USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 919 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 41 TYR OH : rot 165:sc= 1.08 USER MOD Set 1.2: A 67 TYR OH : rot -125:sc= 0.111 USER MOD Set 2.1: A 62 GLN : amide:sc= -2.02! K(o=-2!,f=0.23) USER MOD Set 2.2: A 63 GLN : amide:sc= 0.0551 K(o=-2,f=-9.6!) USER MOD Set 3.1: A 46 MET CE :methyl -153:sc= -2.12 (180deg=-3.44!) USER MOD Set 3.2: A 50 LYS NZ :NH3+ 168:sc= 0.801 (180deg=0.717) USER MOD Set 4.1: A 7 GLN : amide:sc= -0.0999 X(o=0.2,f=0.22) USER MOD Set 4.2: A 29 GLN : amide:sc= 0.299 K(o=0.2,f=-1.5!) USER MOD Set 5.1: A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 5.2: A 26 CYS SG : rot -130:sc= 0 USER MOD Single : A 2 SER OG : rot 27:sc= 0.122 USER MOD Single : A 3 GLN : amide:sc= 0 K(o=0,f=-0.84) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ 170:sc= 1.17 (180deg=1.07) USER MOD Single : A 12 ASN : amide:sc= -1.98! K(o=-2!,f=-1.4) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 GLN : amide:sc= -1.31! K(o=-1.3!,f=0) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 HIS : no HD1:sc=-0.00483 X(o=-0.0048,f=-0.0054) USER MOD Single : A 27 TYR OH : rot 65:sc= 0.785 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= -2.24! K(o=-2.2!,f=-0.79) USER MOD Single : A 36 GLN : amide:sc= -0.871 K(o=-0.87,f=0) USER MOD Single : A 37 ASN : amide:sc= 0.0749 K(o=0.075,f=-5.1!) USER MOD Single : A 42 SER OG : rot -124:sc= -1.09 USER MOD Single : A 43 ASN : amide:sc= -1.69 K(o=-1.7,f=-4.8) USER MOD Single : A 44 LYS NZ :NH3+ 166:sc= 1.23 (180deg=1.22) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= -0.804 USER MOD Single : A 56 GLN : amide:sc= -1.03 K(o=-1,f=-0.077) USER MOD Single : A 59 GLN : amide:sc= -0.103 X(o=-0.1,f=-0.12) USER MOD Single : A 60 MET CE :methyl 159:sc= -0.167 (180deg=-1.21) USER MOD Single : A 61 CYS SG : rot 78:sc= -0.727 USER MOD Single : A 68 THR OG1 : rot 180:sc= -0.127 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 180:sc= -0.0195 USER MOD Single : A 73 HIS : no HE2:sc= -2.01! X(o=-2!,f=-2.4) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ 159:sc= 0.696 (180deg=-0.195!) USER MOD Single : A 81 GLN : amide:sc= -8.29! C(o=-8.3!,f=-9.1!) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= 1.18 K(o=1.2,f=-0.0032) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : B 703 THR OG1 : rot -160:sc= 0 USER MOD Single : B 705 MET CE :methyl -140:sc= -1.45 (180deg=-4.29!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 21.732 -13.681 -4.990 1.00 0.00 N ATOM 2 CA SER A 2 20.659 -12.671 -4.937 1.00 0.00 C ATOM 3 C SER A 2 21.230 -11.273 -5.123 1.00 0.00 C ATOM 4 O SER A 2 22.200 -10.905 -4.460 1.00 0.00 O ATOM 5 CB SER A 2 19.901 -12.758 -3.615 1.00 0.00 C ATOM 6 OG SER A 2 19.380 -14.061 -3.460 1.00 0.00 O ATOM 0 HA SER A 2 19.962 -12.874 -5.750 1.00 0.00 H new ATOM 0 HB2 SER A 2 20.566 -12.519 -2.785 1.00 0.00 H new ATOM 0 HB3 SER A 2 19.093 -12.027 -3.597 1.00 0.00 H new ATOM 0 HG SER A 2 19.938 -14.697 -3.954 1.00 0.00 H new ATOM 14 N GLN A 3 20.625 -10.496 -6.024 1.00 0.00 N ATOM 15 CA GLN A 3 21.048 -9.132 -6.307 1.00 0.00 C ATOM 16 C GLN A 3 19.873 -8.304 -6.823 1.00 0.00 C ATOM 17 O GLN A 3 18.814 -8.848 -7.128 1.00 0.00 O ATOM 18 CB GLN A 3 22.188 -9.145 -7.330 1.00 0.00 C ATOM 19 CG GLN A 3 21.752 -9.766 -8.664 1.00 0.00 C ATOM 20 CD GLN A 3 22.880 -9.776 -9.689 1.00 0.00 C ATOM 21 OE1 GLN A 3 23.913 -9.137 -9.511 1.00 0.00 O ATOM 22 NE2 GLN A 3 22.693 -10.510 -10.782 1.00 0.00 N ATOM 0 H GLN A 3 19.825 -10.801 -6.578 1.00 0.00 H new ATOM 0 HA GLN A 3 21.407 -8.674 -5.385 1.00 0.00 H new ATOM 0 HB2 GLN A 3 22.535 -8.126 -7.500 1.00 0.00 H new ATOM 0 HB3 GLN A 3 23.031 -9.706 -6.927 1.00 0.00 H new ATOM 0 HG2 GLN A 3 21.409 -10.787 -8.493 1.00 0.00 H new ATOM 0 HG3 GLN A 3 20.905 -9.208 -9.063 1.00 0.00 H new ATOM 0 HE21 GLN A 3 21.825 -11.031 -10.904 1.00 0.00 H new ATOM 0 HE22 GLN A 3 23.418 -10.552 -11.498 1.00 0.00 H new ATOM 31 N PHE A 4 20.066 -6.986 -6.924 1.00 0.00 N ATOM 32 CA PHE A 4 19.048 -6.071 -7.423 1.00 0.00 C ATOM 33 C PHE A 4 19.758 -4.793 -7.810 1.00 0.00 C ATOM 34 O PHE A 4 19.467 -4.163 -8.820 1.00 0.00 O ATOM 35 CB PHE A 4 18.060 -5.767 -6.296 1.00 0.00 C ATOM 36 CG PHE A 4 17.070 -4.658 -6.595 1.00 0.00 C ATOM 37 CD1 PHE A 4 17.433 -3.307 -6.456 1.00 0.00 C ATOM 38 CD2 PHE A 4 15.767 -4.986 -6.996 1.00 0.00 C ATOM 39 CE1 PHE A 4 16.493 -2.295 -6.683 1.00 0.00 C ATOM 40 CE2 PHE A 4 14.830 -3.972 -7.232 1.00 0.00 C ATOM 41 CZ PHE A 4 15.191 -2.628 -7.077 1.00 0.00 C ATOM 0 H PHE A 4 20.938 -6.527 -6.660 1.00 0.00 H new ATOM 0 HA PHE A 4 18.511 -6.499 -8.270 1.00 0.00 H new ATOM 0 HB2 PHE A 4 17.505 -6.676 -6.064 1.00 0.00 H new ATOM 0 HB3 PHE A 4 18.623 -5.500 -5.402 1.00 0.00 H new ATOM 0 HD1 PHE A 4 18.443 -3.049 -6.173 1.00 0.00 H new ATOM 0 HD2 PHE A 4 15.486 -6.021 -7.123 1.00 0.00 H new ATOM 0 HE1 PHE A 4 16.771 -1.259 -6.555 1.00 0.00 H new ATOM 0 HE2 PHE A 4 13.825 -4.228 -7.535 1.00 0.00 H new ATOM 0 HZ PHE A 4 14.466 -1.849 -7.261 1.00 0.00 H new ATOM 51 N GLU A 5 20.716 -4.430 -6.963 1.00 0.00 N ATOM 52 CA GLU A 5 21.554 -3.280 -7.151 1.00 0.00 C ATOM 53 C GLU A 5 22.248 -3.290 -8.499 1.00 0.00 C ATOM 54 O GLU A 5 22.241 -2.278 -9.186 1.00 0.00 O ATOM 55 CB GLU A 5 22.622 -3.325 -6.079 1.00 0.00 C ATOM 56 CG GLU A 5 21.995 -3.099 -4.705 1.00 0.00 C ATOM 57 CD GLU A 5 23.060 -3.055 -3.610 1.00 0.00 C ATOM 58 OE1 GLU A 5 23.571 -4.142 -3.261 1.00 0.00 O ATOM 59 OE2 GLU A 5 23.352 -1.935 -3.133 1.00 0.00 O ATOM 0 H GLU A 5 20.926 -4.949 -6.110 1.00 0.00 H new ATOM 0 HA GLU A 5 20.935 -2.385 -7.098 1.00 0.00 H new ATOM 0 HB2 GLU A 5 23.131 -4.289 -6.101 1.00 0.00 H new ATOM 0 HB3 GLU A 5 23.376 -2.562 -6.273 1.00 0.00 H new ATOM 0 HG2 GLU A 5 21.434 -2.164 -4.708 1.00 0.00 H new ATOM 0 HG3 GLU A 5 21.284 -3.897 -4.492 1.00 0.00 H new ATOM 66 N LYS A 6 22.857 -4.407 -8.913 1.00 0.00 N ATOM 67 CA LYS A 6 23.663 -4.338 -10.111 1.00 0.00 C ATOM 68 C LYS A 6 22.747 -4.217 -11.312 1.00 0.00 C ATOM 69 O LYS A 6 23.045 -3.500 -12.258 1.00 0.00 O ATOM 70 CB LYS A 6 24.513 -5.590 -10.229 1.00 0.00 C ATOM 71 CG LYS A 6 25.892 -5.378 -9.606 1.00 0.00 C ATOM 72 CD LYS A 6 25.803 -5.131 -8.102 1.00 0.00 C ATOM 73 CE LYS A 6 27.223 -5.024 -7.555 1.00 0.00 C ATOM 74 NZ LYS A 6 27.220 -4.815 -6.094 1.00 0.00 N ATOM 0 H LYS A 6 22.807 -5.318 -8.457 1.00 0.00 H new ATOM 0 HA LYS A 6 24.322 -3.471 -10.066 1.00 0.00 H new ATOM 0 HB2 LYS A 6 24.011 -6.422 -9.735 1.00 0.00 H new ATOM 0 HB3 LYS A 6 24.622 -5.862 -11.279 1.00 0.00 H new ATOM 0 HG2 LYS A 6 26.514 -6.253 -9.794 1.00 0.00 H new ATOM 0 HG3 LYS A 6 26.381 -4.530 -10.085 1.00 0.00 H new ATOM 0 HD2 LYS A 6 25.247 -4.216 -7.899 1.00 0.00 H new ATOM 0 HD3 LYS A 6 25.267 -5.945 -7.614 1.00 0.00 H new ATOM 0 HE2 LYS A 6 27.776 -5.932 -7.794 1.00 0.00 H new ATOM 0 HE3 LYS A 6 27.741 -4.198 -8.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 28.199 -4.746 -5.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 26.712 -3.935 -5.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 26.746 -5.616 -5.630 1.00 0.00 H new ATOM 88 N GLN A 7 21.627 -4.926 -11.260 1.00 0.00 N ATOM 89 CA GLN A 7 20.597 -4.898 -12.276 1.00 0.00 C ATOM 90 C GLN A 7 19.993 -3.499 -12.421 1.00 0.00 C ATOM 91 O GLN A 7 19.257 -3.233 -13.369 1.00 0.00 O ATOM 92 CB GLN A 7 19.534 -5.900 -11.842 1.00 0.00 C ATOM 93 CG GLN A 7 20.158 -7.283 -11.655 1.00 0.00 C ATOM 94 CD GLN A 7 20.381 -7.958 -12.995 1.00 0.00 C ATOM 95 OE1 GLN A 7 21.382 -7.727 -13.668 1.00 0.00 O ATOM 96 NE2 GLN A 7 19.441 -8.805 -13.394 1.00 0.00 N ATOM 0 H GLN A 7 21.409 -5.553 -10.485 1.00 0.00 H new ATOM 0 HA GLN A 7 21.012 -5.157 -13.250 1.00 0.00 H new ATOM 0 HB2 GLN A 7 19.073 -5.572 -10.910 1.00 0.00 H new ATOM 0 HB3 GLN A 7 18.742 -5.948 -12.590 1.00 0.00 H new ATOM 0 HG2 GLN A 7 21.107 -7.191 -11.127 1.00 0.00 H new ATOM 0 HG3 GLN A 7 19.507 -7.900 -11.036 1.00 0.00 H new ATOM 0 HE21 GLN A 7 18.623 -8.972 -12.808 1.00 0.00 H new ATOM 0 HE22 GLN A 7 19.536 -9.289 -14.287 1.00 0.00 H new ATOM 105 N LYS A 8 20.306 -2.607 -11.474 1.00 0.00 N ATOM 106 CA LYS A 8 19.785 -1.253 -11.428 1.00 0.00 C ATOM 107 C LYS A 8 20.879 -0.246 -11.746 1.00 0.00 C ATOM 108 O LYS A 8 20.638 0.738 -12.434 1.00 0.00 O ATOM 109 CB LYS A 8 19.285 -1.075 -10.003 1.00 0.00 C ATOM 110 CG LYS A 8 18.726 0.318 -9.752 1.00 0.00 C ATOM 111 CD LYS A 8 18.167 0.264 -8.337 1.00 0.00 C ATOM 112 CE LYS A 8 19.278 0.099 -7.304 1.00 0.00 C ATOM 113 NZ LYS A 8 20.115 1.309 -7.195 1.00 0.00 N ATOM 0 H LYS A 8 20.943 -2.820 -10.706 1.00 0.00 H new ATOM 0 HA LYS A 8 18.995 -1.091 -12.162 1.00 0.00 H new ATOM 0 HB2 LYS A 8 18.512 -1.816 -9.797 1.00 0.00 H new ATOM 0 HB3 LYS A 8 20.103 -1.266 -9.308 1.00 0.00 H new ATOM 0 HG2 LYS A 8 19.502 1.078 -9.842 1.00 0.00 H new ATOM 0 HG3 LYS A 8 17.950 0.569 -10.475 1.00 0.00 H new ATOM 0 HD2 LYS A 8 17.609 1.177 -8.130 1.00 0.00 H new ATOM 0 HD3 LYS A 8 17.465 -0.565 -8.253 1.00 0.00 H new ATOM 0 HE2 LYS A 8 18.839 -0.127 -6.332 1.00 0.00 H new ATOM 0 HE3 LYS A 8 19.903 -0.751 -7.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 20.745 1.222 -6.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 20.685 1.416 -8.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 19.505 2.143 -7.077 1.00 0.00 H new ATOM 127 N GLU A 9 22.081 -0.513 -11.237 1.00 0.00 N ATOM 128 CA GLU A 9 23.269 0.315 -11.406 1.00 0.00 C ATOM 129 C GLU A 9 23.932 0.079 -12.758 1.00 0.00 C ATOM 130 O GLU A 9 24.599 0.969 -13.282 1.00 0.00 O ATOM 131 CB GLU A 9 24.239 -0.023 -10.277 1.00 0.00 C ATOM 132 CG GLU A 9 23.541 0.290 -8.954 1.00 0.00 C ATOM 133 CD GLU A 9 23.566 1.777 -8.621 1.00 0.00 C ATOM 134 OE1 GLU A 9 24.680 2.336 -8.516 1.00 0.00 O ATOM 135 OE2 GLU A 9 22.459 2.340 -8.475 1.00 0.00 O ATOM 0 H GLU A 9 22.258 -1.345 -10.674 1.00 0.00 H new ATOM 0 HA GLU A 9 22.984 1.367 -11.371 1.00 0.00 H new ATOM 0 HB2 GLU A 9 24.524 -1.074 -10.320 1.00 0.00 H new ATOM 0 HB3 GLU A 9 25.155 0.560 -10.373 1.00 0.00 H new ATOM 0 HG2 GLU A 9 22.507 -0.051 -9.002 1.00 0.00 H new ATOM 0 HG3 GLU A 9 24.023 -0.267 -8.151 1.00 0.00 H new ATOM 142 N GLN A 10 23.752 -1.114 -13.327 1.00 0.00 N ATOM 143 CA GLN A 10 24.269 -1.405 -14.656 1.00 0.00 C ATOM 144 C GLN A 10 23.469 -0.679 -15.733 1.00 0.00 C ATOM 145 O GLN A 10 24.050 -0.048 -16.615 1.00 0.00 O ATOM 146 CB GLN A 10 24.206 -2.913 -14.921 1.00 0.00 C ATOM 147 CG GLN A 10 25.162 -3.286 -16.049 1.00 0.00 C ATOM 148 CD GLN A 10 24.666 -4.524 -16.785 1.00 0.00 C ATOM 149 OE1 GLN A 10 25.129 -5.633 -16.538 1.00 0.00 O ATOM 150 NE2 GLN A 10 23.714 -4.334 -17.695 1.00 0.00 N ATOM 0 H GLN A 10 23.254 -1.888 -12.887 1.00 0.00 H new ATOM 0 HA GLN A 10 25.302 -1.059 -14.694 1.00 0.00 H new ATOM 0 HB2 GLN A 10 24.468 -3.461 -14.016 1.00 0.00 H new ATOM 0 HB3 GLN A 10 23.189 -3.202 -15.185 1.00 0.00 H new ATOM 0 HG2 GLN A 10 25.252 -2.453 -16.747 1.00 0.00 H new ATOM 0 HG3 GLN A 10 26.157 -3.471 -15.644 1.00 0.00 H new ATOM 0 HE21 GLN A 10 23.356 -3.395 -17.870 1.00 0.00 H new ATOM 0 HE22 GLN A 10 23.342 -5.127 -18.217 1.00 0.00 H new ATOM 159 N GLY A 11 22.136 -0.760 -15.667 1.00 0.00 N ATOM 160 CA GLY A 11 21.282 -0.076 -16.626 1.00 0.00 C ATOM 161 C GLY A 11 21.278 1.425 -16.346 1.00 0.00 C ATOM 162 O GLY A 11 20.842 2.214 -17.181 1.00 0.00 O ATOM 0 H GLY A 11 21.632 -1.293 -14.958 1.00 0.00 H new ATOM 0 HA2 GLY A 11 21.636 -0.264 -17.639 1.00 0.00 H new ATOM 0 HA3 GLY A 11 20.267 -0.468 -16.565 1.00 0.00 H new ATOM 166 N ASN A 12 21.770 1.811 -15.164 1.00 0.00 N ATOM 167 CA ASN A 12 21.831 3.187 -14.697 1.00 0.00 C ATOM 168 C ASN A 12 22.673 4.046 -15.627 1.00 0.00 C ATOM 169 O ASN A 12 22.580 5.266 -15.567 1.00 0.00 O ATOM 170 CB ASN A 12 22.475 3.181 -13.315 1.00 0.00 C ATOM 171 CG ASN A 12 21.825 4.094 -12.288 1.00 0.00 C ATOM 172 OD1 ASN A 12 21.583 5.271 -12.538 1.00 0.00 O ATOM 173 ND2 ASN A 12 21.545 3.527 -11.117 1.00 0.00 N ATOM 0 H ASN A 12 22.148 1.147 -14.489 1.00 0.00 H new ATOM 0 HA ASN A 12 20.824 3.602 -14.669 1.00 0.00 H new ATOM 0 HB2 ASN A 12 22.460 2.161 -12.930 1.00 0.00 H new ATOM 0 HB3 ASN A 12 23.522 3.467 -13.419 1.00 0.00 H new ATOM 0 HD21 ASN A 12 21.109 4.076 -10.376 1.00 0.00 H new ATOM 0 HD22 ASN A 12 21.767 2.544 -10.960 1.00 0.00 H new ATOM 180 N SER A 13 23.488 3.424 -16.484 1.00 0.00 N ATOM 181 CA SER A 13 24.258 4.175 -17.462 1.00 0.00 C ATOM 182 C SER A 13 23.810 3.846 -18.880 1.00 0.00 C ATOM 183 O SER A 13 23.854 4.716 -19.746 1.00 0.00 O ATOM 184 CB SER A 13 25.745 3.906 -17.258 1.00 0.00 C ATOM 185 OG SER A 13 26.039 2.551 -17.521 1.00 0.00 O ATOM 0 H SER A 13 23.626 2.414 -16.516 1.00 0.00 H new ATOM 0 HA SER A 13 24.081 5.241 -17.316 1.00 0.00 H new ATOM 0 HB2 SER A 13 26.331 4.547 -17.917 1.00 0.00 H new ATOM 0 HB3 SER A 13 26.030 4.155 -16.236 1.00 0.00 H new ATOM 0 HG SER A 13 26.997 2.392 -17.388 1.00 0.00 H new ATOM 191 N LEU A 14 23.372 2.611 -19.146 1.00 0.00 N ATOM 192 CA LEU A 14 22.814 2.240 -20.435 1.00 0.00 C ATOM 193 C LEU A 14 21.660 3.166 -20.818 1.00 0.00 C ATOM 194 O LEU A 14 21.484 3.483 -21.993 1.00 0.00 O ATOM 195 CB LEU A 14 22.340 0.804 -20.312 1.00 0.00 C ATOM 196 CG LEU A 14 23.502 -0.153 -20.027 1.00 0.00 C ATOM 197 CD1 LEU A 14 23.219 -1.372 -20.870 1.00 0.00 C ATOM 198 CD2 LEU A 14 24.897 0.321 -20.442 1.00 0.00 C ATOM 0 H LEU A 14 23.398 1.847 -18.470 1.00 0.00 H new ATOM 0 HA LEU A 14 23.563 2.333 -21.222 1.00 0.00 H new ATOM 0 HB2 LEU A 14 21.604 0.731 -19.512 1.00 0.00 H new ATOM 0 HB3 LEU A 14 21.840 0.505 -21.233 1.00 0.00 H new ATOM 0 HG LEU A 14 23.539 -0.288 -18.946 1.00 0.00 H new ATOM 0 HD11 LEU A 14 24.009 -2.108 -20.722 1.00 0.00 H new ATOM 0 HD12 LEU A 14 22.262 -1.803 -20.577 1.00 0.00 H new ATOM 0 HD13 LEU A 14 23.182 -1.087 -21.921 1.00 0.00 H new ATOM 0 HD21 LEU A 14 25.632 -0.443 -20.188 1.00 0.00 H new ATOM 0 HD22 LEU A 14 24.916 0.499 -21.517 1.00 0.00 H new ATOM 0 HD23 LEU A 14 25.138 1.245 -19.917 1.00 0.00 H new ATOM 210 N PHE A 15 20.881 3.601 -19.825 1.00 0.00 N ATOM 211 CA PHE A 15 19.756 4.496 -20.036 1.00 0.00 C ATOM 212 C PHE A 15 20.247 5.882 -20.428 1.00 0.00 C ATOM 213 O PHE A 15 19.597 6.572 -21.208 1.00 0.00 O ATOM 214 CB PHE A 15 18.987 4.575 -18.721 1.00 0.00 C ATOM 215 CG PHE A 15 18.128 5.803 -18.537 1.00 0.00 C ATOM 216 CD1 PHE A 15 16.954 5.977 -19.283 1.00 0.00 C ATOM 217 CD2 PHE A 15 18.511 6.769 -17.599 1.00 0.00 C ATOM 218 CE1 PHE A 15 16.156 7.110 -19.076 1.00 0.00 C ATOM 219 CE2 PHE A 15 17.686 7.872 -17.349 1.00 0.00 C ATOM 220 CZ PHE A 15 16.519 8.053 -18.102 1.00 0.00 C ATOM 0 H PHE A 15 21.019 3.337 -18.849 1.00 0.00 H new ATOM 0 HA PHE A 15 19.120 4.124 -20.840 1.00 0.00 H new ATOM 0 HB2 PHE A 15 18.351 3.694 -18.640 1.00 0.00 H new ATOM 0 HB3 PHE A 15 19.702 4.528 -17.900 1.00 0.00 H new ATOM 0 HD1 PHE A 15 16.665 5.239 -20.016 1.00 0.00 H new ATOM 0 HD2 PHE A 15 19.445 6.663 -17.067 1.00 0.00 H new ATOM 0 HE1 PHE A 15 15.263 7.257 -19.665 1.00 0.00 H new ATOM 0 HE2 PHE A 15 17.949 8.581 -16.578 1.00 0.00 H new ATOM 0 HZ PHE A 15 15.897 8.920 -17.933 1.00 0.00 H new ATOM 230 N LYS A 16 21.395 6.292 -19.887 1.00 0.00 N ATOM 231 CA LYS A 16 21.915 7.628 -20.116 1.00 0.00 C ATOM 232 C LYS A 16 22.747 7.724 -21.399 1.00 0.00 C ATOM 233 O LYS A 16 23.144 8.821 -21.791 1.00 0.00 O ATOM 234 CB LYS A 16 22.756 8.032 -18.910 1.00 0.00 C ATOM 235 CG LYS A 16 22.055 7.615 -17.622 1.00 0.00 C ATOM 236 CD LYS A 16 22.814 8.146 -16.415 1.00 0.00 C ATOM 237 CE LYS A 16 22.522 9.630 -16.206 1.00 0.00 C ATOM 238 NZ LYS A 16 23.279 10.164 -15.056 1.00 0.00 N ATOM 0 H LYS A 16 21.979 5.711 -19.286 1.00 0.00 H new ATOM 0 HA LYS A 16 21.072 8.307 -20.243 1.00 0.00 H new ATOM 0 HB2 LYS A 16 23.738 7.563 -18.968 1.00 0.00 H new ATOM 0 HB3 LYS A 16 22.917 9.110 -18.913 1.00 0.00 H new ATOM 0 HG2 LYS A 16 21.034 7.996 -17.615 1.00 0.00 H new ATOM 0 HG3 LYS A 16 21.990 6.528 -17.570 1.00 0.00 H new ATOM 0 HD2 LYS A 16 22.530 7.585 -15.525 1.00 0.00 H new ATOM 0 HD3 LYS A 16 23.884 7.997 -16.557 1.00 0.00 H new ATOM 0 HE2 LYS A 16 22.783 10.186 -17.107 1.00 0.00 H new ATOM 0 HE3 LYS A 16 21.454 9.774 -16.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 23.062 11.174 -14.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 23.011 9.648 -14.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 24.298 10.047 -15.227 1.00 0.00 H new ATOM 252 N GLN A 17 23.019 6.590 -22.058 1.00 0.00 N ATOM 253 CA GLN A 17 23.879 6.528 -23.230 1.00 0.00 C ATOM 254 C GLN A 17 23.093 6.637 -24.528 1.00 0.00 C ATOM 255 O GLN A 17 23.647 7.060 -25.540 1.00 0.00 O ATOM 256 CB GLN A 17 24.601 5.183 -23.229 1.00 0.00 C ATOM 257 CG GLN A 17 25.795 5.234 -22.279 1.00 0.00 C ATOM 258 CD GLN A 17 26.655 3.988 -22.424 1.00 0.00 C ATOM 259 OE1 GLN A 17 27.766 4.041 -22.945 1.00 0.00 O ATOM 260 NE2 GLN A 17 26.138 2.857 -21.964 1.00 0.00 N ATOM 0 H GLN A 17 22.640 5.684 -21.783 1.00 0.00 H new ATOM 0 HA GLN A 17 24.573 7.367 -23.179 1.00 0.00 H new ATOM 0 HB2 GLN A 17 23.915 4.393 -22.923 1.00 0.00 H new ATOM 0 HB3 GLN A 17 24.937 4.940 -24.237 1.00 0.00 H new ATOM 0 HG2 GLN A 17 26.394 6.121 -22.488 1.00 0.00 H new ATOM 0 HG3 GLN A 17 25.444 5.321 -21.251 1.00 0.00 H new ATOM 0 HE21 GLN A 17 25.211 2.856 -21.538 1.00 0.00 H new ATOM 0 HE22 GLN A 17 26.667 1.988 -22.036 1.00 0.00 H new ATOM 269 N GLY A 18 21.812 6.261 -24.510 1.00 0.00 N ATOM 270 CA GLY A 18 21.010 6.261 -25.726 1.00 0.00 C ATOM 271 C GLY A 18 20.151 5.027 -25.864 1.00 0.00 C ATOM 272 O GLY A 18 19.141 5.025 -26.568 1.00 0.00 O ATOM 0 H GLY A 18 21.315 5.956 -23.673 1.00 0.00 H new ATOM 0 HA2 GLY A 18 20.372 7.144 -25.734 1.00 0.00 H new ATOM 0 HA3 GLY A 18 21.670 6.337 -26.590 1.00 0.00 H new ATOM 276 N LEU A 19 20.573 3.973 -25.179 1.00 0.00 N ATOM 277 CA LEU A 19 20.031 2.653 -25.373 1.00 0.00 C ATOM 278 C LEU A 19 19.109 2.308 -24.221 1.00 0.00 C ATOM 279 O LEU A 19 19.318 1.375 -23.451 1.00 0.00 O ATOM 280 CB LEU A 19 21.147 1.660 -25.656 1.00 0.00 C ATOM 281 CG LEU A 19 22.503 1.885 -24.971 1.00 0.00 C ATOM 282 CD1 LEU A 19 22.566 1.053 -23.698 1.00 0.00 C ATOM 283 CD2 LEU A 19 23.643 1.427 -25.880 1.00 0.00 C ATOM 0 H LEU A 19 21.306 4.020 -24.471 1.00 0.00 H new ATOM 0 HA LEU A 19 19.402 2.608 -26.262 1.00 0.00 H new ATOM 0 HB2 LEU A 19 20.791 0.669 -25.375 1.00 0.00 H new ATOM 0 HB3 LEU A 19 21.315 1.645 -26.733 1.00 0.00 H new ATOM 0 HG LEU A 19 22.605 2.948 -24.752 1.00 0.00 H new ATOM 0 HD11 LEU A 19 23.527 1.210 -23.208 1.00 0.00 H new ATOM 0 HD12 LEU A 19 21.763 1.355 -23.026 1.00 0.00 H new ATOM 0 HD13 LEU A 19 22.453 -0.002 -23.947 1.00 0.00 H new ATOM 0 HD21 LEU A 19 24.597 1.593 -25.379 1.00 0.00 H new ATOM 0 HD22 LEU A 19 23.529 0.366 -26.100 1.00 0.00 H new ATOM 0 HD23 LEU A 19 23.617 1.995 -26.810 1.00 0.00 H new ATOM 295 N TYR A 20 18.071 3.132 -24.146 1.00 0.00 N ATOM 296 CA TYR A 20 17.027 3.073 -23.152 1.00 0.00 C ATOM 297 C TYR A 20 16.519 1.659 -22.978 1.00 0.00 C ATOM 298 O TYR A 20 16.279 1.257 -21.849 1.00 0.00 O ATOM 299 CB TYR A 20 15.909 3.983 -23.645 1.00 0.00 C ATOM 300 CG TYR A 20 16.452 5.326 -24.064 1.00 0.00 C ATOM 301 CD1 TYR A 20 17.243 6.053 -23.163 1.00 0.00 C ATOM 302 CD2 TYR A 20 16.192 5.831 -25.348 1.00 0.00 C ATOM 303 CE1 TYR A 20 17.788 7.286 -23.554 1.00 0.00 C ATOM 304 CE2 TYR A 20 16.730 7.066 -25.739 1.00 0.00 C ATOM 305 CZ TYR A 20 17.534 7.794 -24.841 1.00 0.00 C ATOM 306 OH TYR A 20 18.066 8.992 -25.216 1.00 0.00 O ATOM 0 H TYR A 20 17.936 3.893 -24.812 1.00 0.00 H new ATOM 0 HA TYR A 20 17.402 3.394 -22.180 1.00 0.00 H new ATOM 0 HB2 TYR A 20 15.398 3.515 -24.486 1.00 0.00 H new ATOM 0 HB3 TYR A 20 15.169 4.116 -22.856 1.00 0.00 H new ATOM 0 HD1 TYR A 20 17.432 5.666 -22.173 1.00 0.00 H new ATOM 0 HD2 TYR A 20 15.577 5.268 -26.035 1.00 0.00 H new ATOM 0 HE1 TYR A 20 18.404 7.846 -22.865 1.00 0.00 H new ATOM 0 HE2 TYR A 20 16.528 7.457 -26.725 1.00 0.00 H new ATOM 0 HH TYR A 20 17.795 9.197 -26.135 1.00 0.00 H new ATOM 316 N ARG A 21 16.352 0.910 -24.075 1.00 0.00 N ATOM 317 CA ARG A 21 15.764 -0.416 -24.023 1.00 0.00 C ATOM 318 C ARG A 21 16.735 -1.374 -23.362 1.00 0.00 C ATOM 319 O ARG A 21 16.328 -2.192 -22.546 1.00 0.00 O ATOM 320 CB ARG A 21 15.502 -0.881 -25.453 1.00 0.00 C ATOM 321 CG ARG A 21 14.270 -1.770 -25.556 1.00 0.00 C ATOM 322 CD ARG A 21 14.185 -2.866 -24.491 1.00 0.00 C ATOM 323 NE ARG A 21 12.998 -3.700 -24.707 1.00 0.00 N ATOM 324 CZ ARG A 21 12.742 -4.832 -24.046 1.00 0.00 C ATOM 325 NH1 ARG A 21 13.582 -5.290 -23.124 1.00 0.00 N ATOM 326 NH2 ARG A 21 11.632 -5.512 -24.310 1.00 0.00 N ATOM 0 H ARG A 21 16.621 1.211 -25.012 1.00 0.00 H new ATOM 0 HA ARG A 21 14.835 -0.391 -23.453 1.00 0.00 H new ATOM 0 HB2 ARG A 21 15.374 -0.011 -26.098 1.00 0.00 H new ATOM 0 HB3 ARG A 21 16.372 -1.425 -25.821 1.00 0.00 H new ATOM 0 HG2 ARG A 21 13.380 -1.145 -25.487 1.00 0.00 H new ATOM 0 HG3 ARG A 21 14.256 -2.237 -26.541 1.00 0.00 H new ATOM 0 HD2 ARG A 21 15.082 -3.484 -24.524 1.00 0.00 H new ATOM 0 HD3 ARG A 21 14.145 -2.416 -23.499 1.00 0.00 H new ATOM 0 HE ARG A 21 12.323 -3.395 -25.409 1.00 0.00 H new ATOM 0 HH11 ARG A 21 14.437 -4.775 -22.912 1.00 0.00 H new ATOM 0 HH12 ARG A 21 13.372 -6.156 -22.628 1.00 0.00 H new ATOM 0 HH21 ARG A 21 10.979 -5.169 -25.015 1.00 0.00 H new ATOM 0 HH22 ARG A 21 11.432 -6.377 -23.808 1.00 0.00 H new ATOM 340 N GLU A 22 18.019 -1.271 -23.710 1.00 0.00 N ATOM 341 CA GLU A 22 19.039 -2.121 -23.110 1.00 0.00 C ATOM 342 C GLU A 22 19.120 -1.853 -21.613 1.00 0.00 C ATOM 343 O GLU A 22 19.564 -2.708 -20.849 1.00 0.00 O ATOM 344 CB GLU A 22 20.393 -1.853 -23.763 1.00 0.00 C ATOM 345 CG GLU A 22 20.333 -2.127 -25.266 1.00 0.00 C ATOM 346 CD GLU A 22 21.697 -2.001 -25.942 1.00 0.00 C ATOM 347 OE1 GLU A 22 22.691 -2.485 -25.353 1.00 0.00 O ATOM 348 OE2 GLU A 22 21.738 -1.420 -27.052 1.00 0.00 O ATOM 0 H GLU A 22 18.372 -0.609 -24.401 1.00 0.00 H new ATOM 0 HA GLU A 22 18.771 -3.165 -23.270 1.00 0.00 H new ATOM 0 HB2 GLU A 22 20.688 -0.818 -23.589 1.00 0.00 H new ATOM 0 HB3 GLU A 22 21.155 -2.483 -23.304 1.00 0.00 H new ATOM 0 HG2 GLU A 22 19.940 -3.130 -25.433 1.00 0.00 H new ATOM 0 HG3 GLU A 22 19.636 -1.430 -25.731 1.00 0.00 H new ATOM 355 N ALA A 23 18.689 -0.662 -21.190 1.00 0.00 N ATOM 356 CA ALA A 23 18.675 -0.300 -19.787 1.00 0.00 C ATOM 357 C ALA A 23 17.521 -1.014 -19.076 1.00 0.00 C ATOM 358 O ALA A 23 17.677 -1.487 -17.952 1.00 0.00 O ATOM 359 CB ALA A 23 18.534 1.221 -19.695 1.00 0.00 C ATOM 0 H ALA A 23 18.344 0.068 -21.813 1.00 0.00 H new ATOM 0 HA ALA A 23 19.599 -0.607 -19.296 1.00 0.00 H new ATOM 0 HB1 ALA A 23 18.521 1.522 -18.648 1.00 0.00 H new ATOM 0 HB2 ALA A 23 19.376 1.696 -20.198 1.00 0.00 H new ATOM 0 HB3 ALA A 23 17.605 1.530 -20.173 1.00 0.00 H new ATOM 365 N VAL A 24 16.357 -1.096 -19.728 1.00 0.00 N ATOM 366 CA VAL A 24 15.152 -1.690 -19.191 1.00 0.00 C ATOM 367 C VAL A 24 15.327 -3.184 -19.094 1.00 0.00 C ATOM 368 O VAL A 24 14.775 -3.870 -18.243 1.00 0.00 O ATOM 369 CB VAL A 24 13.955 -1.404 -20.090 1.00 0.00 C ATOM 370 CG1 VAL A 24 14.104 -0.144 -20.903 1.00 0.00 C ATOM 371 CG2 VAL A 24 13.434 -2.570 -20.903 1.00 0.00 C ATOM 0 H VAL A 24 16.235 -0.736 -20.674 1.00 0.00 H new ATOM 0 HA VAL A 24 14.972 -1.258 -18.206 1.00 0.00 H new ATOM 0 HB VAL A 24 13.156 -1.224 -19.370 1.00 0.00 H new ATOM 0 HG11 VAL A 24 13.217 -0.002 -21.520 1.00 0.00 H new ATOM 0 HG12 VAL A 24 14.222 0.709 -20.234 1.00 0.00 H new ATOM 0 HG13 VAL A 24 14.982 -0.226 -21.544 1.00 0.00 H new ATOM 0 HG21 VAL A 24 12.583 -2.245 -21.502 1.00 0.00 H new ATOM 0 HG22 VAL A 24 14.222 -2.936 -21.561 1.00 0.00 H new ATOM 0 HG23 VAL A 24 13.121 -3.370 -20.232 1.00 0.00 H new ATOM 381 N HIS A 25 16.131 -3.656 -20.028 1.00 0.00 N ATOM 382 CA HIS A 25 16.446 -5.046 -20.216 1.00 0.00 C ATOM 383 C HIS A 25 17.155 -5.648 -19.003 1.00 0.00 C ATOM 384 O HIS A 25 17.351 -6.860 -18.940 1.00 0.00 O ATOM 385 CB HIS A 25 17.301 -5.142 -21.464 1.00 0.00 C ATOM 386 CG HIS A 25 16.894 -6.246 -22.393 1.00 0.00 C ATOM 387 ND1 HIS A 25 16.636 -7.576 -22.062 1.00 0.00 N ATOM 388 CD2 HIS A 25 16.687 -6.063 -23.727 1.00 0.00 C ATOM 389 CE1 HIS A 25 16.263 -8.153 -23.217 1.00 0.00 C ATOM 390 NE2 HIS A 25 16.296 -7.276 -24.233 1.00 0.00 N ATOM 0 H HIS A 25 16.599 -3.049 -20.701 1.00 0.00 H new ATOM 0 HA HIS A 25 15.529 -5.624 -20.331 1.00 0.00 H new ATOM 0 HB2 HIS A 25 17.254 -4.194 -21.999 1.00 0.00 H new ATOM 0 HB3 HIS A 25 18.340 -5.291 -21.171 1.00 0.00 H new ATOM 0 HD2 HIS A 25 16.807 -5.142 -24.278 1.00 0.00 H new ATOM 0 HE1 HIS A 25 15.974 -9.189 -23.315 1.00 0.00 H new ATOM 0 HE2 HIS A 25 16.070 -7.476 -25.207 1.00 0.00 H new ATOM 398 N CYS A 26 17.534 -4.799 -18.039 1.00 0.00 N ATOM 399 CA CYS A 26 18.116 -5.224 -16.772 1.00 0.00 C ATOM 400 C CYS A 26 17.256 -4.688 -15.626 1.00 0.00 C ATOM 401 O CYS A 26 17.194 -5.280 -14.549 1.00 0.00 O ATOM 402 CB CYS A 26 19.555 -4.716 -16.666 1.00 0.00 C ATOM 403 SG CYS A 26 20.537 -5.405 -18.025 1.00 0.00 S ATOM 0 H CYS A 26 17.441 -3.787 -18.124 1.00 0.00 H new ATOM 0 HA CYS A 26 18.139 -6.312 -16.715 1.00 0.00 H new ATOM 0 HB2 CYS A 26 19.572 -3.627 -16.706 1.00 0.00 H new ATOM 0 HB3 CYS A 26 19.985 -5.007 -15.708 1.00 0.00 H new ATOM 0 HG CYS A 26 21.630 -5.925 -17.550 1.00 0.00 H new ATOM 409 N TYR A 27 16.589 -3.557 -15.874 1.00 0.00 N ATOM 410 CA TYR A 27 15.580 -2.986 -14.996 1.00 0.00 C ATOM 411 C TYR A 27 14.435 -3.968 -14.795 1.00 0.00 C ATOM 412 O TYR A 27 13.840 -4.006 -13.724 1.00 0.00 O ATOM 413 CB TYR A 27 15.011 -1.766 -15.711 1.00 0.00 C ATOM 414 CG TYR A 27 15.903 -0.554 -15.849 1.00 0.00 C ATOM 415 CD1 TYR A 27 17.123 -0.457 -15.166 1.00 0.00 C ATOM 416 CD2 TYR A 27 15.472 0.491 -16.674 1.00 0.00 C ATOM 417 CE1 TYR A 27 17.910 0.696 -15.314 1.00 0.00 C ATOM 418 CE2 TYR A 27 16.242 1.643 -16.819 1.00 0.00 C ATOM 419 CZ TYR A 27 17.469 1.751 -16.141 1.00 0.00 C ATOM 420 OH TYR A 27 18.224 2.872 -16.274 1.00 0.00 O ATOM 0 H TYR A 27 16.745 -3.003 -16.716 1.00 0.00 H new ATOM 0 HA TYR A 27 16.023 -2.742 -14.031 1.00 0.00 H new ATOM 0 HB2 TYR A 27 14.707 -2.075 -16.711 1.00 0.00 H new ATOM 0 HB3 TYR A 27 14.107 -1.459 -15.184 1.00 0.00 H new ATOM 0 HD1 TYR A 27 17.455 -1.264 -14.530 1.00 0.00 H new ATOM 0 HD2 TYR A 27 14.534 0.404 -17.203 1.00 0.00 H new ATOM 0 HE1 TYR A 27 18.854 0.776 -14.795 1.00 0.00 H new ATOM 0 HE2 TYR A 27 15.898 2.450 -17.449 1.00 0.00 H new ATOM 0 HH TYR A 27 19.068 2.647 -16.719 1.00 0.00 H new ATOM 430 N ASP A 28 14.124 -4.762 -15.820 1.00 0.00 N ATOM 431 CA ASP A 28 13.012 -5.694 -15.793 1.00 0.00 C ATOM 432 C ASP A 28 13.223 -6.745 -14.705 1.00 0.00 C ATOM 433 O ASP A 28 12.256 -7.262 -14.146 1.00 0.00 O ATOM 434 CB ASP A 28 12.872 -6.346 -17.166 1.00 0.00 C ATOM 435 CG ASP A 28 11.633 -7.233 -17.234 1.00 0.00 C ATOM 436 OD1 ASP A 28 10.521 -6.660 -17.275 1.00 0.00 O ATOM 437 OD2 ASP A 28 11.805 -8.472 -17.244 1.00 0.00 O ATOM 0 H ASP A 28 14.645 -4.771 -16.697 1.00 0.00 H new ATOM 0 HA ASP A 28 12.092 -5.158 -15.560 1.00 0.00 H new ATOM 0 HB2 ASP A 28 12.812 -5.574 -17.933 1.00 0.00 H new ATOM 0 HB3 ASP A 28 13.760 -6.941 -17.381 1.00 0.00 H new ATOM 442 N GLN A 29 14.485 -7.063 -14.393 1.00 0.00 N ATOM 443 CA GLN A 29 14.776 -8.011 -13.340 1.00 0.00 C ATOM 444 C GLN A 29 14.650 -7.377 -11.955 1.00 0.00 C ATOM 445 O GLN A 29 14.626 -8.097 -10.961 1.00 0.00 O ATOM 446 CB GLN A 29 16.160 -8.625 -13.531 1.00 0.00 C ATOM 447 CG GLN A 29 16.200 -9.469 -14.809 1.00 0.00 C ATOM 448 CD GLN A 29 16.808 -8.720 -15.987 1.00 0.00 C ATOM 449 OE1 GLN A 29 18.016 -8.521 -16.040 1.00 0.00 O ATOM 450 NE2 GLN A 29 15.980 -8.302 -16.943 1.00 0.00 N ATOM 0 H GLN A 29 15.307 -6.675 -14.857 1.00 0.00 H new ATOM 0 HA GLN A 29 14.034 -8.807 -13.403 1.00 0.00 H new ATOM 0 HB2 GLN A 29 16.910 -7.836 -13.585 1.00 0.00 H new ATOM 0 HB3 GLN A 29 16.411 -9.245 -12.670 1.00 0.00 H new ATOM 0 HG2 GLN A 29 16.776 -10.376 -14.623 1.00 0.00 H new ATOM 0 HG3 GLN A 29 15.188 -9.781 -15.065 1.00 0.00 H new ATOM 0 HE21 GLN A 29 14.979 -8.485 -16.867 1.00 0.00 H new ATOM 0 HE22 GLN A 29 16.347 -7.799 -17.751 1.00 0.00 H new ATOM 459 N LEU A 30 14.563 -6.042 -11.864 1.00 0.00 N ATOM 460 CA LEU A 30 14.294 -5.389 -10.590 1.00 0.00 C ATOM 461 C LEU A 30 12.862 -5.688 -10.188 1.00 0.00 C ATOM 462 O LEU A 30 12.571 -5.887 -9.012 1.00 0.00 O ATOM 463 CB LEU A 30 14.439 -3.873 -10.723 1.00 0.00 C ATOM 464 CG LEU A 30 15.803 -3.452 -11.261 1.00 0.00 C ATOM 465 CD1 LEU A 30 15.945 -1.934 -11.185 1.00 0.00 C ATOM 466 CD2 LEU A 30 16.940 -4.100 -10.479 1.00 0.00 C ATOM 0 H LEU A 30 14.675 -5.405 -12.653 1.00 0.00 H new ATOM 0 HA LEU A 30 15.002 -5.758 -9.848 1.00 0.00 H new ATOM 0 HB2 LEU A 30 13.660 -3.495 -11.386 1.00 0.00 H new ATOM 0 HB3 LEU A 30 14.280 -3.411 -9.749 1.00 0.00 H new ATOM 0 HG LEU A 30 15.866 -3.784 -12.297 1.00 0.00 H new ATOM 0 HD11 LEU A 30 16.921 -1.640 -11.571 1.00 0.00 H new ATOM 0 HD12 LEU A 30 15.163 -1.465 -11.782 1.00 0.00 H new ATOM 0 HD13 LEU A 30 15.853 -1.611 -10.148 1.00 0.00 H new ATOM 0 HD21 LEU A 30 17.896 -3.776 -10.891 1.00 0.00 H new ATOM 0 HD22 LEU A 30 16.877 -3.803 -9.432 1.00 0.00 H new ATOM 0 HD23 LEU A 30 16.861 -5.185 -10.554 1.00 0.00 H new ATOM 478 N ILE A 31 11.966 -5.717 -11.175 1.00 0.00 N ATOM 479 CA ILE A 31 10.575 -6.015 -10.910 1.00 0.00 C ATOM 480 C ILE A 31 10.411 -7.509 -10.674 1.00 0.00 C ATOM 481 O ILE A 31 9.624 -7.932 -9.842 1.00 0.00 O ATOM 482 CB ILE A 31 9.682 -5.572 -12.073 1.00 0.00 C ATOM 483 CG1 ILE A 31 9.920 -4.120 -12.484 1.00 0.00 C ATOM 484 CG2 ILE A 31 8.262 -5.651 -11.553 1.00 0.00 C ATOM 485 CD1 ILE A 31 10.687 -4.054 -13.793 1.00 0.00 C ATOM 0 H ILE A 31 12.185 -5.538 -12.155 1.00 0.00 H new ATOM 0 HA ILE A 31 10.269 -5.465 -10.020 1.00 0.00 H new ATOM 0 HB ILE A 31 9.888 -6.203 -12.937 1.00 0.00 H new ATOM 0 HG12 ILE A 31 8.965 -3.605 -12.589 1.00 0.00 H new ATOM 0 HG13 ILE A 31 10.477 -3.602 -11.703 1.00 0.00 H new ATOM 0 HG21 ILE A 31 7.570 -5.346 -12.338 1.00 0.00 H new ATOM 0 HG22 ILE A 31 8.041 -6.675 -11.252 1.00 0.00 H new ATOM 0 HG23 ILE A 31 8.152 -4.989 -10.694 1.00 0.00 H new ATOM 0 HD11 ILE A 31 10.847 -3.012 -14.069 1.00 0.00 H new ATOM 0 HD12 ILE A 31 11.650 -4.550 -13.676 1.00 0.00 H new ATOM 0 HD13 ILE A 31 10.115 -4.553 -14.575 1.00 0.00 H new ATOM 497 N THR A 32 11.145 -8.342 -11.393 1.00 0.00 N ATOM 498 CA THR A 32 11.011 -9.774 -11.179 1.00 0.00 C ATOM 499 C THR A 32 11.685 -10.211 -9.879 1.00 0.00 C ATOM 500 O THR A 32 11.283 -11.214 -9.291 1.00 0.00 O ATOM 501 CB THR A 32 11.652 -10.469 -12.378 1.00 0.00 C ATOM 502 OG1 THR A 32 10.870 -10.242 -13.529 1.00 0.00 O ATOM 503 CG2 THR A 32 11.845 -11.970 -12.206 1.00 0.00 C ATOM 0 H THR A 32 11.819 -8.065 -12.107 1.00 0.00 H new ATOM 0 HA THR A 32 9.959 -10.043 -11.089 1.00 0.00 H new ATOM 0 HB THR A 32 12.647 -10.035 -12.474 1.00 0.00 H new ATOM 0 HG1 THR A 32 11.283 -10.687 -14.298 1.00 0.00 H new ATOM 0 HG21 THR A 32 12.306 -12.383 -13.103 1.00 0.00 H new ATOM 0 HG22 THR A 32 12.490 -12.158 -11.348 1.00 0.00 H new ATOM 0 HG23 THR A 32 10.877 -12.445 -12.044 1.00 0.00 H new ATOM 511 N ALA A 33 12.701 -9.476 -9.418 1.00 0.00 N ATOM 512 CA ALA A 33 13.348 -9.799 -8.158 1.00 0.00 C ATOM 513 C ALA A 33 12.584 -9.174 -6.996 1.00 0.00 C ATOM 514 O ALA A 33 12.599 -9.700 -5.884 1.00 0.00 O ATOM 515 CB ALA A 33 14.779 -9.261 -8.157 1.00 0.00 C ATOM 0 H ALA A 33 13.085 -8.662 -9.898 1.00 0.00 H new ATOM 0 HA ALA A 33 13.359 -10.883 -8.043 1.00 0.00 H new ATOM 0 HB1 ALA A 33 15.259 -9.506 -7.210 1.00 0.00 H new ATOM 0 HB2 ALA A 33 15.339 -9.714 -8.975 1.00 0.00 H new ATOM 0 HB3 ALA A 33 14.761 -8.179 -8.285 1.00 0.00 H new ATOM 521 N GLN A 34 11.920 -8.051 -7.268 1.00 0.00 N ATOM 522 CA GLN A 34 11.156 -7.319 -6.287 1.00 0.00 C ATOM 523 C GLN A 34 9.959 -6.671 -6.972 1.00 0.00 C ATOM 524 O GLN A 34 9.914 -5.463 -7.188 1.00 0.00 O ATOM 525 CB GLN A 34 12.112 -6.299 -5.688 1.00 0.00 C ATOM 526 CG GLN A 34 11.900 -6.015 -4.204 1.00 0.00 C ATOM 527 CD GLN A 34 13.204 -5.440 -3.673 1.00 0.00 C ATOM 528 OE1 GLN A 34 13.513 -5.533 -2.490 1.00 0.00 O ATOM 529 NE2 GLN A 34 13.974 -4.843 -4.580 1.00 0.00 N ATOM 0 H GLN A 34 11.905 -7.626 -8.195 1.00 0.00 H new ATOM 0 HA GLN A 34 10.755 -7.952 -5.496 1.00 0.00 H new ATOM 0 HB2 GLN A 34 13.133 -6.651 -5.834 1.00 0.00 H new ATOM 0 HB3 GLN A 34 12.015 -5.364 -6.240 1.00 0.00 H new ATOM 0 HG2 GLN A 34 11.080 -5.311 -4.059 1.00 0.00 H new ATOM 0 HG3 GLN A 34 11.635 -6.928 -3.670 1.00 0.00 H new ATOM 0 HE21 GLN A 34 13.671 -4.792 -5.553 1.00 0.00 H new ATOM 0 HE22 GLN A 34 14.867 -4.436 -4.302 1.00 0.00 H new ATOM 538 N PRO A 35 8.977 -7.495 -7.323 1.00 0.00 N ATOM 539 CA PRO A 35 7.803 -7.081 -8.075 1.00 0.00 C ATOM 540 C PRO A 35 6.932 -6.157 -7.252 1.00 0.00 C ATOM 541 O PRO A 35 6.008 -5.516 -7.748 1.00 0.00 O ATOM 542 CB PRO A 35 7.122 -8.379 -8.478 1.00 0.00 C ATOM 543 CG PRO A 35 7.797 -9.502 -7.691 1.00 0.00 C ATOM 544 CD PRO A 35 8.988 -8.897 -6.989 1.00 0.00 C ATOM 0 HA PRO A 35 8.044 -6.493 -8.961 1.00 0.00 H new ATOM 0 HB2 PRO A 35 6.056 -8.340 -8.256 1.00 0.00 H new ATOM 0 HB3 PRO A 35 7.218 -8.548 -9.550 1.00 0.00 H new ATOM 0 HG2 PRO A 35 7.105 -9.937 -6.970 1.00 0.00 H new ATOM 0 HG3 PRO A 35 8.110 -10.306 -8.358 1.00 0.00 H new ATOM 0 HD2 PRO A 35 8.920 -9.042 -5.911 1.00 0.00 H new ATOM 0 HD3 PRO A 35 9.915 -9.369 -7.316 1.00 0.00 H new ATOM 552 N GLN A 36 7.272 -6.115 -5.972 1.00 0.00 N ATOM 553 CA GLN A 36 6.748 -5.151 -5.025 1.00 0.00 C ATOM 554 C GLN A 36 7.770 -4.065 -4.685 1.00 0.00 C ATOM 555 O GLN A 36 7.964 -3.718 -3.519 1.00 0.00 O ATOM 556 CB GLN A 36 6.201 -5.836 -3.774 1.00 0.00 C ATOM 557 CG GLN A 36 5.172 -6.913 -4.100 1.00 0.00 C ATOM 558 CD GLN A 36 5.742 -8.290 -3.792 1.00 0.00 C ATOM 559 OE1 GLN A 36 5.462 -8.877 -2.751 1.00 0.00 O ATOM 560 NE2 GLN A 36 6.555 -8.817 -4.703 1.00 0.00 N ATOM 0 H GLN A 36 7.936 -6.768 -5.556 1.00 0.00 H new ATOM 0 HA GLN A 36 5.911 -4.648 -5.509 1.00 0.00 H new ATOM 0 HB2 GLN A 36 7.026 -6.282 -3.218 1.00 0.00 H new ATOM 0 HB3 GLN A 36 5.746 -5.089 -3.124 1.00 0.00 H new ATOM 0 HG2 GLN A 36 4.265 -6.748 -3.519 1.00 0.00 H new ATOM 0 HG3 GLN A 36 4.892 -6.853 -5.152 1.00 0.00 H new ATOM 0 HE21 GLN A 36 6.766 -8.301 -5.557 1.00 0.00 H new ATOM 0 HE22 GLN A 36 6.967 -9.737 -4.547 1.00 0.00 H new ATOM 569 N ASN A 37 8.424 -3.526 -5.716 1.00 0.00 N ATOM 570 CA ASN A 37 9.356 -2.411 -5.605 1.00 0.00 C ATOM 571 C ASN A 37 9.097 -1.465 -6.771 1.00 0.00 C ATOM 572 O ASN A 37 8.911 -1.912 -7.903 1.00 0.00 O ATOM 573 CB ASN A 37 10.794 -2.929 -5.625 1.00 0.00 C ATOM 574 CG ASN A 37 11.529 -2.531 -6.889 1.00 0.00 C ATOM 575 OD1 ASN A 37 12.226 -1.525 -6.928 1.00 0.00 O ATOM 576 ND2 ASN A 37 11.370 -3.326 -7.936 1.00 0.00 N ATOM 0 H ASN A 37 8.315 -3.864 -6.672 1.00 0.00 H new ATOM 0 HA ASN A 37 9.212 -1.879 -4.664 1.00 0.00 H new ATOM 0 HB2 ASN A 37 11.330 -2.542 -4.758 1.00 0.00 H new ATOM 0 HB3 ASN A 37 10.788 -4.015 -5.537 1.00 0.00 H new ATOM 0 HD21 ASN A 37 11.837 -3.109 -8.816 1.00 0.00 H new ATOM 0 HD22 ASN A 37 10.780 -4.155 -7.862 1.00 0.00 H new ATOM 583 N PRO A 38 9.087 -0.157 -6.513 1.00 0.00 N ATOM 584 CA PRO A 38 8.837 0.834 -7.535 1.00 0.00 C ATOM 585 C PRO A 38 9.998 1.084 -8.484 1.00 0.00 C ATOM 586 O PRO A 38 9.755 1.069 -9.684 1.00 0.00 O ATOM 587 CB PRO A 38 8.637 2.118 -6.772 1.00 0.00 C ATOM 588 CG PRO A 38 8.519 1.768 -5.297 1.00 0.00 C ATOM 589 CD PRO A 38 9.277 0.458 -5.217 1.00 0.00 C ATOM 0 HA PRO A 38 8.003 0.491 -8.146 1.00 0.00 H new ATOM 0 HB2 PRO A 38 9.475 2.796 -6.938 1.00 0.00 H new ATOM 0 HB3 PRO A 38 7.739 2.631 -7.116 1.00 0.00 H new ATOM 0 HG2 PRO A 38 8.962 2.534 -4.660 1.00 0.00 H new ATOM 0 HG3 PRO A 38 7.480 1.657 -4.987 1.00 0.00 H new ATOM 0 HD2 PRO A 38 10.334 0.624 -5.009 1.00 0.00 H new ATOM 0 HD3 PRO A 38 8.891 -0.175 -4.418 1.00 0.00 H new ATOM 597 N VAL A 39 11.238 1.314 -8.012 1.00 0.00 N ATOM 598 CA VAL A 39 12.368 1.556 -8.894 1.00 0.00 C ATOM 599 C VAL A 39 12.369 0.646 -10.111 1.00 0.00 C ATOM 600 O VAL A 39 12.772 1.032 -11.202 1.00 0.00 O ATOM 601 CB VAL A 39 13.693 1.426 -8.149 1.00 0.00 C ATOM 602 CG1 VAL A 39 13.636 1.450 -6.632 1.00 0.00 C ATOM 603 CG2 VAL A 39 14.610 0.343 -8.699 1.00 0.00 C ATOM 0 H VAL A 39 11.471 1.335 -7.019 1.00 0.00 H new ATOM 0 HA VAL A 39 12.257 2.581 -9.248 1.00 0.00 H new ATOM 0 HB VAL A 39 14.167 2.379 -8.382 1.00 0.00 H new ATOM 0 HG11 VAL A 39 14.643 1.349 -6.228 1.00 0.00 H new ATOM 0 HG12 VAL A 39 13.204 2.394 -6.299 1.00 0.00 H new ATOM 0 HG13 VAL A 39 13.019 0.624 -6.278 1.00 0.00 H new ATOM 0 HG21 VAL A 39 15.530 0.314 -8.115 1.00 0.00 H new ATOM 0 HG22 VAL A 39 14.110 -0.624 -8.636 1.00 0.00 H new ATOM 0 HG23 VAL A 39 14.847 0.561 -9.740 1.00 0.00 H new ATOM 613 N GLY A 40 11.901 -0.571 -9.879 1.00 0.00 N ATOM 614 CA GLY A 40 11.740 -1.584 -10.912 1.00 0.00 C ATOM 615 C GLY A 40 10.922 -1.012 -12.062 1.00 0.00 C ATOM 616 O GLY A 40 11.394 -0.949 -13.196 1.00 0.00 O ATOM 0 H GLY A 40 11.617 -0.888 -8.952 1.00 0.00 H new ATOM 0 HA2 GLY A 40 12.716 -1.909 -11.272 1.00 0.00 H new ATOM 0 HA3 GLY A 40 11.243 -2.463 -10.500 1.00 0.00 H new ATOM 620 N TYR A 41 9.694 -0.590 -11.762 1.00 0.00 N ATOM 621 CA TYR A 41 8.819 0.056 -12.712 1.00 0.00 C ATOM 622 C TYR A 41 9.386 1.414 -13.099 1.00 0.00 C ATOM 623 O TYR A 41 9.213 1.851 -14.230 1.00 0.00 O ATOM 624 CB TYR A 41 7.482 0.252 -12.001 1.00 0.00 C ATOM 625 CG TYR A 41 6.838 -1.034 -11.554 1.00 0.00 C ATOM 626 CD1 TYR A 41 6.178 -1.855 -12.476 1.00 0.00 C ATOM 627 CD2 TYR A 41 6.918 -1.402 -10.207 1.00 0.00 C ATOM 628 CE1 TYR A 41 5.605 -3.062 -12.051 1.00 0.00 C ATOM 629 CE2 TYR A 41 6.362 -2.616 -9.775 1.00 0.00 C ATOM 630 CZ TYR A 41 5.698 -3.448 -10.697 1.00 0.00 C ATOM 631 OH TYR A 41 5.149 -4.625 -10.289 1.00 0.00 O ATOM 0 H TYR A 41 9.282 -0.694 -10.835 1.00 0.00 H new ATOM 0 HA TYR A 41 8.712 -0.541 -13.617 1.00 0.00 H new ATOM 0 HB2 TYR A 41 7.633 0.893 -11.132 1.00 0.00 H new ATOM 0 HB3 TYR A 41 6.799 0.777 -12.669 1.00 0.00 H new ATOM 0 HD1 TYR A 41 6.110 -1.559 -13.513 1.00 0.00 H new ATOM 0 HD2 TYR A 41 7.408 -0.751 -9.498 1.00 0.00 H new ATOM 0 HE1 TYR A 41 5.093 -3.696 -12.760 1.00 0.00 H new ATOM 0 HE2 TYR A 41 6.443 -2.911 -8.739 1.00 0.00 H new ATOM 0 HH TYR A 41 5.498 -4.859 -9.404 1.00 0.00 H new ATOM 641 N SER A 42 10.061 2.084 -12.162 1.00 0.00 N ATOM 642 CA SER A 42 10.473 3.475 -12.318 1.00 0.00 C ATOM 643 C SER A 42 11.548 3.630 -13.384 1.00 0.00 C ATOM 644 O SER A 42 11.564 4.623 -14.107 1.00 0.00 O ATOM 645 CB SER A 42 11.008 4.006 -10.985 1.00 0.00 C ATOM 646 OG SER A 42 10.080 3.738 -9.959 1.00 0.00 O ATOM 0 H SER A 42 10.337 1.672 -11.271 1.00 0.00 H new ATOM 0 HA SER A 42 9.599 4.046 -12.631 1.00 0.00 H new ATOM 0 HB2 SER A 42 11.965 3.538 -10.754 1.00 0.00 H new ATOM 0 HB3 SER A 42 11.187 5.079 -11.056 1.00 0.00 H new ATOM 0 HG SER A 42 9.840 4.575 -9.509 1.00 0.00 H new ATOM 652 N ASN A 43 12.448 2.651 -13.483 1.00 0.00 N ATOM 653 CA ASN A 43 13.564 2.730 -14.409 1.00 0.00 C ATOM 654 C ASN A 43 13.125 2.207 -15.778 1.00 0.00 C ATOM 655 O ASN A 43 13.406 2.828 -16.804 1.00 0.00 O ATOM 656 CB ASN A 43 14.722 1.920 -13.820 1.00 0.00 C ATOM 657 CG ASN A 43 15.174 2.470 -12.475 1.00 0.00 C ATOM 658 OD1 ASN A 43 14.687 3.491 -12.003 1.00 0.00 O ATOM 659 ND2 ASN A 43 16.122 1.787 -11.844 1.00 0.00 N ATOM 0 H ASN A 43 12.420 1.795 -12.929 1.00 0.00 H new ATOM 0 HA ASN A 43 13.896 3.758 -14.551 1.00 0.00 H new ATOM 0 HB2 ASN A 43 14.415 0.881 -13.702 1.00 0.00 H new ATOM 0 HB3 ASN A 43 15.561 1.928 -14.516 1.00 0.00 H new ATOM 0 HD21 ASN A 43 16.466 2.109 -10.939 1.00 0.00 H new ATOM 0 HD22 ASN A 43 16.506 0.941 -12.264 1.00 0.00 H new ATOM 666 N LYS A 44 12.428 1.063 -15.788 1.00 0.00 N ATOM 667 CA LYS A 44 11.818 0.497 -16.986 1.00 0.00 C ATOM 668 C LYS A 44 10.825 1.496 -17.574 1.00 0.00 C ATOM 669 O LYS A 44 10.588 1.478 -18.774 1.00 0.00 O ATOM 670 CB LYS A 44 11.138 -0.804 -16.566 1.00 0.00 C ATOM 671 CG LYS A 44 10.417 -1.490 -17.732 1.00 0.00 C ATOM 672 CD LYS A 44 9.842 -2.825 -17.260 1.00 0.00 C ATOM 673 CE LYS A 44 9.106 -3.509 -18.413 1.00 0.00 C ATOM 674 NZ LYS A 44 8.546 -4.807 -17.989 1.00 0.00 N ATOM 0 H LYS A 44 12.273 0.502 -14.951 1.00 0.00 H new ATOM 0 HA LYS A 44 12.556 0.290 -17.761 1.00 0.00 H new ATOM 0 HB2 LYS A 44 11.884 -1.484 -16.153 1.00 0.00 H new ATOM 0 HB3 LYS A 44 10.422 -0.596 -15.771 1.00 0.00 H new ATOM 0 HG2 LYS A 44 9.618 -0.850 -18.107 1.00 0.00 H new ATOM 0 HG3 LYS A 44 11.110 -1.652 -18.558 1.00 0.00 H new ATOM 0 HD2 LYS A 44 10.643 -3.468 -16.896 1.00 0.00 H new ATOM 0 HD3 LYS A 44 9.159 -2.663 -16.426 1.00 0.00 H new ATOM 0 HE2 LYS A 44 8.304 -2.863 -18.771 1.00 0.00 H new ATOM 0 HE3 LYS A 44 9.791 -3.660 -19.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 7.862 -5.138 -18.699 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 9.313 -5.503 -17.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 8.068 -4.696 -17.072 1.00 0.00 H new ATOM 688 N ALA A 45 10.244 2.366 -16.742 1.00 0.00 N ATOM 689 CA ALA A 45 9.281 3.360 -17.205 1.00 0.00 C ATOM 690 C ALA A 45 9.974 4.580 -17.794 1.00 0.00 C ATOM 691 O ALA A 45 9.607 5.030 -18.875 1.00 0.00 O ATOM 692 CB ALA A 45 8.408 3.822 -16.040 1.00 0.00 C ATOM 0 H ALA A 45 10.428 2.399 -15.739 1.00 0.00 H new ATOM 0 HA ALA A 45 8.675 2.888 -17.978 1.00 0.00 H new ATOM 0 HB1 ALA A 45 7.692 4.564 -16.394 1.00 0.00 H new ATOM 0 HB2 ALA A 45 7.871 2.968 -15.626 1.00 0.00 H new ATOM 0 HB3 ALA A 45 9.037 4.264 -15.267 1.00 0.00 H new ATOM 698 N MET A 46 10.978 5.120 -17.101 1.00 0.00 N ATOM 699 CA MET A 46 11.686 6.294 -17.587 1.00 0.00 C ATOM 700 C MET A 46 12.285 6.042 -18.972 1.00 0.00 C ATOM 701 O MET A 46 12.375 6.954 -19.790 1.00 0.00 O ATOM 702 CB MET A 46 12.783 6.662 -16.594 1.00 0.00 C ATOM 703 CG MET A 46 13.458 7.993 -16.937 1.00 0.00 C ATOM 704 SD MET A 46 12.479 9.496 -16.657 1.00 0.00 S ATOM 705 CE MET A 46 11.516 9.622 -18.188 1.00 0.00 C ATOM 0 H MET A 46 11.314 4.762 -16.207 1.00 0.00 H new ATOM 0 HA MET A 46 10.980 7.120 -17.678 1.00 0.00 H new ATOM 0 HB2 MET A 46 12.358 6.721 -15.592 1.00 0.00 H new ATOM 0 HB3 MET A 46 13.533 5.871 -16.576 1.00 0.00 H new ATOM 0 HG2 MET A 46 14.375 8.070 -16.353 1.00 0.00 H new ATOM 0 HG3 MET A 46 13.749 7.967 -17.987 1.00 0.00 H new ATOM 0 HE1 MET A 46 11.263 10.666 -18.374 1.00 0.00 H new ATOM 0 HE2 MET A 46 12.105 9.238 -19.021 1.00 0.00 H new ATOM 0 HE3 MET A 46 10.601 9.038 -18.091 1.00 0.00 H new ATOM 715 N ALA A 47 12.692 4.799 -19.233 1.00 0.00 N ATOM 716 CA ALA A 47 13.221 4.421 -20.525 1.00 0.00 C ATOM 717 C ALA A 47 12.119 4.414 -21.582 1.00 0.00 C ATOM 718 O ALA A 47 12.365 4.807 -22.719 1.00 0.00 O ATOM 719 CB ALA A 47 13.835 3.033 -20.403 1.00 0.00 C ATOM 0 H ALA A 47 12.661 4.038 -18.554 1.00 0.00 H new ATOM 0 HA ALA A 47 13.976 5.143 -20.835 1.00 0.00 H new ATOM 0 HB1 ALA A 47 14.240 2.728 -21.368 1.00 0.00 H new ATOM 0 HB2 ALA A 47 14.635 3.053 -19.663 1.00 0.00 H new ATOM 0 HB3 ALA A 47 13.070 2.323 -20.091 1.00 0.00 H new ATOM 725 N LEU A 48 10.908 3.980 -21.220 1.00 0.00 N ATOM 726 CA LEU A 48 9.793 3.942 -22.154 1.00 0.00 C ATOM 727 C LEU A 48 9.368 5.348 -22.572 1.00 0.00 C ATOM 728 O LEU A 48 8.725 5.496 -23.601 1.00 0.00 O ATOM 729 CB LEU A 48 8.617 3.185 -21.534 1.00 0.00 C ATOM 730 CG LEU A 48 8.914 1.694 -21.376 1.00 0.00 C ATOM 731 CD1 LEU A 48 7.828 1.062 -20.509 1.00 0.00 C ATOM 732 CD2 LEU A 48 8.948 0.967 -22.715 1.00 0.00 C ATOM 0 H LEU A 48 10.681 3.650 -20.282 1.00 0.00 H new ATOM 0 HA LEU A 48 10.119 3.417 -23.052 1.00 0.00 H new ATOM 0 HB2 LEU A 48 8.384 3.613 -20.559 1.00 0.00 H new ATOM 0 HB3 LEU A 48 7.733 3.314 -22.159 1.00 0.00 H new ATOM 0 HG LEU A 48 9.897 1.600 -20.915 1.00 0.00 H new ATOM 0 HD11 LEU A 48 8.031 -0.002 -20.390 1.00 0.00 H new ATOM 0 HD12 LEU A 48 7.819 1.541 -19.530 1.00 0.00 H new ATOM 0 HD13 LEU A 48 6.857 1.195 -20.987 1.00 0.00 H new ATOM 0 HD21 LEU A 48 9.162 -0.089 -22.550 1.00 0.00 H new ATOM 0 HD22 LEU A 48 7.981 1.068 -23.209 1.00 0.00 H new ATOM 0 HD23 LEU A 48 9.724 1.401 -23.345 1.00 0.00 H new ATOM 744 N ILE A 49 9.714 6.387 -21.804 1.00 0.00 N ATOM 745 CA ILE A 49 9.459 7.752 -22.246 1.00 0.00 C ATOM 746 C ILE A 49 10.490 8.125 -23.297 1.00 0.00 C ATOM 747 O ILE A 49 10.148 8.626 -24.364 1.00 0.00 O ATOM 748 CB ILE A 49 9.558 8.725 -21.061 1.00 0.00 C ATOM 749 CG1 ILE A 49 8.245 8.800 -20.287 1.00 0.00 C ATOM 750 CG2 ILE A 49 9.923 10.130 -21.539 1.00 0.00 C ATOM 751 CD1 ILE A 49 8.075 7.592 -19.366 1.00 0.00 C ATOM 0 H ILE A 49 10.163 6.307 -20.891 1.00 0.00 H new ATOM 0 HA ILE A 49 8.455 7.815 -22.664 1.00 0.00 H new ATOM 0 HB ILE A 49 10.339 8.343 -20.404 1.00 0.00 H new ATOM 0 HG12 ILE A 49 8.220 9.716 -19.697 1.00 0.00 H new ATOM 0 HG13 ILE A 49 7.410 8.848 -20.986 1.00 0.00 H new ATOM 0 HG21 ILE A 49 9.987 10.801 -20.682 1.00 0.00 H new ATOM 0 HG22 ILE A 49 10.885 10.102 -22.051 1.00 0.00 H new ATOM 0 HG23 ILE A 49 9.157 10.491 -22.226 1.00 0.00 H new ATOM 0 HD11 ILE A 49 7.130 7.674 -18.828 1.00 0.00 H new ATOM 0 HD12 ILE A 49 8.076 6.678 -19.960 1.00 0.00 H new ATOM 0 HD13 ILE A 49 8.898 7.561 -18.652 1.00 0.00 H new ATOM 763 N LYS A 50 11.764 7.873 -22.986 1.00 0.00 N ATOM 764 CA LYS A 50 12.856 8.107 -23.901 1.00 0.00 C ATOM 765 C LYS A 50 12.766 7.222 -25.151 1.00 0.00 C ATOM 766 O LYS A 50 13.485 7.464 -26.118 1.00 0.00 O ATOM 767 CB LYS A 50 14.145 7.872 -23.129 1.00 0.00 C ATOM 768 CG LYS A 50 14.933 9.174 -23.032 1.00 0.00 C ATOM 769 CD LYS A 50 14.221 10.202 -22.154 1.00 0.00 C ATOM 770 CE LYS A 50 14.320 9.792 -20.687 1.00 0.00 C ATOM 771 NZ LYS A 50 14.087 10.952 -19.802 1.00 0.00 N ATOM 0 H LYS A 50 12.056 7.499 -22.083 1.00 0.00 H new ATOM 0 HA LYS A 50 12.819 9.130 -24.275 1.00 0.00 H new ATOM 0 HB2 LYS A 50 13.919 7.498 -22.131 1.00 0.00 H new ATOM 0 HB3 LYS A 50 14.744 7.110 -23.627 1.00 0.00 H new ATOM 0 HG2 LYS A 50 15.923 8.971 -22.624 1.00 0.00 H new ATOM 0 HG3 LYS A 50 15.078 9.587 -24.030 1.00 0.00 H new ATOM 0 HD2 LYS A 50 14.668 11.186 -22.296 1.00 0.00 H new ATOM 0 HD3 LYS A 50 13.174 10.282 -22.448 1.00 0.00 H new ATOM 0 HE2 LYS A 50 13.589 9.012 -20.472 1.00 0.00 H new ATOM 0 HE3 LYS A 50 15.305 9.369 -20.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 13.957 10.622 -18.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 14.906 11.592 -19.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 13.234 11.460 -20.113 1.00 0.00 H new ATOM 785 N LEU A 51 11.892 6.208 -25.149 1.00 0.00 N ATOM 786 CA LEU A 51 11.618 5.380 -26.308 1.00 0.00 C ATOM 787 C LEU A 51 10.297 5.836 -26.937 1.00 0.00 C ATOM 788 O LEU A 51 10.063 5.649 -28.128 1.00 0.00 O ATOM 789 CB LEU A 51 11.475 3.929 -25.848 1.00 0.00 C ATOM 790 CG LEU A 51 12.791 3.294 -25.390 1.00 0.00 C ATOM 791 CD1 LEU A 51 12.475 1.967 -24.703 1.00 0.00 C ATOM 792 CD2 LEU A 51 13.728 3.010 -26.560 1.00 0.00 C ATOM 0 H LEU A 51 11.352 5.944 -24.325 1.00 0.00 H new ATOM 0 HA LEU A 51 12.426 5.465 -27.035 1.00 0.00 H new ATOM 0 HB2 LEU A 51 10.757 3.886 -25.029 1.00 0.00 H new ATOM 0 HB3 LEU A 51 11.062 3.338 -26.665 1.00 0.00 H new ATOM 0 HG LEU A 51 13.285 3.994 -24.716 1.00 0.00 H new ATOM 0 HD11 LEU A 51 13.402 1.500 -24.370 1.00 0.00 H new ATOM 0 HD12 LEU A 51 11.830 2.147 -23.843 1.00 0.00 H new ATOM 0 HD13 LEU A 51 11.967 1.306 -25.405 1.00 0.00 H new ATOM 0 HD21 LEU A 51 14.648 2.560 -26.188 1.00 0.00 H new ATOM 0 HD22 LEU A 51 13.244 2.324 -27.255 1.00 0.00 H new ATOM 0 HD23 LEU A 51 13.962 3.943 -27.074 1.00 0.00 H new ATOM 804 N GLY A 52 9.439 6.440 -26.109 1.00 0.00 N ATOM 805 CA GLY A 52 8.148 6.995 -26.486 1.00 0.00 C ATOM 806 C GLY A 52 7.044 5.943 -26.447 1.00 0.00 C ATOM 807 O GLY A 52 5.975 6.138 -27.021 1.00 0.00 O ATOM 0 H GLY A 52 9.640 6.557 -25.116 1.00 0.00 H new ATOM 0 HA2 GLY A 52 7.894 7.813 -25.812 1.00 0.00 H new ATOM 0 HA3 GLY A 52 8.213 7.416 -27.489 1.00 0.00 H new ATOM 811 N GLU A 53 7.305 4.826 -25.765 1.00 0.00 N ATOM 812 CA GLU A 53 6.336 3.780 -25.486 1.00 0.00 C ATOM 813 C GLU A 53 5.637 4.082 -24.182 1.00 0.00 C ATOM 814 O GLU A 53 5.290 3.202 -23.401 1.00 0.00 O ATOM 815 CB GLU A 53 7.017 2.412 -25.472 1.00 0.00 C ATOM 816 CG GLU A 53 8.054 2.287 -26.591 1.00 0.00 C ATOM 817 CD GLU A 53 8.391 0.824 -26.871 1.00 0.00 C ATOM 818 OE1 GLU A 53 7.601 0.172 -27.592 1.00 0.00 O ATOM 819 OE2 GLU A 53 9.440 0.366 -26.361 1.00 0.00 O ATOM 0 H GLU A 53 8.229 4.624 -25.382 1.00 0.00 H new ATOM 0 HA GLU A 53 5.584 3.751 -26.274 1.00 0.00 H new ATOM 0 HB2 GLU A 53 7.501 2.256 -24.508 1.00 0.00 H new ATOM 0 HB3 GLU A 53 6.266 1.630 -25.582 1.00 0.00 H new ATOM 0 HG2 GLU A 53 7.672 2.755 -27.498 1.00 0.00 H new ATOM 0 HG3 GLU A 53 8.960 2.825 -26.312 1.00 0.00 H new ATOM 826 N TYR A 54 5.447 5.380 -23.982 1.00 0.00 N ATOM 827 CA TYR A 54 4.624 5.971 -22.966 1.00 0.00 C ATOM 828 C TYR A 54 3.406 5.119 -22.619 1.00 0.00 C ATOM 829 O TYR A 54 3.089 4.979 -21.445 1.00 0.00 O ATOM 830 CB TYR A 54 4.075 7.216 -23.617 1.00 0.00 C ATOM 831 CG TYR A 54 5.018 8.219 -24.217 1.00 0.00 C ATOM 832 CD1 TYR A 54 6.179 8.618 -23.547 1.00 0.00 C ATOM 833 CD2 TYR A 54 4.721 8.732 -25.486 1.00 0.00 C ATOM 834 CE1 TYR A 54 7.059 9.521 -24.158 1.00 0.00 C ATOM 835 CE2 TYR A 54 5.616 9.604 -26.119 1.00 0.00 C ATOM 836 CZ TYR A 54 6.785 10.016 -25.449 1.00 0.00 C ATOM 837 OH TYR A 54 7.648 10.885 -26.049 1.00 0.00 O ATOM 0 H TYR A 54 5.898 6.082 -24.569 1.00 0.00 H new ATOM 0 HA TYR A 54 5.210 6.115 -22.058 1.00 0.00 H new ATOM 0 HB2 TYR A 54 3.393 6.898 -24.406 1.00 0.00 H new ATOM 0 HB3 TYR A 54 3.477 7.738 -22.870 1.00 0.00 H new ATOM 0 HD1 TYR A 54 6.396 8.231 -22.562 1.00 0.00 H new ATOM 0 HD2 TYR A 54 3.800 8.455 -25.977 1.00 0.00 H new ATOM 0 HE1 TYR A 54 7.951 9.839 -23.638 1.00 0.00 H new ATOM 0 HE2 TYR A 54 5.411 9.960 -27.118 1.00 0.00 H new ATOM 0 HH TYR A 54 7.307 11.125 -26.936 1.00 0.00 H new ATOM 847 N THR A 55 2.721 4.551 -23.624 1.00 0.00 N ATOM 848 CA THR A 55 1.503 3.776 -23.401 1.00 0.00 C ATOM 849 C THR A 55 1.734 2.739 -22.315 1.00 0.00 C ATOM 850 O THR A 55 0.858 2.448 -21.506 1.00 0.00 O ATOM 851 CB THR A 55 1.081 3.067 -24.690 1.00 0.00 C ATOM 852 OG1 THR A 55 1.134 3.962 -25.775 1.00 0.00 O ATOM 853 CG2 THR A 55 -0.345 2.550 -24.520 1.00 0.00 C ATOM 0 H THR A 55 2.997 4.618 -24.604 1.00 0.00 H new ATOM 0 HA THR A 55 0.714 4.460 -23.090 1.00 0.00 H new ATOM 0 HB THR A 55 1.759 2.237 -24.889 1.00 0.00 H new ATOM 0 HG1 THR A 55 0.864 3.498 -26.595 1.00 0.00 H new ATOM 0 HG21 THR A 55 -0.659 2.042 -25.432 1.00 0.00 H new ATOM 0 HG22 THR A 55 -0.381 1.851 -23.684 1.00 0.00 H new ATOM 0 HG23 THR A 55 -1.014 3.387 -24.322 1.00 0.00 H new ATOM 861 N GLN A 56 2.948 2.201 -22.333 1.00 0.00 N ATOM 862 CA GLN A 56 3.419 1.202 -21.393 1.00 0.00 C ATOM 863 C GLN A 56 3.959 1.863 -20.130 1.00 0.00 C ATOM 864 O GLN A 56 3.728 1.381 -19.025 1.00 0.00 O ATOM 865 CB GLN A 56 4.525 0.396 -22.070 1.00 0.00 C ATOM 866 CG GLN A 56 4.087 -0.166 -23.422 1.00 0.00 C ATOM 867 CD GLN A 56 2.820 -1.005 -23.306 1.00 0.00 C ATOM 868 OE1 GLN A 56 2.875 -2.213 -23.095 1.00 0.00 O ATOM 869 NE2 GLN A 56 1.669 -0.353 -23.447 1.00 0.00 N ATOM 0 H GLN A 56 3.651 2.459 -23.026 1.00 0.00 H new ATOM 0 HA GLN A 56 2.594 0.551 -21.105 1.00 0.00 H new ATOM 0 HB2 GLN A 56 5.401 1.030 -22.209 1.00 0.00 H new ATOM 0 HB3 GLN A 56 4.825 -0.424 -21.418 1.00 0.00 H new ATOM 0 HG2 GLN A 56 3.916 0.655 -24.118 1.00 0.00 H new ATOM 0 HG3 GLN A 56 4.889 -0.775 -23.839 1.00 0.00 H new ATOM 0 HE21 GLN A 56 1.670 0.652 -23.621 1.00 0.00 H new ATOM 0 HE22 GLN A 56 0.785 -0.858 -23.381 1.00 0.00 H new ATOM 878 N ALA A 57 4.677 2.971 -20.299 1.00 0.00 N ATOM 879 CA ALA A 57 5.238 3.743 -19.203 1.00 0.00 C ATOM 880 C ALA A 57 4.174 4.216 -18.215 1.00 0.00 C ATOM 881 O ALA A 57 4.402 4.224 -17.006 1.00 0.00 O ATOM 882 CB ALA A 57 5.919 4.968 -19.809 1.00 0.00 C ATOM 0 H ALA A 57 4.886 3.360 -21.218 1.00 0.00 H new ATOM 0 HA ALA A 57 5.933 3.109 -18.653 1.00 0.00 H new ATOM 0 HB1 ALA A 57 6.353 5.574 -19.014 1.00 0.00 H new ATOM 0 HB2 ALA A 57 6.706 4.647 -20.491 1.00 0.00 H new ATOM 0 HB3 ALA A 57 5.184 5.560 -20.355 1.00 0.00 H new ATOM 888 N ILE A 58 3.009 4.608 -18.735 1.00 0.00 N ATOM 889 CA ILE A 58 1.893 5.093 -17.938 1.00 0.00 C ATOM 890 C ILE A 58 1.448 3.989 -16.988 1.00 0.00 C ATOM 891 O ILE A 58 1.053 4.267 -15.858 1.00 0.00 O ATOM 892 CB ILE A 58 0.760 5.482 -18.893 1.00 0.00 C ATOM 893 CG1 ILE A 58 1.202 6.624 -19.817 1.00 0.00 C ATOM 894 CG2 ILE A 58 -0.510 5.917 -18.160 1.00 0.00 C ATOM 895 CD1 ILE A 58 0.454 6.531 -21.145 1.00 0.00 C ATOM 0 H ILE A 58 2.817 4.595 -19.737 1.00 0.00 H new ATOM 0 HA ILE A 58 2.179 5.963 -17.346 1.00 0.00 H new ATOM 0 HB ILE A 58 0.532 4.587 -19.471 1.00 0.00 H new ATOM 0 HG12 ILE A 58 1.003 7.585 -19.343 1.00 0.00 H new ATOM 0 HG13 ILE A 58 2.277 6.570 -19.990 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -1.278 6.181 -18.887 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -0.868 5.099 -17.535 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -0.291 6.782 -17.534 1.00 0.00 H new ATOM 0 HD11 ILE A 58 0.771 7.344 -21.799 1.00 0.00 H new ATOM 0 HD12 ILE A 58 0.675 5.576 -21.621 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -0.618 6.607 -20.965 1.00 0.00 H new ATOM 907 N GLN A 59 1.510 2.733 -17.443 1.00 0.00 N ATOM 908 CA GLN A 59 1.119 1.599 -16.637 1.00 0.00 C ATOM 909 C GLN A 59 2.166 1.286 -15.569 1.00 0.00 C ATOM 910 O GLN A 59 1.819 0.878 -14.466 1.00 0.00 O ATOM 911 CB GLN A 59 0.960 0.388 -17.547 1.00 0.00 C ATOM 912 CG GLN A 59 -0.005 0.621 -18.698 1.00 0.00 C ATOM 913 CD GLN A 59 -1.251 1.354 -18.241 1.00 0.00 C ATOM 914 OE1 GLN A 59 -1.962 0.907 -17.344 1.00 0.00 O ATOM 915 NE2 GLN A 59 -1.520 2.497 -18.859 1.00 0.00 N ATOM 0 H GLN A 59 1.833 2.487 -18.379 1.00 0.00 H new ATOM 0 HA GLN A 59 0.181 1.836 -16.134 1.00 0.00 H new ATOM 0 HB2 GLN A 59 1.935 0.115 -17.950 1.00 0.00 H new ATOM 0 HB3 GLN A 59 0.611 -0.458 -16.956 1.00 0.00 H new ATOM 0 HG2 GLN A 59 0.491 1.197 -19.479 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -0.286 -0.336 -19.138 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -0.904 2.834 -19.599 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -2.343 3.039 -18.594 1.00 0.00 H new ATOM 924 N MET A 60 3.445 1.478 -15.902 1.00 0.00 N ATOM 925 CA MET A 60 4.543 1.235 -14.973 1.00 0.00 C ATOM 926 C MET A 60 4.516 2.230 -13.816 1.00 0.00 C ATOM 927 O MET A 60 4.701 1.845 -12.662 1.00 0.00 O ATOM 928 CB MET A 60 5.880 1.398 -15.695 1.00 0.00 C ATOM 929 CG MET A 60 6.122 0.432 -16.856 1.00 0.00 C ATOM 930 SD MET A 60 5.949 -1.327 -16.475 1.00 0.00 S ATOM 931 CE MET A 60 4.223 -1.539 -16.985 1.00 0.00 C ATOM 0 H MET A 60 3.744 1.805 -16.821 1.00 0.00 H new ATOM 0 HA MET A 60 4.429 0.222 -14.588 1.00 0.00 H new ATOM 0 HB2 MET A 60 5.947 2.418 -16.074 1.00 0.00 H new ATOM 0 HB3 MET A 60 6.683 1.274 -14.969 1.00 0.00 H new ATOM 0 HG2 MET A 60 5.427 0.679 -17.659 1.00 0.00 H new ATOM 0 HG3 MET A 60 7.127 0.603 -17.241 1.00 0.00 H new ATOM 0 HE1 MET A 60 4.029 -2.593 -17.184 1.00 0.00 H new ATOM 0 HE2 MET A 60 3.563 -1.193 -16.189 1.00 0.00 H new ATOM 0 HE3 MET A 60 4.037 -0.959 -17.889 1.00 0.00 H new ATOM 941 N CYS A 61 4.290 3.509 -14.115 1.00 0.00 N ATOM 942 CA CYS A 61 4.386 4.549 -13.107 1.00 0.00 C ATOM 943 C CYS A 61 3.295 4.380 -12.054 1.00 0.00 C ATOM 944 O CYS A 61 3.579 4.292 -10.865 1.00 0.00 O ATOM 945 CB CYS A 61 4.291 5.901 -13.802 1.00 0.00 C ATOM 946 SG CYS A 61 5.745 6.120 -14.854 1.00 0.00 S ATOM 0 H CYS A 61 4.040 3.843 -15.046 1.00 0.00 H new ATOM 0 HA CYS A 61 5.341 4.481 -12.586 1.00 0.00 H new ATOM 0 HB2 CYS A 61 3.381 5.955 -14.400 1.00 0.00 H new ATOM 0 HB3 CYS A 61 4.235 6.701 -13.064 1.00 0.00 H new ATOM 0 HG CYS A 61 5.593 5.440 -15.951 1.00 0.00 H new ATOM 952 N GLN A 62 2.034 4.333 -12.479 1.00 0.00 N ATOM 953 CA GLN A 62 0.940 4.065 -11.555 1.00 0.00 C ATOM 954 C GLN A 62 1.129 2.771 -10.748 1.00 0.00 C ATOM 955 O GLN A 62 0.596 2.663 -9.643 1.00 0.00 O ATOM 956 CB GLN A 62 -0.398 4.100 -12.295 1.00 0.00 C ATOM 957 CG GLN A 62 -0.474 3.127 -13.468 1.00 0.00 C ATOM 958 CD GLN A 62 -1.363 1.938 -13.139 1.00 0.00 C ATOM 959 OE1 GLN A 62 -2.548 1.925 -13.464 1.00 0.00 O ATOM 960 NE2 GLN A 62 -0.799 0.930 -12.488 1.00 0.00 N ATOM 0 H GLN A 62 1.749 4.476 -13.448 1.00 0.00 H new ATOM 0 HA GLN A 62 0.941 4.862 -10.811 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -1.199 3.871 -11.592 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -0.575 5.111 -12.661 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -0.862 3.642 -14.347 1.00 0.00 H new ATOM 0 HG3 GLN A 62 0.527 2.777 -13.719 1.00 0.00 H new ATOM 0 HE21 GLN A 62 0.188 0.975 -12.234 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -1.352 0.109 -12.241 1.00 0.00 H new ATOM 969 N GLN A 63 1.874 1.793 -11.269 1.00 0.00 N ATOM 970 CA GLN A 63 2.244 0.588 -10.538 1.00 0.00 C ATOM 971 C GLN A 63 3.245 0.894 -9.431 1.00 0.00 C ATOM 972 O GLN A 63 3.068 0.426 -8.311 1.00 0.00 O ATOM 973 CB GLN A 63 2.898 -0.378 -11.532 1.00 0.00 C ATOM 974 CG GLN A 63 2.257 -1.758 -11.572 1.00 0.00 C ATOM 975 CD GLN A 63 0.819 -1.725 -12.069 1.00 0.00 C ATOM 976 OE1 GLN A 63 -0.114 -1.583 -11.283 1.00 0.00 O ATOM 977 NE2 GLN A 63 0.617 -1.849 -13.377 1.00 0.00 N ATOM 0 H GLN A 63 2.239 1.820 -12.221 1.00 0.00 H new ATOM 0 HA GLN A 63 1.351 0.160 -10.082 1.00 0.00 H new ATOM 0 HB2 GLN A 63 2.855 0.060 -12.529 1.00 0.00 H new ATOM 0 HB3 GLN A 63 3.952 -0.486 -11.277 1.00 0.00 H new ATOM 0 HG2 GLN A 63 2.846 -2.409 -12.219 1.00 0.00 H new ATOM 0 HG3 GLN A 63 2.282 -2.194 -10.573 1.00 0.00 H new ATOM 0 HE21 GLN A 63 1.411 -1.966 -14.007 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -0.332 -1.827 -13.751 1.00 0.00 H new ATOM 986 N GLY A 64 4.294 1.670 -9.710 1.00 0.00 N ATOM 987 CA GLY A 64 5.269 2.031 -8.694 1.00 0.00 C ATOM 988 C GLY A 64 4.599 2.516 -7.404 1.00 0.00 C ATOM 989 O GLY A 64 5.078 2.215 -6.311 1.00 0.00 O ATOM 0 H GLY A 64 4.485 2.058 -10.634 1.00 0.00 H new ATOM 0 HA2 GLY A 64 5.899 1.169 -8.474 1.00 0.00 H new ATOM 0 HA3 GLY A 64 5.922 2.814 -9.080 1.00 0.00 H new ATOM 993 N LEU A 65 3.496 3.264 -7.525 1.00 0.00 N ATOM 994 CA LEU A 65 2.779 3.865 -6.403 1.00 0.00 C ATOM 995 C LEU A 65 2.072 2.837 -5.522 1.00 0.00 C ATOM 996 O LEU A 65 1.463 3.205 -4.517 1.00 0.00 O ATOM 997 CB LEU A 65 1.744 4.854 -6.946 1.00 0.00 C ATOM 998 CG LEU A 65 2.420 5.975 -7.737 1.00 0.00 C ATOM 999 CD1 LEU A 65 1.361 6.689 -8.561 1.00 0.00 C ATOM 1000 CD2 LEU A 65 3.106 6.980 -6.804 1.00 0.00 C ATOM 0 H LEU A 65 3.070 3.471 -8.429 1.00 0.00 H new ATOM 0 HA LEU A 65 3.519 4.366 -5.779 1.00 0.00 H new ATOM 0 HB2 LEU A 65 1.035 4.329 -7.586 1.00 0.00 H new ATOM 0 HB3 LEU A 65 1.174 5.279 -6.120 1.00 0.00 H new ATOM 0 HG LEU A 65 3.184 5.541 -8.382 1.00 0.00 H new ATOM 0 HD11 LEU A 65 1.825 7.493 -9.132 1.00 0.00 H new ATOM 0 HD12 LEU A 65 0.893 5.981 -9.245 1.00 0.00 H new ATOM 0 HD13 LEU A 65 0.604 7.106 -7.897 1.00 0.00 H new ATOM 0 HD21 LEU A 65 3.577 7.764 -7.397 1.00 0.00 H new ATOM 0 HD22 LEU A 65 2.365 7.423 -6.139 1.00 0.00 H new ATOM 0 HD23 LEU A 65 3.864 6.468 -6.212 1.00 0.00 H new ATOM 1012 N ARG A 66 2.141 1.552 -5.877 1.00 0.00 N ATOM 1013 CA ARG A 66 1.490 0.488 -5.138 1.00 0.00 C ATOM 1014 C ARG A 66 2.391 0.051 -4.001 1.00 0.00 C ATOM 1015 O ARG A 66 1.967 -0.614 -3.059 1.00 0.00 O ATOM 1016 CB ARG A 66 1.334 -0.662 -6.120 1.00 0.00 C ATOM 1017 CG ARG A 66 0.363 -0.254 -7.215 1.00 0.00 C ATOM 1018 CD ARG A 66 0.222 -1.415 -8.185 1.00 0.00 C ATOM 1019 NE ARG A 66 -0.453 -2.560 -7.565 1.00 0.00 N ATOM 1020 CZ ARG A 66 -1.162 -3.479 -8.231 1.00 0.00 C ATOM 1021 NH1 ARG A 66 -1.312 -3.407 -9.551 1.00 0.00 N ATOM 1022 NH2 ARG A 66 -1.731 -4.479 -7.568 1.00 0.00 N ATOM 0 H ARG A 66 2.657 1.226 -6.694 1.00 0.00 H new ATOM 0 HA ARG A 66 0.532 0.805 -4.726 1.00 0.00 H new ATOM 0 HB2 ARG A 66 2.301 -0.921 -6.552 1.00 0.00 H new ATOM 0 HB3 ARG A 66 0.967 -1.550 -5.604 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -0.606 0.003 -6.787 1.00 0.00 H new ATOM 0 HG3 ARG A 66 0.727 0.633 -7.734 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -0.340 -1.091 -9.061 1.00 0.00 H new ATOM 0 HD3 ARG A 66 1.209 -1.719 -8.534 1.00 0.00 H new ATOM 0 HE ARG A 66 -0.377 -2.663 -6.553 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -0.883 -2.642 -10.072 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -1.856 -4.117 -10.042 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -1.627 -4.544 -6.555 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -2.272 -5.182 -8.071 1.00 0.00 H new ATOM 1036 N TYR A 67 3.653 0.450 -4.127 1.00 0.00 N ATOM 1037 CA TYR A 67 4.725 0.029 -3.258 1.00 0.00 C ATOM 1038 C TYR A 67 5.413 1.173 -2.512 1.00 0.00 C ATOM 1039 O TYR A 67 6.250 0.926 -1.648 1.00 0.00 O ATOM 1040 CB TYR A 67 5.711 -0.688 -4.171 1.00 0.00 C ATOM 1041 CG TYR A 67 5.029 -1.587 -5.170 1.00 0.00 C ATOM 1042 CD1 TYR A 67 4.412 -2.770 -4.746 1.00 0.00 C ATOM 1043 CD2 TYR A 67 4.993 -1.211 -6.521 1.00 0.00 C ATOM 1044 CE1 TYR A 67 3.775 -3.605 -5.676 1.00 0.00 C ATOM 1045 CE2 TYR A 67 4.312 -2.017 -7.442 1.00 0.00 C ATOM 1046 CZ TYR A 67 3.712 -3.229 -7.030 1.00 0.00 C ATOM 1047 OH TYR A 67 3.074 -4.027 -7.932 1.00 0.00 O ATOM 0 H TYR A 67 3.957 1.092 -4.859 1.00 0.00 H new ATOM 0 HA TYR A 67 4.331 -0.604 -2.463 1.00 0.00 H new ATOM 0 HB2 TYR A 67 6.311 0.051 -4.703 1.00 0.00 H new ATOM 0 HB3 TYR A 67 6.397 -1.279 -3.565 1.00 0.00 H new ATOM 0 HD1 TYR A 67 4.426 -3.040 -3.700 1.00 0.00 H new ATOM 0 HD2 TYR A 67 5.486 -0.308 -6.848 1.00 0.00 H new ATOM 0 HE1 TYR A 67 3.333 -4.536 -5.353 1.00 0.00 H new ATOM 0 HE2 TYR A 67 4.245 -1.710 -8.475 1.00 0.00 H new ATOM 0 HH TYR A 67 3.686 -4.246 -8.666 1.00 0.00 H new ATOM 1057 N THR A 68 5.071 2.427 -2.833 1.00 0.00 N ATOM 1058 CA THR A 68 5.687 3.604 -2.220 1.00 0.00 C ATOM 1059 C THR A 68 5.121 3.910 -0.832 1.00 0.00 C ATOM 1060 O THR A 68 5.165 5.053 -0.381 1.00 0.00 O ATOM 1061 CB THR A 68 5.521 4.814 -3.139 1.00 0.00 C ATOM 1062 OG1 THR A 68 4.165 4.972 -3.499 1.00 0.00 O ATOM 1063 CG2 THR A 68 6.359 4.628 -4.402 1.00 0.00 C ATOM 0 H THR A 68 4.358 2.651 -3.527 1.00 0.00 H new ATOM 0 HA THR A 68 6.746 3.384 -2.087 1.00 0.00 H new ATOM 0 HB THR A 68 5.857 5.703 -2.606 1.00 0.00 H new ATOM 0 HG1 THR A 68 4.071 5.751 -4.086 1.00 0.00 H new ATOM 0 HG21 THR A 68 6.235 5.494 -5.052 1.00 0.00 H new ATOM 0 HG22 THR A 68 7.409 4.526 -4.130 1.00 0.00 H new ATOM 0 HG23 THR A 68 6.031 3.731 -4.927 1.00 0.00 H new ATOM 1071 N SER A 69 4.588 2.893 -0.151 1.00 0.00 N ATOM 1072 CA SER A 69 3.987 3.015 1.173 1.00 0.00 C ATOM 1073 C SER A 69 4.980 3.401 2.273 1.00 0.00 C ATOM 1074 O SER A 69 4.609 3.426 3.447 1.00 0.00 O ATOM 1075 CB SER A 69 3.356 1.677 1.534 1.00 0.00 C ATOM 1076 OG SER A 69 2.327 1.359 0.623 1.00 0.00 O ATOM 0 H SER A 69 4.563 1.941 -0.516 1.00 0.00 H new ATOM 0 HA SER A 69 3.255 3.820 1.119 1.00 0.00 H new ATOM 0 HB2 SER A 69 4.115 0.895 1.523 1.00 0.00 H new ATOM 0 HB3 SER A 69 2.955 1.718 2.547 1.00 0.00 H new ATOM 0 HG SER A 69 1.931 0.496 0.865 1.00 0.00 H new ATOM 1082 N THR A 70 6.228 3.699 1.917 1.00 0.00 N ATOM 1083 CA THR A 70 7.289 4.001 2.875 1.00 0.00 C ATOM 1084 C THR A 70 8.192 5.137 2.375 1.00 0.00 C ATOM 1085 O THR A 70 8.275 5.402 1.177 1.00 0.00 O ATOM 1086 CB THR A 70 8.091 2.725 3.142 1.00 0.00 C ATOM 1087 OG1 THR A 70 9.207 3.019 3.954 1.00 0.00 O ATOM 1088 CG2 THR A 70 8.569 2.087 1.837 1.00 0.00 C ATOM 0 H THR A 70 6.534 3.738 0.945 1.00 0.00 H new ATOM 0 HA THR A 70 6.843 4.348 3.807 1.00 0.00 H new ATOM 0 HB THR A 70 7.436 2.019 3.653 1.00 0.00 H new ATOM 0 HG1 THR A 70 9.715 2.198 4.122 1.00 0.00 H new ATOM 0 HG21 THR A 70 9.135 1.183 2.060 1.00 0.00 H new ATOM 0 HG22 THR A 70 7.708 1.832 1.220 1.00 0.00 H new ATOM 0 HG23 THR A 70 9.205 2.790 1.300 1.00 0.00 H new ATOM 1096 N ALA A 71 8.869 5.808 3.315 1.00 0.00 N ATOM 1097 CA ALA A 71 9.691 6.980 3.040 1.00 0.00 C ATOM 1098 C ALA A 71 11.024 6.652 2.364 1.00 0.00 C ATOM 1099 O ALA A 71 11.750 7.569 1.992 1.00 0.00 O ATOM 1100 CB ALA A 71 9.940 7.722 4.349 1.00 0.00 C ATOM 0 H ALA A 71 8.857 5.544 4.300 1.00 0.00 H new ATOM 0 HA ALA A 71 9.141 7.601 2.333 1.00 0.00 H new ATOM 0 HB1 ALA A 71 10.554 8.602 4.157 1.00 0.00 H new ATOM 0 HB2 ALA A 71 8.987 8.031 4.779 1.00 0.00 H new ATOM 0 HB3 ALA A 71 10.457 7.064 5.048 1.00 0.00 H new ATOM 1106 N GLU A 72 11.371 5.375 2.186 1.00 0.00 N ATOM 1107 CA GLU A 72 12.522 5.018 1.367 1.00 0.00 C ATOM 1108 C GLU A 72 12.151 5.098 -0.114 1.00 0.00 C ATOM 1109 O GLU A 72 13.028 5.048 -0.974 1.00 0.00 O ATOM 1110 CB GLU A 72 12.995 3.610 1.711 1.00 0.00 C ATOM 1111 CG GLU A 72 11.882 2.580 1.550 1.00 0.00 C ATOM 1112 CD GLU A 72 12.321 1.210 2.063 1.00 0.00 C ATOM 1113 OE1 GLU A 72 12.932 0.466 1.262 1.00 0.00 O ATOM 1114 OE2 GLU A 72 12.044 0.919 3.247 1.00 0.00 O ATOM 0 H GLU A 72 10.875 4.582 2.594 1.00 0.00 H new ATOM 0 HA GLU A 72 13.331 5.719 1.570 1.00 0.00 H new ATOM 0 HB2 GLU A 72 13.833 3.342 1.068 1.00 0.00 H new ATOM 0 HB3 GLU A 72 13.361 3.591 2.737 1.00 0.00 H new ATOM 0 HG2 GLU A 72 10.997 2.909 2.094 1.00 0.00 H new ATOM 0 HG3 GLU A 72 11.601 2.505 0.500 1.00 0.00 H new ATOM 1121 N HIS A 73 10.849 5.222 -0.393 1.00 0.00 N ATOM 1122 CA HIS A 73 10.318 5.233 -1.744 1.00 0.00 C ATOM 1123 C HIS A 73 9.608 6.555 -2.044 1.00 0.00 C ATOM 1124 O HIS A 73 8.885 6.660 -3.031 1.00 0.00 O ATOM 1125 CB HIS A 73 9.357 4.060 -1.935 1.00 0.00 C ATOM 1126 CG HIS A 73 9.984 2.688 -1.887 1.00 0.00 C ATOM 1127 ND1 HIS A 73 9.268 1.489 -1.867 1.00 0.00 N ATOM 1128 CD2 HIS A 73 11.318 2.413 -1.865 1.00 0.00 C ATOM 1129 CE1 HIS A 73 10.200 0.521 -1.831 1.00 0.00 C ATOM 1130 NE2 HIS A 73 11.437 1.044 -1.834 1.00 0.00 N ATOM 0 H HIS A 73 10.133 5.318 0.327 1.00 0.00 H new ATOM 0 HA HIS A 73 11.150 5.131 -2.441 1.00 0.00 H new ATOM 0 HB2 HIS A 73 8.587 4.115 -1.165 1.00 0.00 H new ATOM 0 HB3 HIS A 73 8.856 4.177 -2.896 1.00 0.00 H new ATOM 0 HD1 HIS A 73 8.255 1.373 -1.877 1.00 0.00 H new ATOM 0 HD2 HIS A 73 12.125 3.131 -1.871 1.00 0.00 H new ATOM 0 HE1 HIS A 73 9.983 -0.537 -1.803 1.00 0.00 H new ATOM 1138 N VAL A 74 9.796 7.575 -1.206 1.00 0.00 N ATOM 1139 CA VAL A 74 9.207 8.885 -1.459 1.00 0.00 C ATOM 1140 C VAL A 74 9.865 9.554 -2.666 1.00 0.00 C ATOM 1141 O VAL A 74 9.228 10.313 -3.393 1.00 0.00 O ATOM 1142 CB VAL A 74 9.364 9.758 -0.215 1.00 0.00 C ATOM 1143 CG1 VAL A 74 10.829 9.975 0.156 1.00 0.00 C ATOM 1144 CG2 VAL A 74 8.725 11.114 -0.470 1.00 0.00 C ATOM 0 H VAL A 74 10.349 7.518 -0.351 1.00 0.00 H new ATOM 0 HA VAL A 74 8.148 8.760 -1.683 1.00 0.00 H new ATOM 0 HB VAL A 74 8.876 9.241 0.611 1.00 0.00 H new ATOM 0 HG11 VAL A 74 10.890 10.601 1.046 1.00 0.00 H new ATOM 0 HG12 VAL A 74 11.300 9.013 0.356 1.00 0.00 H new ATOM 0 HG13 VAL A 74 11.344 10.466 -0.669 1.00 0.00 H new ATOM 0 HG21 VAL A 74 8.835 11.740 0.415 1.00 0.00 H new ATOM 0 HG22 VAL A 74 9.215 11.594 -1.317 1.00 0.00 H new ATOM 0 HG23 VAL A 74 7.666 10.981 -0.691 1.00 0.00 H new ATOM 1154 N ALA A 75 11.150 9.264 -2.875 1.00 0.00 N ATOM 1155 CA ALA A 75 11.912 9.766 -4.014 1.00 0.00 C ATOM 1156 C ALA A 75 11.205 9.423 -5.310 1.00 0.00 C ATOM 1157 O ALA A 75 11.026 10.243 -6.204 1.00 0.00 O ATOM 1158 CB ALA A 75 13.247 9.030 -4.023 1.00 0.00 C ATOM 0 H ALA A 75 11.694 8.668 -2.251 1.00 0.00 H new ATOM 0 HA ALA A 75 12.028 10.847 -3.931 1.00 0.00 H new ATOM 0 HB1 ALA A 75 13.849 9.378 -4.863 1.00 0.00 H new ATOM 0 HB2 ALA A 75 13.777 9.226 -3.091 1.00 0.00 H new ATOM 0 HB3 ALA A 75 13.071 7.959 -4.122 1.00 0.00 H new ATOM 1164 N ILE A 76 10.814 8.157 -5.358 1.00 0.00 N ATOM 1165 CA ILE A 76 10.168 7.466 -6.444 1.00 0.00 C ATOM 1166 C ILE A 76 8.737 7.928 -6.612 1.00 0.00 C ATOM 1167 O ILE A 76 8.240 8.052 -7.726 1.00 0.00 O ATOM 1168 CB ILE A 76 10.185 6.031 -5.959 1.00 0.00 C ATOM 1169 CG1 ILE A 76 11.568 5.440 -6.198 1.00 0.00 C ATOM 1170 CG2 ILE A 76 9.037 5.202 -6.505 1.00 0.00 C ATOM 1171 CD1 ILE A 76 11.659 4.739 -7.541 1.00 0.00 C ATOM 0 H ILE A 76 10.959 7.539 -4.560 1.00 0.00 H new ATOM 0 HA ILE A 76 10.654 7.628 -7.406 1.00 0.00 H new ATOM 0 HB ILE A 76 10.005 6.014 -4.884 1.00 0.00 H new ATOM 0 HG12 ILE A 76 12.315 6.233 -6.151 1.00 0.00 H new ATOM 0 HG13 ILE A 76 11.803 4.733 -5.403 1.00 0.00 H new ATOM 0 HG21 ILE A 76 9.107 4.185 -6.120 1.00 0.00 H new ATOM 0 HG22 ILE A 76 8.090 5.643 -6.194 1.00 0.00 H new ATOM 0 HG23 ILE A 76 9.088 5.182 -7.594 1.00 0.00 H new ATOM 0 HD11 ILE A 76 12.662 4.332 -7.672 1.00 0.00 H new ATOM 0 HD12 ILE A 76 10.931 3.929 -7.579 1.00 0.00 H new ATOM 0 HD13 ILE A 76 11.450 5.452 -8.339 1.00 0.00 H new ATOM 1183 N ARG A 77 8.079 8.179 -5.485 1.00 0.00 N ATOM 1184 CA ARG A 77 6.699 8.649 -5.462 1.00 0.00 C ATOM 1185 C ARG A 77 6.588 10.000 -6.166 1.00 0.00 C ATOM 1186 O ARG A 77 5.494 10.448 -6.511 1.00 0.00 O ATOM 1187 CB ARG A 77 6.222 8.692 -4.009 1.00 0.00 C ATOM 1188 CG ARG A 77 4.759 9.122 -3.900 1.00 0.00 C ATOM 1189 CD ARG A 77 4.671 10.585 -3.467 1.00 0.00 C ATOM 1190 NE ARG A 77 3.279 10.995 -3.245 1.00 0.00 N ATOM 1191 CZ ARG A 77 2.434 11.350 -4.218 1.00 0.00 C ATOM 1192 NH1 ARG A 77 2.821 11.355 -5.490 1.00 0.00 N ATOM 1193 NH2 ARG A 77 1.187 11.703 -3.924 1.00 0.00 N ATOM 0 H ARG A 77 8.490 8.062 -4.559 1.00 0.00 H new ATOM 0 HA ARG A 77 6.049 7.966 -6.009 1.00 0.00 H new ATOM 0 HB2 ARG A 77 6.345 7.708 -3.557 1.00 0.00 H new ATOM 0 HB3 ARG A 77 6.846 9.383 -3.443 1.00 0.00 H new ATOM 0 HG2 ARG A 77 4.260 8.988 -4.860 1.00 0.00 H new ATOM 0 HG3 ARG A 77 4.239 8.490 -3.180 1.00 0.00 H new ATOM 0 HD2 ARG A 77 5.245 10.730 -2.552 1.00 0.00 H new ATOM 0 HD3 ARG A 77 5.122 11.220 -4.230 1.00 0.00 H new ATOM 0 HE ARG A 77 2.934 11.010 -2.285 1.00 0.00 H new ATOM 0 HH11 ARG A 77 3.774 11.086 -5.734 1.00 0.00 H new ATOM 0 HH12 ARG A 77 2.165 11.628 -6.222 1.00 0.00 H new ATOM 0 HH21 ARG A 77 0.872 11.704 -2.954 1.00 0.00 H new ATOM 0 HH22 ARG A 77 0.544 11.973 -4.669 1.00 0.00 H new ATOM 1207 N SER A 78 7.737 10.641 -6.373 1.00 0.00 N ATOM 1208 CA SER A 78 7.861 11.904 -7.079 1.00 0.00 C ATOM 1209 C SER A 78 8.205 11.675 -8.548 1.00 0.00 C ATOM 1210 O SER A 78 8.115 12.602 -9.353 1.00 0.00 O ATOM 1211 CB SER A 78 9.000 12.674 -6.411 1.00 0.00 C ATOM 1212 OG SER A 78 8.979 14.030 -6.802 1.00 0.00 O ATOM 0 H SER A 78 8.632 10.280 -6.042 1.00 0.00 H new ATOM 0 HA SER A 78 6.920 12.453 -7.037 1.00 0.00 H new ATOM 0 HB2 SER A 78 8.909 12.601 -5.327 1.00 0.00 H new ATOM 0 HB3 SER A 78 9.956 12.227 -6.682 1.00 0.00 H new ATOM 0 HG SER A 78 9.714 14.508 -6.364 1.00 0.00 H new ATOM 1218 N LYS A 79 8.600 10.448 -8.911 1.00 0.00 N ATOM 1219 CA LYS A 79 8.973 10.121 -10.281 1.00 0.00 C ATOM 1220 C LYS A 79 7.797 9.490 -11.008 1.00 0.00 C ATOM 1221 O LYS A 79 7.552 9.799 -12.171 1.00 0.00 O ATOM 1222 CB LYS A 79 10.143 9.138 -10.261 1.00 0.00 C ATOM 1223 CG LYS A 79 11.349 9.734 -9.543 1.00 0.00 C ATOM 1224 CD LYS A 79 12.486 8.720 -9.477 1.00 0.00 C ATOM 1225 CE LYS A 79 13.643 9.397 -8.754 1.00 0.00 C ATOM 1226 NZ LYS A 79 14.836 8.539 -8.732 1.00 0.00 N ATOM 0 H LYS A 79 8.668 9.663 -8.263 1.00 0.00 H new ATOM 0 HA LYS A 79 9.262 11.034 -10.801 1.00 0.00 H new ATOM 0 HB2 LYS A 79 9.839 8.216 -9.764 1.00 0.00 H new ATOM 0 HB3 LYS A 79 10.418 8.874 -11.282 1.00 0.00 H new ATOM 0 HG2 LYS A 79 11.683 10.631 -10.064 1.00 0.00 H new ATOM 0 HG3 LYS A 79 11.066 10.038 -8.535 1.00 0.00 H new ATOM 0 HD2 LYS A 79 12.172 7.822 -8.946 1.00 0.00 H new ATOM 0 HD3 LYS A 79 12.785 8.410 -10.478 1.00 0.00 H new ATOM 0 HE2 LYS A 79 13.880 10.340 -9.246 1.00 0.00 H new ATOM 0 HE3 LYS A 79 13.346 9.636 -7.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 15.681 9.123 -8.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 14.746 7.839 -7.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 14.926 8.046 -9.644 1.00 0.00 H new ATOM 1240 N LEU A 80 7.063 8.610 -10.326 1.00 0.00 N ATOM 1241 CA LEU A 80 5.908 7.914 -10.878 1.00 0.00 C ATOM 1242 C LEU A 80 4.794 8.891 -11.257 1.00 0.00 C ATOM 1243 O LEU A 80 3.782 8.482 -11.807 1.00 0.00 O ATOM 1244 CB LEU A 80 5.375 6.958 -9.818 1.00 0.00 C ATOM 1245 CG LEU A 80 6.161 5.651 -9.667 1.00 0.00 C ATOM 1246 CD1 LEU A 80 7.541 5.607 -10.305 1.00 0.00 C ATOM 1247 CD2 LEU A 80 6.258 5.333 -8.183 1.00 0.00 C ATOM 0 H LEU A 80 7.261 8.359 -9.357 1.00 0.00 H new ATOM 0 HA LEU A 80 6.219 7.382 -11.777 1.00 0.00 H new ATOM 0 HB2 LEU A 80 5.368 7.473 -8.857 1.00 0.00 H new ATOM 0 HB3 LEU A 80 4.340 6.716 -10.057 1.00 0.00 H new ATOM 0 HG LEU A 80 5.602 4.901 -10.226 1.00 0.00 H new ATOM 0 HD11 LEU A 80 7.993 4.631 -10.128 1.00 0.00 H new ATOM 0 HD12 LEU A 80 7.451 5.776 -11.378 1.00 0.00 H new ATOM 0 HD13 LEU A 80 8.169 6.382 -9.867 1.00 0.00 H new ATOM 0 HD21 LEU A 80 6.814 4.406 -8.045 1.00 0.00 H new ATOM 0 HD22 LEU A 80 6.774 6.145 -7.670 1.00 0.00 H new ATOM 0 HD23 LEU A 80 5.256 5.221 -7.769 1.00 0.00 H new ATOM 1259 N GLN A 81 4.986 10.174 -10.960 1.00 0.00 N ATOM 1260 CA GLN A 81 4.098 11.265 -11.282 1.00 0.00 C ATOM 1261 C GLN A 81 4.630 12.179 -12.386 1.00 0.00 C ATOM 1262 O GLN A 81 3.855 12.913 -12.987 1.00 0.00 O ATOM 1263 CB GLN A 81 4.053 12.046 -9.971 1.00 0.00 C ATOM 1264 CG GLN A 81 2.939 11.606 -9.045 1.00 0.00 C ATOM 1265 CD GLN A 81 2.686 10.115 -9.059 1.00 0.00 C ATOM 1266 OE1 GLN A 81 1.696 9.655 -9.614 1.00 0.00 O ATOM 1267 NE2 GLN A 81 3.581 9.357 -8.448 1.00 0.00 N ATOM 0 H GLN A 81 5.817 10.488 -10.459 1.00 0.00 H new ATOM 0 HA GLN A 81 3.139 10.902 -11.651 1.00 0.00 H new ATOM 0 HB2 GLN A 81 5.008 11.934 -9.457 1.00 0.00 H new ATOM 0 HB3 GLN A 81 3.933 13.106 -10.193 1.00 0.00 H new ATOM 0 HG2 GLN A 81 3.182 11.914 -8.028 1.00 0.00 H new ATOM 0 HG3 GLN A 81 2.021 12.123 -9.325 1.00 0.00 H new ATOM 0 HE21 GLN A 81 4.391 9.785 -7.999 1.00 0.00 H new ATOM 0 HE22 GLN A 81 3.462 8.344 -8.426 1.00 0.00 H new ATOM 1276 N TYR A 82 5.937 12.149 -12.663 1.00 0.00 N ATOM 1277 CA TYR A 82 6.550 13.006 -13.675 1.00 0.00 C ATOM 1278 C TYR A 82 6.467 12.400 -15.067 1.00 0.00 C ATOM 1279 O TYR A 82 5.947 13.011 -15.998 1.00 0.00 O ATOM 1280 CB TYR A 82 8.032 13.155 -13.345 1.00 0.00 C ATOM 1281 CG TYR A 82 8.919 13.385 -14.552 1.00 0.00 C ATOM 1282 CD1 TYR A 82 8.825 14.566 -15.304 1.00 0.00 C ATOM 1283 CD2 TYR A 82 9.831 12.386 -14.921 1.00 0.00 C ATOM 1284 CE1 TYR A 82 9.676 14.758 -16.403 1.00 0.00 C ATOM 1285 CE2 TYR A 82 10.719 12.595 -15.984 1.00 0.00 C ATOM 1286 CZ TYR A 82 10.636 13.785 -16.740 1.00 0.00 C ATOM 1287 OH TYR A 82 11.482 13.988 -17.791 1.00 0.00 O ATOM 0 H TYR A 82 6.597 11.530 -12.191 1.00 0.00 H new ATOM 0 HA TYR A 82 6.017 13.957 -13.668 1.00 0.00 H new ATOM 0 HB2 TYR A 82 8.156 13.988 -12.653 1.00 0.00 H new ATOM 0 HB3 TYR A 82 8.369 12.257 -12.827 1.00 0.00 H new ATOM 0 HD1 TYR A 82 8.102 15.323 -15.038 1.00 0.00 H new ATOM 0 HD2 TYR A 82 9.849 11.450 -14.383 1.00 0.00 H new ATOM 0 HE1 TYR A 82 9.594 15.658 -16.994 1.00 0.00 H new ATOM 0 HE2 TYR A 82 11.463 11.850 -16.224 1.00 0.00 H new ATOM 0 HH TYR A 82 12.081 13.217 -17.883 1.00 0.00 H new ATOM 1297 N ARG A 83 6.991 11.186 -15.220 1.00 0.00 N ATOM 1298 CA ARG A 83 7.048 10.555 -16.526 1.00 0.00 C ATOM 1299 C ARG A 83 5.723 9.846 -16.777 1.00 0.00 C ATOM 1300 O ARG A 83 5.492 9.299 -17.850 1.00 0.00 O ATOM 1301 CB ARG A 83 8.312 9.696 -16.658 1.00 0.00 C ATOM 1302 CG ARG A 83 8.285 8.379 -15.885 1.00 0.00 C ATOM 1303 CD ARG A 83 8.780 8.570 -14.457 1.00 0.00 C ATOM 1304 NE ARG A 83 10.246 8.468 -14.359 1.00 0.00 N ATOM 1305 CZ ARG A 83 10.880 7.689 -13.477 1.00 0.00 C ATOM 1306 NH1 ARG A 83 10.195 6.874 -12.680 1.00 0.00 N ATOM 1307 NH2 ARG A 83 12.205 7.720 -13.379 1.00 0.00 N ATOM 0 H ARG A 83 7.378 10.627 -14.459 1.00 0.00 H new ATOM 0 HA ARG A 83 7.153 11.285 -17.328 1.00 0.00 H new ATOM 0 HB2 ARG A 83 8.475 9.477 -17.713 1.00 0.00 H new ATOM 0 HB3 ARG A 83 9.167 10.281 -16.319 1.00 0.00 H new ATOM 0 HG2 ARG A 83 7.270 7.983 -15.871 1.00 0.00 H new ATOM 0 HG3 ARG A 83 8.908 7.643 -16.393 1.00 0.00 H new ATOM 0 HD2 ARG A 83 8.460 9.545 -14.091 1.00 0.00 H new ATOM 0 HD3 ARG A 83 8.321 7.821 -13.812 1.00 0.00 H new ATOM 0 HE ARG A 83 10.810 9.024 -15.001 1.00 0.00 H new ATOM 0 HH11 ARG A 83 9.177 6.840 -12.739 1.00 0.00 H new ATOM 0 HH12 ARG A 83 10.687 6.283 -12.010 1.00 0.00 H new ATOM 0 HH21 ARG A 83 12.746 8.342 -13.980 1.00 0.00 H new ATOM 0 HH22 ARG A 83 12.681 7.122 -12.703 1.00 0.00 H new ATOM 1321 N LEU A 84 4.858 9.874 -15.761 1.00 0.00 N ATOM 1322 CA LEU A 84 3.471 9.454 -15.860 1.00 0.00 C ATOM 1323 C LEU A 84 2.633 10.560 -16.485 1.00 0.00 C ATOM 1324 O LEU A 84 1.636 10.272 -17.132 1.00 0.00 O ATOM 1325 CB LEU A 84 2.944 9.187 -14.448 1.00 0.00 C ATOM 1326 CG LEU A 84 1.430 8.992 -14.354 1.00 0.00 C ATOM 1327 CD1 LEU A 84 0.945 7.831 -15.224 1.00 0.00 C ATOM 1328 CD2 LEU A 84 1.071 8.738 -12.891 1.00 0.00 C ATOM 0 H LEU A 84 5.115 10.198 -14.828 1.00 0.00 H new ATOM 0 HA LEU A 84 3.407 8.558 -16.478 1.00 0.00 H new ATOM 0 HB2 LEU A 84 3.436 8.298 -14.054 1.00 0.00 H new ATOM 0 HB3 LEU A 84 3.229 10.020 -13.805 1.00 0.00 H new ATOM 0 HG LEU A 84 0.936 9.891 -14.723 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.136 7.730 -15.126 1.00 0.00 H new ATOM 0 HD12 LEU A 84 1.198 8.027 -16.266 1.00 0.00 H new ATOM 0 HD13 LEU A 84 1.427 6.908 -14.901 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.006 8.596 -12.800 1.00 0.00 H new ATOM 0 HD22 LEU A 84 1.586 7.844 -12.540 1.00 0.00 H new ATOM 0 HD23 LEU A 84 1.376 9.593 -12.288 1.00 0.00 H new ATOM 1340 N GLU A 85 3.022 11.824 -16.302 1.00 0.00 N ATOM 1341 CA GLU A 85 2.192 12.939 -16.726 1.00 0.00 C ATOM 1342 C GLU A 85 2.508 13.408 -18.141 1.00 0.00 C ATOM 1343 O GLU A 85 1.727 14.156 -18.726 1.00 0.00 O ATOM 1344 CB GLU A 85 2.303 14.074 -15.710 1.00 0.00 C ATOM 1345 CG GLU A 85 3.400 15.085 -16.043 1.00 0.00 C ATOM 1346 CD GLU A 85 3.358 16.275 -15.084 1.00 0.00 C ATOM 1347 OE1 GLU A 85 2.434 17.106 -15.236 1.00 0.00 O ATOM 1348 OE2 GLU A 85 4.247 16.348 -14.206 1.00 0.00 O ATOM 0 H GLU A 85 3.903 12.094 -15.865 1.00 0.00 H new ATOM 0 HA GLU A 85 1.158 12.595 -16.760 1.00 0.00 H new ATOM 0 HB2 GLU A 85 1.347 14.594 -15.652 1.00 0.00 H new ATOM 0 HB3 GLU A 85 2.497 13.651 -14.724 1.00 0.00 H new ATOM 0 HG2 GLU A 85 4.375 14.601 -15.985 1.00 0.00 H new ATOM 0 HG3 GLU A 85 3.278 15.435 -17.068 1.00 0.00 H new ATOM 1355 N LEU A 86 3.642 12.976 -18.693 1.00 0.00 N ATOM 1356 CA LEU A 86 4.048 13.416 -20.019 1.00 0.00 C ATOM 1357 C LEU A 86 3.822 12.317 -21.050 1.00 0.00 C ATOM 1358 O LEU A 86 3.461 12.600 -22.189 1.00 0.00 O ATOM 1359 CB LEU A 86 5.512 13.868 -19.963 1.00 0.00 C ATOM 1360 CG LEU A 86 6.540 12.736 -20.014 1.00 0.00 C ATOM 1361 CD1 LEU A 86 6.860 12.353 -21.464 1.00 0.00 C ATOM 1362 CD2 LEU A 86 7.837 13.200 -19.350 1.00 0.00 C ATOM 0 H LEU A 86 4.288 12.327 -18.243 1.00 0.00 H new ATOM 0 HA LEU A 86 3.436 14.261 -20.334 1.00 0.00 H new ATOM 0 HB2 LEU A 86 5.699 14.547 -20.795 1.00 0.00 H new ATOM 0 HB3 LEU A 86 5.666 14.438 -19.047 1.00 0.00 H new ATOM 0 HG LEU A 86 6.122 11.874 -19.495 1.00 0.00 H new ATOM 0 HD11 LEU A 86 7.593 11.546 -21.474 1.00 0.00 H new ATOM 0 HD12 LEU A 86 5.949 12.022 -21.962 1.00 0.00 H new ATOM 0 HD13 LEU A 86 7.266 13.218 -21.988 1.00 0.00 H new ATOM 0 HD21 LEU A 86 8.572 12.395 -19.385 1.00 0.00 H new ATOM 0 HD22 LEU A 86 8.226 14.070 -19.880 1.00 0.00 H new ATOM 0 HD23 LEU A 86 7.639 13.466 -18.312 1.00 0.00 H new ATOM 1374 N ALA A 87 4.038 11.063 -20.644 1.00 0.00 N ATOM 1375 CA ALA A 87 3.842 9.888 -21.453 1.00 0.00 C ATOM 1376 C ALA A 87 2.423 9.887 -22.010 1.00 0.00 C ATOM 1377 O ALA A 87 2.237 9.977 -23.216 1.00 0.00 O ATOM 1378 CB ALA A 87 4.106 8.688 -20.549 1.00 0.00 C ATOM 0 H ALA A 87 4.367 10.845 -19.703 1.00 0.00 H new ATOM 0 HA ALA A 87 4.516 9.857 -22.309 1.00 0.00 H new ATOM 0 HB1 ALA A 87 3.970 7.768 -21.117 1.00 0.00 H new ATOM 0 HB2 ALA A 87 5.128 8.734 -20.172 1.00 0.00 H new ATOM 0 HB3 ALA A 87 3.409 8.703 -19.711 1.00 0.00 H new ATOM 1384 N GLN A 88 1.409 9.789 -21.144 1.00 0.00 N ATOM 1385 CA GLN A 88 0.023 9.794 -21.589 1.00 0.00 C ATOM 1386 C GLN A 88 -0.363 11.088 -22.295 1.00 0.00 C ATOM 1387 O GLN A 88 -1.361 11.130 -23.018 1.00 0.00 O ATOM 1388 CB GLN A 88 -0.924 9.550 -20.431 1.00 0.00 C ATOM 1389 CG GLN A 88 -0.710 10.512 -19.269 1.00 0.00 C ATOM 1390 CD GLN A 88 -1.666 10.196 -18.120 1.00 0.00 C ATOM 1391 OE1 GLN A 88 -2.882 10.205 -18.293 1.00 0.00 O ATOM 1392 NE2 GLN A 88 -1.119 9.915 -16.941 1.00 0.00 N ATOM 0 H GLN A 88 1.528 9.706 -20.134 1.00 0.00 H new ATOM 0 HA GLN A 88 -0.065 8.981 -22.309 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -1.951 9.640 -20.785 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -0.798 8.527 -20.076 1.00 0.00 H new ATOM 0 HG2 GLN A 88 0.320 10.444 -18.920 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -0.866 11.537 -19.606 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -0.104 9.917 -16.836 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -1.714 9.697 -16.142 1.00 0.00 H new ATOM 1401 N GLY A 89 0.427 12.138 -22.086 1.00 0.00 N ATOM 1402 CA GLY A 89 0.223 13.423 -22.731 1.00 0.00 C ATOM 1403 C GLY A 89 0.888 13.443 -24.107 1.00 0.00 C ATOM 1404 O GLY A 89 0.909 14.479 -24.771 1.00 0.00 O ATOM 0 H GLY A 89 1.231 12.116 -21.459 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -0.844 13.620 -22.833 1.00 0.00 H new ATOM 0 HA3 GLY A 89 0.635 14.218 -22.110 1.00 0.00 H new ATOM 1408 N ALA A 90 1.423 12.293 -24.524 1.00 0.00 N ATOM 1409 CA ALA A 90 2.038 12.086 -25.823 1.00 0.00 C ATOM 1410 C ALA A 90 1.501 10.807 -26.472 1.00 0.00 C ATOM 1411 O ALA A 90 1.926 10.442 -27.570 1.00 0.00 O ATOM 1412 CB ALA A 90 3.548 11.997 -25.643 1.00 0.00 C ATOM 0 H ALA A 90 1.437 11.456 -23.941 1.00 0.00 H new ATOM 0 HA ALA A 90 1.796 12.922 -26.479 1.00 0.00 H new ATOM 0 HB1 ALA A 90 4.021 11.841 -26.612 1.00 0.00 H new ATOM 0 HB2 ALA A 90 3.917 12.924 -25.203 1.00 0.00 H new ATOM 0 HB3 ALA A 90 3.787 11.162 -24.984 1.00 0.00 H new ATOM 1418 N VAL A 91 0.571 10.127 -25.792 1.00 0.00 N ATOM 1419 CA VAL A 91 0.037 8.831 -26.196 1.00 0.00 C ATOM 1420 C VAL A 91 -1.368 8.925 -26.743 1.00 0.00 C ATOM 1421 O VAL A 91 -2.107 9.863 -26.459 1.00 0.00 O ATOM 1422 CB VAL A 91 0.078 7.925 -24.982 1.00 0.00 C ATOM 1423 CG1 VAL A 91 -0.499 6.517 -25.003 1.00 0.00 C ATOM 1424 CG2 VAL A 91 1.515 7.591 -24.821 1.00 0.00 C ATOM 0 H VAL A 91 0.162 10.475 -24.925 1.00 0.00 H new ATOM 0 HA VAL A 91 0.645 8.431 -27.007 1.00 0.00 H new ATOM 0 HB VAL A 91 -0.501 8.494 -24.254 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -0.359 6.052 -24.027 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -1.563 6.563 -25.234 1.00 0.00 H new ATOM 0 HG13 VAL A 91 0.012 5.926 -25.763 1.00 0.00 H new ATOM 0 HG21 VAL A 91 1.642 6.934 -23.960 1.00 0.00 H new ATOM 0 HG22 VAL A 91 1.874 7.087 -25.718 1.00 0.00 H new ATOM 0 HG23 VAL A 91 2.086 8.506 -24.666 1.00 0.00 H new ATOM 1434 N GLY A 92 -1.727 7.923 -27.543 1.00 0.00 N ATOM 1435 CA GLY A 92 -3.036 7.825 -28.147 1.00 0.00 C ATOM 1436 C GLY A 92 -3.282 8.920 -29.188 1.00 0.00 C ATOM 1437 O GLY A 92 -4.384 9.019 -29.727 1.00 0.00 O ATOM 0 H GLY A 92 -1.104 7.153 -27.787 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -3.143 6.848 -28.619 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -3.797 7.889 -27.370 1.00 0.00 H new ATOM 1441 N SER A 93 -2.267 9.744 -29.472 1.00 0.00 N ATOM 1442 CA SER A 93 -2.362 10.819 -30.452 1.00 0.00 C ATOM 1443 C SER A 93 -2.576 10.290 -31.867 1.00 0.00 C ATOM 1444 O SER A 93 -2.471 9.091 -32.111 1.00 0.00 O ATOM 1445 CB SER A 93 -1.096 11.676 -30.384 1.00 0.00 C ATOM 1446 OG SER A 93 0.039 10.885 -30.686 1.00 0.00 O ATOM 0 H SER A 93 -1.354 9.679 -29.023 1.00 0.00 H new ATOM 0 HA SER A 93 -3.234 11.426 -30.208 1.00 0.00 H new ATOM 0 HB2 SER A 93 -1.170 12.505 -31.088 1.00 0.00 H new ATOM 0 HB3 SER A 93 -0.993 12.110 -29.389 1.00 0.00 H new ATOM 0 HG SER A 93 0.846 11.440 -30.642 1.00 0.00 H new ATOM 1452 N VAL A 94 -2.878 11.213 -32.786 1.00 0.00 N ATOM 1453 CA VAL A 94 -3.218 10.952 -34.184 1.00 0.00 C ATOM 1454 C VAL A 94 -4.294 9.884 -34.335 1.00 0.00 C ATOM 1455 O VAL A 94 -4.043 8.682 -34.258 1.00 0.00 O ATOM 1456 CB VAL A 94 -1.976 10.660 -35.024 1.00 0.00 C ATOM 1457 CG1 VAL A 94 -2.412 10.428 -36.472 1.00 0.00 C ATOM 1458 CG2 VAL A 94 -1.046 11.869 -34.973 1.00 0.00 C ATOM 0 H VAL A 94 -2.892 12.208 -32.562 1.00 0.00 H new ATOM 0 HA VAL A 94 -3.654 11.870 -34.579 1.00 0.00 H new ATOM 0 HB VAL A 94 -1.459 9.780 -34.640 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -1.537 10.218 -37.086 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -3.097 9.581 -36.515 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -2.914 11.320 -36.848 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -0.156 11.669 -35.570 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -1.562 12.742 -35.372 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -0.754 12.060 -33.940 1.00 0.00 H new ATOM 1468 N GLN A 95 -5.512 10.364 -34.560 1.00 0.00 N ATOM 1469 CA GLN A 95 -6.705 9.561 -34.721 1.00 0.00 C ATOM 1470 C GLN A 95 -6.892 9.091 -36.169 1.00 0.00 C ATOM 1471 O GLN A 95 -7.881 8.428 -36.474 1.00 0.00 O ATOM 1472 CB GLN A 95 -7.870 10.456 -34.317 1.00 0.00 C ATOM 1473 CG GLN A 95 -7.816 10.765 -32.818 1.00 0.00 C ATOM 1474 CD GLN A 95 -8.523 12.078 -32.510 1.00 0.00 C ATOM 1475 OE1 GLN A 95 -9.735 12.117 -32.317 1.00 0.00 O ATOM 1476 NE2 GLN A 95 -7.758 13.170 -32.461 1.00 0.00 N ATOM 0 H GLN A 95 -5.696 11.364 -34.637 1.00 0.00 H new ATOM 0 HA GLN A 95 -6.638 8.661 -34.110 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -7.837 11.385 -34.887 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -8.813 9.966 -34.559 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -8.284 9.955 -32.258 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -6.778 10.821 -32.491 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -6.754 13.097 -32.627 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -8.177 14.077 -32.258 1.00 0.00 H new ATOM 1485 N ILE A 96 -5.953 9.429 -37.059 1.00 0.00 N ATOM 1486 CA ILE A 96 -6.057 9.139 -38.486 1.00 0.00 C ATOM 1487 C ILE A 96 -4.718 8.680 -39.078 1.00 0.00 C ATOM 1488 O ILE A 96 -4.311 9.173 -40.131 1.00 0.00 O ATOM 1489 CB ILE A 96 -6.602 10.373 -39.226 1.00 0.00 C ATOM 1490 CG1 ILE A 96 -5.752 11.615 -38.920 1.00 0.00 C ATOM 1491 CG2 ILE A 96 -8.059 10.620 -38.836 1.00 0.00 C ATOM 1492 CD1 ILE A 96 -6.200 12.821 -39.750 1.00 0.00 C ATOM 0 H ILE A 96 -5.094 9.915 -36.803 1.00 0.00 H new ATOM 0 HA ILE A 96 -6.753 8.311 -38.617 1.00 0.00 H new ATOM 0 HB ILE A 96 -6.550 10.180 -40.298 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -5.825 11.855 -37.859 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -4.704 11.399 -39.126 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -8.434 11.496 -39.366 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -8.659 9.750 -39.102 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -8.124 10.791 -37.761 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.577 13.682 -39.507 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -6.102 12.589 -40.811 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -7.241 13.052 -39.524 1.00 0.00 H new ATOM 1504 N PRO A 97 -4.010 7.744 -38.427 1.00 0.00 N ATOM 1505 CA PRO A 97 -2.705 7.279 -38.876 1.00 0.00 C ATOM 1506 C PRO A 97 -2.836 6.449 -40.149 1.00 0.00 C ATOM 1507 O PRO A 97 -3.927 6.006 -40.507 1.00 0.00 O ATOM 1508 CB PRO A 97 -2.173 6.415 -37.726 1.00 0.00 C ATOM 1509 CG PRO A 97 -3.444 5.870 -37.082 1.00 0.00 C ATOM 1510 CD PRO A 97 -4.416 7.041 -37.222 1.00 0.00 C ATOM 0 HA PRO A 97 -2.037 8.108 -39.111 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -1.530 5.613 -38.089 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -1.584 7.002 -37.021 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -3.807 4.978 -37.593 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -3.285 5.597 -36.039 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -5.445 6.689 -37.301 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -4.369 7.696 -36.352 1.00 0.00 H new ATOM 1518 N VAL A 98 -1.711 6.231 -40.839 1.00 0.00 N ATOM 1519 CA VAL A 98 -1.660 5.395 -42.035 1.00 0.00 C ATOM 1520 C VAL A 98 -1.648 3.924 -41.630 1.00 0.00 C ATOM 1521 O VAL A 98 -0.701 3.188 -41.893 1.00 0.00 O ATOM 1522 CB VAL A 98 -0.494 5.823 -42.942 1.00 0.00 C ATOM 1523 CG1 VAL A 98 0.893 5.535 -42.352 1.00 0.00 C ATOM 1524 CG2 VAL A 98 -0.606 5.149 -44.305 1.00 0.00 C ATOM 0 H VAL A 98 -0.810 6.632 -40.580 1.00 0.00 H new ATOM 0 HA VAL A 98 -2.555 5.534 -42.641 1.00 0.00 H new ATOM 0 HB VAL A 98 -0.580 6.905 -43.038 1.00 0.00 H new ATOM 0 HG11 VAL A 98 1.661 5.865 -43.051 1.00 0.00 H new ATOM 0 HG12 VAL A 98 1.006 6.070 -41.409 1.00 0.00 H new ATOM 0 HG13 VAL A 98 0.998 4.464 -42.176 1.00 0.00 H new ATOM 0 HG21 VAL A 98 0.226 5.462 -44.935 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -0.579 4.067 -44.179 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -1.546 5.436 -44.777 1.00 0.00 H new ATOM 1534 N VAL A 99 -2.733 3.491 -40.981 1.00 0.00 N ATOM 1535 CA VAL A 99 -2.954 2.149 -40.472 1.00 0.00 C ATOM 1536 C VAL A 99 -3.075 1.088 -41.569 1.00 0.00 C ATOM 1537 O VAL A 99 -3.667 0.027 -41.387 1.00 0.00 O ATOM 1538 CB VAL A 99 -4.173 2.236 -39.545 1.00 0.00 C ATOM 1539 CG1 VAL A 99 -5.487 2.246 -40.329 1.00 0.00 C ATOM 1540 CG2 VAL A 99 -4.143 1.117 -38.520 1.00 0.00 C ATOM 0 H VAL A 99 -3.521 4.109 -40.790 1.00 0.00 H new ATOM 0 HA VAL A 99 -2.084 1.802 -39.914 1.00 0.00 H new ATOM 0 HB VAL A 99 -4.120 3.186 -39.013 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -6.325 2.308 -39.634 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -5.505 3.107 -40.998 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -5.569 1.330 -40.914 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -5.015 1.195 -37.871 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -4.156 0.155 -39.032 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -3.236 1.197 -37.920 1.00 0.00 H new ATOM 1550 N GLU A 100 -2.499 1.402 -42.720 1.00 0.00 N ATOM 1551 CA GLU A 100 -2.462 0.612 -43.927 1.00 0.00 C ATOM 1552 C GLU A 100 -1.850 -0.767 -43.679 1.00 0.00 C ATOM 1553 O GLU A 100 -0.961 -0.932 -42.844 1.00 0.00 O ATOM 1554 CB GLU A 100 -1.631 1.412 -44.936 1.00 0.00 C ATOM 1555 CG GLU A 100 -1.428 0.643 -46.220 1.00 0.00 C ATOM 1556 CD GLU A 100 -0.865 1.533 -47.327 1.00 0.00 C ATOM 1557 OE1 GLU A 100 0.380 1.629 -47.418 1.00 0.00 O ATOM 1558 OE2 GLU A 100 -1.680 2.116 -48.074 1.00 0.00 O ATOM 0 H GLU A 100 -2.008 2.288 -42.836 1.00 0.00 H new ATOM 0 HA GLU A 100 -3.469 0.428 -44.301 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -2.130 2.357 -45.152 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -0.662 1.655 -44.499 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -0.748 -0.190 -46.042 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -2.378 0.217 -46.543 1.00 0.00 H new ATOM 1565 N VAL A 101 -2.344 -1.752 -44.428 1.00 0.00 N ATOM 1566 CA VAL A 101 -1.848 -3.121 -44.426 1.00 0.00 C ATOM 1567 C VAL A 101 -1.826 -3.628 -45.863 1.00 0.00 C ATOM 1568 O VAL A 101 -2.805 -3.474 -46.592 1.00 0.00 O ATOM 1569 CB VAL A 101 -2.741 -4.012 -43.559 1.00 0.00 C ATOM 1570 CG1 VAL A 101 -2.151 -5.419 -43.453 1.00 0.00 C ATOM 1571 CG2 VAL A 101 -2.889 -3.436 -42.152 1.00 0.00 C ATOM 0 H VAL A 101 -3.123 -1.612 -45.071 1.00 0.00 H new ATOM 0 HA VAL A 101 -0.842 -3.149 -44.008 1.00 0.00 H new ATOM 0 HB VAL A 101 -3.721 -4.056 -44.035 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -2.798 -6.039 -42.833 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -2.073 -5.857 -44.448 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -1.160 -5.365 -43.002 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -3.528 -4.088 -41.557 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -1.908 -3.364 -41.683 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -3.337 -2.444 -42.210 1.00 0.00 H new ATOM 1581 N ASP A 102 -0.709 -4.229 -46.273 1.00 0.00 N ATOM 1582 CA ASP A 102 -0.524 -4.702 -47.637 1.00 0.00 C ATOM 1583 C ASP A 102 0.504 -5.833 -47.671 1.00 0.00 C ATOM 1584 O ASP A 102 1.225 -6.018 -48.653 1.00 0.00 O ATOM 1585 CB ASP A 102 -0.116 -3.511 -48.512 1.00 0.00 C ATOM 1586 CG ASP A 102 -0.045 -3.869 -49.996 1.00 0.00 C ATOM 1587 OD1 ASP A 102 -0.993 -4.529 -50.481 1.00 0.00 O ATOM 1588 OD2 ASP A 102 0.960 -3.476 -50.632 1.00 0.00 O ATOM 0 H ASP A 102 0.092 -4.400 -45.665 1.00 0.00 H new ATOM 0 HA ASP A 102 -1.452 -5.116 -48.031 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -0.831 -2.700 -48.371 1.00 0.00 H new ATOM 0 HB3 ASP A 102 0.855 -3.140 -48.185 1.00 0.00 H new ATOM 1593 N GLU A 103 0.571 -6.594 -46.580 1.00 0.00 N ATOM 1594 CA GLU A 103 1.518 -7.687 -46.420 1.00 0.00 C ATOM 1595 C GLU A 103 0.902 -8.779 -45.551 1.00 0.00 C ATOM 1596 O GLU A 103 -0.314 -8.830 -45.357 1.00 0.00 O ATOM 1597 CB GLU A 103 2.807 -7.157 -45.776 1.00 0.00 C ATOM 1598 CG GLU A 103 4.037 -7.918 -46.263 1.00 0.00 C ATOM 1599 CD GLU A 103 5.310 -7.387 -45.607 1.00 0.00 C ATOM 1600 OE1 GLU A 103 5.624 -7.861 -44.494 1.00 0.00 O ATOM 1601 OE2 GLU A 103 5.962 -6.514 -46.217 1.00 0.00 O ATOM 0 H GLU A 103 -0.040 -6.464 -45.774 1.00 0.00 H new ATOM 0 HA GLU A 103 1.757 -8.109 -47.396 1.00 0.00 H new ATOM 0 HB2 GLU A 103 2.920 -6.098 -46.007 1.00 0.00 H new ATOM 0 HB3 GLU A 103 2.733 -7.241 -44.692 1.00 0.00 H new ATOM 0 HG2 GLU A 103 3.924 -8.979 -46.039 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.118 -7.828 -47.346 1.00 0.00 H new ATOM 1608 N LEU A 104 1.768 -9.647 -45.033 1.00 0.00 N ATOM 1609 CA LEU A 104 1.445 -10.716 -44.106 1.00 0.00 C ATOM 1610 C LEU A 104 0.628 -10.222 -42.907 1.00 0.00 C ATOM 1611 O LEU A 104 0.566 -9.024 -42.631 1.00 0.00 O ATOM 1612 CB LEU A 104 2.781 -11.314 -43.664 1.00 0.00 C ATOM 1613 CG LEU A 104 3.279 -12.347 -44.663 1.00 0.00 C ATOM 1614 CD1 LEU A 104 4.754 -12.654 -44.400 1.00 0.00 C ATOM 1615 CD2 LEU A 104 2.431 -13.590 -44.417 1.00 0.00 C ATOM 0 H LEU A 104 2.761 -9.618 -45.263 1.00 0.00 H new ATOM 0 HA LEU A 104 0.815 -11.463 -44.590 1.00 0.00 H new ATOM 0 HB2 LEU A 104 3.521 -10.520 -43.559 1.00 0.00 H new ATOM 0 HB3 LEU A 104 2.669 -11.777 -42.684 1.00 0.00 H new ATOM 0 HG LEU A 104 3.195 -11.997 -45.692 1.00 0.00 H new ATOM 0 HD11 LEU A 104 5.105 -13.395 -45.119 1.00 0.00 H new ATOM 0 HD12 LEU A 104 5.340 -11.741 -44.504 1.00 0.00 H new ATOM 0 HD13 LEU A 104 4.870 -13.046 -43.389 1.00 0.00 H new ATOM 0 HD21 LEU A 104 2.735 -14.380 -45.104 1.00 0.00 H new ATOM 0 HD22 LEU A 104 2.571 -13.928 -43.390 1.00 0.00 H new ATOM 0 HD23 LEU A 104 1.380 -13.352 -44.580 1.00 0.00 H new ATOM 1627 N PRO A 105 -0.001 -11.169 -42.196 1.00 0.00 N ATOM 1628 CA PRO A 105 -0.826 -10.951 -41.017 1.00 0.00 C ATOM 1629 C PRO A 105 -0.118 -10.112 -39.951 1.00 0.00 C ATOM 1630 O PRO A 105 1.090 -9.887 -40.016 1.00 0.00 O ATOM 1631 CB PRO A 105 -1.154 -12.355 -40.500 1.00 0.00 C ATOM 1632 CG PRO A 105 -1.088 -13.223 -41.752 1.00 0.00 C ATOM 1633 CD PRO A 105 0.058 -12.576 -42.518 1.00 0.00 C ATOM 0 HA PRO A 105 -1.722 -10.382 -41.263 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -0.437 -12.682 -39.747 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -2.141 -12.392 -40.038 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -0.884 -14.267 -41.515 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -2.021 -13.200 -42.315 1.00 0.00 H new ATOM 0 HD2 PRO A 105 1.016 -13.005 -42.225 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -0.048 -12.737 -43.591 1.00 0.00 H new ATOM 1641 N GLU A 106 -0.884 -9.646 -38.962 1.00 0.00 N ATOM 1642 CA GLU A 106 -0.412 -8.721 -37.933 1.00 0.00 C ATOM 1643 C GLU A 106 0.620 -9.322 -36.974 1.00 0.00 C ATOM 1644 O GLU A 106 0.909 -8.731 -35.933 1.00 0.00 O ATOM 1645 CB GLU A 106 -1.618 -8.164 -37.167 1.00 0.00 C ATOM 1646 CG GLU A 106 -2.370 -9.271 -36.423 1.00 0.00 C ATOM 1647 CD GLU A 106 -3.557 -8.692 -35.658 1.00 0.00 C ATOM 1648 OE1 GLU A 106 -3.363 -8.310 -34.482 1.00 0.00 O ATOM 1649 OE2 GLU A 106 -4.658 -8.636 -36.257 1.00 0.00 O ATOM 0 H GLU A 106 -1.864 -9.906 -38.853 1.00 0.00 H new ATOM 0 HA GLU A 106 0.117 -7.917 -38.445 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -1.282 -7.410 -36.456 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -2.294 -7.667 -37.863 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -2.719 -10.022 -37.132 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -1.695 -9.775 -35.731 1.00 0.00 H new ATOM 1656 N GLY A 107 1.181 -10.486 -37.302 1.00 0.00 N ATOM 1657 CA GLY A 107 2.155 -11.140 -36.443 1.00 0.00 C ATOM 1658 C GLY A 107 2.598 -12.502 -36.972 1.00 0.00 C ATOM 1659 O GLY A 107 3.084 -13.327 -36.197 1.00 0.00 O ATOM 0 H GLY A 107 0.973 -10.994 -38.162 1.00 0.00 H new ATOM 0 HA2 GLY A 107 3.028 -10.496 -36.337 1.00 0.00 H new ATOM 0 HA3 GLY A 107 1.728 -11.264 -35.448 1.00 0.00 H new ATOM 1663 N TYR A 108 2.440 -12.763 -38.275 1.00 0.00 N ATOM 1664 CA TYR A 108 2.760 -14.040 -38.874 1.00 0.00 C ATOM 1665 C TYR A 108 4.261 -14.294 -38.954 1.00 0.00 C ATOM 1666 O TYR A 108 4.691 -15.441 -39.064 1.00 0.00 O ATOM 1667 CB TYR A 108 2.119 -13.924 -40.236 1.00 0.00 C ATOM 1668 CG TYR A 108 2.493 -14.935 -41.261 1.00 0.00 C ATOM 1669 CD1 TYR A 108 3.762 -14.891 -41.843 1.00 0.00 C ATOM 1670 CD2 TYR A 108 1.534 -15.868 -41.663 1.00 0.00 C ATOM 1671 CE1 TYR A 108 4.061 -15.756 -42.899 1.00 0.00 C ATOM 1672 CE2 TYR A 108 1.844 -16.762 -42.694 1.00 0.00 C ATOM 1673 CZ TYR A 108 3.111 -16.711 -43.317 1.00 0.00 C ATOM 1674 OH TYR A 108 3.408 -17.579 -44.327 1.00 0.00 O ATOM 0 H TYR A 108 2.082 -12.078 -38.940 1.00 0.00 H new ATOM 0 HA TYR A 108 2.397 -14.889 -38.295 1.00 0.00 H new ATOM 0 HB2 TYR A 108 1.038 -13.964 -40.103 1.00 0.00 H new ATOM 0 HB3 TYR A 108 2.355 -12.938 -40.635 1.00 0.00 H new ATOM 0 HD1 TYR A 108 4.505 -14.196 -41.481 1.00 0.00 H new ATOM 0 HD2 TYR A 108 0.566 -15.899 -41.184 1.00 0.00 H new ATOM 0 HE1 TYR A 108 5.019 -15.693 -43.395 1.00 0.00 H new ATOM 0 HE2 TYR A 108 1.114 -17.491 -43.014 1.00 0.00 H new ATOM 0 HH TYR A 108 2.642 -18.169 -44.487 1.00 0.00 H new ATOM 1684 N ASP A 109 5.033 -13.206 -38.888 1.00 0.00 N ATOM 1685 CA ASP A 109 6.487 -13.154 -38.958 1.00 0.00 C ATOM 1686 C ASP A 109 7.119 -14.377 -39.628 1.00 0.00 C ATOM 1687 O ASP A 109 7.470 -15.350 -38.963 1.00 0.00 O ATOM 1688 CB ASP A 109 7.051 -12.921 -37.554 1.00 0.00 C ATOM 1689 CG ASP A 109 8.553 -12.668 -37.582 1.00 0.00 C ATOM 1690 OD1 ASP A 109 9.043 -12.198 -38.633 1.00 0.00 O ATOM 1691 OD2 ASP A 109 9.201 -12.950 -36.548 1.00 0.00 O ATOM 0 H ASP A 109 4.626 -12.277 -38.777 1.00 0.00 H new ATOM 0 HA ASP A 109 6.753 -12.318 -39.605 1.00 0.00 H new ATOM 0 HB2 ASP A 109 6.547 -12.069 -37.097 1.00 0.00 H new ATOM 0 HB3 ASP A 109 6.840 -13.789 -36.929 1.00 0.00 H new ATOM 1696 N ARG A 110 7.262 -14.308 -40.957 1.00 0.00 N ATOM 1697 CA ARG A 110 7.770 -15.392 -41.790 1.00 0.00 C ATOM 1698 C ARG A 110 9.150 -15.889 -41.355 1.00 0.00 C ATOM 1699 O ARG A 110 9.492 -17.039 -41.632 1.00 0.00 O ATOM 1700 CB ARG A 110 7.821 -14.894 -43.238 1.00 0.00 C ATOM 1701 CG ARG A 110 8.140 -16.027 -44.215 1.00 0.00 C ATOM 1702 CD ARG A 110 8.143 -15.498 -45.645 1.00 0.00 C ATOM 1703 NE ARG A 110 8.434 -16.569 -46.606 1.00 0.00 N ATOM 1704 CZ ARG A 110 8.475 -16.396 -47.929 1.00 0.00 C ATOM 1705 NH1 ARG A 110 8.264 -15.197 -48.468 1.00 0.00 N ATOM 1706 NH2 ARG A 110 8.730 -17.428 -48.729 1.00 0.00 N ATOM 0 H ARG A 110 7.020 -13.473 -41.491 1.00 0.00 H new ATOM 0 HA ARG A 110 7.098 -16.244 -41.687 1.00 0.00 H new ATOM 0 HB2 ARG A 110 6.864 -14.444 -43.502 1.00 0.00 H new ATOM 0 HB3 ARG A 110 8.576 -14.113 -43.328 1.00 0.00 H new ATOM 0 HG2 ARG A 110 9.111 -16.461 -43.977 1.00 0.00 H new ATOM 0 HG3 ARG A 110 7.402 -16.823 -44.115 1.00 0.00 H new ATOM 0 HD2 ARG A 110 7.174 -15.054 -45.873 1.00 0.00 H new ATOM 0 HD3 ARG A 110 8.887 -14.707 -45.742 1.00 0.00 H new ATOM 0 HE ARG A 110 8.616 -17.503 -46.240 1.00 0.00 H new ATOM 0 HH11 ARG A 110 8.068 -14.396 -47.868 1.00 0.00 H new ATOM 0 HH12 ARG A 110 8.298 -15.080 -49.481 1.00 0.00 H new ATOM 0 HH21 ARG A 110 8.894 -18.353 -48.332 1.00 0.00 H new ATOM 0 HH22 ARG A 110 8.761 -17.294 -49.740 1.00 0.00 H new ATOM 1720 N SER A 111 9.937 -15.041 -40.682 1.00 0.00 N ATOM 1721 CA SER A 111 11.307 -15.369 -40.301 1.00 0.00 C ATOM 1722 C SER A 111 11.668 -14.727 -38.966 1.00 0.00 C ATOM 1723 O SER A 111 11.501 -15.414 -37.936 1.00 0.00 O ATOM 1724 CB SER A 111 12.265 -14.926 -41.393 1.00 0.00 C ATOM 1725 OG SER A 111 11.986 -15.610 -42.596 1.00 0.00 O ATOM 1726 OXT SER A 111 12.109 -13.556 -38.983 1.00 0.00 O ATOM 0 H SER A 111 9.638 -14.111 -40.389 1.00 0.00 H new ATOM 0 HA SER A 111 11.389 -16.449 -40.181 1.00 0.00 H new ATOM 0 HB2 SER A 111 12.177 -13.851 -41.549 1.00 0.00 H new ATOM 0 HB3 SER A 111 13.293 -15.121 -41.086 1.00 0.00 H new ATOM 0 HG SER A 111 12.609 -15.315 -43.292 1.00 0.00 H new TER 1732 SER A 111 ATOM 1733 N ALA B 701 18.865 22.175 -14.459 1.00 0.00 N ATOM 1734 CA ALA B 701 18.694 20.719 -14.353 1.00 0.00 C ATOM 1735 C ALA B 701 18.926 20.261 -12.916 1.00 0.00 C ATOM 1736 O ALA B 701 20.041 20.359 -12.401 1.00 0.00 O ATOM 1737 CB ALA B 701 19.639 19.989 -15.313 1.00 0.00 C ATOM 0 HA ALA B 701 17.670 20.472 -14.634 1.00 0.00 H new ATOM 0 HB1 ALA B 701 19.495 18.913 -15.217 1.00 0.00 H new ATOM 0 HB2 ALA B 701 19.424 20.294 -16.337 1.00 0.00 H new ATOM 0 HB3 ALA B 701 20.671 20.240 -15.069 1.00 0.00 H new ATOM 1745 N ASP B 702 17.872 19.756 -12.269 1.00 0.00 N ATOM 1746 CA ASP B 702 17.919 19.334 -10.874 1.00 0.00 C ATOM 1747 C ASP B 702 17.049 18.097 -10.657 1.00 0.00 C ATOM 1748 O ASP B 702 16.544 17.867 -9.560 1.00 0.00 O ATOM 1749 CB ASP B 702 17.476 20.483 -9.967 1.00 0.00 C ATOM 1750 CG ASP B 702 18.360 21.715 -10.124 1.00 0.00 C ATOM 1751 OD1 ASP B 702 18.026 22.558 -10.989 1.00 0.00 O ATOM 1752 OD2 ASP B 702 19.363 21.809 -9.380 1.00 0.00 O ATOM 0 H ASP B 702 16.958 19.629 -12.705 1.00 0.00 H new ATOM 0 HA ASP B 702 18.945 19.068 -10.619 1.00 0.00 H new ATOM 0 HB2 ASP B 702 16.444 20.747 -10.196 1.00 0.00 H new ATOM 0 HB3 ASP B 702 17.497 20.153 -8.928 1.00 0.00 H new ATOM 1757 N THR B 703 16.875 17.308 -11.716 1.00 0.00 N ATOM 1758 CA THR B 703 16.031 16.127 -11.715 1.00 0.00 C ATOM 1759 C THR B 703 16.569 15.010 -10.830 1.00 0.00 C ATOM 1760 O THR B 703 17.699 15.043 -10.341 1.00 0.00 O ATOM 1761 CB THR B 703 15.937 15.586 -13.141 1.00 0.00 C ATOM 1762 OG1 THR B 703 17.227 15.301 -13.628 1.00 0.00 O ATOM 1763 CG2 THR B 703 15.285 16.600 -14.066 1.00 0.00 C ATOM 0 H THR B 703 17.328 17.480 -12.613 1.00 0.00 H new ATOM 0 HA THR B 703 15.061 16.431 -11.323 1.00 0.00 H new ATOM 0 HB THR B 703 15.330 14.681 -13.117 1.00 0.00 H new ATOM 0 HG1 THR B 703 17.206 15.264 -14.607 1.00 0.00 H new ATOM 0 HG21 THR B 703 15.230 16.190 -15.075 1.00 0.00 H new ATOM 0 HG22 THR B 703 14.279 16.823 -13.710 1.00 0.00 H new ATOM 0 HG23 THR B 703 15.877 17.515 -14.078 1.00 0.00 H new ATOM 1771 N GLU B 704 15.712 14.005 -10.642 1.00 0.00 N ATOM 1772 CA GLU B 704 16.055 12.725 -10.036 1.00 0.00 C ATOM 1773 C GLU B 704 15.327 11.588 -10.758 1.00 0.00 C ATOM 1774 O GLU B 704 15.775 10.443 -10.719 1.00 0.00 O ATOM 1775 CB GLU B 704 15.730 12.742 -8.540 1.00 0.00 C ATOM 1776 CG GLU B 704 14.247 13.014 -8.292 1.00 0.00 C ATOM 1777 CD GLU B 704 13.939 13.036 -6.796 1.00 0.00 C ATOM 1778 OE1 GLU B 704 14.047 11.961 -6.166 1.00 0.00 O ATOM 1779 OE2 GLU B 704 13.593 14.129 -6.291 1.00 0.00 O ATOM 0 H GLU B 704 14.732 14.065 -10.917 1.00 0.00 H new ATOM 0 HA GLU B 704 17.127 12.555 -10.140 1.00 0.00 H new ATOM 0 HB2 GLU B 704 16.005 11.785 -8.096 1.00 0.00 H new ATOM 0 HB3 GLU B 704 16.329 13.507 -8.045 1.00 0.00 H new ATOM 0 HG2 GLU B 704 13.969 13.969 -8.739 1.00 0.00 H new ATOM 0 HG3 GLU B 704 13.646 12.247 -8.780 1.00 0.00 H new ATOM 1786 N MET B 705 14.208 11.895 -11.423 1.00 0.00 N ATOM 1787 CA MET B 705 13.516 10.978 -12.316 1.00 0.00 C ATOM 1788 C MET B 705 14.402 10.588 -13.495 1.00 0.00 C ATOM 1789 O MET B 705 14.227 9.519 -14.075 1.00 0.00 O ATOM 1790 CB MET B 705 12.260 11.640 -12.884 1.00 0.00 C ATOM 1791 CG MET B 705 12.450 13.141 -13.144 1.00 0.00 C ATOM 1792 SD MET B 705 12.314 14.198 -11.678 1.00 0.00 S ATOM 1793 CE MET B 705 10.760 13.532 -11.034 1.00 0.00 C ATOM 0 H MET B 705 13.755 12.806 -11.350 1.00 0.00 H new ATOM 0 HA MET B 705 13.258 10.093 -11.734 1.00 0.00 H new ATOM 0 HB2 MET B 705 11.983 11.146 -13.815 1.00 0.00 H new ATOM 0 HB3 MET B 705 11.433 11.497 -12.189 1.00 0.00 H new ATOM 0 HG2 MET B 705 13.431 13.295 -13.594 1.00 0.00 H new ATOM 0 HG3 MET B 705 11.709 13.464 -13.876 1.00 0.00 H new ATOM 0 HE1 MET B 705 10.145 14.347 -10.653 1.00 0.00 H new ATOM 0 HE2 MET B 705 10.226 13.017 -11.833 1.00 0.00 H new ATOM 0 HE3 MET B 705 10.972 12.830 -10.228 1.00 0.00 H new ATOM 1803 N GLU B 706 15.354 11.457 -13.846 1.00 0.00 N ATOM 1804 CA GLU B 706 16.214 11.244 -14.994 1.00 0.00 C ATOM 1805 C GLU B 706 17.585 10.748 -14.512 1.00 0.00 C ATOM 1806 O GLU B 706 18.593 10.873 -15.203 1.00 0.00 O ATOM 1807 CB GLU B 706 16.241 12.519 -15.849 1.00 0.00 C ATOM 1808 CG GLU B 706 16.625 12.157 -17.285 1.00 0.00 C ATOM 1809 CD GLU B 706 16.488 13.343 -18.236 1.00 0.00 C ATOM 1810 OE1 GLU B 706 17.109 14.393 -17.956 1.00 0.00 O ATOM 1811 OE2 GLU B 706 15.758 13.186 -19.241 1.00 0.00 O ATOM 0 H GLU B 706 15.543 12.322 -13.339 1.00 0.00 H new ATOM 0 HA GLU B 706 15.834 10.461 -15.651 1.00 0.00 H new ATOM 0 HB2 GLU B 706 15.264 13.002 -15.832 1.00 0.00 H new ATOM 0 HB3 GLU B 706 16.956 13.231 -15.438 1.00 0.00 H new ATOM 0 HG2 GLU B 706 17.653 11.795 -17.304 1.00 0.00 H new ATOM 0 HG3 GLU B 706 15.993 11.340 -17.633 1.00 0.00 H new ATOM 1818 N GLU B 707 17.591 10.178 -13.301 1.00 0.00 N ATOM 1819 CA GLU B 707 18.735 9.540 -12.660 1.00 0.00 C ATOM 1820 C GLU B 707 18.294 8.162 -12.158 1.00 0.00 C ATOM 1821 O GLU B 707 18.820 7.632 -11.182 1.00 0.00 O ATOM 1822 CB GLU B 707 19.269 10.417 -11.524 1.00 0.00 C ATOM 1823 CG GLU B 707 19.757 11.765 -12.057 1.00 0.00 C ATOM 1824 CD GLU B 707 20.472 12.563 -10.969 1.00 0.00 C ATOM 1825 OE1 GLU B 707 19.956 12.594 -9.830 1.00 0.00 O ATOM 1826 OE2 GLU B 707 21.534 13.144 -11.286 1.00 0.00 O ATOM 0 H GLU B 707 16.755 10.151 -12.717 1.00 0.00 H new ATOM 0 HA GLU B 707 19.552 9.415 -13.371 1.00 0.00 H new ATOM 0 HB2 GLU B 707 18.485 10.577 -10.783 1.00 0.00 H new ATOM 0 HB3 GLU B 707 20.087 9.904 -11.017 1.00 0.00 H new ATOM 0 HG2 GLU B 707 20.433 11.604 -12.897 1.00 0.00 H new ATOM 0 HG3 GLU B 707 18.910 12.338 -12.435 1.00 0.00 H new ATOM 1833 N VAL B 708 17.302 7.600 -12.858 1.00 0.00 N ATOM 1834 CA VAL B 708 16.687 6.293 -12.658 1.00 0.00 C ATOM 1835 C VAL B 708 16.107 6.082 -11.253 1.00 0.00 C ATOM 1836 O VAL B 708 15.137 6.759 -10.908 1.00 0.00 O ATOM 1837 CB VAL B 708 17.523 5.148 -13.263 1.00 0.00 C ATOM 1838 CG1 VAL B 708 18.311 5.666 -14.464 1.00 0.00 C ATOM 1839 CG2 VAL B 708 18.555 4.468 -12.373 1.00 0.00 C ATOM 0 H VAL B 708 16.877 8.093 -13.643 1.00 0.00 H new ATOM 0 HA VAL B 708 15.777 6.268 -13.257 1.00 0.00 H new ATOM 0 HB VAL B 708 16.759 4.403 -13.486 1.00 0.00 H new ATOM 0 HG11 VAL B 708 18.901 4.854 -14.890 1.00 0.00 H new ATOM 0 HG12 VAL B 708 17.620 6.045 -15.217 1.00 0.00 H new ATOM 0 HG13 VAL B 708 18.976 6.469 -14.144 1.00 0.00 H new ATOM 0 HG21 VAL B 708 19.062 3.685 -12.937 1.00 0.00 H new ATOM 0 HG22 VAL B 708 19.285 5.203 -12.035 1.00 0.00 H new ATOM 0 HG23 VAL B 708 18.057 4.028 -11.509 1.00 0.00 H new ATOM 1849 N ASP B 709 16.653 5.173 -10.441 1.00 0.00 N ATOM 1850 CA ASP B 709 16.050 4.761 -9.182 1.00 0.00 C ATOM 1851 C ASP B 709 15.984 5.897 -8.166 1.00 0.00 C ATOM 1852 O ASP B 709 17.010 6.587 -7.985 1.00 0.00 O ATOM 1853 CB ASP B 709 16.788 3.557 -8.589 1.00 0.00 C ATOM 1854 CG ASP B 709 18.268 3.814 -8.303 1.00 0.00 C ATOM 1855 OD1 ASP B 709 19.020 4.062 -9.270 1.00 0.00 O ATOM 1856 OD2 ASP B 709 18.638 3.753 -7.109 1.00 0.00 O ATOM 1857 OXT ASP B 709 14.896 6.068 -7.573 1.00 0.00 O ATOM 0 H ASP B 709 17.534 4.701 -10.646 1.00 0.00 H new ATOM 0 HA ASP B 709 15.024 4.470 -9.408 1.00 0.00 H new ATOM 0 HB2 ASP B 709 16.295 3.262 -7.662 1.00 0.00 H new ATOM 0 HB3 ASP B 709 16.702 2.716 -9.277 1.00 0.00 H new TER 1862 ASP B 709