10.705 9.909 13.627 1.00 0.00 H new ATOM 755 N SER A 54 -13.138 14.144 11.102 1.00 0.00 N ATOM 756 CA SER A 54 -13.011 15.434 10.433 1.00 0.00 C ATOM 757 C SER A 54 -12.256 16.428 11.310 1.00 0.00 C ATOM 758 O SER A 54 -11.794 17.465 10.836 1.00 0.00 O ATOM 759 CB SER A 54 -14.393 15.990 10.086 1.00 0.00 C ATOM 760 OG SER A 54 -15.095 16.378 11.254 1.00 0.00 O ATOM 0 H SER A 54 -14.099 13.822 11.219 1.00 0.00 H new ATOM 0 HA SER A 54 -12.446 15.285 9.513 1.00 0.00 H new ATOM 0 HB2 SER A 54 -14.287 16.847 9.420 1.00 0.00 H new ATOM 0 HB3 SER A 54 -14.967 15.236 9.547 1.00 0.00 H new ATOM 0 HG SER A 54 -15.974 16.731 11.005 1.00 0.00 H new ATOM 766 N GLY A 55 -12.135 16.103 12.593 1.00 0.00 N ATOM 767 CA GLY A 55 -11.435 16.977 13.517 1.00 0.00 C ATOM 768 C GLY A 55 -9.929 16.896 13.364 1.00 0.00 C ATOM 769 O GLY A 55 -9.226 17.893 13.531 1.00 0.00 O ATOM 0 H GLY A 55 -12.509 15.250 13.010 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -11.759 18.005 13.356 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -11.708 16.714 14.539 1.00 0.00 H new ATOM 773 N THR A 56 -9.431 15.705 13.047 1.00 0.00 N ATOM 774 CA THR A 56 -7.999 15.496 12.875 1.00 0.00 C ATOM 775 C THR A 56 -7.608 15.560 11.403 1.00 0.00 C ATOM 776 O THR A 56 -6.442 15.769 11.071 1.00 0.00 O ATOM 777 CB THR A 56 -7.555 14.140 13.455 1.00 0.00 C ATOM 778 OG1 THR A 56 -8.227 13.073 12.775 1.00 0.00 O ATOM 779 CG2 THR A 56 -7.851 14.065 14.945 1.00 0.00 C ATOM 0 H THR A 56 -9.999 14.870 12.904 1.00 0.00 H new ATOM 0 HA THR A 56 -7.495 16.296 13.417 1.00 0.00 H new ATOM 0 HB THR A 56 -6.479 14.042 13.310 1.00 0.00 H new ATOM 0 HG1 THR A 56 -8.962 13.438 12.239 1.00 0.00 H new ATOM 0 HG21 THR A 56 -7.529 13.098 15.332 1.00 0.00 H new ATOM 0 HG22 THR A 56 -7.315 14.860 15.463 1.00 0.00 H new ATOM 0 HG23 THR A 56 -8.922 14.183 15.110 1.00 0.00 H new ATOM 787 N GLN A 57 -8.590 15.378 10.526 1.00 0.00 N ATOM 788 CA GLN A 57 -8.346 15.416 9.089 1.00 0.00 C ATOM 789 C GLN A 57 -7.991 16.827 8.633 1.00 0.00 C ATOM 790 O GLN A 57 -8.734 17.775 8.882 1.00 0.00 O ATOM 791 CB GLN A 57 -9.576 14.915 8.329 1.00 0.00 C ATOM 792 CG GLN A 57 -9.757 13.407 8.390 1.00 0.00 C ATOM 793 CD GLN A 57 -11.129 12.965 7.919 1.00 0.00 C ATOM 794 OE1 GLN A 57 -12.123 13.129 8.627 1.00 0.00 O ATOM 795 NE2 GLN A 57 -11.189 12.401 6.719 1.00 0.00 N ATOM 0 H GLN A 57 -9.561 15.203 10.785 1.00 0.00 H new ATOM 0 HA GLN A 57 -7.502 14.762 8.872 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -10.465 15.396 8.736 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -9.498 15.221 7.286 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -8.994 12.928 7.776 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -9.601 13.067 9.414 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -10.339 12.285 6.167 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -12.085 12.083 6.349 1.00 0.00 H new ATOM 804 N ASN A 58 -6.850 16.958 7.964 1.00 0.00 N ATOM 805 CA ASN A 58 -6.396 18.255 7.474 1.00 0.00 C ATOM 806 C ASN A 58 -6.258 18.244 5.955 1.00 0.00 C ATOM 807 O ASN A 58 -6.432 19.270 5.298 1.00 0.00 O ATOM 808 CB ASN A 58 -5.058 18.626 8.117 1.00 0.00 C ATOM 809 CG ASN A 58 -4.883 20.125 8.261 1.00 0.00 C ATOM 810 OD1 ASN A 58 -5.057 20.680 9.346 1.00 0.00 O ATOM 811 ND2 ASN A 58 -4.536 20.789 7.164 1.00 0.00 N ATOM 0 H ASN A 58 -6.223 16.183 7.749 1.00 0.00 H new ATOM 0 HA ASN A 58 -7.142 19.001 7.748 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -4.988 18.159 9.099 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -4.244 18.224 7.514 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -4.403 21.800 7.200 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -4.402 20.288 6.286 1.00 0.00 H new ATOM 818 N GLY A 59 -5.944 17.076 5.403 1.00 0.00 N ATOM 819 CA GLY A 59 -5.788 16.953 3.965 1.00 0.00 C ATOM 820 C GLY A 59 -6.700 15.898 3.371 1.00 0.00 C ATOM 821 O GLY A 59 -7.458 15.246 4.090 1.00 0.00 O ATOM 0 H GLY A 59 -5.795 16.213 5.926 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -5.997 17.915 3.496 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -4.752 16.704 3.735 1.00 0.00 H new ATOM 825 N PHE A 60 -6.629 15.730 2.055 1.00 0.00 N ATOM 826 CA PHE A 60 -7.457 14.749 1.363 1.00 0.00 C ATOM 827 C PHE A 60 -6.824 13.362 1.427 1.00 0.00 C ATOM 828 O PHE A 60 -5.680 13.171 1.014 1.00 0.00 O ATOM 829 CB PHE A 60 -7.664 15.161 -0.095 1.00 0.00 C ATOM 830 CG PHE A 60 -8.631 14.283 -0.836 1.00 0.00 C ATOM 831 CD1 PHE A 60 -9.970 14.253 -0.482 1.00 0.00 C ATOM 832 CD2 PHE A 60 -8.201 13.486 -1.885 1.00 0.00 C ATOM 833 CE1 PHE A 60 -10.863 13.446 -1.162 1.00 0.00 C ATOM 834 CE2 PHE A 60 -9.089 12.678 -2.568 1.00 0.00 C ATOM 835 CZ PHE A 60 -10.422 12.656 -2.205 1.00 0.00 C ATOM 0 H PHE A 60 -6.006 16.261 1.446 1.00 0.00 H new ATOM 0 HA PHE A 60 -8.425 14.711 1.862 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -8.023 16.190 -0.126 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -6.703 15.143 -0.609 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -10.320 14.867 0.335 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -7.160 13.497 -2.172 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -11.905 13.433 -0.878 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -8.742 12.064 -3.385 1.00 0.00 H new ATOM 0 HZ PHE A 60 -11.117 12.022 -2.736 1.00 0.00 H new ATOM 845 N ILE A 61 -7.577 12.398 1.947 1.00 0.00 N ATOM 846 CA ILE A 61 -7.090 11.029 2.064 1.00 0.00 C ATOM 847 C ILE A 61 -6.807 10.427 0.692 1.00 0.00 C ATOM 848 O ILE A 61 -7.707 10.295 -0.138 1.00 0.00 O ATOM 849 CB ILE A 61 -8.100 10.135 2.807 1.00 0.00 C ATOM 850 CG1 ILE A 61 -8.389 10.701 4.199 1.00 0.00 C ATOM 851 CG2 ILE A 61 -7.573 8.711 2.907 1.00 0.00 C ATOM 852 CD1 ILE A 61 -7.162 10.797 5.079 1.00 0.00 C ATOM 0 H ILE A 61 -8.526 12.540 2.294 1.00 0.00 H new ATOM 0 HA ILE A 61 -6.164 11.071 2.637 1.00 0.00 H new ATOM 0 HB ILE A 61 -9.032 10.118 2.242 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -8.830 11.692 4.095 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -9.131 10.072 4.691 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -8.298 8.091 3.435 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -7.414 8.311 1.906 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -6.629 8.710 3.452 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -7.442 11.206 6.050 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -6.732 9.804 5.214 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -6.427 11.450 4.608 1.00 0.00 H new ATOM 864 N THR A 62 -5.551 10.060 0.461 1.00 0.00 N ATOM 865 CA THR A 62 -5.149 9.470 -0.810 1.00 0.00 C ATOM 866 C THR A 62 -5.000 7.958 -0.692 1.00 0.00 C ATOM 867 O THR A 62 -5.474 7.209 -1.546 1.00 0.00 O ATOM 868 CB THR A 62 -3.820 10.068 -1.311 1.00 0.00 C ATOM 869 OG1 THR A 62 -2.814 9.943 -0.299 1.00 0.00 O ATOM 870 CG2 THR A 62 -3.992 11.533 -1.684 1.00 0.00 C ATOM 0 H THR A 62 -4.794 10.161 1.137 1.00 0.00 H new ATOM 0 HA THR A 62 -5.936 9.699 -1.528 1.00 0.00 H new ATOM 0 HB THR A 62 -3.511 9.517 -2.200 1.00 0.00 H new ATOM 0 HG1 THR A 62 -1.972 10.324 -0.626 1.00 0.00 H new ATOM 0 HG21 THR A 62 -3.041 11.933 -2.035 1.00 0.00 H new ATOM 0 HG22 THR A 62 -4.737 11.622 -2.475 1.00 0.00 H new ATOM 0 HG23 THR A 62 -4.322 12.095 -0.810 1.00 0.00 H new ATOM 878 N GLY A 63 -4.339 7.514 0.373 1.00 0.00 N ATOM 879 CA GLY A 63 -4.140 6.092 0.583 1.00 0.00 C ATOM 880 C GLY A 63 -3.811 5.759 2.025 1.00 0.00 C ATOM 881 O GLY A 63 -3.890 6.620 2.901 1.00 0.00 O ATOM 0 H GLY A 63 -3.938 8.114 1.094 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -5.040 5.555 0.286 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -3.333 5.742 -0.061 1.00 0.00 H new ATOM 885 N TYR A 64 -3.443 4.507 2.272 1.00 0.00 N ATOM 886 CA TYR A 64 -3.105 4.062 3.618 1.00 0.00 C ATOM 887 C TYR A 64 -1.878 3.154 3.600 1.00 0.00 C ATOM 888 O TYR A 64 -1.822 2.180 2.849 1.00 0.00 O ATOM 889 CB TYR A 64 -4.289 3.325 4.247 1.00 0.00 C ATOM 890 CG TYR A 64 -5.512 4.193 4.433 1.00 0.00 C ATOM 891 CD1 TYR A 64 -6.188 4.719 3.339 1.00 0.00 C ATOM 892 CD2 TYR A 64 -5.994 4.486 5.703 1.00 0.00 C ATOM 893 CE1 TYR A 64 -7.306 5.513 3.504 1.00 0.00 C ATOM 894 CE2 TYR A 64 -7.112 5.278 5.878 1.00 0.00 C ATOM 895 CZ TYR A 64 -7.765 5.789 4.775 1.00 0.00 C ATOM 896 OH TYR A 64 -8.879 6.579 4.944 1.00 0.00 O ATOM 0 H TYR A 64 -3.371 3.782 1.558 1.00 0.00 H new ATOM 0 HA TYR A 64 -2.874 4.943 4.217 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -4.551 2.473 3.620 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -3.986 2.927 5.215 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -5.833 4.503 2.342 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -5.485 4.087 6.568 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -7.818 5.916 2.642 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -7.473 5.496 6.872 1.00 0.00 H new ATOM 0 HH TYR A 64 -9.508 6.133 5.549 1.00 0.00 H new ATOM 906 N LYS A 65 -0.896 3.482 4.433 1.00 0.00 N ATOM 907 CA LYS A 65 0.330 2.697 4.516 1.00 0.00 C ATOM 908 C LYS A 65 0.106 1.421 5.320 1.00 0.00 C ATOM 909 O LYS A 65 -0.361 1.467 6.459 1.00 0.00 O ATOM 910 CB LYS A 65 1.447 3.526 5.155 1.00 0.00 C ATOM 911 CG LYS A 65 2.827 2.908 5.001 1.00 0.00 C ATOM 912 CD LYS A 65 3.911 3.825 5.541 1.00 0.00 C ATOM 913 CE LYS A 65 4.341 4.852 4.504 1.00 0.00 C ATOM 914 NZ LYS A 65 3.521 6.093 4.581 1.00 0.00 N ATOM 0 H LYS A 65 -0.925 4.286 5.060 1.00 0.00 H new ATOM 0 HA LYS A 65 0.624 2.420 3.504 1.00 0.00 H new ATOM 0 HB2 LYS A 65 1.451 4.520 4.708 1.00 0.00 H new ATOM 0 HB3 LYS A 65 1.232 3.654 6.216 1.00 0.00 H new ATOM 0 HG2 LYS A 65 2.860 1.954 5.527 1.00 0.00 H new ATOM 0 HG3 LYS A 65 3.017 2.698 3.948 1.00 0.00 H new ATOM 0 HD2 LYS A 65 3.546 4.337 6.431 1.00 0.00 H new ATOM 0 HD3 LYS A 65 4.773 3.231 5.846 1.00 0.00 H new ATOM 0 HE2 LYS A 65 5.392 5.101 4.653 1.00 0.00 H new ATOM 0 HE3 LYS A 65 4.254 4.420 3.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 3.076 6.273 3.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 2.783 5.977 5.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 4.131 6.897 4.834 1.00 0.00 H new ATOM 928 N ILE A 66 0.443 0.283 4.722 1.00 0.00 N ATOM 929 CA ILE A 66 0.281 -1.005 5.385 1.00 0.00 C ATOM 930 C ILE A 66 1.622 -1.712 5.549 1.00 0.00 C ATOM 931 O ILE A 66 2.194 -2.212 4.580 1.00 0.00 O ATOM 932 CB ILE A 66 -0.678 -1.923 4.604 1.00 0.00 C ATOM 933 CG1 ILE A 66 -1.960 -1.169 4.244 1.00 0.00 C ATOM 934 CG2 ILE A 66 -1.000 -3.168 5.417 1.00 0.00 C ATOM 935 CD1 ILE A 66 -2.603 -1.648 2.962 1.00 0.00 C ATOM 0 H ILE A 66 0.830 0.227 3.780 1.00 0.00 H new ATOM 0 HA ILE A 66 -0.143 -0.802 6.369 1.00 0.00 H new ATOM 0 HB ILE A 66 -0.189 -2.233 3.680 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -2.675 -1.273 5.060 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -1.734 -0.107 4.152 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -1.679 -3.806 4.851 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -0.080 -3.713 5.628 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -1.472 -2.878 6.355 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -3.506 -1.069 2.770 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -1.906 -1.518 2.134 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -2.861 -2.703 3.056 1.00 0.00 H new ATOM 947 N ARG A 67 2.118 -1.750 6.781 1.00 0.00 N ATOM 948 CA ARG A 67 3.392 -2.397 7.073 1.00 0.00 C ATOM 949 C ARG A 67 3.174 -3.795 7.644 1.00 0.00 C ATOM 950 O ARG A 67 2.430 -3.974 8.609 1.00 0.00 O ATOM 951 CB ARG A 67 4.203 -1.553 8.057 1.00 0.00 C ATOM 952 CG ARG A 67 4.920 -0.380 7.408 1.00 0.00 C ATOM 953 CD ARG A 67 6.315 -0.768 6.944 1.00 0.00 C ATOM 954 NE ARG A 67 7.079 0.387 6.481 1.00 0.00 N ATOM 955 CZ ARG A 67 8.362 0.331 6.141 1.00 0.00 C ATOM 956 NH1 ARG A 67 9.021 -0.817 6.212 1.00 0.00 N ATOM 957 NH2 ARG A 67 8.988 1.426 5.728 1.00 0.00 N ATOM 0 H ARG A 67 1.657 -1.340 7.594 1.00 0.00 H new ATOM 0 HA ARG A 67 3.947 -2.488 6.139 1.00 0.00 H new ATOM 0 HB2 ARG A 67 3.537 -1.176 8.834 1.00 0.00 H new ATOM 0 HB3 ARG A 67 4.938 -2.190 8.549 1.00 0.00 H new ATOM 0 HG2 ARG A 67 4.339 -0.022 6.558 1.00 0.00 H new ATOM 0 HG3 ARG A 67 4.988 0.444 8.118 1.00 0.00 H new ATOM 0 HD2 ARG A 67 6.848 -1.251 7.763 1.00 0.00 H new ATOM 0 HD3 ARG A 67 6.239 -1.499 6.139 1.00 0.00 H new ATOM 0 HE ARG A 67 6.602 1.286 6.415 1.00 0.00 H new ATOM 0 HH11 ARG A 67 8.543 -1.661 6.528 1.00 0.00 H new ATOM 0 HH12 ARG A 67 10.006 -0.857 5.950 1.00 0.00 H new ATOM 0 HH21 ARG A 67 8.484 2.311 5.672 1.00 0.00 H new ATOM 0 HH22 ARG A 67 9.973 1.383 5.467 1.00 0.00 H new ATOM 971 N HIS A 68 3.827 -4.783 7.041 1.00 0.00 N ATOM 972 CA HIS A 68 3.705 -6.166 7.489 1.00 0.00 C ATOM 973 C HIS A 68 5.067 -6.734 7.877 1.00 0.00 C ATOM 974 O HIS A 68 6.103 -6.261 7.408 1.00 0.00 O ATOM 975 CB HIS A 68 3.074 -7.026 6.394 1.00 0.00 C ATOM 976 CG HIS A 68 4.075 -7.654 5.474 1.00 0.00 C ATOM 977 ND1 HIS A 68 5.291 -7.077 5.179 1.00 0.00 N ATOM 978 CD2 HIS A 68 4.035 -8.818 4.784 1.00 0.00 C ATOM 979 CE1 HIS A 68 5.956 -7.857 4.345 1.00 0.00 C ATOM 980 NE2 HIS A 68 5.215 -8.921 4.090 1.00 0.00 N ATOM 0 H HIS A 68 4.446 -4.652 6.241 1.00 0.00 H new ATOM 0 HA HIS A 68 3.061 -6.181 8.368 1.00 0.00 H new ATOM 0 HB2 HIS A 68 2.477 -7.811 6.859 1.00 0.00 H new ATOM 0 HB3 HIS A 68 2.391 -6.411 5.809 1.00 0.00 H new ATOM 0 HD1 HIS A 68 5.626 -6.187 5.547 1.00 0.00 H new ATOM 0 HD2 HIS A 68 3.225 -9.533 4.780 1.00 0.00 H new ATOM 0 HE1 HIS A 68 6.938 -7.659 3.941 1.00 0.00 H new ATOM 989 N ARG A 69 5.057 -7.748 8.735 1.00 0.00 N ATOM 990 CA ARG A 69 6.292 -8.379 9.186 1.00 0.00 C ATOM 991 C ARG A 69 6.039 -9.818 9.624 1.00 0.00 C ATOM 992 O ARG A 69 4.959 -10.149 10.114 1.00 0.00 O ATOM 993 CB ARG A 69 6.903 -7.583 10.341 1.00 0.00 C ATOM 994 CG ARG A 69 6.041 -7.566 11.592 1.00 0.00 C ATOM 995 CD ARG A 69 6.883 -7.398 12.847 1.00 0.00 C ATOM 996 NE ARG A 69 6.091 -7.561 14.063 1.00 0.00 N ATOM 997 CZ ARG A 69 6.602 -7.491 15.288 1.00 0.00 C ATOM 998 NH1 ARG A 69 7.897 -7.263 15.457 1.00 0.00 N ATOM 999 NH2 ARG A 69 5.817 -7.650 16.346 1.00 0.00 N ATOM 0 H ARG A 69 4.208 -8.150 9.132 1.00 0.00 H new ATOM 0 HA ARG A 69 6.992 -8.390 8.350 1.00 0.00 H new ATOM 0 HB2 ARG A 69 7.877 -8.006 10.587 1.00 0.00 H new ATOM 0 HB3 ARG A 69 7.074 -6.557 10.014 1.00 0.00 H new ATOM 0 HG2 ARG A 69 5.318 -6.753 11.526 1.00 0.00 H new ATOM 0 HG3 ARG A 69 5.472 -8.494 11.656 1.00 0.00 H new ATOM 0 HD2 ARG A 69 7.692 -8.128 12.841 1.00 0.00 H new ATOM 0 HD3 ARG A 69 7.344 -6.410 12.845 1.00 0.00 H new ATOM 0 HE ARG A 69 5.091 -7.738 13.967 1.00 0.00 H new ATOM 0 HH11 ARG A 69 8.503 -7.141 14.646 1.00 0.00 H new ATOM 0 HH12 ARG A 69 8.287 -7.210 16.398 1.00 0.00 H new ATOM 0 HH21 ARG A 69 4.820 -7.826 16.220 1.00 0.00 H new ATOM 0 HH22 ARG A 69 6.210 -7.596 17.286 1.00 0.00 H new ATOM 1013 N LYS A 70 7.041 -10.672 9.443 1.00 0.00 N ATOM 1014 CA LYS A 70 6.929 -12.076 9.820 1.00 0.00 C ATOM 1015 C LYS A 70 7.880 -12.409 10.965 1.00 0.00 C ATOM 1016 O LYS A 70 9.047 -12.016 10.953 1.00 0.00 O ATOM 1017 CB LYS A 70 7.228 -12.973 8.617 1.00 0.00 C ATOM 1018 CG LYS A 70 6.501 -14.306 8.656 1.00 0.00 C ATOM 1019 CD LYS A 70 7.274 -15.340 9.458 1.00 0.00 C ATOM 1020 CE LYS A 70 6.466 -16.614 9.650 1.00 0.00 C ATOM 1021 NZ LYS A 70 7.331 -17.770 10.013 1.00 0.00 N ATOM 0 H LYS A 70 7.941 -10.416 9.037 1.00 0.00 H new ATOM 0 HA LYS A 70 5.908 -12.257 10.155 1.00 0.00 H new ATOM 0 HB2 LYS A 70 6.953 -12.445 7.704 1.00 0.00 H new ATOM 0 HB3 LYS A 70 8.302 -13.156 8.569 1.00 0.00 H new ATOM 0 HG2 LYS A 70 5.512 -14.169 9.094 1.00 0.00 H new ATOM 0 HG3 LYS A 70 6.352 -14.670 7.639 1.00 0.00 H new ATOM 0 HD2 LYS A 70 8.208 -15.574 8.948 1.00 0.00 H new ATOM 0 HD3 LYS A 70 7.538 -14.925 10.431 1.00 0.00 H new ATOM 0 HE2 LYS A 70 5.722 -16.458 10.431 1.00 0.00 H new ATOM 0 HE3 LYS A 70 5.923 -16.841 8.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 6.749 -18.518 10.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 7.794 -18.139 9.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 8.055 -17.462 10.693 1.00 0.00 H new ATOM 1035 N THR A 71 7.374 -13.139 11.955 1.00 0.00 N ATOM 1036 CA THR A 71 8.178 -13.526 13.107 1.00 0.00 C ATOM 1037 C THR A 71 9.559 -14.008 12.678 1.00 0.00 C ATOM 1038 O THR A 71 10.568 -13.355 12.946 1.00 0.00 O ATOM 1039 CB THR A 71 7.490 -14.636 13.924 1.00 0.00 C ATOM 1040 OG1 THR A 71 7.467 -15.855 13.173 1.00 0.00 O ATOM 1041 CG2 THR A 71 6.070 -14.236 14.294 1.00 0.00 C ATOM 0 H THR A 71 6.411 -13.474 11.981 1.00 0.00 H new ATOM 0 HA THR A 71 8.284 -12.638 13.730 1.00 0.00 H new ATOM 0 HB THR A 71 8.059 -14.786 14.842 1.00 0.00 H new ATOM 0 HG1 THR A 71 7.030 -16.556 13.700 1.00 0.00 H new ATOM 0 HG21 THR A 71 5.605 -15.036 14.870 1.00 0.00 H new ATOM 0 HG22 THR A 71 6.093 -13.324 14.891 1.00 0.00 H new ATOM 0 HG23 THR A 71 5.493 -14.061 13.386 1.00 0.00 H new ATOM 1049 N THR A 72 9.598 -15.155 12.007 1.00 0.00 N ATOM 1050 CA THR A 72 10.855 -15.725 11.540 1.00 0.00 C ATOM 1051 C THR A 72 11.687 -14.686 10.796 1.00 0.00 C ATOM 1052 O THR A 72 12.837 -14.427 11.152 1.00 0.00 O ATOM 1053 CB THR A 72 10.616 -16.933 10.615 1.00 0.00 C ATOM 1054 OG1 THR A 72 9.901 -17.955 11.319 1.00 0.00 O ATOM 1055 CG2 THR A 72 11.934 -17.491 10.101 1.00 0.00 C ATOM 0 H THR A 72 8.773 -15.707 11.775 1.00 0.00 H new ATOM 0 HA THR A 72 11.399 -16.057 12.424 1.00 0.00 H new ATOM 0 HB THR A 72 10.025 -16.598 9.762 1.00 0.00 H new ATOM 0 HG1 THR A 72 9.751 -18.719 10.724 1.00 0.00 H new ATOM 0 HG21 THR A 72 11.739 -18.343 9.450 1.00 0.00 H new ATOM 0 HG22 THR A 72 12.462 -16.719 9.540 1.00 0.00 H new ATOM 0 HG23 THR A 72 12.547 -17.811 10.944 1.00 0.00 H new ATOM 1063 N ARG A 73 11.098 -14.094 9.762 1.00 0.00 N ATOM 1064 CA ARG A 73 11.786 -13.084 8.968 1.00 0.00 C ATOM 1065 C ARG A 73 11.031 -11.758 9.003 1.00 0.00 C ATOM 1066 O ARG A 73 10.002 -11.600 8.346 1.00 0.00 O ATOM 1067 CB ARG A 73 11.938 -13.558 7.521 1.00 0.00 C ATOM 1068 CG ARG A 73 10.628 -13.991 6.882 1.00 0.00 C ATOM 1069 CD ARG A 73 10.844 -15.109 5.874 1.00 0.00 C ATOM 1070 NE ARG A 73 11.082 -14.594 4.528 1.00 0.00 N ATOM 1071 CZ ARG A 73 10.974 -15.333 3.429 1.00 0.00 C ATOM 1072 NH1 ARG A 73 10.632 -16.611 3.516 1.00 0.00 N ATOM 1073 NH2 ARG A 73 11.208 -14.793 2.240 1.00 0.00 N ATOM 0 H ARG A 73 10.147 -14.296 9.455 1.00 0.00 H new ATOM 0 HA ARG A 73 12.775 -12.931 9.399 1.00 0.00 H new ATOM 0 HB2 ARG A 73 12.374 -12.754 6.928 1.00 0.00 H new ATOM 0 HB3 ARG A 73 12.640 -14.392 7.492 1.00 0.00 H new ATOM 0 HG2 ARG A 73 9.937 -14.326 7.656 1.00 0.00 H new ATOM 0 HG3 ARG A 73 10.164 -13.138 6.387 1.00 0.00 H new ATOM 0 HD2 ARG A 73 11.693 -15.718 6.184 1.00 0.00 H new ATOM 0 HD3 ARG A 73 9.971 -15.761 5.863 1.00 0.00 H new ATOM 0 HE ARG A 73 11.345 -13.614 4.426 1.00 0.00 H new ATOM 0 HH11 ARG A 73 10.451 -17.030 4.428 1.00 0.00 H new ATOM 0 HH12 ARG A 73 10.550 -17.176 2.671 1.00 0.00 H new ATOM 0 HH21 ARG A 73 11.471 -13.810 2.169 1.00 0.00 H new ATOM 0 HH22 ARG A 73 11.125 -15.361 1.397 1.00 0.00 H new ATOM 1087 N ARG A 74 11.550 -10.808 9.775 1.00 0.00 N ATOM 1088 CA ARG A 74 10.924 -9.497 9.898 1.00 0.00 C ATOM 1089 C ARG A 74 10.279 -9.077 8.580 1.00 0.00 C ATOM 1090 O ARG A 74 9.163 -8.560 8.561 1.00 0.00 O ATOM 1091 CB ARG A 74 11.957 -8.454 10.327 1.00 0.00 C ATOM 1092 CG ARG A 74 13.098 -8.283 9.338 1.00 0.00 C ATOM 1093 CD ARG A 74 14.260 -7.519 9.953 1.00 0.00 C ATOM 1094 NE ARG A 74 15.476 -7.633 9.153 1.00 0.00 N ATOM 1095 CZ ARG A 74 16.685 -7.316 9.603 1.00 0.00 C ATOM 1096 NH1 ARG A 74 16.838 -6.868 10.842 1.00 0.00 N ATOM 1097 NH2 ARG A 74 17.744 -7.448 8.815 1.00 0.00 N ATOM 0 H ARG A 74 12.402 -10.922 10.324 1.00 0.00 H new ATOM 0 HA ARG A 74 10.146 -9.563 10.659 1.00 0.00 H new ATOM 0 HB2 ARG A 74 11.458 -7.495 10.462 1.00 0.00 H new ATOM 0 HB3 ARG A 74 12.367 -8.739 11.296 1.00 0.00 H new ATOM 0 HG2 ARG A 74 13.441 -9.262 9.004 1.00 0.00 H new ATOM 0 HG3 ARG A 74 12.739 -7.753 8.456 1.00 0.00 H new ATOM 0 HD2 ARG A 74 13.990 -6.468 10.053 1.00 0.00 H new ATOM 0 HD3 ARG A 74 14.451 -7.897 10.958 1.00 0.00 H new ATOM 0 HE ARG A 74 15.393 -7.975 8.196 1.00 0.00 H new ATOM 0 HH11 ARG A 74 16.026 -6.766 11.451 1.00 0.00 H new ATOM 0 HH12 ARG A 74 17.767 -6.625 11.185 1.00 0.00 H new ATOM 0 HH21 ARG A 74 17.631 -7.793 7.862 1.00 0.00 H new ATOM 0 HH22 ARG A 74 18.672 -7.204 9.162 1.00 0.00 H new ATOM 1111 N GLY A 75 10.990 -9.304 7.480 1.00 0.00 N ATOM 1112 CA GLY A 75 10.471 -8.943 6.174 1.00 0.00 C ATOM 1113 C GLY A 75 9.611 -7.695 6.216 1.00 0.00 C ATOM 1114 O GLY A 75 8.579 -7.623 5.550 1.00 0.00 O ATOM 0 H GLY A 75 11.916 -9.731 7.470 1.00 0.00 H new ATOM 0 HA2 GLY A 75 11.302 -8.784 5.487 1.00 0.00 H new ATOM 0 HA3 GLY A 75 9.884 -9.772 5.778 1.00 0.00 H new ATOM 1118 N GLU A 76 10.037 -6.711 7.002 1.00 0.00 N ATOM 1119 CA GLU A 76 9.296 -5.462 7.130 1.00 0.00 C ATOM 1120 C GLU A 76 9.213 -4.738 5.789 1.00 0.00 C ATOM 1121 O GLU A 76 10.234 -4.393 5.195 1.00 0.00 O ATOM 1122 CB GLU A 76 9.956 -4.556 8.172 1.00 0.00 C ATOM 1123 CG GLU A 76 8.996 -3.572 8.819 1.00 0.00 C ATOM 1124 CD GLU A 76 9.701 -2.575 9.718 1.00 0.00 C ATOM 1125 OE1 GLU A 76 10.032 -2.941 10.865 1.00 0.00 O ATOM 1126 OE2 GLU A 76 9.921 -1.428 9.274 1.00 0.00 O ATOM 0 H GLU A 76 10.890 -6.755 7.559 1.00 0.00 H new ATOM 0 HA GLU A 76 8.284 -5.702 7.456 1.00 0.00 H new ATOM 0 HB2 GLU A 76 10.405 -5.176 8.948 1.00 0.00 H new ATOM 0 HB3 GLU A 76 10.766 -4.002 7.698 1.00 0.00 H new ATOM 0 HG2 GLU A 76 8.454 -3.034 8.041 1.00 0.00 H new ATOM 0 HG3 GLU A 76 8.256 -4.121 9.402 1.00 0.00 H new ATOM 1133 N MET A 77 7.991 -4.513 5.319 1.00 0.00 N ATOM 1134 CA MET A 77 7.775 -3.830 4.049 1.00 0.00 C ATOM 1135 C MET A 77 6.449 -3.077 4.055 1.00 0.00 C ATOM 1136 O MET A 77 5.636 -3.241 4.965 1.00 0.00 O ATOM 1137 CB MET A 77 7.798 -4.835 2.895 1.00 0.00 C ATOM 1138 CG MET A 77 6.430 -5.401 2.554 1.00 0.00 C ATOM 1139 SD MET A 77 6.524 -6.852 1.487 1.00 0.00 S ATOM 1140 CE MET A 77 5.580 -6.293 0.072 1.00 0.00 C ATOM 0 H MET A 77 7.135 -4.793 5.798 1.00 0.00 H new ATOM 0 HA MET A 77 8.581 -3.110 3.911 1.00 0.00 H new ATOM 0 HB2 MET A 77 8.212 -4.351 2.011 1.00 0.00 H new ATOM 0 HB3 MET A 77 8.468 -5.656 3.152 1.00 0.00 H new ATOM 0 HG2 MET A 77 5.911 -5.665 3.475 1.00 0.00 H new ATOM 0 HG3 MET A 77 5.835 -4.631 2.062 1.00 0.00 H new ATOM 0 HE1 MET A 77 5.547 -7.083 -0.678 1.00 0.00 H new ATOM 0 HE2 MET A 77 4.565 -6.048 0.386 1.00 0.00 H new ATOM 0 HE3 MET A 77 6.052 -5.408 -0.354 1.00 0.00 H new ATOM 1150 N GLU A 78 6.237 -2.251 3.035 1.00 0.00 N ATOM 1151 CA GLU A 78 5.009 -1.472 2.926 1.00 0.00 C ATOM 1152 C GLU A 78 4.358 -1.672 1.561 1.00 0.00 C ATOM 1153 O GLU A 78 5.034 -1.963 0.573 1.00 0.00 O ATOM 1154 CB GLU A 78 5.299 0.013 3.153 1.00 0.00 C ATOM 1155 CG GLU A 78 6.281 0.601 2.152 1.00 0.00 C ATOM 1156 CD GLU A 78 5.668 0.795 0.779 1.00 0.00 C ATOM 1157 OE1 GLU A 78 4.491 1.205 0.708 1.00 0.00 O ATOM 1158 OE2 GLU A 78 6.365 0.535 -0.224 1.00 0.00 O ATOM 0 H GLU A 78 6.899 -2.104 2.273 1.00 0.00 H new ATOM 0 HA GLU A 78 4.318 -1.821 3.693 1.00 0.00 H new ATOM 0 HB2 GLU A 78 4.363 0.569 3.101 1.00 0.00 H new ATOM 0 HB3 GLU A 78 5.695 0.148 4.160 1.00 0.00 H new ATOM 0 HG2 GLU A 78 6.642 1.560 2.523 1.00 0.00 H new ATOM 0 HG3 GLU A 78 7.147 -0.056 2.070 1.00 0.00 H new ATOM 1165 N THR A 79 3.039 -1.514 1.512 1.00 0.00 N ATOM 1166 CA THR A 79 2.295 -1.678 0.269 1.00 0.00 C ATOM 1167 C THR A 79 1.037 -0.816 0.263 1.00 0.00 C ATOM 1168 O THR A 79 0.117 -1.038 1.051 1.00 0.00 O ATOM 1169 CB THR A 79 1.896 -3.149 0.044 1.00 0.00 C ATOM 1170 OG1 THR A 79 3.066 -3.946 -0.167 1.00 0.00 O ATOM 1171 CG2 THR A 79 0.965 -3.279 -1.152 1.00 0.00 C ATOM 0 H THR A 79 2.464 -1.273 2.319 1.00 0.00 H new ATOM 0 HA THR A 79 2.954 -1.360 -0.539 1.00 0.00 H new ATOM 0 HB THR A 79 1.372 -3.502 0.932 1.00 0.00 H new ATOM 0 HG1 THR A 79 2.805 -4.880 -0.308 1.00 0.00 H new ATOM 0 HG21 THR A 79 0.696 -4.326 -1.292 1.00 0.00 H new ATOM 0 HG22 THR A 79 0.063 -2.693 -0.976 1.00 0.00 H new ATOM 0 HG23 THR A 79 1.468 -2.911 -2.046 1.00 0.00 H new ATOM 1179 N LEU A 80 1.004 0.167 -0.629 1.00 0.00 N ATOM 1180 CA LEU A 80 -0.142 1.063 -0.739 1.00 0.00 C ATOM 1181 C LEU A 80 -1.162 0.523 -1.736 1.00 0.00 C ATOM 1182 O LEU A 80 -0.797 -0.003 -2.787 1.00 0.00 O ATOM 1183 CB LEU A 80 0.316 2.459 -1.165 1.00 0.00 C ATOM 1184 CG LEU A 80 0.640 3.434 -0.032 1.00 0.00 C ATOM 1185 CD1 LEU A 80 1.122 4.763 -0.594 1.00 0.00 C ATOM 1186 CD2 LEU A 80 -0.575 3.638 0.860 1.00 0.00 C ATOM 0 H LEU A 80 1.758 0.364 -1.287 1.00 0.00 H new ATOM 0 HA LEU A 80 -0.617 1.127 0.240 1.00 0.00 H new ATOM 0 HB2 LEU A 80 1.202 2.354 -1.791 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -0.463 2.901 -1.786 1.00 0.00 H new ATOM 0 HG LEU A 80 1.440 3.007 0.572 1.00 0.00 H new ATOM 0 HD11 LEU A 80 1.348 5.444 0.226 1.00 0.00 H new ATOM 0 HD12 LEU A 80 2.020 4.602 -1.190 1.00 0.00 H new ATOM 0 HD13 LEU A 80 0.343 5.196 -1.222 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -0.326 4.335 1.660 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -1.396 4.043 0.269 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -0.875 2.683 1.291 1.00 0.00 H new ATOM 1198 N GLU A 81 -2.441 0.660 -1.400 1.00 0.00 N ATOM 1199 CA GLU A 81 -3.513 0.187 -2.267 1.00 0.00 C ATOM 1200 C GLU A 81 -4.612 1.238 -2.396 1.00 0.00 C ATOM 1201 O GLU A 81 -5.451 1.406 -1.512 1.00 0.00 O ATOM 1202 CB GLU A 81 -4.100 -1.117 -1.725 1.00 0.00 C ATOM 1203 CG GLU A 81 -5.440 -1.484 -2.340 1.00 0.00 C ATOM 1204 CD GLU A 81 -5.665 -2.983 -2.397 1.00 0.00 C ATOM 1205 OE1 GLU A 81 -5.578 -3.637 -1.337 1.00 0.00 O ATOM 1206 OE2 GLU A 81 -5.929 -3.501 -3.502 1.00 0.00 O ATOM 0 H GLU A 81 -2.759 1.095 -0.534 1.00 0.00 H new ATOM 0 HA GLU A 81 -3.092 0.004 -3.255 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -3.393 -1.927 -1.906 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -4.217 -1.031 -0.645 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -6.240 -1.022 -1.761 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -5.498 -1.073 -3.348 1.00 0.00 H new ATOM 1213 N PRO A 82 -4.607 1.963 -3.525 1.00 0.00 N ATOM 1214 CA PRO A 82 -5.596 3.010 -3.798 1.00 0.00 C ATOM 1215 C PRO A 82 -6.988 2.440 -4.053 1.00 0.00 C ATOM 1216 O PRO A 82 -7.989 3.005 -3.616 1.00 0.00 O ATOM 1217 CB PRO A 82 -5.056 3.688 -5.059 1.00 0.00 C ATOM 1218 CG PRO A 82 -4.231 2.643 -5.728 1.00 0.00 C ATOM 1219 CD PRO A 82 -3.636 1.816 -4.622 1.00 0.00 C ATOM 0 HA PRO A 82 -5.717 3.687 -2.952 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -5.867 4.026 -5.705 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -4.459 4.566 -4.812 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -4.841 2.029 -6.390 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -3.451 3.094 -6.341 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -3.519 0.774 -4.918 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -2.649 2.179 -4.336 1.00 0.00 H new ATOM 1227 N ASN A 83 -7.041 1.318 -4.763 1.00 0.00 N ATOM 1228 CA ASN A 83 -8.311 0.672 -5.077 1.00 0.00 C ATOM 1229 C ASN A 83 -9.307 0.847 -3.934 1.00 0.00 C ATOM 1230 O ASN A 83 -10.286 1.581 -4.058 1.00 0.00 O ATOM 1231 CB ASN A 83 -8.094 -0.817 -5.356 1.00 0.00 C ATOM 1232 CG ASN A 83 -6.915 -1.066 -6.277 1.00 0.00 C ATOM 1233 OD1 ASN A 83 -5.963 -1.756 -5.910 1.00 0.00 O ATOM 1234 ND2 ASN A 83 -6.973 -0.505 -7.478 1.00 0.00 N ATOM 0 H ASN A 83 -6.220 0.837 -5.132 1.00 0.00 H new ATOM 0 HA ASN A 83 -8.721 1.146 -5.969 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -7.933 -1.341 -4.414 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -8.996 -1.235 -5.803 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -6.209 -0.638 -8.140 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -7.782 0.059 -7.739 1.00 0.00 H new ATOM 1241 N ASN A 84 -9.049 0.166 -2.822 1.00 0.00 N ATOM 1242 CA ASN A 84 -9.923 0.245 -1.657 1.00 0.00 C ATOM 1243 C ASN A 84 -9.110 0.440 -0.381 1.00 0.00 C ATOM 1244 O ASN A 84 -7.879 0.449 -0.410 1.00 0.00 O ATOM 1245 CB ASN A 84 -10.774 -1.021 -1.545 1.00 0.00 C ATOM 1246 CG ASN A 84 -11.427 -1.397 -2.861 1.00 0.00 C ATOM 1247 OD1 ASN A 84 -10.935 -2.263 -3.586 1.00 0.00 O ATOM 1248 ND2 ASN A 84 -12.540 -0.746 -3.177 1.00 0.00 N ATOM 0 H ASN A 84 -8.242 -0.447 -2.703 1.00 0.00 H new ATOM 0 HA ASN A 84 -10.580 1.105 -1.784 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -10.149 -1.846 -1.204 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -11.545 -0.871 -0.789 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -13.023 -0.956 -4.050 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -12.912 -0.036 -2.546 1.00 0.00 H new ATOM 1255 N LEU A 85 -9.807 0.595 0.739 1.00 0.00 N ATOM 1256 CA LEU A 85 -9.152 0.789 2.028 1.00 0.00 C ATOM 1257 C LEU A 85 -8.858 -0.551 2.696 1.00 0.00 C ATOM 1258 O LEU A 85 -8.853 -0.655 3.923 1.00 0.00 O ATOM 1259 CB LEU A 85 -10.026 1.647 2.944 1.00 0.00 C ATOM 1260 CG LEU A 85 -10.522 2.968 2.353 1.00 0.00 C ATOM 1261 CD1 LEU A 85 -11.863 3.353 2.958 1.00 0.00 C ATOM 1262 CD2 LEU A 85 -9.497 4.070 2.577 1.00 0.00 C ATOM 0 H LEU A 85 -10.826 0.590 0.781 1.00 0.00 H new ATOM 0 HA LEU A 85 -8.207 1.303 1.853 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -10.893 1.057 3.243 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -9.462 1.866 3.850 1.00 0.00 H new ATOM 0 HG LEU A 85 -10.656 2.837 1.279 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -12.200 4.295 2.526 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -12.595 2.574 2.746 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -11.756 3.466 4.037 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -9.866 5.003 2.150 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -9.331 4.201 3.646 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -8.558 3.797 2.095 1.00 0.00 H new ATOM 1274 N TRP A 86 -8.611 -1.570 1.882 1.00 0.00 N ATOM 1275 CA TRP A 86 -8.313 -2.903 2.395 1.00 0.00 C ATOM 1276 C TRP A 86 -7.367 -3.647 1.459 1.00 0.00 C ATOM 1277 O TRP A 86 -7.366 -3.417 0.250 1.00 0.00 O ATOM 1278 CB TRP A 86 -9.604 -3.702 2.577 1.00 0.00 C ATOM 1279 CG TRP A 86 -10.431 -3.788 1.329 1.00 0.00 C ATOM 1280 CD1 TRP A 86 -11.430 -2.938 0.948 1.00 0.00 C ATOM 1281 CD2 TRP A 86 -10.330 -4.779 0.301 1.00 0.00 C ATOM 1282 NE1 TRP A 86 -11.956 -3.342 -0.256 1.00 0.00 N ATOM 1283 CE2 TRP A 86 -11.298 -4.468 -0.674 1.00 0.00 C ATOM 1284 CE3 TRP A 86 -9.515 -5.897 0.108 1.00 0.00 C ATOM 1285 CZ2 TRP A 86 -11.471 -5.236 -1.822 1.00 0.00 C ATOM 1286 CZ3 TRP A 86 -9.688 -6.659 -1.032 1.00 0.00 C ATOM 1287 CH2 TRP A 86 -10.660 -6.326 -1.985 1.00 0.00 C ATOM 0 H TRP A 86 -8.611 -1.500 0.864 1.00 0.00 H new ATOM 0 HA TRP A 86 -7.824 -2.792 3.363 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -9.355 -4.710 2.909 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -10.198 -3.243 3.367 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -11.758 -2.076 1.510 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -12.714 -2.878 -0.757 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -8.763 -6.161 0.837 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -12.219 -4.981 -2.558 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -9.064 -7.526 -1.191 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -10.771 -6.942 -2.865 1.00 0.00 H new ATOM 1298 N TYR A 87 -6.564 -4.541 2.026 1.00 0.00 N ATOM 1299 CA TYR A 87 -5.612 -5.318 1.241 1.00 0.00 C ATOM 1300 C TYR A 87 -5.624 -6.784 1.665 1.00 0.00 C ATOM 1301 O TYR A 87 -5.191 -7.128 2.766 1.00 0.00 O ATOM 1302 CB TYR A 87 -4.203 -4.743 1.395 1.00 0.00 C ATOM 1303 CG TYR A 87 -3.197 -5.338 0.435 1.00 0.00 C ATOM 1304 CD1 TYR A 87 -2.833 -6.677 0.522 1.00 0.00 C ATOM 1305 CD2 TYR A 87 -2.611 -4.563 -0.557 1.00 0.00 C ATOM 1306 CE1 TYR A 87 -1.915 -7.225 -0.353 1.00 0.00 C ATOM 1307 CE2 TYR A 87 -1.693 -5.103 -1.437 1.00 0.00 C ATOM 1308 CZ TYR A 87 -1.348 -6.434 -1.330 1.00 0.00 C ATOM 1309 OH TYR A 87 -0.432 -6.975 -2.203 1.00 0.00 O ATOM 0 H TYR A 87 -6.553 -4.745 3.025 1.00 0.00 H new ATOM 0 HA TYR A 87 -5.909 -5.259 0.194 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -4.242 -3.664 1.245 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -3.861 -4.911 2.416 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -3.275 -7.299 1.286 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -2.877 -3.520 -0.642 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -1.643 -8.267 -0.272 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -1.248 -4.487 -2.204 1.00 0.00 H new ATOM 0 HH TYR A 87 -0.130 -6.285 -2.830 1.00 0.00 H new ATOM 1319 N LEU A 88 -6.123 -7.643 0.784 1.00 0.00 N ATOM 1320 CA LEU A 88 -6.192 -9.073 1.065 1.00 0.00 C ATOM 1321 C LEU A 88 -4.866 -9.755 0.746 1.00 0.00 C ATOM 1322 O LEU A 88 -4.362 -9.665 -0.374 1.00 0.00 O ATOM 1323 CB LEU A 88 -7.318 -9.718 0.254 1.00 0.00 C ATOM 1324 CG LEU A 88 -7.810 -11.078 0.752 1.00 0.00 C ATOM 1325 CD1 LEU A 88 -8.936 -10.902 1.759 1.00 0.00 C ATOM 1326 CD2 LEU A 88 -8.265 -11.941 -0.415 1.00 0.00 C ATOM 0 H LEU A 88 -6.486 -7.375 -0.131 1.00 0.00 H new ATOM 0 HA LEU A 88 -6.398 -9.200 2.128 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -8.165 -9.032 0.236 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -6.978 -9.832 -0.775 1.00 0.00 H new ATOM 0 HG LEU A 88 -6.982 -11.583 1.249 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -9.273 -11.880 2.102 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -8.576 -10.323 2.610 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -9.767 -10.377 1.288 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -8.612 -12.905 -0.042 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -9.079 -11.442 -0.941 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -7.431 -12.096 -1.100 1.00 0.00 H new ATOM 1338 N PHE A 89 -4.305 -10.440 1.738 1.00 0.00 N ATOM 1339 CA PHE A 89 -3.037 -11.139 1.563 1.00 0.00 C ATOM 1340 C PHE A 89 -3.261 -12.641 1.413 1.00 0.00 C ATOM 1341 O PHE A 89 -4.242 -13.189 1.917 1.00 0.00 O ATOM 1342 CB PHE A 89 -2.112 -10.866 2.751 1.00 0.00 C ATOM 1343 CG PHE A 89 -1.494 -9.497 2.727 1.00 0.00 C ATOM 1344 CD1 PHE A 89 -0.318 -9.266 2.032 1.00 0.00 C ATOM 1345 CD2 PHE A 89 -2.089 -8.442 3.400 1.00 0.00 C ATOM 1346 CE1 PHE A 89 0.254 -8.008 2.008 1.00 0.00 C ATOM 1347 CE2 PHE A 89 -1.522 -7.182 3.379 1.00 0.00 C ATOM 1348 CZ PHE A 89 -0.348 -6.965 2.683 1.00 0.00 C ATOM 0 H PHE A 89 -4.709 -10.526 2.671 1.00 0.00 H new ATOM 0 HA PHE A 89 -2.567 -10.766 0.653 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -2.677 -10.985 3.676 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.319 -11.614 2.763 1.00 0.00 H new ATOM 0 HD1 PHE A 89 0.157 -10.079 1.503 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -3.006 -8.606 3.947 1.00 0.00 H new ATOM 0 HE1 PHE A 89 1.171 -7.841 1.462 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -1.996 -6.367 3.906 1.00 0.00 H new ATOM 0 HZ PHE A 89 0.098 -5.981 2.667 1.00 0.00 H new ATOM 1358 N THR A 90 -2.343 -13.303 0.715 1.00 0.00 N ATOM 1359 CA THR A 90 -2.439 -14.740 0.496 1.00 0.00 C ATOM 1360 C THR A 90 -1.057 -15.376 0.403 1.00 0.00 C ATOM 1361 O THR A 90 -0.071 -14.701 0.111 1.00 0.00 O ATOM 1362 CB THR A 90 -3.227 -15.062 -0.788 1.00 0.00 C ATOM 1363 OG1 THR A 90 -2.615 -14.417 -1.912 1.00 0.00 O ATOM 1364 CG2 THR A 90 -4.674 -14.609 -0.663 1.00 0.00 C ATOM 0 H THR A 90 -1.524 -12.866 0.292 1.00 0.00 H new ATOM 0 HA THR A 90 -2.970 -15.155 1.353 1.00 0.00 H new ATOM 0 HB THR A 90 -3.213 -16.142 -0.936 1.00 0.00 H new ATOM 0 HG1 THR A 90 -3.120 -14.627 -2.725 1.00 0.00 H new ATOM 0 HG21 THR A 90 -5.210 -14.847 -1.582 1.00 0.00 H new ATOM 0 HG22 THR A 90 -5.145 -15.122 0.175 1.00 0.00 H new ATOM 0 HG23 THR A 90 -4.705 -13.533 -0.493 1.00 0.00 H new ATOM 1372 N GLY A 91 -0.992 -16.681 0.653 1.00 0.00 N ATOM 1373 CA GLY A 91 0.275 -17.386 0.592 1.00 0.00 C ATOM 1374 C GLY A 91 1.043 -17.311 1.896 1.00 0.00 C ATOM 1375 O GLY A 91 2.223 -16.956 1.911 1.00 0.00 O ATOM 0 H GLY A 91 -1.794 -17.262 0.897 1.00 0.00 H new ATOM 0 HA2 GLY A 91 0.094 -18.431 0.340 1.00 0.00 H new ATOM 0 HA3 GLY A 91 0.883 -16.966 -0.209 1.00 0.00 H new ATOM 1379 N LEU A 92 0.375 -17.646 2.995 1.00 0.00 N ATOM 1380 CA LEU A 92 1.003 -17.614 4.311 1.00 0.00 C ATOM 1381 C LEU A 92 1.114 -19.018 4.896 1.00 0.00 C ATOM 1382 O LEU A 92 0.314 -19.898 4.578 1.00 0.00 O ATOM 1383 CB LEU A 92 0.202 -16.717 5.258 1.00 0.00 C ATOM 1384 CG LEU A 92 -0.205 -15.351 4.704 1.00 0.00 C ATOM 1385 CD1 LEU A 92 -1.310 -14.740 5.551 1.00 0.00 C ATOM 1386 CD2 LEU A 92 0.998 -14.421 4.640 1.00 0.00 C ATOM 0 H LEU A 92 -0.601 -17.943 3.000 1.00 0.00 H new ATOM 0 HA LEU A 92 2.008 -17.207 4.197 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -0.701 -17.250 5.554 1.00 0.00 H new ATOM 0 HB3 LEU A 92 0.790 -16.560 6.162 1.00 0.00 H new ATOM 0 HG LEU A 92 -0.586 -15.489 3.692 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -1.587 -13.768 5.142 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -2.179 -15.398 5.544 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -0.957 -14.615 6.575 1.00 0.00 H new ATOM 0 HD21 LEU A 92 0.689 -13.454 4.243 1.00 0.00 H new ATOM 0 HD22 LEU A 92 1.409 -14.288 5.641 1.00 0.00 H new ATOM 0 HD23 LEU A 92 1.758 -14.854 3.990 1.00 0.00 H new ATOM 1398 N GLU A 93 2.110 -19.220 5.753 1.00 0.00 N ATOM 1399 CA GLU A 93 2.323 -20.518 6.383 1.00 0.00 C ATOM 1400 C GLU A 93 1.324 -20.745 7.514 1.00 0.00 C ATOM 1401 O GLU A 93 1.204 -19.926 8.426 1.00 0.00 O ATOM 1402 CB GLU A 93 3.752 -20.619 6.922 1.00 0.00 C ATOM 1403 CG GLU A 93 4.791 -20.886 5.845 1.00 0.00 C ATOM 1404 CD GLU A 93 5.131 -19.645 5.042 1.00 0.00 C ATOM 1405 OE1 GLU A 93 5.169 -18.547 5.634 1.00 0.00 O ATOM 1406 OE2 GLU A 93 5.359 -19.774 3.821 1.00 0.00 O ATOM 0 H GLU A 93 2.781 -18.502 6.027 1.00 0.00 H new ATOM 0 HA GLU A 93 2.171 -21.289 5.628 1.00 0.00 H new ATOM 0 HB2 GLU A 93 4.004 -19.691 7.436 1.00 0.00 H new ATOM 0 HB3 GLU A 93 3.796 -21.417 7.664 1.00 0.00 H new ATOM 0 HG2 GLU A 93 5.698 -21.274 6.309 1.00 0.00 H new ATOM 0 HG3 GLU A 93 4.421 -21.660 5.172 1.00 0.00 H new ATOM 1413 N LYS A 94 0.609 -21.862 7.447 1.00 0.00 N ATOM 1414 CA LYS A 94 -0.380 -22.200 8.465 1.00 0.00 C ATOM 1415 C LYS A 94 0.287 -22.428 9.817 1.00 0.00 C ATOM 1416 O LYS A 94 1.294 -23.129 9.913 1.00 0.00 O ATOM 1417 CB LYS A 94 -1.161 -23.449 8.051 1.00 0.00 C ATOM 1418 CG LYS A 94 -0.284 -24.670 7.833 1.00 0.00 C ATOM 1419 CD LYS A 94 -0.982 -25.712 6.975 1.00 0.00 C ATOM 1420 CE LYS A 94 -0.107 -26.939 6.766 1.00 0.00 C ATOM 1421 NZ LYS A 94 -0.447 -27.653 5.504 1.00 0.00 N ATOM 0 H LYS A 94 0.695 -22.549 6.698 1.00 0.00 H new ATOM 0 HA LYS A 94 -1.071 -21.362 8.558 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -1.901 -23.676 8.819 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -1.709 -23.237 7.133 1.00 0.00 H new ATOM 0 HG2 LYS A 94 0.648 -24.369 7.355 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -0.021 -25.107 8.796 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -1.918 -26.008 7.449 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -1.238 -25.277 6.009 1.00 0.00 H new ATOM 0 HE2 LYS A 94 0.941 -26.639 6.743 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -0.225 -27.618 7.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 0.171 -28.483 5.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -1.439 -27.962 5.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -0.310 -27.013 4.696 1.00 0.00 H new ATOM 1435 N GLY A 95 -0.282 -21.834 10.861 1.00 0.00 N ATOM 1436 CA GLY A 95 0.270 -21.986 12.194 1.00 0.00 C ATOM 1437 C GLY A 95 1.452 -21.069 12.440 1.00 0.00 C ATOM 1438 O GLY A 95 2.492 -21.505 12.935 1.00 0.00 O ATOM 0 H GLY A 95 -1.116 -21.250 10.807 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -0.506 -21.779 12.931 1.00 0.00 H new ATOM 0 HA3 GLY A 95 0.580 -23.021 12.340 1.00 0.00 H new ATOM 1442 N SER A 96 1.294 -19.796 12.093 1.00 0.00 N ATOM 1443 CA SER A 96 2.359 -18.816 12.274 1.00 0.00 C ATOM 1444 C SER A 96 1.792 -17.476 12.730 1.00 0.00 C ATOM 1445 O SER A 96 0.627 -17.166 12.481 1.00 0.00 O ATOM 1446 CB SER A 96 3.141 -18.635 10.971 1.00 0.00 C ATOM 1447 OG SER A 96 4.110 -19.657 10.813 1.00 0.00 O ATOM 0 H SER A 96 0.439 -19.419 11.685 1.00 0.00 H new ATOM 0 HA SER A 96 3.033 -19.187 13.046 1.00 0.00 H new ATOM 0 HB2 SER A 96 2.453 -18.647 10.125 1.00 0.00 H new ATOM 0 HB3 SER A 96 3.631 -17.661 10.969 1.00 0.00 H new ATOM 0 HG SER A 96 3.885 -20.414 11.393 1.00 0.00 H new ATOM 1453 N GLN A 97 2.624 -16.685 13.400 1.00 0.00 N ATOM 1454 CA GLN A 97 2.206 -15.378 13.892 1.00 0.00 C ATOM 1455 C GLN A 97 2.532 -14.285 12.880 1.00 0.00 C ATOM 1456 O GLN A 97 3.591 -14.303 12.251 1.00 0.00 O ATOM 1457 CB GLN A 97 2.885 -15.071 15.228 1.00 0.00 C ATOM 1458 CG GLN A 97 2.054 -14.189 16.145 1.00 0.00 C ATOM 1459 CD GLN A 97 2.421 -14.356 17.606 1.00 0.00 C ATOM 1460 OE1 GLN A 97 3.469 -13.887 18.052 1.00 0.00 O ATOM 1461 NE2 GLN A 97 1.559 -15.026 18.361 1.00 0.00 N ATOM 0 H GLN A 97 3.591 -16.927 13.614 1.00 0.00 H new ATOM 0 HA GLN A 97 1.126 -15.402 14.038 1.00 0.00 H new ATOM 0 HB2 GLN A 97 3.103 -16.009 15.739 1.00 0.00 H new ATOM 0 HB3 GLN A 97 3.841 -14.583 15.037 1.00 0.00 H new ATOM 0 HG2 GLN A 97 2.187 -13.146 15.858 1.00 0.00 H new ATOM 0 HG3 GLN A 97 0.998 -14.424 16.010 1.00 0.00 H new ATOM 0 HE21 GLN A 97 0.703 -15.398 17.950 1.00 0.00 H new ATOM 0 HE22 GLN A 97 1.753 -15.169 19.352 1.00 0.00 H new ATOM 1470 N TYR A 98 1.616 -13.335 12.726 1.00 0.00 N ATOM 1471 CA TYR A 98 1.805 -12.236 11.788 1.00 0.00 C ATOM 1472 C TYR A 98 1.327 -10.918 12.389 1.00 0.00 C ATOM 1473 O TYR A 98 0.441 -10.897 13.244 1.00 0.00 O ATOM 1474 CB TYR A 98 1.056 -12.516 10.484 1.00 0.00 C ATOM 1475 CG TYR A 98 1.473 -13.803 9.810 1.00 0.00 C ATOM 1476 CD1 TYR A 98 2.694 -13.903 9.155 1.00 0.00 C ATOM 1477 CD2 TYR A 98 0.646 -14.920 9.830 1.00 0.00 C ATOM 1478 CE1 TYR A 98 3.079 -15.077 8.537 1.00 0.00 C ATOM 1479 CE2 TYR A 98 1.024 -16.099 9.216 1.00 0.00 C ATOM 1480 CZ TYR A 98 2.241 -16.172 8.571 1.00 0.00 C ATOM 1481 OH TYR A 98 2.621 -17.344 7.958 1.00 0.00 O ATOM 0 H TYR A 98 0.735 -13.304 13.239 1.00 0.00 H new ATOM 0 HA TYR A 98 2.871 -12.152 11.576 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -0.014 -12.554 10.690 1.00 0.00 H new ATOM 0 HB3 TYR A 98 1.219 -11.686 9.796 1.00 0.00 H new ATOM 0 HD1 TYR A 98 3.354 -13.048 9.128 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -0.308 -14.866 10.334 1.00 0.00 H new ATOM 0 HE1 TYR A 98 4.031 -15.137 8.030 1.00 0.00 H new ATOM 0 HE2 TYR A 98 0.370 -16.958 9.241 1.00 0.00 H new ATOM 0 HH TYR A 98 1.956 -18.040 8.143 1.00 0.00 H new ATOM 1491 N SER A 99 1.921 -9.818 11.936 1.00 0.00 N ATOM 1492 CA SER A 99 1.560 -8.495 12.431 1.00 0.00 C ATOM 1493 C SER A 99 1.159 -7.576 11.281 1.00 0.00 C ATOM 1494 O SER A 99 1.698 -7.671 10.178 1.00 0.00 O ATOM 1495 CB SER A 99 2.727 -7.881 13.207 1.00 0.00 C ATOM 1496 OG SER A 99 2.731 -8.320 14.554 1.00 0.00 O ATOM 0 H SER A 99 2.654 -9.817 11.227 1.00 0.00 H new ATOM 0 HA SER A 99 0.707 -8.605 13.100 1.00 0.00 H new ATOM 0 HB2 SER A 99 3.668 -8.153 12.730 1.00 0.00 H new ATOM 0 HB3 SER A 99 2.657 -6.794 13.176 1.00 0.00 H new ATOM 0 HG SER A 99 3.120 -7.624 15.124 1.00 0.00 H new ATOM 1502 N PHE A 100 0.208 -6.686 11.547 1.00 0.00 N ATOM 1503 CA PHE A 100 -0.267 -5.750 10.535 1.00 0.00 C ATOM 1504 C PHE A 100 -0.642 -4.412 11.166 1.00 0.00 C ATOM 1505 O PHE A 100 -1.002 -4.347 12.341 1.00 0.00 O ATOM 1506 CB PHE A 100 -1.473 -6.333 9.796 1.00 0.00 C ATOM 1507 CG PHE A 100 -1.147 -7.558 8.990 1.00 0.00 C ATOM 1508 CD1 PHE A 100 -1.220 -8.818 9.559 1.00 0.00 C ATOM 1509 CD2 PHE A 100 -0.765 -7.448 7.662 1.00 0.00 C ATOM 1510 CE1 PHE A 100 -0.921 -9.947 8.820 1.00 0.00 C ATOM 1511 CE2 PHE A 100 -0.465 -8.573 6.918 1.00 0.00 C ATOM 1512 CZ PHE A 100 -0.542 -9.824 7.497 1.00 0.00 C ATOM 0 H PHE A 100 -0.248 -6.594 12.454 1.00 0.00 H new ATOM 0 HA PHE A 100 0.541 -5.583 9.823 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -2.248 -6.580 10.521 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -1.886 -5.572 9.134 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -1.514 -8.920 10.593 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -0.701 -6.472 7.204 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -0.984 -10.924 9.276 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -0.170 -8.474 5.884 1.00 0.00 H new ATOM 0 HZ PHE A 100 -0.307 -10.704 6.917 1.00 0.00 H new ATOM 1522 N GLN A 101 -0.553 -3.346 10.376 1.00 0.00 N ATOM 1523 CA GLN A 101 -0.881 -2.010 10.857 1.00 0.00 C ATOM 1524 C GLN A 101 -1.485 -1.163 9.741 1.00 0.00 C ATOM 1525 O GLN A 101 -1.424 -1.529 8.568 1.00 0.00 O ATOM 1526 CB GLN A 101 0.368 -1.324 11.414 1.00 0.00 C ATOM 1527 CG GLN A 101 1.343 -0.870 10.340 1.00 0.00 C ATOM 1528 CD GLN A 101 2.139 0.353 10.753 1.00 0.00 C ATOM 1529 OE1 GLN A 101 1.709 1.487 10.543 1.00 0.00 O ATOM 1530 NE2 GLN A 101 3.306 0.128 11.344 1.00 0.00 N ATOM 0 H GLN A 101 -0.257 -3.382 9.401 1.00 0.00 H new ATOM 0 HA GLN A 101 -1.618 -2.109 11.654 1.00 0.00 H new ATOM 0 HB2 GLN A 101 0.065 -0.461 12.006 1.00 0.00 H new ATOM 0 HB3 GLN A 101 0.878 -2.010 12.090 1.00 0.00 H new ATOM 0 HG2 GLN A 101 2.029 -1.685 10.110 1.00 0.00 H new ATOM 0 HG3 GLN A 101 0.793 -0.649 9.425 1.00 0.00 H new ATOM 0 HE21 GLN A 101 3.623 -0.829 11.498 1.00 0.00 H new ATOM 0 HE22 GLN A 101 3.885 0.912 11.644 1.00 0.00 H new ATOM 1539 N VAL A 102 -2.069 -0.029 10.116 1.00 0.00 N ATOM 1540 CA VAL A 102 -2.684 0.871 9.147 1.00 0.00 C ATOM 1541 C VAL A 102 -2.428 2.329 9.512 1.00 0.00 C ATOM 1542 O VAL A 102 -2.573 2.725 10.668 1.00 0.00 O ATOM 1543 CB VAL A 102 -4.203 0.636 9.049 1.00 0.00 C ATOM 1544 CG1 VAL A 102 -4.836 1.633 8.090 1.00 0.00 C ATOM 1545 CG2 VAL A 102 -4.494 -0.792 8.616 1.00 0.00 C ATOM 0 H VAL A 102 -2.129 0.288 11.084 1.00 0.00 H new ATOM 0 HA VAL A 102 -2.228 0.656 8.181 1.00 0.00 H new ATOM 0 HB VAL A 102 -4.642 0.788 10.035 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -5.909 1.452 8.033 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -4.657 2.647 8.449 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -4.395 1.516 7.100 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -5.572 -0.940 8.552 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -4.044 -0.975 7.640 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -4.075 -1.486 9.345 1.00 0.00 H new ATOM 1555 N SER A 103 -2.046 3.124 8.517 1.00 0.00 N ATOM 1556 CA SER A 103 -1.767 4.539 8.733 1.00 0.00 C ATOM 1557 C SER A 103 -2.504 5.400 7.712 1.00 0.00 C ATOM 1558 O SER A 103 -2.538 5.082 6.524 1.00 0.00 O ATOM 1559 CB SER A 103 -0.262 4.802 8.648 1.00 0.00 C ATOM 1560 OG SER A 103 0.111 5.895 9.468 1.00 0.00 O ATOM 0 H SER A 103 -1.923 2.812 7.554 1.00 0.00 H new ATOM 0 HA SER A 103 -2.120 4.806 9.729 1.00 0.00 H new ATOM 0 HB2 SER A 103 0.284 3.910 8.955 1.00 0.00 H new ATOM 0 HB3 SER A 103 0.017 5.007 7.614 1.00 0.00 H new ATOM 0 HG SER A 103 1.077 6.042 9.398 1.00 0.00 H new ATOM 1566 N ALA A 104 -3.094 6.493 8.186 1.00 0.00 N ATOM 1567 CA ALA A 104 -3.829 7.402 7.315 1.00 0.00 C ATOM 1568 C ALA A 104 -2.894 8.418 6.668 1.00 0.00 C ATOM 1569 O ALA A 104 -2.097 9.064 7.348 1.00 0.00 O ATOM 1570 CB ALA A 104 -4.923 8.113 8.098 1.00 0.00 C ATOM 0 H ALA A 104 -3.077 6.770 9.168 1.00 0.00 H new ATOM 0 HA ALA A 104 -4.289 6.813 6.521 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -5.464 8.789 7.436 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -5.614 7.377 8.508 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -4.476 8.684 8.912 1.00 0.00 H new ATOM 1576 N MET A 105 -2.997 8.555 5.350 1.00 0.00 N ATOM 1577 CA MET A 105 -2.161 9.493 4.612 1.00 0.00 C ATOM 1578 C MET A 105 -3.012 10.560 3.930 1.00 0.00 C ATOM 1579 O MET A 105 -4.058 10.260 3.353 1.00 0.00 O ATOM 1580 CB MET A 105 -1.321 8.751 3.570 1.00 0.00 C ATOM 1581 CG MET A 105 0.003 8.237 4.111 1.00 0.00 C ATOM 1582 SD MET A 105 1.237 8.002 2.818 1.00 0.00 S ATOM 1583 CE MET A 105 0.755 6.400 2.177 1.00 0.00 C ATOM 0 H MET A 105 -3.651 8.028 4.772 1.00 0.00 H new ATOM 0 HA MET A 105 -1.495 9.983 5.322 1.00 0.00 H new ATOM 0 HB2 MET A 105 -1.897 7.910 3.183 1.00 0.00 H new ATOM 0 HB3 MET A 105 -1.127 9.418 2.730 1.00 0.00 H new ATOM 0 HG2 MET A 105 0.386 8.940 4.850 1.00 0.00 H new ATOM 0 HG3 MET A 105 -0.162 7.291 4.626 1.00 0.00 H new ATOM 0 HE1 MET A 105 1.639 5.773 2.062 1.00 0.00 H new ATOM 0 HE2 MET A 105 0.061 5.925 2.870 1.00 0.00 H new ATOM 0 HE3 MET A 105 0.271 6.526 1.208 1.00 0.00 H new ATOM 1593 N THR A 106 -2.557 11.807 3.999 1.00 0.00 N ATOM 1594 CA THR A 106 -3.277 12.918 3.390 1.00 0.00 C ATOM 1595 C THR A 106 -2.422 13.618 2.340 1.00 0.00 C ATOM 1596 O THR A 106 -1.248 13.294 2.164 1.00 0.00 O ATOM 1597 CB THR A 106 -3.718 13.949 4.447 1.00 0.00 C ATOM 1598 OG1 THR A 106 -2.580 14.413 5.182 1.00 0.00 O ATOM 1599 CG2 THR A 106 -4.734 13.343 5.403 1.00 0.00 C ATOM 0 H THR A 106 -1.693 12.073 4.471 1.00 0.00 H new ATOM 0 HA THR A 106 -4.162 12.497 2.912 1.00 0.00 H new ATOM 0 HB THR A 106 -4.184 14.789 3.932 1.00 0.00 H new ATOM 0 HG1 THR A 106 -2.794 15.268 5.610 1.00 0.00 H new ATOM 0 HG21 THR A 106 -5.030 14.089 6.140 1.00 0.00 H new ATOM 0 HG22 THR A 106 -5.611 13.017 4.843 1.00 0.00 H new ATOM 0 HG23 THR A 106 -4.290 12.487 5.912 1.00 0.00 H new ATOM 1607 N VAL A 107 -3.019 14.580 1.643 1.00 0.00 N ATOM 1608 CA VAL A 107 -2.311 15.328 0.611 1.00 0.00 C ATOM 1609 C VAL A 107 -1.030 15.945 1.160 1.00 0.00 C ATOM 1610 O VAL A 107 -0.096 16.232 0.412 1.00 0.00 O ATOM 1611 CB VAL A 107 -3.193 16.443 0.020 1.00 0.00 C ATOM 1612 CG1 VAL A 107 -3.526 17.480 1.083 1.00 0.00 C ATOM 1613 CG2 VAL A 107 -2.506 17.091 -1.172 1.00 0.00 C ATOM 0 H VAL A 107 -3.991 14.859 1.774 1.00 0.00 H new ATOM 0 HA VAL A 107 -2.060 14.618 -0.177 1.00 0.00 H new ATOM 0 HB VAL A 107 -4.126 15.999 -0.326 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -4.150 18.260 0.647 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -4.063 17.002 1.902 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -2.604 17.922 1.462 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -3.144 17.877 -1.577 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -1.557 17.522 -0.855 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -2.324 16.339 -1.940 1.00 0.00 H new ATOM 1623 N ASN A 108 -0.993 16.148 2.473 1.00 0.00 N ATOM 1624 CA ASN A 108 0.174 16.732 3.124 1.00 0.00 C ATOM 1625 C ASN A 108 1.276 15.691 3.301 1.00 0.00 C ATOM 1626 O ASN A 108 2.355 15.810 2.722 1.00 0.00 O ATOM 1627 CB ASN A 108 -0.213 17.317 4.483 1.00 0.00 C ATOM 1628 CG ASN A 108 -1.349 18.317 4.380 1.00 0.00 C ATOM 1629 OD1 ASN A 108 -1.562 18.925 3.330 1.00 0.00 O ATOM 1630 ND2 ASN A 108 -2.085 18.491 5.471 1.00 0.00 N ATOM 0 H ASN A 108 -1.758 15.917 3.107 1.00 0.00 H new ATOM 0 HA ASN A 108 0.552 17.531 2.487 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -0.504 16.509 5.154 1.00 0.00 H new ATOM 0 HB3 ASN A 108 0.656 17.803 4.927 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -2.863 19.150 5.461 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -1.872 17.966 6.319 1.00 0.00 H new ATOM 1637 N GLY A 109 0.995 14.671 4.106 1.00 0.00 N ATOM 1638 CA GLY A 109 1.971 13.624 4.345 1.00 0.00 C ATOM 1639 C GLY A 109 1.362 12.402 5.003 1.00 0.00 C ATOM 1640 O GLY A 109 0.266 11.973 4.639 1.00 0.00 O ATOM 0 H GLY A 109 0.109 14.551 4.597 1.00 0.00 H new ATOM 0 HA2 GLY A 109 2.427 13.334 3.398 1.00 0.00 H new ATOM 0 HA3 GLY A 109 2.769 14.013 4.977 1.00 0.00 H new ATOM 1644 N THR A 110 2.073 11.838 5.975 1.00 0.00 N ATOM 1645 CA THR A 110 1.597 10.657 6.683 1.00 0.00 C ATOM 1646 C THR A 110 1.560 10.896 8.188 1.00 0.00 C ATOM 1647 O THR A 110 2.506 11.429 8.765 1.00 0.00 O ATOM 1648 CB THR A 110 2.483 9.432 6.391 1.00 0.00 C ATOM 1649 OG1 THR A 110 2.625 9.255 4.977 1.00 0.00 O ATOM 1650 CG2 THR A 110 1.889 8.174 7.006 1.00 0.00 C ATOM 0 H THR A 110 2.981 12.181 6.289 1.00 0.00 H new ATOM 0 HA THR A 110 0.587 10.459 6.324 1.00 0.00 H new ATOM 0 HB THR A 110 3.463 9.607 6.836 1.00 0.00 H new ATOM 0 HG1 THR A 110 2.347 8.348 4.731 1.00 0.00 H new ATOM 0 HG21 THR A 110 2.533 7.322 6.786 1.00 0.00 H new ATOM 0 HG22 THR A 110 1.810 8.299 8.086 1.00 0.00 H new ATOM 0 HG23 THR A 110 0.898 7.997 6.587 1.00 0.00 H new ATOM 1658 N GLY A 111 0.460 10.496 8.819 1.00 0.00 N ATOM 1659 CA GLY A 111 0.320 10.675 10.253 1.00 0.00 C ATOM 1660 C GLY A 111 0.803 9.471 11.037 1.00 0.00 C ATOM 1661 O GLY A 111 1.474 8.586 10.506 1.00 0.00 O ATOM 0 H GLY A 111 -0.337 10.051 8.363 1.00 0.00 H new ATOM 0 HA2 GLY A 111 0.882 11.556 10.563 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -0.726 10.864 10.492 1.00 0.00 H new ATOM 1665 N PRO A 112 0.460 9.428 12.333 1.00 0.00 N ATOM 1666 CA PRO A 112 0.853 8.329 13.220 1.00 0.00 C ATOM 1667 C PRO A 112 0.132 7.028 12.885 1.00 0.00 C ATOM 1668 O PRO A 112 -1.094 6.976 12.789 1.00 0.00 O ATOM 1669 CB PRO A 112 0.440 8.828 14.607 1.00 0.00 C ATOM 1670 CG PRO A 112 -0.661 9.797 14.348 1.00 0.00 C ATOM 1671 CD PRO A 112 -0.338 10.449 13.032 1.00 0.00 C ATOM 0 HA PRO A 112 1.914 8.096 13.135 1.00 0.00 H new ATOM 0 HB2 PRO A 112 0.104 8.006 15.239 1.00 0.00 H new ATOM 0 HB3 PRO A 112 1.275 9.305 15.121 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -1.625 9.290 14.306 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -0.725 10.538 15.145 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -1.241 10.703 12.477 1.00 0.00 H new ATOM 0 HD3 PRO A 112 0.223 11.374 13.168 1.00 0.00 H new ATOM 1679 N PRO A 113 0.909 5.950 12.702 1.00 0.00 N ATOM 1680 CA PRO A 113 0.366 4.628 12.376 1.00 0.00 C ATOM 1681 C PRO A 113 -0.389 4.007 13.546 1.00 0.00 C ATOM 1682 O PRO A 113 -0.193 4.393 14.699 1.00 0.00 O ATOM 1683 CB PRO A 113 1.612 3.804 12.046 1.00 0.00 C ATOM 1684 CG PRO A 113 2.717 4.474 12.788 1.00 0.00 C ATOM 1685 CD PRO A 113 2.379 5.939 12.800 1.00 0.00 C ATOM 0 HA PRO A 113 -0.358 4.674 11.563 1.00 0.00 H new ATOM 0 HB2 PRO A 113 1.496 2.767 12.361 1.00 0.00 H new ATOM 0 HB3 PRO A 113 1.806 3.792 10.973 1.00 0.00 H new ATOM 0 HG2 PRO A 113 2.798 4.084 13.803 1.00 0.00 H new ATOM 0 HG3 PRO A 113 3.676 4.299 12.301 1.00 0.00 H new ATOM 0 HD2 PRO A 113 2.725 6.424 13.713 1.00 0.00 H new ATOM 0 HD3 PRO A 113 2.842 6.465 11.965 1.00 0.00 H new ATOM 1693 N SER A 114 -1.253 3.043 13.243 1.00 0.00 N ATOM 1694 CA SER A 114 -2.040 2.371 14.270 1.00 0.00 C ATOM 1695 C SER A 114 -1.188 1.361 15.032 1.00 0.00 C ATOM 1696 O SER A 114 -0.072 1.042 14.626 1.00 0.00 O ATOM 1697 CB SER A 114 -3.244 1.668 13.640 1.00 0.00 C ATOM 1698 OG SER A 114 -2.901 0.365 13.199 1.00 0.00 O ATOM 0 H SER A 114 -1.426 2.710 12.294 1.00 0.00 H new ATOM 0 HA SER A 114 -2.395 3.124 14.973 1.00 0.00 H new ATOM 0 HB2 SER A 114 -4.055 1.608 14.366 1.00 0.00 H new ATOM 0 HB3 SER A 114 -3.612 2.255 12.799 1.00 0.00 H new ATOM 0 HG SER A 114 -3.054 -0.276 13.924 1.00 0.00 H new ATOM 1704 N ASN A 115 -1.724 0.862 16.141 1.00 0.00 N ATOM 1705 CA ASN A 115 -1.014 -0.112 16.963 1.00 0.00 C ATOM 1706 C ASN A 115 -0.654 -1.351 16.149 1.00 0.00 C ATOM 1707 O ASN A 115 -1.244 -1.610 15.099 1.00 0.00 O ATOM 1708 CB ASN A 115 -1.866 -0.511 18.169 1.00 0.00 C ATOM 1709 CG ASN A 115 -2.035 0.626 19.159 1.00 0.00 C ATOM 1710 OD1 ASN A 115 -1.420 1.683 19.018 1.00 0.00 O ATOM 1711 ND2 ASN A 115 -2.872 0.413 20.168 1.00 0.00 N ATOM 0 H ASN A 115 -2.648 1.116 16.491 1.00 0.00 H new ATOM 0 HA ASN A 115 -0.092 0.351 17.315 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -2.847 -0.838 17.825 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -1.404 -1.361 18.671 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -3.026 1.141 20.865 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -3.361 -0.479 20.246 1.00 0.00 H new ATOM 1718 N TRP A 116 0.316 -2.113 16.640 1.00 0.00 N ATOM 1719 CA TRP A 116 0.754 -3.326 15.958 1.00 0.00 C ATOM 1720 C TRP A 116 -0.153 -4.502 16.302 1.00 0.00 C ATOM 1721 O TRP A 116 0.091 -5.224 17.268 1.00 0.00 O ATOM 1722 CB TRP A 116 2.200 -3.654 16.336 1.00 0.00 C ATOM 1723 CG TRP A 116 3.211 -2.877 15.547 1.00 0.00 C ATOM 1724 CD1 TRP A 116 3.953 -1.817 15.984 1.00 0.00 C ATOM 1725 CD2 TRP A 116 3.588 -3.099 14.184 1.00 0.00 C ATOM 1726 NE1 TRP A 116 4.769 -1.367 14.975 1.00 0.00 N ATOM 1727 CE2 TRP A 116 4.565 -2.137 13.860 1.00 0.00 C ATOM 1728 CE3 TRP A 116 3.198 -4.018 13.206 1.00 0.00 C ATOM 1729 CZ2 TRP A 116 5.154 -2.069 12.600 1.00 0.00 C ATOM 1730 CZ3 TRP A 116 3.783 -3.948 11.956 1.00 0.00 C ATOM 1731 CH2 TRP A 116 4.753 -2.980 11.662 1.00 0.00 C ATOM 0 H TRP A 116 0.814 -1.913 17.507 1.00 0.00 H new ATOM 0 HA TRP A 116 0.697 -3.150 14.884 1.00 0.00 H new ATOM 0 HB2 TRP A 116 2.345 -3.453 17.397 1.00 0.00 H new ATOM 0 HB3 TRP A 116 2.374 -4.720 16.187 1.00 0.00 H new ATOM 0 HD1 TRP A 116 3.905 -1.395 16.977 1.00 0.00 H new ATOM 0 HE1 TRP A 116 5.421 -0.586 15.044 1.00 0.00 H new ATOM 0 HE3 TRP A 116 2.453 -4.769 13.423 1.00 0.00 H new ATOM 0 HZ2 TRP A 116 5.901 -1.323 12.372 1.00 0.00 H new ATOM 0 HZ3 TRP A 116 3.487 -4.652 11.192 1.00 0.00 H new ATOM 0 HH2 TRP A 116 5.192 -2.953 10.676 1.00 0.00 H new ATOM 1742 N TYR A 117 -1.200 -4.688 15.505 1.00 0.00 N ATOM 1743 CA TYR A 117 -2.145 -5.776 15.727 1.00 0.00 C ATOM 1744 C TYR A 117 -1.595 -7.094 15.190 1.00 0.00 C ATOM 1745 O TYR A 117 -1.190 -7.186 14.031 1.00 0.00 O ATOM 1746 CB TYR A 117 -3.484 -5.460 15.060 1.00 0.00 C ATOM 1747 CG TYR A 117 -4.223 -4.306 15.701 1.00 0.00 C ATOM 1748 CD1 TYR A 117 -3.905 -2.991 15.384 1.00 0.00 C ATOM 1749 CD2 TYR A 117 -5.238 -4.532 16.622 1.00 0.00 C ATOM 1750 CE1 TYR A 117 -4.577 -1.934 15.968 1.00 0.00 C ATOM 1751 CE2 TYR A 117 -5.916 -3.481 17.209 1.00 0.00 C ATOM 1752 CZ TYR A 117 -5.581 -2.184 16.879 1.00 0.00 C ATOM 1753 OH TYR A 117 -6.253 -1.134 17.462 1.00 0.00 O ATOM 0 H TYR A 117 -1.415 -4.100 14.700 1.00 0.00 H new ATOM 0 HA TYR A 117 -2.297 -5.878 16.802 1.00 0.00 H new ATOM 0 HB2 TYR A 117 -3.311 -5.231 14.008 1.00 0.00 H new ATOM 0 HB3 TYR A 117 -4.115 -6.348 15.093 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -3.120 -2.792 14.670 1.00 0.00 H new ATOM 0 HD2 TYR A 117 -5.502 -5.546 16.884 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -4.317 -0.917 15.712 1.00 0.00 H new ATOM 0 HE2 TYR A 117 -6.704 -3.674 17.922 1.00 0.00 H new ATOM 0 HH TYR A 117 -6.930 -1.481 18.079 1.00 0.00 H new ATOM 1763 N THR A 118 -1.584 -8.115 16.042 1.00 0.00 N ATOM 1764 CA THR A 118 -1.084 -9.428 15.655 1.00 0.00 C ATOM 1765 C THR A 118 -2.231 -10.400 15.402 1.00 0.00 C ATOM 1766 O THR A 118 -3.242 -10.378 16.102 1.00 0.00 O ATOM 1767 CB THR A 118 -0.157 -10.016 16.736 1.00 0.00 C ATOM 1768 OG1 THR A 118 0.885 -9.085 17.047 1.00 0.00 O ATOM 1769 CG2 THR A 118 0.453 -11.329 16.268 1.00 0.00 C ATOM 0 H THR A 118 -1.916 -8.057 17.005 1.00 0.00 H new ATOM 0 HA THR A 118 -0.517 -9.292 14.734 1.00 0.00 H new ATOM 0 HB THR A 118 -0.752 -10.207 17.629 1.00 0.00 H new ATOM 0 HG1 THR A 118 1.399 -8.887 16.237 1.00 0.00 H new ATOM 0 HG21 THR A 118 1.104 -11.726 17.047 1.00 0.00 H new ATOM 0 HG22 THR A 118 -0.342 -12.045 16.059 1.00 0.00 H new ATOM 0 HG23 THR A 118 1.034 -11.158 15.362 1.00 0.00 H new ATOM 1777 N ALA A 119 -2.066 -11.253 14.396 1.00 0.00 N ATOM 1778 CA ALA A 119 -3.087 -12.235 14.052 1.00 0.00 C ATOM 1779 C ALA A 119 -2.486 -13.631 13.929 1.00 0.00 C ATOM 1780 O ALA A 119 -1.376 -13.796 13.424 1.00 0.00 O ATOM 1781 CB ALA A 119 -3.783 -11.842 12.758 1.00 0.00 C ATOM 0 H ALA A 119 -1.235 -11.284 13.805 1.00 0.00 H new ATOM 0 HA ALA A 119 -3.823 -12.254 14.856 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -4.543 -12.584 12.514 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -4.254 -10.867 12.880 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -3.051 -11.793 11.952 1.00 0.00 H new ATOM 1787 N GLU A 120 -3.226 -14.632 14.394 1.00 0.00 N ATOM 1788 CA GLU A 120 -2.764 -16.014 14.336 1.00 0.00 C ATOM 1789 C GLU A 120 -3.598 -16.826 13.348 1.00 0.00 C ATOM 1790 O GLU A 120 -4.824 -16.876 13.447 1.00 0.00 O ATOM 1791 CB GLU A 120 -2.830 -16.656 15.723 1.00 0.00 C ATOM 1792 CG GLU A 120 -1.983 -15.943 16.764 1.00 0.00 C ATOM 1793 CD GLU A 120 -2.379 -16.302 18.184 1.00 0.00 C ATOM 1794 OE1 GLU A 120 -1.879 -17.324 18.698 1.00 0.00 O ATOM 1795 OE2 GLU A 120 -3.189 -15.561 18.780 1.00 0.00 O ATOM 0 H GLU A 120 -4.147 -14.512 14.815 1.00 0.00 H new ATOM 0 HA GLU A 120 -1.729 -16.010 13.994 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -3.867 -16.671 16.058 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -2.504 -17.694 15.650 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -0.934 -16.195 16.608 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -2.075 -14.866 16.626 1.00 0.00 H new ATOM 1802 N THR A 121 -2.923 -17.461 12.395 1.00 0.00 N ATOM 1803 CA THR A 121 -3.599 -18.268 11.388 1.00 0.00 C ATOM 1804 C THR A 121 -3.879 -19.674 11.908 1.00 0.00 C ATOM 1805 O THR A 121 -3.071 -20.271 12.619 1.00 0.00 O ATOM 1806 CB THR A 121 -2.767 -18.368 10.095 1.00 0.00 C ATOM 1807 OG1 THR A 121 -1.434 -18.789 10.402 1.00 0.00 O ATOM 1808 CG2 THR A 121 -2.728 -17.029 9.373 1.00 0.00 C ATOM 0 H THR A 121 -1.908 -17.432 12.300 1.00 0.00 H new ATOM 0 HA THR A 121 -4.543 -17.770 11.166 1.00 0.00 H new ATOM 0 HB THR A 121 -3.238 -19.102 9.441 1.00 0.00 H new ATOM 0 HG1 THR A 121 -0.912 -18.852 9.575 1.00 0.00 H new ATOM 0 HG21 THR A 121 -2.135 -17.123 8.463 1.00 0.00 H new ATOM 0 HG22 THR A 121 -3.742 -16.725 9.115 1.00 0.00 H new ATOM 0 HG23 THR A 121 -2.278 -16.278 10.023 1.00 0.00 H new ATOM 1816 N PRO A 122 -5.051 -20.217 11.546 1.00 0.00 N ATOM 1817 CA PRO A 122 -5.464 -21.560 11.964 1.00 0.00 C ATOM 1818 C PRO A 122 -4.638 -22.654 11.296 1.00 0.00 C ATOM 1819 O PRO A 122 -4.639 -22.784 10.072 1.00 0.00 O ATOM 1820 CB PRO A 122 -6.924 -21.640 11.511 1.00 0.00 C ATOM 1821 CG PRO A 122 -7.023 -20.675 10.380 1.00 0.00 C ATOM 1822 CD PRO A 122 -6.063 -19.562 10.700 1.00 0.00 C ATOM 0 HA PRO A 122 -5.327 -21.714 13.034 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -7.185 -22.650 11.194 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -7.605 -21.373 12.320 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -6.765 -21.153 9.435 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -8.040 -20.296 10.278 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -5.621 -19.141 9.797 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -6.557 -18.744 11.224 1.00 0.00 H new ATOM 1830 N GLU A 123 -3.936 -23.439 12.108 1.00 0.00 N ATOM 1831 CA GLU A 123 -3.106 -24.522 11.593 1.00 0.00 C ATOM 1832 C GLU A 123 -3.884 -25.378 10.598 1.00 0.00 C ATOM 1833 O GLU A 123 -3.336 -25.837 9.597 1.00 0.00 O ATOM 1834 CB GLU A 123 -2.596 -25.393 12.743 1.00 0.00 C ATOM 1835 CG GLU A 123 -1.609 -24.683 13.654 1.00 0.00 C ATOM 1836 CD GLU A 123 -0.903 -25.633 14.602 1.00 0.00 C ATOM 1837 OE1 GLU A 123 -1.588 -26.233 15.457 1.00 0.00 O ATOM 1838 OE2 GLU A 123 0.332 -25.775 14.491 1.00 0.00 O ATOM 0 H GLU A 123 -3.926 -23.345 13.124 1.00 0.00 H new ATOM 0 HA GLU A 123 -2.254 -24.079 11.076 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -3.446 -25.731 13.336 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -2.121 -26.283 12.330 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -0.868 -24.164 13.046 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -2.135 -23.923 14.232 1.00 0.00 H new ATOM 1845 N ASN A 124 -5.166 -25.588 10.882 1.00 0.00 N ATOM 1846 CA ASN A 124 -6.020 -26.390 10.013 1.00 0.00 C ATOM 1847 C ASN A 124 -6.217 -25.707 8.664 1.00 0.00 C ATOM 1848 O ASN A 124 -7.142 -24.914 8.488 1.00 0.00 O ATOM 1849 CB ASN A 124 -7.376 -26.631 10.678 1.00 0.00 C ATOM 1850 CG ASN A 124 -8.231 -27.618 9.907 1.00 0.00 C ATOM 1851 OD1 ASN A 124 -7.896 -28.798 9.803 1.00 0.00 O ATOM 1852 ND2 ASN A 124 -9.342 -27.137 9.361 1.00 0.00 N ATOM 0 H ASN A 124 -5.636 -25.214 11.707 1.00 0.00 H new ATOM 0 HA ASN A 124 -5.529 -27.349 9.847 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -7.220 -27.003 11.691 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -7.908 -25.684 10.765 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -9.957 -27.753 8.830 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -9.580 -26.152 9.473 1.00 0.00 H new TER 1859 ASN A 124