USER MOD reduce.3.24.130724 H: found=0, std=0, add=1044, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 0 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: B 36 GLN : amide:sc= -1.34 K(o=-1.1,f=-2) USER MOD Set 1.2: B 44 LYS NZ :NH3+ -171:sc= 0.22 (180deg=0.187) USER MOD Set 2.1: B 11 MET CE :methyl -135:sc= -3.79 (180deg=-10.3!) USER MOD Set 2.2: B 30 MET CE :methyl -147:sc= -3.68 (180deg=-7.96!) USER MOD Set 3.1: A 32 SER OG : rot 41:sc= 1.28 USER MOD Set 3.2: A 36 GLN : amide:sc= 1.03 K(o=2.3,f=-1.2) USER MOD Set 4.1: A 26 ASN : amide:sc= 1.82 K(o=2.7,f=-3!) USER MOD Set 4.2: B 63 SER OG : rot 141:sc= 0.921 USER MOD Set 5.1: A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.2: B 43 SER OG : rot -0:sc= 1.3 USER MOD Set 6.1: A 11 MET CE :methyl 175:sc= -3.13 (180deg=-3.28) USER MOD Set 6.2: A 30 MET CE :methyl -140:sc= -2.55 (180deg=-6.36!) USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 HIS : no HD1:sc= -0.0213 X(o=-0.021,f=-0.29) USER MOD Single : A 8 ASN : amide:sc= 0 X(o=0,f=-0.0065) USER MOD Single : A 13 MET CE :methyl -173:sc= -0.053 (180deg=-0.0996) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= 0.684 K(o=0.68,f=0) USER MOD Single : A 39 GLN : amide:sc= -0.0416 K(o=-0.042,f=-0.97) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ -124:sc= 0 (180deg=-0.0499) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0.561 USER MOD Single : A 51 TYR OH : rot 153:sc= -1.85! USER MOD Single : A 53 ASN : amide:sc= -1.03 K(o=-1,f=-4.5!) USER MOD Single : A 62 GLN :FLIP amide:sc= -0.589 F(o=-4.4!,f=-0.59) USER MOD Single : A 63 SER OG : rot 169:sc= 0.675 USER MOD Single : B 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 6 HIS : no HD1:sc=-0.00609 X(o=-0.0061,f=-0.02) USER MOD Single : B 8 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 13 MET CE :methyl -113:sc= -0.955 (180deg=-4.07!) USER MOD Single : B 18 LYS NZ :NH3+ -120:sc= 0.487 (180deg=0) USER MOD Single : B 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 ASN : amide:sc= -0.409! X(o=-0.41!,f=-0.64) USER MOD Single : B 29 SER OG : rot 180:sc= 0 USER MOD Single : B 31 ASN : amide:sc= -0.644 K(o=-0.64,f=-1.8) USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 39 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 46 SER OG : rot 35:sc= 0.744 USER MOD Single : B 49 THR OG1 : rot 180:sc= 0 USER MOD Single : B 51 TYR OH : rot 180:sc= 0 USER MOD Single : B 53 ASN : amide:sc= -0.959 K(o=-0.96,f=-2.6!) USER MOD Single : B 62 GLN : amide:sc= -1.11 K(o=-1.1,f=-2.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 15.350 -17.928 1.350 1.00 0.00 N ATOM 2 CA ALA A 1 16.423 -17.479 0.433 1.00 0.00 C ATOM 3 C ALA A 1 16.388 -15.945 0.139 1.00 0.00 C ATOM 4 O ALA A 1 15.329 -15.357 -0.107 1.00 0.00 O ATOM 5 CB ALA A 1 16.296 -18.322 -0.847 1.00 0.00 C ATOM 0 H1 ALA A 1 15.430 -18.954 1.503 1.00 0.00 H new ATOM 0 H2 ALA A 1 15.442 -17.434 2.261 1.00 0.00 H new ATOM 0 H3 ALA A 1 14.423 -17.712 0.931 1.00 0.00 H new ATOM 0 HA ALA A 1 17.394 -17.632 0.903 1.00 0.00 H new ATOM 0 HB1 ALA A 1 17.069 -18.026 -1.556 1.00 0.00 H new ATOM 0 HB2 ALA A 1 16.414 -19.377 -0.601 1.00 0.00 H new ATOM 0 HB3 ALA A 1 15.314 -18.161 -1.293 1.00 0.00 H new ATOM 6 N ARG A 2 17.563 -15.290 0.123 1.00 0.00 N ATOM 7 CA ARG A 2 17.657 -13.816 -0.110 1.00 0.00 C ATOM 8 C ARG A 2 17.781 -13.433 -1.624 1.00 0.00 C ATOM 9 O ARG A 2 18.838 -13.041 -2.121 1.00 0.00 O ATOM 10 CB ARG A 2 18.747 -13.207 0.817 1.00 0.00 C ATOM 11 CG ARG A 2 18.401 -13.188 2.330 1.00 0.00 C ATOM 12 CD ARG A 2 17.318 -12.167 2.729 1.00 0.00 C ATOM 13 NE ARG A 2 17.002 -12.329 4.172 1.00 0.00 N ATOM 14 CZ ARG A 2 15.834 -12.066 4.748 1.00 0.00 C ATOM 15 NH1 ARG A 2 14.791 -11.610 4.122 1.00 0.00 N ATOM 16 NH2 ARG A 2 15.732 -12.283 6.010 1.00 0.00 N ATOM 0 H ARG A 2 18.464 -15.746 0.267 1.00 0.00 H new ATOM 0 HA ARG A 2 16.711 -13.355 0.173 1.00 0.00 H new ATOM 0 HB2 ARG A 2 19.671 -13.769 0.680 1.00 0.00 H new ATOM 0 HB3 ARG A 2 18.944 -12.185 0.494 1.00 0.00 H new ATOM 0 HG2 ARG A 2 18.070 -14.183 2.626 1.00 0.00 H new ATOM 0 HG3 ARG A 2 19.309 -12.974 2.894 1.00 0.00 H new ATOM 0 HD2 ARG A 2 17.667 -11.153 2.532 1.00 0.00 H new ATOM 0 HD3 ARG A 2 16.421 -12.317 2.129 1.00 0.00 H new ATOM 0 HE ARG A 2 17.749 -12.673 4.775 1.00 0.00 H new ATOM 0 HH11 ARG A 2 14.836 -11.430 3.119 1.00 0.00 H new ATOM 0 HH12 ARG A 2 13.927 -11.432 4.633 1.00 0.00 H new ATOM 0 HH21 ARG A 2 16.531 -12.644 6.532 1.00 0.00 H new ATOM 0 HH22 ARG A 2 14.852 -12.094 6.490 1.00 0.00 H new ATOM 17 N ASP A 3 16.646 -13.528 -2.339 1.00 0.00 N ATOM 18 CA ASP A 3 16.490 -13.019 -3.728 1.00 0.00 C ATOM 19 C ASP A 3 15.000 -12.648 -4.010 1.00 0.00 C ATOM 20 O ASP A 3 14.621 -11.481 -3.934 1.00 0.00 O ATOM 21 CB ASP A 3 17.213 -13.960 -4.741 1.00 0.00 C ATOM 22 CG ASP A 3 17.047 -13.576 -6.207 1.00 0.00 C ATOM 23 OD1 ASP A 3 17.621 -12.635 -6.740 1.00 0.00 O ATOM 24 OD2 ASP A 3 16.145 -14.374 -6.838 1.00 0.00 O ATOM 0 H ASP A 3 15.799 -13.963 -1.972 1.00 0.00 H new ATOM 0 HA ASP A 3 17.008 -12.070 -3.867 1.00 0.00 H new ATOM 0 HB2 ASP A 3 18.277 -13.977 -4.503 1.00 0.00 H new ATOM 0 HB3 ASP A 3 16.840 -14.975 -4.602 1.00 0.00 H new ATOM 25 N ASP A 4 14.153 -13.629 -4.310 1.00 0.00 N ATOM 26 CA ASP A 4 12.678 -13.428 -4.390 1.00 0.00 C ATOM 27 C ASP A 4 11.856 -14.593 -3.740 1.00 0.00 C ATOM 28 O ASP A 4 11.274 -15.413 -4.455 1.00 0.00 O ATOM 29 CB ASP A 4 12.258 -12.959 -5.805 1.00 0.00 C ATOM 30 CG ASP A 4 12.633 -13.839 -7.002 1.00 0.00 C ATOM 31 OD1 ASP A 4 11.868 -14.963 -7.101 1.00 0.00 O ATOM 32 OD2 ASP A 4 13.541 -13.552 -7.777 1.00 0.00 O ATOM 0 H ASP A 4 14.450 -14.585 -4.506 1.00 0.00 H new ATOM 0 HA ASP A 4 12.398 -12.595 -3.746 1.00 0.00 H new ATOM 0 HB2 ASP A 4 11.175 -12.838 -5.807 1.00 0.00 H new ATOM 0 HB3 ASP A 4 12.689 -11.972 -5.970 1.00 0.00 H new ATOM 33 N PRO A 5 11.767 -14.664 -2.382 1.00 0.00 N ATOM 34 CA PRO A 5 10.956 -15.677 -1.666 1.00 0.00 C ATOM 35 C PRO A 5 9.426 -15.364 -1.535 1.00 0.00 C ATOM 36 O PRO A 5 8.937 -14.253 -1.779 1.00 0.00 O ATOM 37 CB PRO A 5 11.703 -15.721 -0.318 1.00 0.00 C ATOM 38 CG PRO A 5 12.136 -14.272 -0.126 1.00 0.00 C ATOM 39 CD PRO A 5 12.595 -13.843 -1.486 1.00 0.00 C ATOM 0 HA PRO A 5 10.894 -16.628 -2.194 1.00 0.00 H new ATOM 0 HB2 PRO A 5 11.057 -16.061 0.492 1.00 0.00 H new ATOM 0 HB3 PRO A 5 12.557 -16.398 -0.350 1.00 0.00 H new ATOM 0 HG2 PRO A 5 11.312 -13.654 0.230 1.00 0.00 H new ATOM 0 HG3 PRO A 5 12.937 -14.190 0.609 1.00 0.00 H new ATOM 0 HD2 PRO A 5 12.434 -12.777 -1.650 1.00 0.00 H new ATOM 0 HD3 PRO A 5 13.659 -14.031 -1.632 1.00 0.00 H new ATOM 40 N HIS A 6 8.713 -16.409 -1.110 1.00 0.00 N ATOM 41 CA HIS A 6 7.233 -16.510 -1.184 1.00 0.00 C ATOM 42 C HIS A 6 6.557 -16.398 0.225 1.00 0.00 C ATOM 43 O HIS A 6 7.010 -17.021 1.194 1.00 0.00 O ATOM 44 CB HIS A 6 6.928 -17.939 -1.745 1.00 0.00 C ATOM 45 CG HIS A 6 7.345 -18.252 -3.184 1.00 0.00 C ATOM 46 ND1 HIS A 6 8.659 -18.429 -3.591 1.00 0.00 N ATOM 47 CD2 HIS A 6 6.480 -18.279 -4.282 1.00 0.00 C ATOM 48 CE1 HIS A 6 8.465 -18.490 -4.946 1.00 0.00 C ATOM 49 NE2 HIS A 6 7.192 -18.473 -5.453 1.00 0.00 N ATOM 0 H HIS A 6 9.147 -17.233 -0.694 1.00 0.00 H new ATOM 0 HA HIS A 6 6.846 -15.700 -1.802 1.00 0.00 H new ATOM 0 HB2 HIS A 6 7.413 -18.664 -1.092 1.00 0.00 H new ATOM 0 HB3 HIS A 6 5.854 -18.107 -1.665 1.00 0.00 H new ATOM 0 HD2 HIS A 6 5.408 -18.165 -4.225 1.00 0.00 H new ATOM 0 HE1 HIS A 6 9.313 -18.551 -5.612 1.00 0.00 H new ATOM 0 HE2 HIS A 6 6.864 -18.574 -6.414 1.00 0.00 H new ATOM 50 N PHE A 7 5.369 -15.779 0.319 1.00 0.00 N ATOM 51 CA PHE A 7 4.312 -16.263 1.249 1.00 0.00 C ATOM 52 C PHE A 7 2.898 -16.212 0.582 1.00 0.00 C ATOM 53 O PHE A 7 2.589 -15.350 -0.249 1.00 0.00 O ATOM 54 CB PHE A 7 4.417 -15.588 2.646 1.00 0.00 C ATOM 55 CG PHE A 7 3.905 -14.151 2.830 1.00 0.00 C ATOM 56 CD1 PHE A 7 2.568 -13.937 3.192 1.00 0.00 C ATOM 57 CD2 PHE A 7 4.765 -13.046 2.740 1.00 0.00 C ATOM 58 CE1 PHE A 7 2.122 -12.661 3.479 1.00 0.00 C ATOM 59 CE2 PHE A 7 4.314 -11.782 3.085 1.00 0.00 C ATOM 60 CZ PHE A 7 3.006 -11.607 3.506 1.00 0.00 C ATOM 0 H PHE A 7 5.110 -14.955 -0.224 1.00 0.00 H new ATOM 0 HA PHE A 7 4.481 -17.320 1.453 1.00 0.00 H new ATOM 0 HB2 PHE A 7 3.882 -16.219 3.355 1.00 0.00 H new ATOM 0 HB3 PHE A 7 5.467 -15.601 2.937 1.00 0.00 H new ATOM 0 HD1 PHE A 7 1.885 -14.771 3.247 1.00 0.00 H new ATOM 0 HD2 PHE A 7 5.781 -13.181 2.401 1.00 0.00 H new ATOM 0 HE1 PHE A 7 1.075 -12.490 3.683 1.00 0.00 H new ATOM 0 HE2 PHE A 7 4.981 -10.935 3.026 1.00 0.00 H new ATOM 0 HZ PHE A 7 2.679 -10.639 3.857 1.00 0.00 H new ATOM 61 N ASN A 8 1.992 -17.118 0.980 1.00 0.00 N ATOM 62 CA ASN A 8 0.559 -17.029 0.577 1.00 0.00 C ATOM 63 C ASN A 8 -0.176 -15.859 1.310 1.00 0.00 C ATOM 64 O ASN A 8 -0.852 -16.077 2.320 1.00 0.00 O ATOM 65 CB ASN A 8 -0.119 -18.414 0.774 1.00 0.00 C ATOM 66 CG ASN A 8 0.264 -19.469 -0.263 1.00 0.00 C ATOM 67 OD1 ASN A 8 1.278 -20.146 -0.153 1.00 0.00 O ATOM 68 ND2 ASN A 8 -0.500 -19.623 -1.314 1.00 0.00 N ATOM 0 H ASN A 8 2.212 -17.917 1.575 1.00 0.00 H new ATOM 0 HA ASN A 8 0.492 -16.781 -0.482 1.00 0.00 H new ATOM 0 HB2 ASN A 8 0.136 -18.790 1.765 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -1.200 -18.280 0.752 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -0.249 -20.302 -2.032 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -1.347 -19.064 -1.415 1.00 0.00 H new ATOM 69 N PHE A 9 -0.063 -14.617 0.787 1.00 0.00 N ATOM 70 CA PHE A 9 -0.903 -13.494 1.217 1.00 0.00 C ATOM 71 C PHE A 9 -2.399 -13.728 0.888 1.00 0.00 C ATOM 72 O PHE A 9 -2.823 -14.360 -0.074 1.00 0.00 O ATOM 73 CB PHE A 9 -0.285 -12.195 0.638 1.00 0.00 C ATOM 74 CG PHE A 9 -0.788 -10.878 1.254 1.00 0.00 C ATOM 75 CD1 PHE A 9 -0.990 -10.729 2.635 1.00 0.00 C ATOM 76 CD2 PHE A 9 -0.834 -9.733 0.454 1.00 0.00 C ATOM 77 CE1 PHE A 9 -1.245 -9.490 3.186 1.00 0.00 C ATOM 78 CE2 PHE A 9 -1.172 -8.503 0.995 1.00 0.00 C ATOM 79 CZ PHE A 9 -1.298 -8.380 2.363 1.00 0.00 C ATOM 0 H PHE A 9 0.610 -14.374 0.060 1.00 0.00 H new ATOM 0 HA PHE A 9 -0.910 -13.397 2.303 1.00 0.00 H new ATOM 0 HB2 PHE A 9 0.797 -12.243 0.764 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -0.480 -12.170 -0.434 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -0.945 -11.597 3.276 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -0.603 -9.808 -0.598 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -1.402 -9.388 4.250 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -1.335 -7.650 0.353 1.00 0.00 H new ATOM 0 HZ PHE A 9 -1.440 -7.402 2.798 1.00 0.00 H new ATOM 80 N ARG A 10 -3.170 -13.180 1.786 1.00 0.00 N ATOM 81 CA ARG A 10 -4.515 -13.658 2.122 1.00 0.00 C ATOM 82 C ARG A 10 -5.329 -12.380 2.424 1.00 0.00 C ATOM 83 O ARG A 10 -5.070 -11.671 3.405 1.00 0.00 O ATOM 84 CB ARG A 10 -4.433 -14.614 3.338 1.00 0.00 C ATOM 85 CG ARG A 10 -5.658 -15.526 3.507 1.00 0.00 C ATOM 86 CD ARG A 10 -7.034 -14.873 3.690 1.00 0.00 C ATOM 87 NE ARG A 10 -7.145 -14.058 4.931 1.00 0.00 N ATOM 88 CZ ARG A 10 -7.685 -14.440 6.079 1.00 0.00 C ATOM 89 NH1 ARG A 10 -8.205 -15.610 6.299 1.00 0.00 N ATOM 90 NH2 ARG A 10 -7.691 -13.583 7.036 1.00 0.00 N ATOM 0 H ARG A 10 -2.887 -12.364 2.329 1.00 0.00 H new ATOM 0 HA ARG A 10 -4.987 -14.229 1.322 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -3.543 -15.235 3.238 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -4.308 -14.021 4.244 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -5.712 -16.175 2.633 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -5.478 -16.168 4.369 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -7.244 -14.239 2.829 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -7.797 -15.651 3.706 1.00 0.00 H new ATOM 0 HE ARG A 10 -6.768 -13.111 4.894 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -8.216 -16.311 5.558 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -8.602 -15.828 7.213 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -7.291 -12.656 6.893 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -8.096 -13.830 7.939 1.00 0.00 H new ATOM 91 N MET A 11 -6.263 -12.058 1.532 1.00 0.00 N ATOM 92 CA MET A 11 -6.965 -10.755 1.596 1.00 0.00 C ATOM 93 C MET A 11 -8.493 -10.933 1.869 1.00 0.00 C ATOM 94 O MET A 11 -9.184 -11.415 0.966 1.00 0.00 O ATOM 95 CB MET A 11 -6.679 -9.985 0.286 1.00 0.00 C ATOM 96 CG MET A 11 -5.384 -9.162 0.196 1.00 0.00 C ATOM 97 SD MET A 11 -3.964 -10.235 0.436 1.00 0.00 S ATOM 98 CE MET A 11 -3.350 -10.264 -1.243 1.00 0.00 C ATOM 0 H MET A 11 -6.556 -12.662 0.764 1.00 0.00 H new ATOM 0 HA MET A 11 -6.590 -10.172 2.437 1.00 0.00 H new ATOM 0 HB2 MET A 11 -6.672 -10.707 -0.530 1.00 0.00 H new ATOM 0 HB3 MET A 11 -7.516 -9.310 0.107 1.00 0.00 H new ATOM 0 HG2 MET A 11 -5.321 -8.671 -0.775 1.00 0.00 H new ATOM 0 HG3 MET A 11 -5.389 -8.375 0.951 1.00 0.00 H new ATOM 0 HE1 MET A 11 -2.410 -10.815 -1.277 1.00 0.00 H new ATOM 0 HE2 MET A 11 -4.080 -10.752 -1.889 1.00 0.00 H new ATOM 0 HE3 MET A 11 -3.185 -9.243 -1.588 1.00 0.00 H new ATOM 99 N PRO A 12 -9.100 -10.466 3.006 1.00 0.00 N ATOM 100 CA PRO A 12 -10.560 -10.158 3.080 1.00 0.00 C ATOM 101 C PRO A 12 -11.158 -9.429 1.838 1.00 0.00 C ATOM 102 O PRO A 12 -10.481 -8.606 1.210 1.00 0.00 O ATOM 103 CB PRO A 12 -10.650 -9.328 4.374 1.00 0.00 C ATOM 104 CG PRO A 12 -9.477 -9.804 5.232 1.00 0.00 C ATOM 105 CD PRO A 12 -8.366 -10.086 4.225 1.00 0.00 C ATOM 0 HA PRO A 12 -11.166 -11.064 3.086 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -10.578 -8.261 4.164 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -11.601 -9.490 4.881 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -9.177 -9.044 5.953 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -9.736 -10.698 5.800 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -7.740 -9.209 4.060 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -7.709 -10.887 4.565 1.00 0.00 H new ATOM 106 N MET A 13 -12.375 -9.799 1.420 1.00 0.00 N ATOM 107 CA MET A 13 -12.843 -9.528 0.025 1.00 0.00 C ATOM 108 C MET A 13 -12.863 -8.043 -0.473 1.00 0.00 C ATOM 109 O MET A 13 -12.641 -7.790 -1.654 1.00 0.00 O ATOM 110 CB MET A 13 -14.194 -10.249 -0.189 1.00 0.00 C ATOM 111 CG MET A 13 -14.701 -10.313 -1.645 1.00 0.00 C ATOM 112 SD MET A 13 -13.421 -10.725 -2.866 1.00 0.00 S ATOM 113 CE MET A 13 -12.748 -12.317 -2.365 1.00 0.00 C ATOM 0 H MET A 13 -13.056 -10.281 2.007 1.00 0.00 H new ATOM 0 HA MET A 13 -12.065 -9.936 -0.621 1.00 0.00 H new ATOM 0 HB2 MET A 13 -14.104 -11.267 0.189 1.00 0.00 H new ATOM 0 HB3 MET A 13 -14.950 -9.750 0.417 1.00 0.00 H new ATOM 0 HG2 MET A 13 -15.498 -11.054 -1.707 1.00 0.00 H new ATOM 0 HG3 MET A 13 -15.140 -9.350 -1.907 1.00 0.00 H new ATOM 0 HE1 MET A 13 -11.888 -12.561 -2.989 1.00 0.00 H new ATOM 0 HE2 MET A 13 -12.437 -12.268 -1.321 1.00 0.00 H new ATOM 0 HE3 MET A 13 -13.511 -13.087 -2.481 1.00 0.00 H new ATOM 114 N GLU A 14 -13.047 -7.066 0.415 1.00 0.00 N ATOM 115 CA GLU A 14 -12.671 -5.652 0.151 1.00 0.00 C ATOM 116 C GLU A 14 -11.178 -5.352 -0.216 1.00 0.00 C ATOM 117 O GLU A 14 -10.969 -4.758 -1.267 1.00 0.00 O ATOM 118 CB GLU A 14 -13.226 -4.745 1.289 1.00 0.00 C ATOM 119 CG GLU A 14 -12.732 -5.017 2.743 1.00 0.00 C ATOM 120 CD GLU A 14 -13.489 -6.102 3.507 1.00 0.00 C ATOM 121 OE1 GLU A 14 -14.608 -5.615 4.114 1.00 0.00 O ATOM 122 OE2 GLU A 14 -13.130 -7.274 3.550 1.00 0.00 O ATOM 0 H GLU A 14 -13.458 -7.217 1.336 1.00 0.00 H new ATOM 0 HA GLU A 14 -13.153 -5.403 -0.794 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -12.984 -3.711 1.041 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -14.313 -4.828 1.284 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -11.678 -5.294 2.703 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -12.796 -4.088 3.309 1.00 0.00 H new ATOM 123 N VAL A 15 -10.153 -5.784 0.545 1.00 0.00 N ATOM 124 CA VAL A 15 -8.708 -5.666 0.145 1.00 0.00 C ATOM 125 C VAL A 15 -8.403 -6.386 -1.180 1.00 0.00 C ATOM 126 O VAL A 15 -7.780 -5.772 -2.035 1.00 0.00 O ATOM 127 CB VAL A 15 -7.708 -6.207 1.236 1.00 0.00 C ATOM 128 CG1 VAL A 15 -6.402 -5.392 1.267 1.00 0.00 C ATOM 129 CG2 VAL A 15 -8.201 -6.377 2.694 1.00 0.00 C ATOM 0 H VAL A 15 -10.287 -6.226 1.455 1.00 0.00 H new ATOM 0 HA VAL A 15 -8.554 -4.593 0.028 1.00 0.00 H new ATOM 0 HB VAL A 15 -7.568 -7.226 0.876 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -5.739 -5.796 2.032 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.913 -5.451 0.295 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -6.628 -4.351 1.496 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -7.387 -6.758 3.311 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -8.530 -5.413 3.082 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -9.034 -7.080 2.717 1.00 0.00 H new ATOM 130 N ARG A 16 -8.805 -7.651 -1.377 1.00 0.00 N ATOM 131 CA ARG A 16 -8.566 -8.305 -2.672 1.00 0.00 C ATOM 132 C ARG A 16 -9.443 -7.807 -3.826 1.00 0.00 C ATOM 133 O ARG A 16 -8.867 -7.644 -4.888 1.00 0.00 O ATOM 134 CB ARG A 16 -8.516 -9.842 -2.631 1.00 0.00 C ATOM 135 CG ARG A 16 -7.262 -10.329 -3.406 1.00 0.00 C ATOM 136 CD ARG A 16 -7.498 -11.699 -3.994 1.00 0.00 C ATOM 137 NE ARG A 16 -6.352 -12.109 -4.838 1.00 0.00 N ATOM 138 CZ ARG A 16 -6.377 -13.107 -5.717 1.00 0.00 C ATOM 139 NH1 ARG A 16 -7.392 -13.898 -5.906 1.00 0.00 N ATOM 140 NH2 ARG A 16 -5.335 -13.289 -6.446 1.00 0.00 N ATOM 0 H ARG A 16 -9.281 -8.225 -0.682 1.00 0.00 H new ATOM 0 HA ARG A 16 -7.552 -7.974 -2.895 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -8.479 -10.190 -1.599 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -9.419 -10.260 -3.076 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -7.022 -9.623 -4.201 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -6.403 -10.358 -2.736 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -7.644 -12.424 -3.193 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -8.411 -11.693 -4.589 1.00 0.00 H new ATOM 0 HE ARG A 16 -5.481 -11.588 -4.738 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -8.244 -13.773 -5.360 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -7.336 -14.643 -6.600 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -4.525 -12.678 -6.340 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -5.318 -14.044 -7.131 1.00 0.00 H new ATOM 141 N GLU A 17 -10.732 -7.462 -3.705 1.00 0.00 N ATOM 142 CA GLU A 17 -11.374 -6.686 -4.795 1.00 0.00 C ATOM 143 C GLU A 17 -10.734 -5.283 -5.025 1.00 0.00 C ATOM 144 O GLU A 17 -10.571 -4.929 -6.183 1.00 0.00 O ATOM 145 CB GLU A 17 -12.905 -6.568 -4.666 1.00 0.00 C ATOM 146 CG GLU A 17 -13.734 -7.870 -4.793 1.00 0.00 C ATOM 147 CD GLU A 17 -13.549 -8.682 -6.075 1.00 0.00 C ATOM 148 OE1 GLU A 17 -14.140 -8.094 -7.148 1.00 0.00 O ATOM 149 OE2 GLU A 17 -12.934 -9.743 -6.133 1.00 0.00 O ATOM 0 H GLU A 17 -11.331 -7.689 -2.911 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.175 -7.286 -5.683 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -13.128 -6.120 -3.698 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -13.254 -5.871 -5.428 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -13.491 -8.512 -3.946 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -14.789 -7.611 -4.704 1.00 0.00 H new ATOM 150 N LYS A 18 -10.309 -4.506 -4.014 1.00 0.00 N ATOM 151 CA LYS A 18 -9.593 -3.224 -4.257 1.00 0.00 C ATOM 152 C LYS A 18 -8.102 -3.299 -4.727 1.00 0.00 C ATOM 153 O LYS A 18 -7.719 -2.548 -5.624 1.00 0.00 O ATOM 154 CB LYS A 18 -10.099 -2.154 -3.266 1.00 0.00 C ATOM 155 CG LYS A 18 -9.466 -2.188 -1.869 1.00 0.00 C ATOM 156 CD LYS A 18 -10.364 -1.601 -0.761 1.00 0.00 C ATOM 157 CE LYS A 18 -9.756 -1.786 0.635 1.00 0.00 C ATOM 158 NZ LYS A 18 -10.642 -1.185 1.650 1.00 0.00 N ATOM 0 H LYS A 18 -10.443 -4.732 -3.028 1.00 0.00 H new ATOM 0 HA LYS A 18 -9.869 -2.809 -5.226 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -9.922 -1.170 -3.701 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -11.178 -2.266 -3.159 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -9.222 -3.220 -1.617 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -8.527 -1.635 -1.893 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -10.523 -0.539 -0.949 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -11.342 -2.081 -0.796 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -9.616 -2.847 0.843 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -8.771 -1.321 0.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -10.225 -1.313 2.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -10.754 -0.169 1.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -11.573 -1.648 1.617 1.00 0.00 H new ATOM 159 N LEU A 19 -7.303 -4.254 -4.241 1.00 0.00 N ATOM 160 CA LEU A 19 -5.961 -4.599 -4.778 1.00 0.00 C ATOM 161 C LEU A 19 -5.976 -5.395 -6.136 1.00 0.00 C ATOM 162 O LEU A 19 -5.112 -5.182 -6.987 1.00 0.00 O ATOM 163 CB LEU A 19 -5.254 -5.247 -3.549 1.00 0.00 C ATOM 164 CG LEU A 19 -3.722 -5.208 -3.478 1.00 0.00 C ATOM 165 CD1 LEU A 19 -3.089 -3.814 -3.277 1.00 0.00 C ATOM 166 CD2 LEU A 19 -3.307 -6.145 -2.324 1.00 0.00 C ATOM 0 H LEU A 19 -7.569 -4.830 -3.442 1.00 0.00 H new ATOM 0 HA LEU A 19 -5.390 -3.742 -5.135 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -5.639 -4.762 -2.652 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -5.561 -6.292 -3.504 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.348 -5.524 -4.452 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -2.004 -3.909 -3.242 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -3.370 -3.164 -4.106 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.446 -3.384 -2.341 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -2.221 -6.151 -2.233 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -3.747 -5.791 -1.392 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -3.660 -7.155 -2.531 1.00 0.00 H new ATOM 167 N LYS A 20 -6.954 -6.289 -6.375 1.00 0.00 N ATOM 168 CA LYS A 20 -7.080 -7.093 -7.603 1.00 0.00 C ATOM 169 C LYS A 20 -7.957 -6.413 -8.713 1.00 0.00 C ATOM 170 O LYS A 20 -7.668 -6.633 -9.884 1.00 0.00 O ATOM 171 CB LYS A 20 -7.666 -8.475 -7.273 1.00 0.00 C ATOM 172 CG LYS A 20 -7.484 -9.589 -8.322 1.00 0.00 C ATOM 173 CD LYS A 20 -8.337 -10.868 -8.107 1.00 0.00 C ATOM 174 CE LYS A 20 -9.579 -10.742 -7.203 1.00 0.00 C ATOM 175 NZ LYS A 20 -10.353 -11.997 -7.155 1.00 0.00 N ATOM 0 H LYS A 20 -7.697 -6.476 -5.701 1.00 0.00 H new ATOM 0 HA LYS A 20 -6.071 -7.187 -8.006 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.220 -8.816 -6.338 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -8.734 -8.354 -7.091 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -7.720 -9.179 -9.304 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -6.433 -9.876 -8.341 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -8.665 -11.224 -9.084 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -7.690 -11.639 -7.687 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -9.268 -10.468 -6.195 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -10.215 -9.937 -7.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -11.180 -11.871 -6.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -10.672 -12.245 -8.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -9.754 -12.760 -6.781 1.00 0.00 H new ATOM 176 N PHE A 21 -9.000 -5.589 -8.411 1.00 0.00 N ATOM 177 CA PHE A 21 -9.471 -4.521 -9.346 1.00 0.00 C ATOM 178 C PHE A 21 -8.332 -3.564 -9.677 1.00 0.00 C ATOM 179 O PHE A 21 -7.893 -3.700 -10.799 1.00 0.00 O ATOM 180 CB PHE A 21 -10.729 -3.702 -8.942 1.00 0.00 C ATOM 181 CG PHE A 21 -12.065 -4.378 -9.212 1.00 0.00 C ATOM 182 CD1 PHE A 21 -12.417 -4.781 -10.504 1.00 0.00 C ATOM 183 CD2 PHE A 21 -12.977 -4.529 -8.171 1.00 0.00 C ATOM 184 CE1 PHE A 21 -13.645 -5.389 -10.732 1.00 0.00 C ATOM 185 CE2 PHE A 21 -14.206 -5.131 -8.397 1.00 0.00 C ATOM 186 CZ PHE A 21 -14.543 -5.569 -9.678 1.00 0.00 C ATOM 0 H PHE A 21 -9.526 -5.641 -7.539 1.00 0.00 H new ATOM 0 HA PHE A 21 -9.800 -5.093 -10.213 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -10.666 -3.473 -7.878 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -10.708 -2.751 -9.474 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -11.734 -4.619 -11.325 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -12.726 -4.175 -7.182 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -13.905 -5.723 -11.726 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -14.902 -5.261 -7.581 1.00 0.00 H new ATOM 0 HZ PHE A 21 -15.496 -6.046 -9.854 1.00 0.00 H new ATOM 187 N ARG A 22 -7.756 -2.702 -8.829 1.00 0.00 N ATOM 188 CA ARG A 22 -6.460 -2.032 -9.160 1.00 0.00 C ATOM 189 C ARG A 22 -5.440 -2.816 -10.108 1.00 0.00 C ATOM 190 O ARG A 22 -5.037 -2.308 -11.154 1.00 0.00 O ATOM 191 CB ARG A 22 -5.954 -1.505 -7.817 1.00 0.00 C ATOM 192 CG ARG A 22 -4.881 -0.434 -8.039 1.00 0.00 C ATOM 193 CD ARG A 22 -4.340 0.050 -6.712 1.00 0.00 C ATOM 194 NE ARG A 22 -3.059 0.722 -6.985 1.00 0.00 N ATOM 195 CZ ARG A 22 -2.850 2.016 -7.111 1.00 0.00 C ATOM 196 NH1 ARG A 22 -3.760 2.932 -6.982 1.00 0.00 N ATOM 197 NH2 ARG A 22 -1.649 2.364 -7.382 1.00 0.00 N ATOM 0 H ARG A 22 -8.146 -2.446 -7.922 1.00 0.00 H new ATOM 0 HA ARG A 22 -6.603 -1.210 -9.861 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -6.783 -1.087 -7.247 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -5.543 -2.325 -7.228 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -4.070 -0.841 -8.643 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -5.303 0.403 -8.595 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -5.041 0.736 -6.238 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -4.198 -0.785 -6.026 1.00 0.00 H new ATOM 0 HE ARG A 22 -2.243 0.119 -7.088 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -4.722 2.669 -6.767 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -3.514 3.915 -7.096 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -0.924 1.654 -7.487 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -1.417 3.351 -7.493 1.00 0.00 H new ATOM 198 N ALA A 23 -5.225 -4.127 -9.908 1.00 0.00 N ATOM 199 CA ALA A 23 -4.670 -5.022 -10.962 1.00 0.00 C ATOM 200 C ALA A 23 -5.505 -5.153 -12.308 1.00 0.00 C ATOM 201 O ALA A 23 -5.107 -4.598 -13.336 1.00 0.00 O ATOM 202 CB ALA A 23 -4.296 -6.295 -10.185 1.00 0.00 C ATOM 0 H ALA A 23 -5.425 -4.601 -9.027 1.00 0.00 H new ATOM 0 HA ALA A 23 -3.791 -4.606 -11.454 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -3.873 -7.029 -10.871 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -3.561 -6.050 -9.418 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -5.188 -6.709 -9.715 1.00 0.00 H new ATOM 203 N GLU A 24 -6.665 -5.825 -12.296 1.00 0.00 N ATOM 204 CA GLU A 24 -7.588 -5.985 -13.470 1.00 0.00 C ATOM 205 C GLU A 24 -8.259 -4.694 -14.081 1.00 0.00 C ATOM 206 O GLU A 24 -8.232 -4.492 -15.295 1.00 0.00 O ATOM 207 CB GLU A 24 -8.664 -7.050 -13.097 1.00 0.00 C ATOM 208 CG GLU A 24 -8.145 -8.483 -12.800 1.00 0.00 C ATOM 209 CD GLU A 24 -9.247 -9.490 -12.490 1.00 0.00 C ATOM 210 OE1 GLU A 24 -9.770 -10.045 -13.615 1.00 0.00 O ATOM 211 OE2 GLU A 24 -9.620 -9.777 -11.358 1.00 0.00 O ATOM 0 H GLU A 24 -7.012 -6.290 -11.457 1.00 0.00 H new ATOM 0 HA GLU A 24 -6.941 -6.297 -14.289 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -9.206 -6.695 -12.221 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -9.383 -7.110 -13.914 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -7.575 -8.837 -13.659 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -7.457 -8.441 -11.956 1.00 0.00 H new ATOM 212 N ALA A 25 -8.863 -3.841 -13.241 1.00 0.00 N ATOM 213 CA ALA A 25 -9.171 -2.412 -13.531 1.00 0.00 C ATOM 214 C ALA A 25 -8.101 -1.558 -14.308 1.00 0.00 C ATOM 215 O ALA A 25 -8.462 -0.775 -15.189 1.00 0.00 O ATOM 216 CB ALA A 25 -9.378 -1.715 -12.157 1.00 0.00 C ATOM 0 H ALA A 25 -9.165 -4.125 -12.309 1.00 0.00 H new ATOM 0 HA ALA A 25 -10.031 -2.449 -14.199 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -9.607 -0.661 -12.315 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -10.204 -2.191 -11.628 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -8.468 -1.804 -11.563 1.00 0.00 H new ATOM 217 N ASN A 26 -6.818 -1.615 -13.880 1.00 0.00 N ATOM 218 CA ASN A 26 -5.838 -0.513 -14.108 1.00 0.00 C ATOM 219 C ASN A 26 -4.489 -0.903 -14.832 1.00 0.00 C ATOM 220 O ASN A 26 -3.750 0.001 -15.230 1.00 0.00 O ATOM 221 CB ASN A 26 -5.787 0.179 -12.703 1.00 0.00 C ATOM 222 CG ASN A 26 -4.509 0.872 -12.262 1.00 0.00 C ATOM 223 OD1 ASN A 26 -4.224 2.021 -12.577 1.00 0.00 O ATOM 224 ND2 ASN A 26 -3.734 0.161 -11.491 1.00 0.00 N ATOM 0 H ASN A 26 -6.431 -2.412 -13.374 1.00 0.00 H new ATOM 0 HA ASN A 26 -6.138 0.196 -14.879 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -6.588 0.918 -12.672 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -6.024 -0.579 -11.956 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -2.865 0.559 -11.134 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -3.996 -0.793 -11.245 1.00 0.00 H new ATOM 225 N GLY A 27 -4.174 -2.193 -15.049 1.00 0.00 N ATOM 226 CA GLY A 27 -3.007 -2.631 -15.878 1.00 0.00 C ATOM 227 C GLY A 27 -1.849 -3.404 -15.203 1.00 0.00 C ATOM 228 O GLY A 27 -0.718 -3.330 -15.686 1.00 0.00 O ATOM 0 H GLY A 27 -4.712 -2.968 -14.661 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -3.393 -3.256 -16.683 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -2.581 -1.741 -16.341 1.00 0.00 H new ATOM 229 N ARG A 28 -2.110 -4.173 -14.139 1.00 0.00 N ATOM 230 CA ARG A 28 -1.112 -5.052 -13.482 1.00 0.00 C ATOM 231 C ARG A 28 -1.826 -6.405 -13.109 1.00 0.00 C ATOM 232 O ARG A 28 -3.029 -6.600 -13.310 1.00 0.00 O ATOM 233 CB ARG A 28 -0.494 -4.229 -12.324 1.00 0.00 C ATOM 234 CG ARG A 28 0.680 -3.244 -12.581 1.00 0.00 C ATOM 235 CD ARG A 28 0.377 -1.733 -12.514 1.00 0.00 C ATOM 236 NE ARG A 28 0.027 -1.194 -11.178 1.00 0.00 N ATOM 237 CZ ARG A 28 -0.266 0.077 -10.929 1.00 0.00 C ATOM 238 NH1 ARG A 28 -0.312 1.015 -11.829 1.00 0.00 N ATOM 239 NH2 ARG A 28 -0.536 0.393 -9.718 1.00 0.00 N ATOM 0 H ARG A 28 -3.029 -4.209 -13.698 1.00 0.00 H new ATOM 0 HA ARG A 28 -0.273 -5.357 -14.107 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -1.303 -3.652 -11.875 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -0.155 -4.941 -11.572 1.00 0.00 H new ATOM 0 HG2 ARG A 28 1.464 -3.461 -11.856 1.00 0.00 H new ATOM 0 HG3 ARG A 28 1.089 -3.460 -13.568 1.00 0.00 H new ATOM 0 HD2 ARG A 28 1.248 -1.192 -12.884 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -0.445 -1.518 -13.196 1.00 0.00 H new ATOM 0 HE ARG A 28 0.010 -1.846 -10.394 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -0.115 0.795 -12.805 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -0.545 1.970 -11.558 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -0.521 -0.320 -8.989 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -0.767 1.358 -9.482 1.00 0.00 H new ATOM 240 N SER A 29 -1.094 -7.398 -12.594 1.00 0.00 N ATOM 241 CA SER A 29 -1.699 -8.717 -12.210 1.00 0.00 C ATOM 242 C SER A 29 -1.168 -9.062 -10.804 1.00 0.00 C ATOM 243 O SER A 29 0.039 -9.196 -10.678 1.00 0.00 O ATOM 244 CB SER A 29 -1.345 -9.766 -13.287 1.00 0.00 C ATOM 245 OG SER A 29 -1.961 -11.019 -12.987 1.00 0.00 O ATOM 0 H SER A 29 -0.090 -7.334 -12.427 1.00 0.00 H new ATOM 0 HA SER A 29 -2.788 -8.690 -12.164 1.00 0.00 H new ATOM 0 HB2 SER A 29 -1.675 -9.417 -14.265 1.00 0.00 H new ATOM 0 HB3 SER A 29 -0.263 -9.890 -13.341 1.00 0.00 H new ATOM 0 HG SER A 29 -1.728 -11.672 -13.680 1.00 0.00 H new ATOM 246 N MET A 30 -1.971 -9.082 -9.728 1.00 0.00 N ATOM 247 CA MET A 30 -1.536 -8.529 -8.402 1.00 0.00 C ATOM 248 C MET A 30 -0.136 -8.859 -7.800 1.00 0.00 C ATOM 249 O MET A 30 0.413 -8.031 -7.082 1.00 0.00 O ATOM 250 CB MET A 30 -2.456 -8.941 -7.258 1.00 0.00 C ATOM 251 CG MET A 30 -3.858 -8.447 -7.276 1.00 0.00 C ATOM 252 SD MET A 30 -4.768 -9.497 -6.138 1.00 0.00 S ATOM 253 CE MET A 30 -4.767 -8.363 -4.765 1.00 0.00 C ATOM 0 H MET A 30 -2.916 -9.466 -9.732 1.00 0.00 H new ATOM 0 HA MET A 30 -1.542 -7.484 -8.713 1.00 0.00 H new ATOM 0 HB2 MET A 30 -2.486 -10.030 -7.230 1.00 0.00 H new ATOM 0 HB3 MET A 30 -1.998 -8.611 -6.326 1.00 0.00 H new ATOM 0 HG2 MET A 30 -3.908 -7.403 -6.968 1.00 0.00 H new ATOM 0 HG3 MET A 30 -4.279 -8.503 -8.280 1.00 0.00 H new ATOM 0 HE1 MET A 30 -4.600 -8.913 -3.839 1.00 0.00 H new ATOM 0 HE2 MET A 30 -3.972 -7.629 -4.900 1.00 0.00 H new ATOM 0 HE3 MET A 30 -5.728 -7.851 -4.715 1.00 0.00 H new ATOM 254 N ASN A 31 0.480 -10.023 -8.016 1.00 0.00 N ATOM 255 CA ASN A 31 1.944 -10.136 -7.805 1.00 0.00 C ATOM 256 C ASN A 31 2.795 -9.015 -8.544 1.00 0.00 C ATOM 257 O ASN A 31 3.452 -8.238 -7.860 1.00 0.00 O ATOM 258 CB ASN A 31 2.413 -11.601 -7.995 1.00 0.00 C ATOM 259 CG ASN A 31 3.822 -11.939 -7.499 1.00 0.00 C ATOM 260 OD1 ASN A 31 4.575 -12.660 -8.140 1.00 0.00 O ATOM 261 ND2 ASN A 31 4.224 -11.461 -6.350 1.00 0.00 N ATOM 0 H ASN A 31 0.018 -10.878 -8.326 1.00 0.00 H new ATOM 0 HA ASN A 31 2.157 -9.902 -6.762 1.00 0.00 H new ATOM 0 HB2 ASN A 31 1.706 -12.254 -7.484 1.00 0.00 H new ATOM 0 HB3 ASN A 31 2.359 -11.841 -9.057 1.00 0.00 H new ATOM 0 HD21 ASN A 31 5.154 -11.690 -5.999 1.00 0.00 H new ATOM 0 HD22 ASN A 31 3.608 -10.859 -5.804 1.00 0.00 H new ATOM 262 N SER A 32 2.593 -8.784 -9.859 1.00 0.00 N ATOM 263 CA SER A 32 2.667 -7.413 -10.471 1.00 0.00 C ATOM 264 C SER A 32 1.960 -6.252 -9.701 1.00 0.00 C ATOM 265 O SER A 32 2.679 -5.391 -9.201 1.00 0.00 O ATOM 266 CB SER A 32 2.386 -7.486 -11.995 1.00 0.00 C ATOM 267 OG SER A 32 2.220 -6.194 -12.590 1.00 0.00 O ATOM 0 H SER A 32 2.376 -9.522 -10.529 1.00 0.00 H new ATOM 0 HA SER A 32 3.699 -7.087 -10.347 1.00 0.00 H new ATOM 0 HB2 SER A 32 3.208 -8.005 -12.487 1.00 0.00 H new ATOM 0 HB3 SER A 32 1.487 -8.078 -12.166 1.00 0.00 H new ATOM 0 HG SER A 32 2.876 -5.572 -12.210 1.00 0.00 H new ATOM 268 N GLU A 33 0.627 -6.163 -9.567 1.00 0.00 N ATOM 269 CA GLU A 33 0.007 -4.893 -9.050 1.00 0.00 C ATOM 270 C GLU A 33 0.206 -4.528 -7.583 1.00 0.00 C ATOM 271 O GLU A 33 0.605 -3.407 -7.265 1.00 0.00 O ATOM 272 CB GLU A 33 -1.513 -4.829 -9.220 1.00 0.00 C ATOM 273 CG GLU A 33 -2.027 -3.367 -9.232 1.00 0.00 C ATOM 274 CD GLU A 33 -2.341 -2.707 -7.893 1.00 0.00 C ATOM 275 OE1 GLU A 33 -3.124 -3.147 -7.060 1.00 0.00 O ATOM 276 OE2 GLU A 33 -1.661 -1.541 -7.752 1.00 0.00 O ATOM 0 H GLU A 33 -0.032 -6.908 -9.793 1.00 0.00 H new ATOM 0 HA GLU A 33 0.564 -4.197 -9.678 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -1.796 -5.322 -10.150 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -1.993 -5.377 -8.409 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -1.281 -2.755 -9.739 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -2.931 -3.336 -9.840 1.00 0.00 H new ATOM 277 N LEU A 34 -0.160 -5.459 -6.691 1.00 0.00 N ATOM 278 CA LEU A 34 0.193 -5.354 -5.288 1.00 0.00 C ATOM 279 C LEU A 34 1.747 -5.121 -5.204 1.00 0.00 C ATOM 280 O LEU A 34 2.075 -4.222 -4.460 1.00 0.00 O ATOM 281 CB LEU A 34 -0.723 -6.308 -4.461 1.00 0.00 C ATOM 282 CG LEU A 34 -0.165 -7.401 -3.594 1.00 0.00 C ATOM 283 CD1 LEU A 34 0.646 -6.759 -2.445 1.00 0.00 C ATOM 284 CD2 LEU A 34 -1.016 -8.378 -2.829 1.00 0.00 C ATOM 0 H LEU A 34 -0.701 -6.291 -6.927 1.00 0.00 H new ATOM 0 HA LEU A 34 -0.059 -4.492 -4.671 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -1.332 -5.676 -3.815 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -1.400 -6.785 -5.170 1.00 0.00 H new ATOM 0 HG LEU A 34 0.317 -7.978 -4.383 1.00 0.00 H new ATOM 0 HD11 LEU A 34 1.057 -7.542 -1.808 1.00 0.00 H new ATOM 0 HD12 LEU A 34 1.460 -6.166 -2.862 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -0.006 -6.116 -1.854 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -0.374 -9.067 -2.280 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -1.651 -7.836 -2.128 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -1.640 -8.939 -3.524 1.00 0.00 H new ATOM 285 N LEU A 35 2.704 -5.634 -6.047 1.00 0.00 N ATOM 286 CA LEU A 35 4.087 -5.067 -6.054 1.00 0.00 C ATOM 287 C LEU A 35 4.225 -3.613 -6.544 1.00 0.00 C ATOM 288 O LEU A 35 4.922 -2.828 -5.916 1.00 0.00 O ATOM 289 CB LEU A 35 5.139 -5.939 -6.769 1.00 0.00 C ATOM 290 CG LEU A 35 5.674 -7.135 -5.963 1.00 0.00 C ATOM 291 CD1 LEU A 35 6.731 -7.831 -6.804 1.00 0.00 C ATOM 292 CD2 LEU A 35 6.308 -6.679 -4.628 1.00 0.00 C ATOM 0 H LEU A 35 2.550 -6.403 -6.699 1.00 0.00 H new ATOM 0 HA LEU A 35 4.298 -5.066 -4.985 1.00 0.00 H new ATOM 0 HB2 LEU A 35 4.704 -6.314 -7.695 1.00 0.00 H new ATOM 0 HB3 LEU A 35 5.981 -5.305 -7.046 1.00 0.00 H new ATOM 0 HG LEU A 35 4.847 -7.805 -5.729 1.00 0.00 H new ATOM 0 HD11 LEU A 35 7.128 -8.685 -6.255 1.00 0.00 H new ATOM 0 HD12 LEU A 35 6.285 -8.175 -7.737 1.00 0.00 H new ATOM 0 HD13 LEU A 35 7.539 -7.133 -7.024 1.00 0.00 H new ATOM 0 HD21 LEU A 35 6.676 -7.549 -4.084 1.00 0.00 H new ATOM 0 HD22 LEU A 35 7.137 -6.001 -4.832 1.00 0.00 H new ATOM 0 HD23 LEU A 35 5.559 -6.165 -4.026 1.00 0.00 H new ATOM 293 N GLN A 36 3.600 -3.243 -7.649 1.00 0.00 N ATOM 294 CA GLN A 36 3.660 -1.850 -8.169 1.00 0.00 C ATOM 295 C GLN A 36 3.089 -0.772 -7.209 1.00 0.00 C ATOM 296 O GLN A 36 3.800 0.199 -6.938 1.00 0.00 O ATOM 297 CB GLN A 36 3.043 -1.793 -9.590 1.00 0.00 C ATOM 298 CG GLN A 36 4.002 -2.125 -10.759 1.00 0.00 C ATOM 299 CD GLN A 36 4.465 -3.576 -10.913 1.00 0.00 C ATOM 300 OE1 GLN A 36 4.033 -4.334 -11.776 1.00 0.00 O ATOM 301 NE2 GLN A 36 5.349 -4.018 -10.060 1.00 0.00 N ATOM 0 H GLN A 36 3.039 -3.876 -8.219 1.00 0.00 H new ATOM 0 HA GLN A 36 4.714 -1.582 -8.236 1.00 0.00 H new ATOM 0 HB2 GLN A 36 2.202 -2.486 -9.628 1.00 0.00 H new ATOM 0 HB3 GLN A 36 2.640 -0.793 -9.750 1.00 0.00 H new ATOM 0 HG2 GLN A 36 3.513 -1.829 -11.687 1.00 0.00 H new ATOM 0 HG3 GLN A 36 4.889 -1.500 -10.652 1.00 0.00 H new ATOM 0 HE21 GLN A 36 5.716 -3.398 -9.338 1.00 0.00 H new ATOM 0 HE22 GLN A 36 5.673 -4.984 -10.116 1.00 0.00 H new ATOM 302 N ILE A 37 1.919 -0.981 -6.579 1.00 0.00 N ATOM 303 CA ILE A 37 1.602 -0.264 -5.313 1.00 0.00 C ATOM 304 C ILE A 37 2.570 -0.515 -4.108 1.00 0.00 C ATOM 305 O ILE A 37 2.808 0.458 -3.438 1.00 0.00 O ATOM 306 CB ILE A 37 0.102 -0.358 -4.852 1.00 0.00 C ATOM 307 CG1 ILE A 37 -0.359 0.974 -4.191 1.00 0.00 C ATOM 308 CG2 ILE A 37 -0.122 -1.550 -3.891 1.00 0.00 C ATOM 309 CD1 ILE A 37 -1.797 1.024 -3.652 1.00 0.00 C ATOM 0 H ILE A 37 1.192 -1.618 -6.906 1.00 0.00 H new ATOM 0 HA ILE A 37 1.783 0.765 -5.625 1.00 0.00 H new ATOM 0 HB ILE A 37 -0.505 -0.529 -5.741 1.00 0.00 H new ATOM 0 HG12 ILE A 37 0.319 1.196 -3.367 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -0.244 1.773 -4.923 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.170 -1.585 -3.592 1.00 0.00 H new ATOM 0 HG22 ILE A 37 0.142 -2.479 -4.396 1.00 0.00 H new ATOM 0 HG23 ILE A 37 0.503 -1.427 -3.007 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -1.989 2.005 -3.218 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -2.498 0.844 -4.467 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -1.926 0.258 -2.887 1.00 0.00 H new ATOM 310 N VAL A 38 2.997 -1.733 -3.729 1.00 0.00 N ATOM 311 CA VAL A 38 3.743 -2.038 -2.460 1.00 0.00 C ATOM 312 C VAL A 38 5.221 -1.482 -2.504 1.00 0.00 C ATOM 313 O VAL A 38 5.716 -0.899 -1.540 1.00 0.00 O ATOM 314 CB VAL A 38 3.766 -3.575 -2.177 1.00 0.00 C ATOM 315 CG1 VAL A 38 4.850 -4.260 -1.306 1.00 0.00 C ATOM 316 CG2 VAL A 38 2.414 -4.088 -1.626 1.00 0.00 C ATOM 0 H VAL A 38 2.837 -2.563 -4.299 1.00 0.00 H new ATOM 0 HA VAL A 38 3.212 -1.536 -1.651 1.00 0.00 H new ATOM 0 HB VAL A 38 4.027 -3.865 -3.195 1.00 0.00 H new ATOM 0 HG11 VAL A 38 4.654 -5.331 -1.256 1.00 0.00 H new ATOM 0 HG12 VAL A 38 5.832 -4.091 -1.748 1.00 0.00 H new ATOM 0 HG13 VAL A 38 4.828 -3.840 -0.300 1.00 0.00 H new ATOM 0 HG21 VAL A 38 2.479 -5.161 -1.445 1.00 0.00 H new ATOM 0 HG22 VAL A 38 2.184 -3.575 -0.692 1.00 0.00 H new ATOM 0 HG23 VAL A 38 1.626 -3.890 -2.353 1.00 0.00 H new ATOM 317 N GLN A 39 5.927 -1.691 -3.640 1.00 0.00 N ATOM 318 CA GLN A 39 7.109 -0.889 -4.055 1.00 0.00 C ATOM 319 C GLN A 39 6.803 0.644 -4.136 1.00 0.00 C ATOM 320 O GLN A 39 7.538 1.422 -3.527 1.00 0.00 O ATOM 321 CB GLN A 39 7.614 -1.426 -5.432 1.00 0.00 C ATOM 322 CG GLN A 39 8.060 -2.913 -5.504 1.00 0.00 C ATOM 323 CD GLN A 39 8.466 -3.553 -6.840 1.00 0.00 C ATOM 324 OE1 GLN A 39 8.786 -4.733 -6.896 1.00 0.00 O ATOM 325 NE2 GLN A 39 8.476 -2.865 -7.954 1.00 0.00 N ATOM 0 H GLN A 39 5.692 -2.429 -4.304 1.00 0.00 H new ATOM 0 HA GLN A 39 7.883 -1.001 -3.296 1.00 0.00 H new ATOM 0 HB2 GLN A 39 6.819 -1.278 -6.163 1.00 0.00 H new ATOM 0 HB3 GLN A 39 8.455 -0.807 -5.746 1.00 0.00 H new ATOM 0 HG2 GLN A 39 8.906 -3.026 -4.826 1.00 0.00 H new ATOM 0 HG3 GLN A 39 7.244 -3.511 -5.098 1.00 0.00 H new ATOM 0 HE21 GLN A 39 8.215 -1.879 -7.947 1.00 0.00 H new ATOM 0 HE22 GLN A 39 8.744 -3.315 -8.829 1.00 0.00 H new ATOM 326 N ASP A 40 5.669 1.080 -4.746 1.00 0.00 N ATOM 327 CA ASP A 40 5.089 2.421 -4.406 1.00 0.00 C ATOM 328 C ASP A 40 4.884 2.791 -2.894 1.00 0.00 C ATOM 329 O ASP A 40 5.069 3.948 -2.505 1.00 0.00 O ATOM 330 CB ASP A 40 3.951 2.932 -5.317 1.00 0.00 C ATOM 331 CG ASP A 40 4.278 3.417 -6.727 1.00 0.00 C ATOM 332 OD1 ASP A 40 4.983 2.507 -7.452 1.00 0.00 O ATOM 333 OD2 ASP A 40 3.916 4.508 -7.152 1.00 0.00 O ATOM 0 H ASP A 40 5.151 0.553 -5.449 1.00 0.00 H new ATOM 0 HA ASP A 40 5.962 3.016 -4.672 1.00 0.00 H new ATOM 0 HB2 ASP A 40 3.220 2.128 -5.409 1.00 0.00 H new ATOM 0 HB3 ASP A 40 3.458 3.752 -4.795 1.00 0.00 H new ATOM 334 N ALA A 41 4.540 1.813 -2.054 1.00 0.00 N ATOM 335 CA ALA A 41 4.042 2.040 -0.696 1.00 0.00 C ATOM 336 C ALA A 41 5.199 2.371 0.273 1.00 0.00 C ATOM 337 O ALA A 41 5.406 3.527 0.647 1.00 0.00 O ATOM 338 CB ALA A 41 3.117 0.838 -0.384 1.00 0.00 C ATOM 0 H ALA A 41 4.601 0.825 -2.302 1.00 0.00 H new ATOM 0 HA ALA A 41 3.430 2.933 -0.573 1.00 0.00 H new ATOM 0 HB1 ALA A 41 2.709 0.944 0.621 1.00 0.00 H new ATOM 0 HB2 ALA A 41 2.301 0.810 -1.106 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.689 -0.088 -0.447 1.00 0.00 H new ATOM 339 N LEU A 42 6.015 1.364 0.555 1.00 0.00 N ATOM 340 CA LEU A 42 7.280 1.554 1.318 1.00 0.00 C ATOM 341 C LEU A 42 8.569 1.962 0.522 1.00 0.00 C ATOM 342 O LEU A 42 9.660 1.907 1.097 1.00 0.00 O ATOM 343 CB LEU A 42 7.422 0.333 2.262 1.00 0.00 C ATOM 344 CG LEU A 42 7.394 -1.091 1.654 1.00 0.00 C ATOM 345 CD1 LEU A 42 8.614 -1.403 0.782 1.00 0.00 C ATOM 346 CD2 LEU A 42 7.279 -2.092 2.805 1.00 0.00 C ATOM 0 H LEU A 42 5.839 0.399 0.274 1.00 0.00 H new ATOM 0 HA LEU A 42 7.190 2.475 1.895 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.362 0.442 2.802 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.622 0.392 3.000 1.00 0.00 H new ATOM 0 HG LEU A 42 6.536 -1.162 0.986 1.00 0.00 H new ATOM 0 HD11 LEU A 42 8.530 -2.416 0.388 1.00 0.00 H new ATOM 0 HD12 LEU A 42 8.661 -0.695 -0.045 1.00 0.00 H new ATOM 0 HD13 LEU A 42 9.520 -1.321 1.382 1.00 0.00 H new ATOM 0 HD21 LEU A 42 7.257 -3.106 2.405 1.00 0.00 H new ATOM 0 HD22 LEU A 42 8.136 -1.983 3.469 1.00 0.00 H new ATOM 0 HD23 LEU A 42 6.362 -1.902 3.362 1.00 0.00 H new ATOM 347 N SER A 43 8.477 2.469 -0.728 1.00 0.00 N ATOM 348 CA SER A 43 9.551 3.337 -1.300 1.00 0.00 C ATOM 349 C SER A 43 9.188 4.830 -1.601 1.00 0.00 C ATOM 350 O SER A 43 10.119 5.640 -1.558 1.00 0.00 O ATOM 351 CB SER A 43 10.182 2.669 -2.544 1.00 0.00 C ATOM 352 OG SER A 43 11.465 3.237 -2.821 1.00 0.00 O ATOM 0 H SER A 43 7.690 2.301 -1.355 1.00 0.00 H new ATOM 0 HA SER A 43 10.271 3.415 -0.485 1.00 0.00 H new ATOM 0 HB2 SER A 43 10.281 1.596 -2.377 1.00 0.00 H new ATOM 0 HB3 SER A 43 9.527 2.799 -3.405 1.00 0.00 H new ATOM 0 HG SER A 43 11.852 2.803 -3.610 1.00 0.00 H new ATOM 353 N LYS A 44 7.964 5.226 -2.029 1.00 0.00 N ATOM 354 CA LYS A 44 7.825 6.442 -2.907 1.00 0.00 C ATOM 355 C LYS A 44 7.473 7.877 -2.332 1.00 0.00 C ATOM 356 O LYS A 44 7.881 8.831 -3.006 1.00 0.00 O ATOM 357 CB LYS A 44 6.975 6.028 -4.143 1.00 0.00 C ATOM 358 CG LYS A 44 7.339 6.772 -5.454 1.00 0.00 C ATOM 359 CD LYS A 44 6.598 6.199 -6.673 1.00 0.00 C ATOM 360 CE LYS A 44 7.072 6.804 -8.001 1.00 0.00 C ATOM 361 NZ LYS A 44 6.407 6.095 -9.114 1.00 0.00 N ATOM 0 H LYS A 44 7.089 4.755 -1.801 1.00 0.00 H new ATOM 0 HA LYS A 44 8.859 6.699 -3.138 1.00 0.00 H new ATOM 0 HB2 LYS A 44 7.090 4.956 -4.305 1.00 0.00 H new ATOM 0 HB3 LYS A 44 5.923 6.205 -3.920 1.00 0.00 H new ATOM 0 HG2 LYS A 44 7.097 7.830 -5.348 1.00 0.00 H new ATOM 0 HG3 LYS A 44 8.414 6.706 -5.621 1.00 0.00 H new ATOM 0 HD2 LYS A 44 6.738 5.118 -6.702 1.00 0.00 H new ATOM 0 HD3 LYS A 44 5.529 6.379 -6.559 1.00 0.00 H new ATOM 0 HE2 LYS A 44 6.835 7.867 -8.037 1.00 0.00 H new ATOM 0 HE3 LYS A 44 8.155 6.715 -8.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 7.126 5.712 -9.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 5.832 5.315 -8.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 5.794 6.758 -9.631 1.00 0.00 H new ATOM 362 N PRO A 45 6.744 8.155 -1.208 1.00 0.00 N ATOM 363 CA PRO A 45 6.253 9.530 -0.901 1.00 0.00 C ATOM 364 C PRO A 45 7.237 10.533 -0.215 1.00 0.00 C ATOM 365 O PRO A 45 7.584 10.429 0.964 1.00 0.00 O ATOM 366 CB PRO A 45 4.993 9.272 -0.061 1.00 0.00 C ATOM 367 CG PRO A 45 5.340 7.952 0.655 1.00 0.00 C ATOM 368 CD PRO A 45 6.131 7.124 -0.361 1.00 0.00 C ATOM 0 HA PRO A 45 6.087 10.067 -1.835 1.00 0.00 H new ATOM 0 HB2 PRO A 45 4.803 10.080 0.645 1.00 0.00 H new ATOM 0 HB3 PRO A 45 4.103 9.176 -0.682 1.00 0.00 H new ATOM 0 HG2 PRO A 45 5.930 8.137 1.553 1.00 0.00 H new ATOM 0 HG3 PRO A 45 4.437 7.428 0.969 1.00 0.00 H new ATOM 0 HD2 PRO A 45 6.881 6.498 0.123 1.00 0.00 H new ATOM 0 HD3 PRO A 45 5.484 6.460 -0.935 1.00 0.00 H new ATOM 369 N SER A 46 7.496 11.638 -0.921 1.00 0.00 N ATOM 370 CA SER A 46 7.395 12.985 -0.290 1.00 0.00 C ATOM 371 C SER A 46 5.896 13.449 -0.075 1.00 0.00 C ATOM 372 O SER A 46 5.024 13.005 -0.835 1.00 0.00 O ATOM 373 CB SER A 46 8.146 13.974 -1.212 1.00 0.00 C ATOM 374 OG SER A 46 9.543 13.677 -1.252 1.00 0.00 O ATOM 0 H SER A 46 7.771 11.644 -1.903 1.00 0.00 H new ATOM 0 HA SER A 46 7.838 12.952 0.705 1.00 0.00 H new ATOM 0 HB2 SER A 46 7.731 13.925 -2.219 1.00 0.00 H new ATOM 0 HB3 SER A 46 7.997 14.993 -0.856 1.00 0.00 H new ATOM 0 HG SER A 46 9.996 14.314 -1.842 1.00 0.00 H new ATOM 375 N PRO A 47 5.530 14.337 0.899 1.00 0.00 N ATOM 376 CA PRO A 47 4.146 14.893 1.000 1.00 0.00 C ATOM 377 C PRO A 47 3.781 15.880 -0.160 1.00 0.00 C ATOM 378 O PRO A 47 4.155 17.057 -0.136 1.00 0.00 O ATOM 379 CB PRO A 47 4.185 15.523 2.408 1.00 0.00 C ATOM 380 CG PRO A 47 5.640 15.949 2.619 1.00 0.00 C ATOM 381 CD PRO A 47 6.459 14.863 1.920 1.00 0.00 C ATOM 0 HA PRO A 47 3.352 14.156 0.885 1.00 0.00 H new ATOM 0 HB2 PRO A 47 3.511 16.377 2.476 1.00 0.00 H new ATOM 0 HB3 PRO A 47 3.870 14.808 3.168 1.00 0.00 H new ATOM 0 HG2 PRO A 47 5.833 16.931 2.188 1.00 0.00 H new ATOM 0 HG3 PRO A 47 5.886 16.012 3.679 1.00 0.00 H new ATOM 0 HD2 PRO A 47 7.364 15.270 1.468 1.00 0.00 H new ATOM 0 HD3 PRO A 47 6.773 14.085 2.617 1.00 0.00 H new ATOM 382 N VAL A 48 3.102 15.381 -1.207 1.00 0.00 N ATOM 383 CA VAL A 48 2.871 16.141 -2.463 1.00 0.00 C ATOM 384 C VAL A 48 1.395 16.657 -2.571 1.00 0.00 C ATOM 385 O VAL A 48 0.439 16.002 -2.135 1.00 0.00 O ATOM 386 CB VAL A 48 3.347 15.212 -3.645 1.00 0.00 C ATOM 387 CG1 VAL A 48 2.619 13.846 -3.740 1.00 0.00 C ATOM 388 CG2 VAL A 48 3.346 15.885 -5.036 1.00 0.00 C ATOM 0 H VAL A 48 2.697 14.445 -1.214 1.00 0.00 H new ATOM 0 HA VAL A 48 3.450 17.064 -2.495 1.00 0.00 H new ATOM 0 HB VAL A 48 4.382 15.019 -3.361 1.00 0.00 H new ATOM 0 HG11 VAL A 48 3.016 13.280 -4.583 1.00 0.00 H new ATOM 0 HG12 VAL A 48 2.777 13.285 -2.819 1.00 0.00 H new ATOM 0 HG13 VAL A 48 1.551 14.012 -3.885 1.00 0.00 H new ATOM 0 HG21 VAL A 48 3.687 15.171 -5.786 1.00 0.00 H new ATOM 0 HG22 VAL A 48 2.336 16.213 -5.281 1.00 0.00 H new ATOM 0 HG23 VAL A 48 4.014 16.746 -5.024 1.00 0.00 H new ATOM 389 N THR A 49 1.212 17.775 -3.306 1.00 0.00 N ATOM 390 CA THR A 49 -0.066 18.073 -4.031 1.00 0.00 C ATOM 391 C THR A 49 -1.335 18.344 -3.141 1.00 0.00 C ATOM 392 O THR A 49 -1.289 18.704 -1.964 1.00 0.00 O ATOM 393 CB THR A 49 -0.186 17.147 -5.312 1.00 0.00 C ATOM 394 OG1 THR A 49 -1.237 17.550 -6.181 1.00 0.00 O ATOM 395 CG2 THR A 49 -0.417 15.657 -5.016 1.00 0.00 C ATOM 0 H THR A 49 1.927 18.493 -3.420 1.00 0.00 H new ATOM 0 HA THR A 49 -0.017 19.086 -4.431 1.00 0.00 H new ATOM 0 HB THR A 49 0.791 17.270 -5.780 1.00 0.00 H new ATOM 0 HG1 THR A 49 -1.269 16.950 -6.955 1.00 0.00 H new ATOM 0 HG21 THR A 49 -0.486 15.106 -5.954 1.00 0.00 H new ATOM 0 HG22 THR A 49 0.415 15.270 -4.428 1.00 0.00 H new ATOM 0 HG23 THR A 49 -1.344 15.537 -4.456 1.00 0.00 H new ATOM 396 N GLY A 50 -2.474 18.264 -3.813 1.00 0.00 N ATOM 397 CA GLY A 50 -3.816 18.613 -3.257 1.00 0.00 C ATOM 398 C GLY A 50 -4.525 17.549 -2.391 1.00 0.00 C ATOM 399 O GLY A 50 -4.988 17.855 -1.293 1.00 0.00 O ATOM 0 H GLY A 50 -2.515 17.950 -4.783 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -3.708 19.517 -2.658 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -4.472 18.860 -4.091 1.00 0.00 H new ATOM 400 N TYR A 51 -4.597 16.298 -2.866 1.00 0.00 N ATOM 401 CA TYR A 51 -5.090 15.136 -2.059 1.00 0.00 C ATOM 402 C TYR A 51 -4.170 14.576 -0.889 1.00 0.00 C ATOM 403 O TYR A 51 -4.277 13.410 -0.514 1.00 0.00 O ATOM 404 CB TYR A 51 -5.733 14.104 -3.063 1.00 0.00 C ATOM 405 CG TYR A 51 -4.985 13.429 -4.259 1.00 0.00 C ATOM 406 CD1 TYR A 51 -3.663 13.751 -4.627 1.00 0.00 C ATOM 407 CD2 TYR A 51 -5.606 12.356 -4.933 1.00 0.00 C ATOM 408 CE1 TYR A 51 -2.964 12.991 -5.553 1.00 0.00 C ATOM 409 CE2 TYR A 51 -4.909 11.624 -5.883 1.00 0.00 C ATOM 410 CZ TYR A 51 -3.603 11.937 -6.167 1.00 0.00 C ATOM 411 OH TYR A 51 -2.911 11.062 -6.903 1.00 0.00 O ATOM 0 H TYR A 51 -4.320 16.047 -3.815 1.00 0.00 H new ATOM 0 HA TYR A 51 -5.863 15.493 -1.379 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -6.114 13.288 -2.449 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -6.597 14.607 -3.496 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -3.184 14.608 -4.178 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -6.631 12.103 -4.708 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -1.936 13.222 -5.789 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -5.394 10.808 -6.399 1.00 0.00 H new ATOM 0 HH TYR A 51 -3.371 10.197 -6.901 1.00 0.00 H new ATOM 412 N ARG A 52 -3.351 15.444 -0.255 1.00 0.00 N ATOM 413 CA ARG A 52 -2.750 15.291 1.117 1.00 0.00 C ATOM 414 C ARG A 52 -1.224 14.910 1.326 1.00 0.00 C ATOM 415 O ARG A 52 -0.384 15.806 1.331 1.00 0.00 O ATOM 416 CB ARG A 52 -3.717 14.763 2.205 1.00 0.00 C ATOM 417 CG ARG A 52 -3.618 15.419 3.600 1.00 0.00 C ATOM 418 CD ARG A 52 -4.299 16.795 3.747 1.00 0.00 C ATOM 419 NE ARG A 52 -5.773 16.662 3.914 1.00 0.00 N ATOM 420 CZ ARG A 52 -6.689 16.824 2.966 1.00 0.00 C ATOM 421 NH1 ARG A 52 -6.427 17.105 1.724 1.00 0.00 N ATOM 422 NH2 ARG A 52 -7.920 16.684 3.308 1.00 0.00 N ATOM 0 H ARG A 52 -3.068 16.319 -0.696 1.00 0.00 H new ATOM 0 HA ARG A 52 -2.612 16.359 1.288 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -4.737 14.887 1.842 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -3.548 13.692 2.320 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -4.055 14.739 4.332 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -2.564 15.528 3.855 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -3.881 17.319 4.607 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -4.085 17.403 2.868 1.00 0.00 H new ATOM 0 HE ARG A 52 -6.112 16.424 4.846 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -5.460 17.216 1.419 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -7.188 17.214 1.054 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -8.158 16.458 4.274 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -8.658 16.799 2.614 1.00 0.00 H new ATOM 423 N ASN A 53 -0.663 13.731 1.664 1.00 0.00 N ATOM 424 CA ASN A 53 -1.158 12.372 1.290 1.00 0.00 C ATOM 425 C ASN A 53 -1.767 11.508 2.467 1.00 0.00 C ATOM 426 O ASN A 53 -1.875 11.918 3.623 1.00 0.00 O ATOM 427 CB ASN A 53 -0.036 11.571 0.465 1.00 0.00 C ATOM 428 CG ASN A 53 1.192 12.276 -0.152 1.00 0.00 C ATOM 429 OD1 ASN A 53 1.086 13.285 -0.825 1.00 0.00 O ATOM 430 ND2 ASN A 53 2.389 11.776 -0.007 1.00 0.00 N ATOM 0 H ASN A 53 0.185 13.688 2.230 1.00 0.00 H new ATOM 0 HA ASN A 53 -2.020 12.552 0.647 1.00 0.00 H new ATOM 0 HB2 ASN A 53 0.348 10.797 1.129 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -0.550 11.064 -0.352 1.00 0.00 H new ATOM 0 HD21 ASN A 53 3.188 12.230 -0.449 1.00 0.00 H new ATOM 0 HD22 ASN A 53 2.525 10.931 0.549 1.00 0.00 H new ATOM 431 N ASP A 54 -2.070 10.211 2.187 1.00 0.00 N ATOM 432 CA ASP A 54 -1.839 9.058 3.116 1.00 0.00 C ATOM 433 C ASP A 54 -0.814 7.914 2.779 1.00 0.00 C ATOM 434 O ASP A 54 -0.534 6.979 3.532 1.00 0.00 O ATOM 435 CB ASP A 54 -2.775 8.802 4.334 1.00 0.00 C ATOM 436 CG ASP A 54 -4.173 8.203 4.459 1.00 0.00 C ATOM 437 OD1 ASP A 54 -4.204 6.854 4.293 1.00 0.00 O ATOM 438 OD2 ASP A 54 -5.147 8.852 4.812 1.00 0.00 O ATOM 0 H ASP A 54 -2.487 9.928 1.300 1.00 0.00 H new ATOM 0 HA ASP A 54 -1.170 9.850 3.453 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -2.170 8.190 5.003 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -2.870 9.783 4.799 1.00 0.00 H new ATOM 439 N ALA A 55 0.064 8.281 1.864 1.00 0.00 N ATOM 440 CA ALA A 55 1.502 7.939 1.879 1.00 0.00 C ATOM 441 C ALA A 55 2.522 8.992 2.527 1.00 0.00 C ATOM 442 O ALA A 55 3.523 8.646 3.158 1.00 0.00 O ATOM 443 CB ALA A 55 1.560 7.541 0.414 1.00 0.00 C ATOM 0 H ALA A 55 -0.198 8.845 1.056 1.00 0.00 H new ATOM 0 HA ALA A 55 1.864 7.179 2.571 1.00 0.00 H new ATOM 0 HB1 ALA A 55 2.574 7.231 0.161 1.00 0.00 H new ATOM 0 HB2 ALA A 55 0.872 6.715 0.234 1.00 0.00 H new ATOM 0 HB3 ALA A 55 1.276 8.391 -0.206 1.00 0.00 H new ATOM 444 N GLU A 56 2.146 10.266 2.696 1.00 0.00 N ATOM 445 CA GLU A 56 2.307 10.987 4.004 1.00 0.00 C ATOM 446 C GLU A 56 1.703 10.221 5.251 1.00 0.00 C ATOM 447 O GLU A 56 2.151 10.299 6.380 1.00 0.00 O ATOM 448 CB GLU A 56 1.646 12.358 3.708 1.00 0.00 C ATOM 449 CG GLU A 56 1.709 13.507 4.731 1.00 0.00 C ATOM 450 CD GLU A 56 0.918 13.339 6.026 1.00 0.00 C ATOM 451 OE1 GLU A 56 -0.182 12.802 6.089 1.00 0.00 O ATOM 452 OE2 GLU A 56 1.568 13.859 7.099 1.00 0.00 O ATOM 0 H GLU A 56 1.728 10.833 1.958 1.00 0.00 H new ATOM 0 HA GLU A 56 3.348 11.078 4.316 1.00 0.00 H new ATOM 0 HB2 GLU A 56 2.085 12.731 2.782 1.00 0.00 H new ATOM 0 HB3 GLU A 56 0.592 12.167 3.507 1.00 0.00 H new ATOM 0 HG2 GLU A 56 2.755 13.667 4.993 1.00 0.00 H new ATOM 0 HG3 GLU A 56 1.361 14.415 4.239 1.00 0.00 H new ATOM 453 N ARG A 57 0.754 9.313 5.086 1.00 0.00 N ATOM 454 CA ARG A 57 0.472 8.285 6.138 1.00 0.00 C ATOM 455 C ARG A 57 1.508 7.083 6.187 1.00 0.00 C ATOM 456 O ARG A 57 1.505 6.114 6.943 1.00 0.00 O ATOM 457 CB ARG A 57 -0.601 9.041 6.980 1.00 0.00 C ATOM 458 CG ARG A 57 -1.365 8.366 8.134 1.00 0.00 C ATOM 459 CD ARG A 57 -2.023 7.012 7.802 1.00 0.00 C ATOM 460 NE ARG A 57 -3.009 6.654 8.851 1.00 0.00 N ATOM 461 CZ ARG A 57 -4.306 6.951 8.836 1.00 0.00 C ATOM 462 NH1 ARG A 57 -4.888 7.659 7.914 1.00 0.00 N ATOM 463 NH2 ARG A 57 -5.026 6.494 9.796 1.00 0.00 N ATOM 0 H ARG A 57 0.162 9.247 4.258 1.00 0.00 H new ATOM 0 HA ARG A 57 0.110 7.305 6.449 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -0.108 9.917 7.401 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -1.351 9.404 6.278 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -0.675 8.219 8.965 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -2.140 9.050 8.481 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -2.516 7.067 6.832 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -1.261 6.237 7.729 1.00 0.00 H new ATOM 0 HE ARG A 57 -2.661 6.133 9.656 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -4.343 8.028 7.134 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -5.889 7.846 7.970 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -4.599 5.928 10.529 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -6.025 6.697 9.825 1.00 0.00 H new ATOM 464 N LEU A 58 2.357 7.045 5.165 1.00 0.00 N ATOM 465 CA LEU A 58 3.748 6.510 5.191 1.00 0.00 C ATOM 466 C LEU A 58 4.712 7.311 6.200 1.00 0.00 C ATOM 467 O LEU A 58 5.637 6.817 6.839 1.00 0.00 O ATOM 468 CB LEU A 58 3.595 4.958 5.054 1.00 0.00 C ATOM 469 CG LEU A 58 2.562 4.416 3.995 1.00 0.00 C ATOM 470 CD1 LEU A 58 3.081 4.526 2.565 1.00 0.00 C ATOM 471 CD2 LEU A 58 2.128 2.995 4.298 1.00 0.00 C ATOM 0 H LEU A 58 2.098 7.399 4.244 1.00 0.00 H new ATOM 0 HA LEU A 58 4.429 6.722 4.367 1.00 0.00 H new ATOM 0 HB2 LEU A 58 4.574 4.544 4.810 1.00 0.00 H new ATOM 0 HB3 LEU A 58 3.315 4.561 6.030 1.00 0.00 H new ATOM 0 HG LEU A 58 1.686 5.059 4.076 1.00 0.00 H new ATOM 0 HD11 LEU A 58 2.331 4.139 1.875 1.00 0.00 H new ATOM 0 HD12 LEU A 58 3.284 5.571 2.331 1.00 0.00 H new ATOM 0 HD13 LEU A 58 3.999 3.947 2.465 1.00 0.00 H new ATOM 0 HD21 LEU A 58 1.416 2.663 3.542 1.00 0.00 H new ATOM 0 HD22 LEU A 58 2.999 2.339 4.290 1.00 0.00 H new ATOM 0 HD23 LEU A 58 1.657 2.960 5.280 1.00 0.00 H new ATOM 472 N ALA A 59 4.430 8.585 6.513 1.00 0.00 N ATOM 473 CA ALA A 59 4.607 9.078 7.941 1.00 0.00 C ATOM 474 C ALA A 59 3.889 8.319 9.124 1.00 0.00 C ATOM 475 O ALA A 59 4.205 8.417 10.306 1.00 0.00 O ATOM 476 CB ALA A 59 4.150 10.517 8.099 1.00 0.00 C ATOM 0 H ALA A 59 4.093 9.285 5.852 1.00 0.00 H new ATOM 0 HA ALA A 59 5.678 8.903 8.046 1.00 0.00 H new ATOM 0 HB1 ALA A 59 4.292 10.833 9.133 1.00 0.00 H new ATOM 0 HB2 ALA A 59 4.735 11.159 7.440 1.00 0.00 H new ATOM 0 HB3 ALA A 59 3.095 10.594 7.838 1.00 0.00 H new ATOM 477 N ASP A 60 2.869 7.557 8.826 1.00 0.00 N ATOM 478 CA ASP A 60 2.611 6.224 9.513 1.00 0.00 C ATOM 479 C ASP A 60 3.418 4.924 9.207 1.00 0.00 C ATOM 480 O ASP A 60 3.390 3.956 9.964 1.00 0.00 O ATOM 481 CB ASP A 60 1.123 6.092 9.789 1.00 0.00 C ATOM 482 CG ASP A 60 0.404 4.741 9.777 1.00 0.00 C ATOM 483 OD1 ASP A 60 0.398 4.182 8.534 1.00 0.00 O ATOM 484 OD2 ASP A 60 -0.092 4.225 10.774 1.00 0.00 O ATOM 0 H ASP A 60 2.176 7.798 8.117 1.00 0.00 H new ATOM 0 HA ASP A 60 3.189 6.311 10.433 1.00 0.00 H new ATOM 0 HB2 ASP A 60 0.947 6.531 10.771 1.00 0.00 H new ATOM 0 HB3 ASP A 60 0.613 6.724 9.062 1.00 0.00 H new ATOM 485 N GLU A 61 4.347 4.996 8.288 1.00 0.00 N ATOM 486 CA GLU A 61 5.740 4.471 8.592 1.00 0.00 C ATOM 487 C GLU A 61 6.475 5.130 9.825 1.00 0.00 C ATOM 488 O GLU A 61 7.307 4.476 10.455 1.00 0.00 O ATOM 489 CB GLU A 61 6.636 4.166 7.349 1.00 0.00 C ATOM 490 CG GLU A 61 7.996 4.888 7.137 1.00 0.00 C ATOM 491 CD GLU A 61 8.678 4.591 5.799 1.00 0.00 C ATOM 492 OE1 GLU A 61 8.132 4.067 4.830 1.00 0.00 O ATOM 493 OE2 GLU A 61 9.976 4.992 5.795 1.00 0.00 O ATOM 0 H GLU A 61 4.219 5.385 7.354 1.00 0.00 H new ATOM 0 HA GLU A 61 5.525 3.472 8.971 1.00 0.00 H new ATOM 0 HB2 GLU A 61 6.843 3.096 7.361 1.00 0.00 H new ATOM 0 HB3 GLU A 61 6.030 4.363 6.465 1.00 0.00 H new ATOM 0 HG2 GLU A 61 7.837 5.963 7.217 1.00 0.00 H new ATOM 0 HG3 GLU A 61 8.672 4.605 7.944 1.00 0.00 H new ATOM 494 N GLN A 62 6.146 6.383 10.222 1.00 0.00 N ATOM 495 CA GLN A 62 6.486 6.931 11.574 1.00 0.00 C ATOM 496 C GLN A 62 5.687 6.257 12.714 1.00 0.00 C ATOM 497 O GLN A 62 6.341 5.740 13.602 1.00 0.00 O ATOM 498 CB GLN A 62 6.679 8.467 11.782 1.00 0.00 C ATOM 499 CG GLN A 62 7.383 9.317 10.685 1.00 0.00 C ATOM 500 CD GLN A 62 8.673 8.817 10.028 1.00 0.00 C ATOM 501 OE1 GLN A 62 8.685 7.626 9.484 1.00 0.00 O flip ATOM 502 NE2 GLN A 62 9.689 9.497 9.989 1.00 0.00 N flip ATOM 0 H GLN A 62 5.643 7.042 9.628 1.00 0.00 H new ATOM 0 HA GLN A 62 7.531 6.625 11.629 1.00 0.00 H new ATOM 0 HB2 GLN A 62 5.691 8.899 11.943 1.00 0.00 H new ATOM 0 HB3 GLN A 62 7.241 8.601 12.707 1.00 0.00 H new ATOM 0 HG2 GLN A 62 6.657 9.480 9.888 1.00 0.00 H new ATOM 0 HG3 GLN A 62 7.600 10.292 11.122 1.00 0.00 H new ATOM 0 HE21 GLN A 62 9.697 10.427 10.408 1.00 0.00 H new ATOM 0 HE22 GLN A 62 10.529 9.134 9.538 1.00 0.00 H new ATOM 503 N SER A 63 4.349 6.079 12.657 1.00 0.00 N ATOM 504 CA SER A 63 3.624 4.985 13.439 1.00 0.00 C ATOM 505 C SER A 63 4.444 3.715 13.744 1.00 0.00 C ATOM 506 O SER A 63 4.535 3.226 14.865 1.00 0.00 O ATOM 507 CB SER A 63 2.271 4.377 12.904 1.00 0.00 C ATOM 508 OG SER A 63 1.264 5.370 12.766 1.00 0.00 O ATOM 0 H SER A 63 3.730 6.659 12.091 1.00 0.00 H new ATOM 0 HA SER A 63 3.430 5.631 14.295 1.00 0.00 H new ATOM 0 HB2 SER A 63 2.444 3.898 11.940 1.00 0.00 H new ATOM 0 HB3 SER A 63 1.926 3.602 13.588 1.00 0.00 H new ATOM 0 HG SER A 63 0.504 4.998 12.272 1.00 0.00 H new ATOM 509 N GLU A 64 5.015 3.203 12.673 1.00 0.00 N ATOM 510 CA GLU A 64 5.602 1.874 12.641 1.00 0.00 C ATOM 511 C GLU A 64 7.082 1.774 13.183 1.00 0.00 C ATOM 512 O GLU A 64 7.430 0.763 13.793 1.00 0.00 O ATOM 513 CB GLU A 64 5.392 1.597 11.128 1.00 0.00 C ATOM 514 CG GLU A 64 5.785 0.226 10.581 1.00 0.00 C ATOM 515 CD GLU A 64 7.283 0.013 10.360 1.00 0.00 C ATOM 516 OE1 GLU A 64 7.931 0.551 9.467 1.00 0.00 O ATOM 517 OE2 GLU A 64 7.826 -0.828 11.275 1.00 0.00 O ATOM 0 H GLU A 64 5.087 3.703 11.787 1.00 0.00 H new ATOM 0 HA GLU A 64 5.164 1.134 13.311 1.00 0.00 H new ATOM 0 HB2 GLU A 64 4.337 1.754 10.905 1.00 0.00 H new ATOM 0 HB3 GLU A 64 5.951 2.350 10.572 1.00 0.00 H new ATOM 0 HG2 GLU A 64 5.424 -0.538 11.270 1.00 0.00 H new ATOM 0 HG3 GLU A 64 5.269 0.070 9.633 1.00 0.00 H new ATOM 518 N LEU A 65 7.962 2.796 13.050 1.00 0.00 N ATOM 519 CA LEU A 65 9.040 3.028 14.081 1.00 0.00 C ATOM 520 C LEU A 65 8.584 3.275 15.572 1.00 0.00 C ATOM 521 O LEU A 65 9.333 2.916 16.483 1.00 0.00 O ATOM 522 CB LEU A 65 10.030 4.130 13.587 1.00 0.00 C ATOM 523 CG LEU A 65 9.401 5.502 13.247 1.00 0.00 C ATOM 524 CD1 LEU A 65 9.149 6.501 14.386 1.00 0.00 C ATOM 525 CD2 LEU A 65 10.002 6.186 12.034 1.00 0.00 C ATOM 0 H LEU A 65 7.962 3.459 12.274 1.00 0.00 H new ATOM 0 HA LEU A 65 9.542 2.064 14.156 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.788 4.280 14.355 1.00 0.00 H new ATOM 0 HB3 LEU A 65 10.544 3.758 12.701 1.00 0.00 H new ATOM 0 HG LEU A 65 8.396 5.164 12.993 1.00 0.00 H new ATOM 0 HD11 LEU A 65 8.705 7.410 13.981 1.00 0.00 H new ATOM 0 HD12 LEU A 65 8.469 6.059 15.114 1.00 0.00 H new ATOM 0 HD13 LEU A 65 10.094 6.744 14.873 1.00 0.00 H new ATOM 0 HD21 LEU A 65 9.502 7.140 11.869 1.00 0.00 H new ATOM 0 HD22 LEU A 65 11.065 6.358 12.203 1.00 0.00 H new ATOM 0 HD23 LEU A 65 9.872 5.552 11.157 1.00 0.00 H new ATOM 526 N VAL A 66 7.408 3.888 15.843 1.00 0.00 N ATOM 527 CA VAL A 66 6.897 4.113 17.237 1.00 0.00 C ATOM 528 C VAL A 66 6.427 2.746 17.905 1.00 0.00 C ATOM 529 O VAL A 66 6.984 2.328 18.921 1.00 0.00 O ATOM 530 CB VAL A 66 5.975 5.408 17.396 1.00 0.00 C ATOM 531 CG1 VAL A 66 5.955 6.524 16.303 1.00 0.00 C ATOM 532 CG2 VAL A 66 4.484 5.124 17.576 1.00 0.00 C ATOM 0 H VAL A 66 6.784 4.241 15.117 1.00 0.00 H new ATOM 0 HA VAL A 66 7.726 4.421 17.875 1.00 0.00 H new ATOM 0 HB VAL A 66 6.506 5.772 18.276 1.00 0.00 H new ATOM 0 HG11 VAL A 66 5.266 7.314 16.602 1.00 0.00 H new ATOM 0 HG12 VAL A 66 6.956 6.940 16.189 1.00 0.00 H new ATOM 0 HG13 VAL A 66 5.629 6.098 15.354 1.00 0.00 H new ATOM 0 HG21 VAL A 66 3.944 6.065 17.675 1.00 0.00 H new ATOM 0 HG22 VAL A 66 4.110 4.580 16.708 1.00 0.00 H new ATOM 0 HG23 VAL A 66 4.334 4.523 18.473 1.00 0.00 H new TER 533 VAL A 66 ATOM 534 N ALA B 1 -19.856 -15.107 5.730 1.00 0.00 N ATOM 535 CA ALA B 1 -19.430 -15.559 4.386 1.00 0.00 C ATOM 536 C ALA B 1 -17.890 -15.796 4.271 1.00 0.00 C ATOM 537 O ALA B 1 -17.072 -14.951 4.651 1.00 0.00 O ATOM 538 CB ALA B 1 -19.937 -14.517 3.375 1.00 0.00 C ATOM 0 H1 ALA B 1 -20.887 -14.968 5.739 1.00 0.00 H new ATOM 0 H2 ALA B 1 -19.597 -15.825 6.436 1.00 0.00 H new ATOM 0 H3 ALA B 1 -19.384 -14.209 5.960 1.00 0.00 H new ATOM 0 HA ALA B 1 -19.863 -16.537 4.178 1.00 0.00 H new ATOM 0 HB1 ALA B 1 -19.643 -14.814 2.368 1.00 0.00 H new ATOM 0 HB2 ALA B 1 -21.024 -14.454 3.432 1.00 0.00 H new ATOM 0 HB3 ALA B 1 -19.504 -13.544 3.607 1.00 0.00 H new ATOM 539 N ARG B 2 -17.491 -16.940 3.690 1.00 0.00 N ATOM 540 CA ARG B 2 -16.051 -17.277 3.471 1.00 0.00 C ATOM 541 C ARG B 2 -15.520 -16.693 2.116 1.00 0.00 C ATOM 542 O ARG B 2 -15.457 -17.378 1.090 1.00 0.00 O ATOM 543 CB ARG B 2 -15.874 -18.818 3.590 1.00 0.00 C ATOM 544 CG ARG B 2 -16.031 -19.395 5.018 1.00 0.00 C ATOM 545 CD ARG B 2 -15.872 -20.925 5.057 1.00 0.00 C ATOM 546 NE ARG B 2 -15.992 -21.424 6.453 1.00 0.00 N ATOM 547 CZ ARG B 2 -17.116 -21.773 7.068 1.00 0.00 C ATOM 548 NH1 ARG B 2 -18.297 -21.714 6.530 1.00 0.00 N ATOM 549 NH2 ARG B 2 -17.020 -22.191 8.280 1.00 0.00 N ATOM 0 H ARG B 2 -18.137 -17.656 3.359 1.00 0.00 H new ATOM 0 HA ARG B 2 -15.438 -16.806 4.240 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -16.602 -19.302 2.939 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -14.885 -19.083 3.216 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -15.289 -18.939 5.674 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -17.012 -19.125 5.410 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -16.632 -21.392 4.431 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -14.903 -21.207 4.646 1.00 0.00 H new ATOM 0 HE ARG B 2 -15.128 -21.506 6.989 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -18.405 -21.382 5.572 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -19.116 -22.000 7.066 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -16.106 -22.244 8.730 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -17.857 -22.470 8.791 1.00 0.00 H new ATOM 550 N ASP B 3 -15.138 -15.406 2.122 1.00 0.00 N ATOM 551 CA ASP B 3 -14.619 -14.693 0.922 1.00 0.00 C ATOM 552 C ASP B 3 -13.288 -13.994 1.329 1.00 0.00 C ATOM 553 O ASP B 3 -13.244 -12.812 1.679 1.00 0.00 O ATOM 554 CB ASP B 3 -15.711 -13.733 0.375 1.00 0.00 C ATOM 555 CG ASP B 3 -16.928 -14.413 -0.243 1.00 0.00 C ATOM 556 OD1 ASP B 3 -16.654 -14.952 -1.461 1.00 0.00 O ATOM 557 OD2 ASP B 3 -18.030 -14.470 0.291 1.00 0.00 O ATOM 0 H ASP B 3 -15.177 -14.821 2.956 1.00 0.00 H new ATOM 0 HA ASP B 3 -14.392 -15.370 0.099 1.00 0.00 H new ATOM 0 HB2 ASP B 3 -16.048 -13.092 1.189 1.00 0.00 H new ATOM 0 HB3 ASP B 3 -15.258 -13.084 -0.375 1.00 0.00 H new ATOM 558 N ASP B 4 -12.189 -14.761 1.329 1.00 0.00 N ATOM 559 CA ASP B 4 -10.845 -14.244 1.705 1.00 0.00 C ATOM 560 C ASP B 4 -9.710 -15.094 1.040 1.00 0.00 C ATOM 561 O ASP B 4 -9.346 -16.125 1.616 1.00 0.00 O ATOM 562 CB ASP B 4 -10.723 -14.041 3.243 1.00 0.00 C ATOM 563 CG ASP B 4 -11.058 -15.179 4.215 1.00 0.00 C ATOM 564 OD1 ASP B 4 -10.404 -16.341 3.930 1.00 0.00 O ATOM 565 OD2 ASP B 4 -11.834 -15.044 5.155 1.00 0.00 O ATOM 0 H ASP B 4 -12.194 -15.748 1.073 1.00 0.00 H new ATOM 0 HA ASP B 4 -10.713 -13.243 1.295 1.00 0.00 H new ATOM 0 HB2 ASP B 4 -9.695 -13.739 3.446 1.00 0.00 H new ATOM 0 HB3 ASP B 4 -11.361 -13.197 3.506 1.00 0.00 H new ATOM 566 N PRO B 5 -9.144 -14.770 -0.158 1.00 0.00 N ATOM 567 CA PRO B 5 -8.345 -15.744 -0.945 1.00 0.00 C ATOM 568 C PRO B 5 -6.819 -15.652 -0.698 1.00 0.00 C ATOM 569 O PRO B 5 -6.235 -14.564 -0.618 1.00 0.00 O ATOM 570 CB PRO B 5 -8.746 -15.411 -2.403 1.00 0.00 C ATOM 571 CG PRO B 5 -9.866 -14.373 -2.289 1.00 0.00 C ATOM 572 CD PRO B 5 -9.546 -13.635 -1.010 1.00 0.00 C ATOM 0 HA PRO B 5 -8.554 -16.776 -0.665 1.00 0.00 H new ATOM 0 HB2 PRO B 5 -7.899 -15.015 -2.963 1.00 0.00 H new ATOM 0 HB3 PRO B 5 -9.088 -16.302 -2.930 1.00 0.00 H new ATOM 0 HG2 PRO B 5 -9.877 -13.700 -3.147 1.00 0.00 H new ATOM 0 HG3 PRO B 5 -10.847 -14.846 -2.243 1.00 0.00 H new ATOM 0 HD2 PRO B 5 -8.746 -12.905 -1.138 1.00 0.00 H new ATOM 0 HD3 PRO B 5 -10.407 -13.098 -0.611 1.00 0.00 H new ATOM 573 N HIS B 6 -6.202 -16.836 -0.643 1.00 0.00 N ATOM 574 CA HIS B 6 -4.733 -16.989 -0.613 1.00 0.00 C ATOM 575 C HIS B 6 -4.127 -16.901 -2.055 1.00 0.00 C ATOM 576 O HIS B 6 -4.355 -17.799 -2.875 1.00 0.00 O ATOM 577 CB HIS B 6 -4.397 -18.383 -0.004 1.00 0.00 C ATOM 578 CG HIS B 6 -4.708 -18.611 1.470 1.00 0.00 C ATOM 579 ND1 HIS B 6 -5.888 -19.177 1.928 1.00 0.00 N ATOM 580 CD2 HIS B 6 -3.846 -18.324 2.535 1.00 0.00 C ATOM 581 CE1 HIS B 6 -5.625 -19.176 3.274 1.00 0.00 C ATOM 582 NE2 HIS B 6 -4.420 -18.713 3.733 1.00 0.00 N ATOM 0 H HIS B 6 -6.704 -17.723 -0.618 1.00 0.00 H new ATOM 0 HA HIS B 6 -4.305 -16.186 -0.013 1.00 0.00 H new ATOM 0 HB2 HIS B 6 -4.934 -19.137 -0.579 1.00 0.00 H new ATOM 0 HB3 HIS B 6 -3.333 -18.565 -0.153 1.00 0.00 H new ATOM 0 HD2 HIS B 6 -2.873 -17.865 2.436 1.00 0.00 H new ATOM 0 HE1 HIS B 6 -6.366 -19.539 3.971 1.00 0.00 H new ATOM 0 HE2 HIS B 6 -4.052 -18.668 4.683 1.00 0.00 H new ATOM 583 N PHE B 7 -3.309 -15.882 -2.360 1.00 0.00 N ATOM 584 CA PHE B 7 -2.367 -15.946 -3.511 1.00 0.00 C ATOM 585 C PHE B 7 -0.898 -15.821 -3.001 1.00 0.00 C ATOM 586 O PHE B 7 -0.611 -15.137 -2.012 1.00 0.00 O ATOM 587 CB PHE B 7 -2.801 -14.958 -4.636 1.00 0.00 C ATOM 588 CG PHE B 7 -2.241 -13.523 -4.645 1.00 0.00 C ATOM 589 CD1 PHE B 7 -0.979 -13.274 -5.203 1.00 0.00 C ATOM 590 CD2 PHE B 7 -2.987 -12.441 -4.162 1.00 0.00 C ATOM 591 CE1 PHE B 7 -0.483 -11.989 -5.253 1.00 0.00 C ATOM 592 CE2 PHE B 7 -2.508 -11.146 -4.283 1.00 0.00 C ATOM 593 CZ PHE B 7 -1.258 -10.924 -4.859 1.00 0.00 C ATOM 0 H PHE B 7 -3.273 -15.007 -1.837 1.00 0.00 H new ATOM 0 HA PHE B 7 -2.406 -16.920 -3.998 1.00 0.00 H new ATOM 0 HB2 PHE B 7 -2.541 -15.416 -5.590 1.00 0.00 H new ATOM 0 HB3 PHE B 7 -3.888 -14.884 -4.604 1.00 0.00 H new ATOM 0 HD1 PHE B 7 -0.393 -14.092 -5.595 1.00 0.00 H new ATOM 0 HD2 PHE B 7 -3.943 -12.617 -3.692 1.00 0.00 H new ATOM 0 HE1 PHE B 7 0.524 -11.817 -5.605 1.00 0.00 H new ATOM 0 HE2 PHE B 7 -3.100 -10.313 -3.933 1.00 0.00 H new ATOM 0 HZ PHE B 7 -0.898 -9.915 -4.996 1.00 0.00 H new ATOM 594 N ASN B 8 0.064 -16.433 -3.707 1.00 0.00 N ATOM 595 CA ASN B 8 1.508 -16.214 -3.418 1.00 0.00 C ATOM 596 C ASN B 8 1.980 -14.770 -3.787 1.00 0.00 C ATOM 597 O ASN B 8 2.444 -14.521 -4.905 1.00 0.00 O ATOM 598 CB ASN B 8 2.352 -17.320 -4.108 1.00 0.00 C ATOM 599 CG ASN B 8 2.276 -18.695 -3.449 1.00 0.00 C ATOM 600 OD1 ASN B 8 1.488 -19.552 -3.825 1.00 0.00 O ATOM 601 ND2 ASN B 8 3.060 -18.940 -2.430 1.00 0.00 N ATOM 0 H ASN B 8 -0.118 -17.078 -4.476 1.00 0.00 H new ATOM 0 HA ASN B 8 1.661 -16.293 -2.342 1.00 0.00 H new ATOM 0 HB2 ASN B 8 2.026 -17.412 -5.144 1.00 0.00 H new ATOM 0 HB3 ASN B 8 3.394 -17.001 -4.129 1.00 0.00 H new ATOM 0 HD21 ASN B 8 3.012 -19.841 -1.954 1.00 0.00 H new ATOM 0 HD22 ASN B 8 3.719 -18.230 -2.111 1.00 0.00 H new ATOM 602 N PHE B 9 1.912 -13.824 -2.827 1.00 0.00 N ATOM 603 CA PHE B 9 2.800 -12.656 -2.838 1.00 0.00 C ATOM 604 C PHE B 9 4.216 -13.069 -2.319 1.00 0.00 C ATOM 605 O PHE B 9 4.479 -14.082 -1.676 1.00 0.00 O ATOM 606 CB PHE B 9 2.067 -11.474 -2.141 1.00 0.00 C ATOM 607 CG PHE B 9 2.518 -10.111 -2.674 1.00 0.00 C ATOM 608 CD1 PHE B 9 2.322 -9.779 -4.016 1.00 0.00 C ATOM 609 CD2 PHE B 9 3.083 -9.153 -1.837 1.00 0.00 C ATOM 610 CE1 PHE B 9 2.745 -8.561 -4.514 1.00 0.00 C ATOM 611 CE2 PHE B 9 3.559 -7.951 -2.332 1.00 0.00 C ATOM 612 CZ PHE B 9 3.313 -7.642 -3.653 1.00 0.00 C ATOM 0 H PHE B 9 1.257 -13.850 -2.045 1.00 0.00 H new ATOM 0 HA PHE B 9 3.016 -12.275 -3.836 1.00 0.00 H new ATOM 0 HB2 PHE B 9 0.992 -11.580 -2.287 1.00 0.00 H new ATOM 0 HB3 PHE B 9 2.249 -11.520 -1.067 1.00 0.00 H new ATOM 0 HD1 PHE B 9 1.834 -10.483 -4.673 1.00 0.00 H new ATOM 0 HD2 PHE B 9 3.152 -9.352 -0.778 1.00 0.00 H new ATOM 0 HE1 PHE B 9 2.633 -8.331 -5.563 1.00 0.00 H new ATOM 0 HE2 PHE B 9 4.110 -7.272 -1.699 1.00 0.00 H new ATOM 0 HZ PHE B 9 3.570 -6.660 -4.023 1.00 0.00 H new ATOM 613 N ARG B 10 5.178 -12.405 -2.903 1.00 0.00 N ATOM 614 CA ARG B 10 6.376 -13.050 -3.502 1.00 0.00 C ATOM 615 C ARG B 10 7.221 -11.921 -4.128 1.00 0.00 C ATOM 616 O ARG B 10 6.855 -11.373 -5.176 1.00 0.00 O ATOM 617 CB ARG B 10 5.995 -14.118 -4.570 1.00 0.00 C ATOM 618 CG ARG B 10 7.130 -15.026 -5.063 1.00 0.00 C ATOM 619 CD ARG B 10 8.260 -14.389 -5.892 1.00 0.00 C ATOM 620 NE ARG B 10 8.959 -15.396 -6.731 1.00 0.00 N ATOM 621 CZ ARG B 10 8.600 -15.774 -7.953 1.00 0.00 C ATOM 622 NH1 ARG B 10 7.549 -15.333 -8.579 1.00 0.00 N ATOM 623 NH2 ARG B 10 9.348 -16.631 -8.550 1.00 0.00 N ATOM 0 H ARG B 10 5.177 -11.389 -2.991 1.00 0.00 H new ATOM 0 HA ARG B 10 6.936 -13.585 -2.735 1.00 0.00 H new ATOM 0 HB2 ARG B 10 5.208 -14.749 -4.157 1.00 0.00 H new ATOM 0 HB3 ARG B 10 5.571 -13.603 -5.432 1.00 0.00 H new ATOM 0 HG2 ARG B 10 7.582 -15.498 -4.191 1.00 0.00 H new ATOM 0 HG3 ARG B 10 6.685 -15.821 -5.661 1.00 0.00 H new ATOM 0 HD2 ARG B 10 7.848 -13.607 -6.530 1.00 0.00 H new ATOM 0 HD3 ARG B 10 8.977 -13.911 -5.224 1.00 0.00 H new ATOM 0 HE ARG B 10 9.789 -15.837 -6.333 1.00 0.00 H new ATOM 0 HH11 ARG B 10 6.938 -14.651 -8.131 1.00 0.00 H new ATOM 0 HH12 ARG B 10 7.336 -15.670 -9.518 1.00 0.00 H new ATOM 0 HH21 ARG B 10 10.180 -16.993 -8.085 1.00 0.00 H new ATOM 0 HH22 ARG B 10 9.110 -16.949 -9.489 1.00 0.00 H new ATOM 624 N MET B 11 8.303 -11.512 -3.467 1.00 0.00 N ATOM 625 CA MET B 11 8.815 -10.127 -3.677 1.00 0.00 C ATOM 626 C MET B 11 10.357 -10.058 -3.918 1.00 0.00 C ATOM 627 O MET B 11 11.086 -10.689 -3.143 1.00 0.00 O ATOM 628 CB MET B 11 8.385 -9.165 -2.536 1.00 0.00 C ATOM 629 CG MET B 11 6.963 -9.236 -1.938 1.00 0.00 C ATOM 630 SD MET B 11 6.828 -10.664 -0.842 1.00 0.00 S ATOM 631 CE MET B 11 5.299 -10.271 0.015 1.00 0.00 C ATOM 0 H MET B 11 8.834 -12.079 -2.806 1.00 0.00 H new ATOM 0 HA MET B 11 8.345 -9.788 -4.600 1.00 0.00 H new ATOM 0 HB2 MET B 11 9.086 -9.309 -1.714 1.00 0.00 H new ATOM 0 HB3 MET B 11 8.528 -8.149 -2.903 1.00 0.00 H new ATOM 0 HG2 MET B 11 6.745 -8.321 -1.387 1.00 0.00 H new ATOM 0 HG3 MET B 11 6.226 -9.309 -2.738 1.00 0.00 H new ATOM 0 HE1 MET B 11 5.424 -10.449 1.083 1.00 0.00 H new ATOM 0 HE2 MET B 11 5.048 -9.223 -0.151 1.00 0.00 H new ATOM 0 HE3 MET B 11 4.496 -10.901 -0.366 1.00 0.00 H new ATOM 632 N PRO B 12 10.922 -9.265 -4.888 1.00 0.00 N ATOM 633 CA PRO B 12 12.387 -9.013 -4.948 1.00 0.00 C ATOM 634 C PRO B 12 12.973 -8.343 -3.661 1.00 0.00 C ATOM 635 O PRO B 12 12.260 -7.749 -2.839 1.00 0.00 O ATOM 636 CB PRO B 12 12.537 -8.215 -6.257 1.00 0.00 C ATOM 637 CG PRO B 12 11.192 -7.523 -6.483 1.00 0.00 C ATOM 638 CD PRO B 12 10.155 -8.457 -5.860 1.00 0.00 C ATOM 0 HA PRO B 12 12.987 -9.923 -4.963 1.00 0.00 H new ATOM 0 HB2 PRO B 12 13.343 -7.486 -6.179 1.00 0.00 H new ATOM 0 HB3 PRO B 12 12.782 -8.874 -7.090 1.00 0.00 H new ATOM 0 HG2 PRO B 12 11.170 -6.540 -6.013 1.00 0.00 H new ATOM 0 HG3 PRO B 12 10.999 -7.372 -7.545 1.00 0.00 H new ATOM 0 HD2 PRO B 12 9.359 -7.896 -5.370 1.00 0.00 H new ATOM 0 HD3 PRO B 12 9.683 -9.086 -6.615 1.00 0.00 H new ATOM 639 N MET B 13 14.271 -8.571 -3.420 1.00 0.00 N ATOM 640 CA MET B 13 14.777 -8.673 -2.025 1.00 0.00 C ATOM 641 C MET B 13 14.636 -7.432 -1.094 1.00 0.00 C ATOM 642 O MET B 13 14.289 -7.589 0.077 1.00 0.00 O ATOM 643 CB MET B 13 16.208 -9.264 -2.064 1.00 0.00 C ATOM 644 CG MET B 13 16.811 -9.684 -0.704 1.00 0.00 C ATOM 645 SD MET B 13 15.618 -10.244 0.548 1.00 0.00 S ATOM 646 CE MET B 13 14.633 -11.539 -0.227 1.00 0.00 C ATOM 0 H MET B 13 14.981 -8.687 -4.143 1.00 0.00 H new ATOM 0 HA MET B 13 14.089 -9.348 -1.515 1.00 0.00 H new ATOM 0 HB2 MET B 13 16.201 -10.135 -2.719 1.00 0.00 H new ATOM 0 HB3 MET B 13 16.870 -8.528 -2.520 1.00 0.00 H new ATOM 0 HG2 MET B 13 17.530 -10.485 -0.878 1.00 0.00 H new ATOM 0 HG3 MET B 13 17.367 -8.839 -0.297 1.00 0.00 H new ATOM 0 HE1 MET B 13 13.605 -11.194 -0.343 1.00 0.00 H new ATOM 0 HE2 MET B 13 15.049 -11.776 -1.206 1.00 0.00 H new ATOM 0 HE3 MET B 13 14.648 -12.431 0.399 1.00 0.00 H new ATOM 647 N GLU B 14 14.811 -6.213 -1.616 1.00 0.00 N ATOM 648 CA GLU B 14 14.426 -4.981 -0.884 1.00 0.00 C ATOM 649 C GLU B 14 12.908 -4.824 -0.534 1.00 0.00 C ATOM 650 O GLU B 14 12.635 -4.421 0.584 1.00 0.00 O ATOM 651 CB GLU B 14 15.068 -3.739 -1.563 1.00 0.00 C ATOM 652 CG GLU B 14 14.329 -3.196 -2.814 1.00 0.00 C ATOM 653 CD GLU B 14 14.998 -1.997 -3.474 1.00 0.00 C ATOM 654 OE1 GLU B 14 15.902 -2.103 -4.297 1.00 0.00 O ATOM 655 OE2 GLU B 14 14.472 -0.811 -3.053 1.00 0.00 O ATOM 0 H GLU B 14 15.214 -6.044 -2.538 1.00 0.00 H new ATOM 0 HA GLU B 14 14.847 -5.079 0.117 1.00 0.00 H new ATOM 0 HB2 GLU B 14 15.132 -2.938 -0.826 1.00 0.00 H new ATOM 0 HB3 GLU B 14 16.089 -3.992 -1.849 1.00 0.00 H new ATOM 0 HG2 GLU B 14 14.245 -3.998 -3.547 1.00 0.00 H new ATOM 0 HG3 GLU B 14 13.314 -2.918 -2.529 1.00 0.00 H new ATOM 656 N VAL B 15 11.916 -5.150 -1.384 1.00 0.00 N ATOM 657 CA VAL B 15 10.472 -5.165 -0.976 1.00 0.00 C ATOM 658 C VAL B 15 10.195 -6.211 0.119 1.00 0.00 C ATOM 659 O VAL B 15 9.537 -5.842 1.080 1.00 0.00 O ATOM 660 CB VAL B 15 9.463 -5.424 -2.148 1.00 0.00 C ATOM 661 CG1 VAL B 15 8.203 -4.552 -2.030 1.00 0.00 C ATOM 662 CG2 VAL B 15 9.989 -5.308 -3.593 1.00 0.00 C ATOM 0 H VAL B 15 12.073 -5.408 -2.358 1.00 0.00 H new ATOM 0 HA VAL B 15 10.304 -4.155 -0.603 1.00 0.00 H new ATOM 0 HB VAL B 15 9.247 -6.482 -2.000 1.00 0.00 H new ATOM 0 HG11 VAL B 15 7.533 -4.766 -2.863 1.00 0.00 H new ATOM 0 HG12 VAL B 15 7.695 -4.772 -1.091 1.00 0.00 H new ATOM 0 HG13 VAL B 15 8.486 -3.499 -2.052 1.00 0.00 H new ATOM 0 HG21 VAL B 15 9.179 -5.514 -4.293 1.00 0.00 H new ATOM 0 HG22 VAL B 15 10.368 -4.300 -3.763 1.00 0.00 H new ATOM 0 HG23 VAL B 15 10.793 -6.028 -3.747 1.00 0.00 H new ATOM 663 N ARG B 16 10.620 -7.485 0.006 1.00 0.00 N ATOM 664 CA ARG B 16 10.414 -8.415 1.135 1.00 0.00 C ATOM 665 C ARG B 16 11.277 -8.158 2.390 1.00 0.00 C ATOM 666 O ARG B 16 10.715 -8.278 3.468 1.00 0.00 O ATOM 667 CB ARG B 16 10.391 -9.909 0.775 1.00 0.00 C ATOM 668 CG ARG B 16 9.269 -10.586 1.602 1.00 0.00 C ATOM 669 CD ARG B 16 9.529 -12.056 1.751 1.00 0.00 C ATOM 670 NE ARG B 16 8.524 -12.676 2.643 1.00 0.00 N ATOM 671 CZ ARG B 16 8.490 -13.972 2.942 1.00 0.00 C ATOM 672 NH1 ARG B 16 9.211 -14.880 2.357 1.00 0.00 N ATOM 673 NH2 ARG B 16 7.698 -14.354 3.877 1.00 0.00 N ATOM 0 H ARG B 16 11.085 -7.880 -0.811 1.00 0.00 H new ATOM 0 HA ARG B 16 9.393 -8.152 1.413 1.00 0.00 H new ATOM 0 HB2 ARG B 16 10.210 -10.041 -0.292 1.00 0.00 H new ATOM 0 HB3 ARG B 16 11.355 -10.368 0.994 1.00 0.00 H new ATOM 0 HG2 ARG B 16 9.206 -10.122 2.586 1.00 0.00 H new ATOM 0 HG3 ARG B 16 8.307 -10.430 1.114 1.00 0.00 H new ATOM 0 HD2 ARG B 16 9.501 -12.537 0.773 1.00 0.00 H new ATOM 0 HD3 ARG B 16 10.529 -12.215 2.155 1.00 0.00 H new ATOM 0 HE ARG B 16 7.813 -12.072 3.054 1.00 0.00 H new ATOM 0 HH11 ARG B 16 9.858 -14.617 1.614 1.00 0.00 H new ATOM 0 HH12 ARG B 16 9.130 -15.856 2.641 1.00 0.00 H new ATOM 0 HH21 ARG B 16 7.119 -13.671 4.366 1.00 0.00 H new ATOM 0 HH22 ARG B 16 7.647 -15.341 4.131 1.00 0.00 H new ATOM 674 N GLU B 17 12.549 -7.743 2.341 1.00 0.00 N ATOM 675 CA GLU B 17 13.181 -7.172 3.565 1.00 0.00 C ATOM 676 C GLU B 17 12.511 -5.857 4.079 1.00 0.00 C ATOM 677 O GLU B 17 12.342 -5.731 5.282 1.00 0.00 O ATOM 678 CB GLU B 17 14.696 -6.965 3.388 1.00 0.00 C ATOM 679 CG GLU B 17 15.544 -8.255 3.466 1.00 0.00 C ATOM 680 CD GLU B 17 17.044 -8.031 3.326 1.00 0.00 C ATOM 681 OE1 GLU B 17 17.590 -7.532 4.470 1.00 0.00 O ATOM 682 OE2 GLU B 17 17.674 -8.275 2.303 1.00 0.00 O ATOM 0 H GLU B 17 13.147 -7.782 1.516 1.00 0.00 H new ATOM 0 HA GLU B 17 13.014 -7.925 4.335 1.00 0.00 H new ATOM 0 HB2 GLU B 17 14.872 -6.490 2.423 1.00 0.00 H new ATOM 0 HB3 GLU B 17 15.045 -6.272 4.153 1.00 0.00 H new ATOM 0 HG2 GLU B 17 15.350 -8.746 4.420 1.00 0.00 H new ATOM 0 HG3 GLU B 17 15.216 -8.939 2.683 1.00 0.00 H new ATOM 683 N LYS B 18 12.077 -4.908 3.239 1.00 0.00 N ATOM 684 CA LYS B 18 11.256 -3.756 3.690 1.00 0.00 C ATOM 685 C LYS B 18 9.839 -4.119 4.240 1.00 0.00 C ATOM 686 O LYS B 18 9.515 -3.680 5.335 1.00 0.00 O ATOM 687 CB LYS B 18 11.286 -2.623 2.653 1.00 0.00 C ATOM 688 CG LYS B 18 12.637 -1.919 2.347 1.00 0.00 C ATOM 689 CD LYS B 18 12.570 -0.845 1.232 1.00 0.00 C ATOM 690 CE LYS B 18 12.281 -1.353 -0.185 1.00 0.00 C ATOM 691 NZ LYS B 18 12.202 -0.214 -1.119 1.00 0.00 N ATOM 0 H LYS B 18 12.277 -4.908 2.239 1.00 0.00 H new ATOM 0 HA LYS B 18 11.735 -3.368 4.589 1.00 0.00 H new ATOM 0 HB2 LYS B 18 10.904 -3.025 1.715 1.00 0.00 H new ATOM 0 HB3 LYS B 18 10.583 -1.858 2.981 1.00 0.00 H new ATOM 0 HG2 LYS B 18 13.003 -1.452 3.261 1.00 0.00 H new ATOM 0 HG3 LYS B 18 13.368 -2.675 2.061 1.00 0.00 H new ATOM 0 HD2 LYS B 18 11.800 -0.122 1.500 1.00 0.00 H new ATOM 0 HD3 LYS B 18 13.519 -0.309 1.216 1.00 0.00 H new ATOM 0 HE2 LYS B 18 13.065 -2.041 -0.501 1.00 0.00 H new ATOM 0 HE3 LYS B 18 11.344 -1.910 -0.197 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 11.261 -0.192 -1.561 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 12.361 0.673 -0.599 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 12.928 -0.318 -1.856 1.00 0.00 H new ATOM 692 N LEU B 19 9.025 -4.930 3.553 1.00 0.00 N ATOM 693 CA LEU B 19 7.715 -5.446 4.038 1.00 0.00 C ATOM 694 C LEU B 19 7.817 -6.415 5.267 1.00 0.00 C ATOM 695 O LEU B 19 7.017 -6.317 6.201 1.00 0.00 O ATOM 696 CB LEU B 19 6.997 -5.942 2.743 1.00 0.00 C ATOM 697 CG LEU B 19 5.456 -5.985 2.665 1.00 0.00 C ATOM 698 CD1 LEU B 19 4.728 -4.648 2.846 1.00 0.00 C ATOM 699 CD2 LEU B 19 5.114 -6.565 1.276 1.00 0.00 C ATOM 0 H LEU B 19 9.256 -5.262 2.616 1.00 0.00 H new ATOM 0 HA LEU B 19 7.092 -4.689 4.515 1.00 0.00 H new ATOM 0 HB2 LEU B 19 7.342 -5.312 1.923 1.00 0.00 H new ATOM 0 HB3 LEU B 19 7.357 -6.951 2.543 1.00 0.00 H new ATOM 0 HG LEU B 19 5.109 -6.587 3.505 1.00 0.00 H new ATOM 0 HD11 LEU B 19 3.652 -4.806 2.771 1.00 0.00 H new ATOM 0 HD12 LEU B 19 4.966 -4.234 3.826 1.00 0.00 H new ATOM 0 HD13 LEU B 19 5.047 -3.952 2.070 1.00 0.00 H new ATOM 0 HD21 LEU B 19 4.031 -6.620 1.161 1.00 0.00 H new ATOM 0 HD22 LEU B 19 5.529 -5.921 0.501 1.00 0.00 H new ATOM 0 HD23 LEU B 19 5.540 -7.564 1.184 1.00 0.00 H new ATOM 700 N LYS B 20 8.825 -7.306 5.291 1.00 0.00 N ATOM 701 CA LYS B 20 9.072 -8.277 6.364 1.00 0.00 C ATOM 702 C LYS B 20 9.895 -7.716 7.561 1.00 0.00 C ATOM 703 O LYS B 20 9.634 -8.144 8.678 1.00 0.00 O ATOM 704 CB LYS B 20 9.714 -9.560 5.802 1.00 0.00 C ATOM 705 CG LYS B 20 9.538 -10.818 6.673 1.00 0.00 C ATOM 706 CD LYS B 20 10.167 -12.112 6.112 1.00 0.00 C ATOM 707 CE LYS B 20 11.437 -11.960 5.260 1.00 0.00 C ATOM 708 NZ LYS B 20 11.945 -13.298 4.898 1.00 0.00 N ATOM 0 H LYS B 20 9.510 -7.369 4.538 1.00 0.00 H new ATOM 0 HA LYS B 20 8.092 -8.515 6.777 1.00 0.00 H new ATOM 0 HB2 LYS B 20 9.291 -9.757 4.817 1.00 0.00 H new ATOM 0 HB3 LYS B 20 10.780 -9.382 5.661 1.00 0.00 H new ATOM 0 HG2 LYS B 20 9.969 -10.622 7.655 1.00 0.00 H new ATOM 0 HG3 LYS B 20 8.472 -10.989 6.822 1.00 0.00 H new ATOM 0 HD2 LYS B 20 10.399 -12.767 6.952 1.00 0.00 H new ATOM 0 HD3 LYS B 20 9.414 -12.621 5.510 1.00 0.00 H new ATOM 0 HE2 LYS B 20 11.218 -11.386 4.360 1.00 0.00 H new ATOM 0 HE3 LYS B 20 12.196 -11.408 5.814 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 12.805 -13.199 4.321 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 12.168 -13.830 5.763 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 11.221 -13.809 4.354 1.00 0.00 H new ATOM 709 N PHE B 21 10.832 -6.753 7.390 1.00 0.00 N ATOM 710 CA PHE B 21 11.230 -5.826 8.486 1.00 0.00 C ATOM 711 C PHE B 21 10.037 -5.004 8.951 1.00 0.00 C ATOM 712 O PHE B 21 9.580 -5.409 9.994 1.00 0.00 O ATOM 713 CB PHE B 21 12.428 -4.894 8.186 1.00 0.00 C ATOM 714 CG PHE B 21 13.788 -5.544 8.005 1.00 0.00 C ATOM 715 CD1 PHE B 21 14.166 -6.716 8.665 1.00 0.00 C ATOM 716 CD2 PHE B 21 14.674 -4.929 7.127 1.00 0.00 C ATOM 717 CE1 PHE B 21 15.388 -7.303 8.388 1.00 0.00 C ATOM 718 CE2 PHE B 21 15.901 -5.508 6.854 1.00 0.00 C ATOM 719 CZ PHE B 21 16.268 -6.702 7.483 1.00 0.00 C ATOM 0 H PHE B 21 11.326 -6.595 6.511 1.00 0.00 H new ATOM 0 HA PHE B 21 11.582 -6.487 9.278 1.00 0.00 H new ATOM 0 HB2 PHE B 21 12.200 -4.332 7.280 1.00 0.00 H new ATOM 0 HB3 PHE B 21 12.505 -4.172 8.999 1.00 0.00 H new ATOM 0 HD1 PHE B 21 13.504 -7.164 9.392 1.00 0.00 H new ATOM 0 HD2 PHE B 21 14.403 -3.995 6.656 1.00 0.00 H new ATOM 0 HE1 PHE B 21 15.663 -8.228 8.872 1.00 0.00 H new ATOM 0 HE2 PHE B 21 16.576 -5.037 6.154 1.00 0.00 H new ATOM 0 HZ PHE B 21 17.224 -7.157 7.271 1.00 0.00 H new ATOM 720 N ARG B 22 9.470 -3.980 8.296 1.00 0.00 N ATOM 721 CA ARG B 22 8.155 -3.368 8.690 1.00 0.00 C ATOM 722 C ARG B 22 7.236 -4.219 9.663 1.00 0.00 C ATOM 723 O ARG B 22 7.178 -3.911 10.853 1.00 0.00 O ATOM 724 CB ARG B 22 7.570 -2.860 7.345 1.00 0.00 C ATOM 725 CG ARG B 22 6.299 -1.993 7.422 1.00 0.00 C ATOM 726 CD ARG B 22 6.394 -0.710 6.597 1.00 0.00 C ATOM 727 NE ARG B 22 5.229 0.135 6.934 1.00 0.00 N ATOM 728 CZ ARG B 22 4.926 1.275 6.344 1.00 0.00 C ATOM 729 NH1 ARG B 22 5.531 1.740 5.292 1.00 0.00 N ATOM 730 NH2 ARG B 22 3.977 1.963 6.863 1.00 0.00 N ATOM 0 H ARG B 22 9.894 -3.541 7.479 1.00 0.00 H new ATOM 0 HA ARG B 22 8.265 -2.536 9.385 1.00 0.00 H new ATOM 0 HB2 ARG B 22 8.343 -2.285 6.834 1.00 0.00 H new ATOM 0 HB3 ARG B 22 7.352 -3.727 6.721 1.00 0.00 H new ATOM 0 HG2 ARG B 22 5.447 -2.578 7.076 1.00 0.00 H new ATOM 0 HG3 ARG B 22 6.106 -1.734 8.463 1.00 0.00 H new ATOM 0 HD2 ARG B 22 7.323 -0.184 6.816 1.00 0.00 H new ATOM 0 HD3 ARG B 22 6.402 -0.941 5.532 1.00 0.00 H new ATOM 0 HE ARG B 22 4.612 -0.188 7.680 1.00 0.00 H new ATOM 0 HH11 ARG B 22 6.295 1.214 4.869 1.00 0.00 H new ATOM 0 HH12 ARG B 22 5.241 2.631 4.889 1.00 0.00 H new ATOM 0 HH21 ARG B 22 3.495 1.621 7.694 1.00 0.00 H new ATOM 0 HH22 ARG B 22 3.704 2.852 6.445 1.00 0.00 H new ATOM 731 N ALA B 23 6.874 -5.448 9.246 1.00 0.00 N ATOM 732 CA ALA B 23 6.461 -6.555 10.150 1.00 0.00 C ATOM 733 C ALA B 23 7.359 -7.031 11.364 1.00 0.00 C ATOM 734 O ALA B 23 6.979 -6.811 12.512 1.00 0.00 O ATOM 735 CB ALA B 23 6.160 -7.689 9.153 1.00 0.00 C ATOM 0 H ALA B 23 6.858 -5.710 8.260 1.00 0.00 H new ATOM 0 HA ALA B 23 5.642 -6.185 10.766 1.00 0.00 H new ATOM 0 HB1 ALA B 23 5.840 -8.577 9.698 1.00 0.00 H new ATOM 0 HB2 ALA B 23 5.368 -7.375 8.473 1.00 0.00 H new ATOM 0 HB3 ALA B 23 7.059 -7.919 8.581 1.00 0.00 H new ATOM 736 N GLU B 24 8.492 -7.720 11.138 1.00 0.00 N ATOM 737 CA GLU B 24 9.461 -8.175 12.196 1.00 0.00 C ATOM 738 C GLU B 24 10.268 -7.079 12.983 1.00 0.00 C ATOM 739 O GLU B 24 10.482 -7.215 14.188 1.00 0.00 O ATOM 740 CB GLU B 24 10.463 -9.200 11.585 1.00 0.00 C ATOM 741 CG GLU B 24 9.862 -10.494 10.979 1.00 0.00 C ATOM 742 CD GLU B 24 10.913 -11.493 10.499 1.00 0.00 C ATOM 743 OE1 GLU B 24 11.655 -11.306 9.541 1.00 0.00 O ATOM 744 OE2 GLU B 24 10.935 -12.624 11.253 1.00 0.00 O ATOM 0 H GLU B 24 8.782 -7.991 10.198 1.00 0.00 H new ATOM 0 HA GLU B 24 8.808 -8.610 12.953 1.00 0.00 H new ATOM 0 HB2 GLU B 24 11.033 -8.694 10.806 1.00 0.00 H new ATOM 0 HB3 GLU B 24 11.171 -9.487 12.363 1.00 0.00 H new ATOM 0 HG2 GLU B 24 9.231 -10.975 11.726 1.00 0.00 H new ATOM 0 HG3 GLU B 24 9.218 -10.227 10.141 1.00 0.00 H new ATOM 745 N ALA B 25 10.709 -6.011 12.302 1.00 0.00 N ATOM 746 CA ALA B 25 11.017 -4.686 12.900 1.00 0.00 C ATOM 747 C ALA B 25 10.045 -4.185 14.048 1.00 0.00 C ATOM 748 O ALA B 25 10.514 -3.718 15.087 1.00 0.00 O ATOM 749 CB ALA B 25 10.948 -3.645 11.756 1.00 0.00 C ATOM 0 H ALA B 25 10.868 -6.036 11.295 1.00 0.00 H new ATOM 0 HA ALA B 25 11.994 -4.795 13.371 1.00 0.00 H new ATOM 0 HB1 ALA B 25 11.169 -2.654 12.152 1.00 0.00 H new ATOM 0 HB2 ALA B 25 11.678 -3.900 10.988 1.00 0.00 H new ATOM 0 HB3 ALA B 25 9.948 -3.648 11.321 1.00 0.00 H new ATOM 750 N ASN B 26 8.705 -4.254 13.821 1.00 0.00 N ATOM 751 CA ASN B 26 7.674 -3.697 14.750 1.00 0.00 C ATOM 752 C ASN B 26 6.936 -4.729 15.688 1.00 0.00 C ATOM 753 O ASN B 26 6.731 -4.460 16.874 1.00 0.00 O ATOM 754 CB ASN B 26 6.753 -2.807 13.849 1.00 0.00 C ATOM 755 CG ASN B 26 5.292 -3.187 13.615 1.00 0.00 C ATOM 756 OD1 ASN B 26 4.383 -2.967 14.404 1.00 0.00 O ATOM 757 ND2 ASN B 26 5.035 -3.793 12.503 1.00 0.00 N ATOM 0 H ASN B 26 8.307 -4.695 12.992 1.00 0.00 H new ATOM 0 HA ASN B 26 8.149 -3.103 15.531 1.00 0.00 H new ATOM 0 HB2 ASN B 26 6.760 -1.804 14.275 1.00 0.00 H new ATOM 0 HB3 ASN B 26 7.228 -2.741 12.870 1.00 0.00 H new ATOM 0 HD21 ASN B 26 4.081 -4.084 12.289 1.00 0.00 H new ATOM 0 HD22 ASN B 26 5.786 -3.981 11.839 1.00 0.00 H new ATOM 758 N GLY B 27 6.451 -5.847 15.123 1.00 0.00 N ATOM 759 CA GLY B 27 5.353 -6.671 15.713 1.00 0.00 C ATOM 760 C GLY B 27 4.035 -6.817 14.895 1.00 0.00 C ATOM 761 O GLY B 27 2.960 -6.854 15.495 1.00 0.00 O ATOM 0 H GLY B 27 6.803 -6.217 14.240 1.00 0.00 H new ATOM 0 HA2 GLY B 27 5.746 -7.671 15.896 1.00 0.00 H new ATOM 0 HA3 GLY B 27 5.099 -6.245 16.684 1.00 0.00 H new ATOM 762 N ARG B 28 4.087 -6.965 13.559 1.00 0.00 N ATOM 763 CA ARG B 28 2.887 -7.222 12.710 1.00 0.00 C ATOM 764 C ARG B 28 3.312 -8.288 11.682 1.00 0.00 C ATOM 765 O ARG B 28 3.817 -7.948 10.627 1.00 0.00 O ATOM 766 CB ARG B 28 2.396 -5.916 12.020 1.00 0.00 C ATOM 767 CG ARG B 28 1.669 -4.845 12.853 1.00 0.00 C ATOM 768 CD ARG B 28 1.528 -3.495 12.090 1.00 0.00 C ATOM 769 NE ARG B 28 0.220 -2.803 12.167 1.00 0.00 N ATOM 770 CZ ARG B 28 -0.421 -2.464 13.293 1.00 0.00 C ATOM 771 NH1 ARG B 28 -0.028 -2.780 14.491 1.00 0.00 N ATOM 772 NH2 ARG B 28 -1.482 -1.748 13.200 1.00 0.00 N ATOM 0 H ARG B 28 4.956 -6.912 13.028 1.00 0.00 H new ATOM 0 HA ARG B 28 2.045 -7.574 13.306 1.00 0.00 H new ATOM 0 HB2 ARG B 28 3.265 -5.441 11.564 1.00 0.00 H new ATOM 0 HB3 ARG B 28 1.729 -6.206 11.208 1.00 0.00 H new ATOM 0 HG2 ARG B 28 0.679 -5.211 13.125 1.00 0.00 H new ATOM 0 HG3 ARG B 28 2.214 -4.679 13.782 1.00 0.00 H new ATOM 0 HD2 ARG B 28 2.292 -2.814 12.465 1.00 0.00 H new ATOM 0 HD3 ARG B 28 1.752 -3.677 11.039 1.00 0.00 H new ATOM 0 HE ARG B 28 -0.232 -2.564 11.285 1.00 0.00 H new ATOM 0 HH11 ARG B 28 0.825 -3.324 14.621 1.00 0.00 H new ATOM 0 HH12 ARG B 28 -0.572 -2.484 15.301 1.00 0.00 H new ATOM 0 HH21 ARG B 28 -1.818 -1.451 12.284 1.00 0.00 H new ATOM 0 HH22 ARG B 28 -1.989 -1.476 14.042 1.00 0.00 H new ATOM 773 N SER B 29 3.039 -9.581 11.851 1.00 0.00 N ATOM 774 CA SER B 29 3.786 -10.625 11.067 1.00 0.00 C ATOM 775 C SER B 29 3.227 -10.624 9.614 1.00 0.00 C ATOM 776 O SER B 29 2.011 -10.530 9.501 1.00 0.00 O ATOM 777 CB SER B 29 3.633 -11.981 11.783 1.00 0.00 C ATOM 778 OG SER B 29 4.413 -12.981 11.124 1.00 0.00 O ATOM 0 H SER B 29 2.336 -9.945 12.494 1.00 0.00 H new ATOM 0 HA SER B 29 4.855 -10.418 11.008 1.00 0.00 H new ATOM 0 HB2 SER B 29 3.950 -11.889 12.822 1.00 0.00 H new ATOM 0 HB3 SER B 29 2.584 -12.277 11.795 1.00 0.00 H new ATOM 0 HG SER B 29 4.308 -13.837 11.590 1.00 0.00 H new ATOM 779 N MET B 30 4.013 -10.520 8.524 1.00 0.00 N ATOM 780 CA MET B 30 3.561 -9.779 7.297 1.00 0.00 C ATOM 781 C MET B 30 2.122 -10.019 6.771 1.00 0.00 C ATOM 782 O MET B 30 1.467 -9.037 6.492 1.00 0.00 O ATOM 783 CB MET B 30 4.461 -10.053 6.085 1.00 0.00 C ATOM 784 CG MET B 30 5.877 -9.562 6.082 1.00 0.00 C ATOM 785 SD MET B 30 6.774 -10.457 4.796 1.00 0.00 S ATOM 786 CE MET B 30 6.787 -9.199 3.519 1.00 0.00 C ATOM 0 H MET B 30 4.946 -10.925 8.453 1.00 0.00 H new ATOM 0 HA MET B 30 3.611 -8.761 7.682 1.00 0.00 H new ATOM 0 HB2 MET B 30 4.491 -11.133 5.940 1.00 0.00 H new ATOM 0 HB3 MET B 30 3.968 -9.628 5.211 1.00 0.00 H new ATOM 0 HG2 MET B 30 5.908 -8.489 5.892 1.00 0.00 H new ATOM 0 HG3 MET B 30 6.340 -9.727 7.055 1.00 0.00 H new ATOM 0 HE1 MET B 30 6.739 -9.674 2.539 1.00 0.00 H new ATOM 0 HE2 MET B 30 5.926 -8.542 3.646 1.00 0.00 H new ATOM 0 HE3 MET B 30 7.704 -8.614 3.594 1.00 0.00 H new ATOM 787 N ASN B 31 1.523 -11.208 6.682 1.00 0.00 N ATOM 788 CA ASN B 31 0.044 -11.281 6.462 1.00 0.00 C ATOM 789 C ASN B 31 -0.842 -10.323 7.379 1.00 0.00 C ATOM 790 O ASN B 31 -1.673 -9.602 6.837 1.00 0.00 O ATOM 791 CB ASN B 31 -0.415 -12.761 6.433 1.00 0.00 C ATOM 792 CG ASN B 31 -1.552 -13.093 5.467 1.00 0.00 C ATOM 793 OD1 ASN B 31 -1.506 -14.087 4.760 1.00 0.00 O ATOM 794 ND2 ASN B 31 -2.563 -12.273 5.344 1.00 0.00 N ATOM 0 H ASN B 31 1.998 -12.108 6.753 1.00 0.00 H new ATOM 0 HA ASN B 31 -0.147 -10.853 5.478 1.00 0.00 H new ATOM 0 HB2 ASN B 31 0.444 -13.382 6.178 1.00 0.00 H new ATOM 0 HB3 ASN B 31 -0.726 -13.044 7.439 1.00 0.00 H new ATOM 0 HD21 ASN B 31 -3.298 -12.468 4.665 1.00 0.00 H new ATOM 0 HD22 ASN B 31 -2.616 -11.438 5.927 1.00 0.00 H new ATOM 795 N SER B 32 -0.520 -10.174 8.679 1.00 0.00 N ATOM 796 CA SER B 32 -0.747 -8.912 9.454 1.00 0.00 C ATOM 797 C SER B 32 -0.122 -7.567 8.936 1.00 0.00 C ATOM 798 O SER B 32 -0.920 -6.695 8.585 1.00 0.00 O ATOM 799 CB SER B 32 -0.522 -9.186 10.961 1.00 0.00 C ATOM 800 OG SER B 32 -0.649 -8.011 11.766 1.00 0.00 O ATOM 0 H SER B 32 -0.095 -10.918 9.232 1.00 0.00 H new ATOM 0 HA SER B 32 -1.792 -8.667 9.264 1.00 0.00 H new ATOM 0 HB2 SER B 32 -1.240 -9.932 11.301 1.00 0.00 H new ATOM 0 HB3 SER B 32 0.471 -9.612 11.103 1.00 0.00 H new ATOM 0 HG SER B 32 -0.499 -8.241 12.707 1.00 0.00 H new ATOM 801 N GLU B 33 1.212 -7.320 8.884 1.00 0.00 N ATOM 802 CA GLU B 33 1.716 -5.971 8.413 1.00 0.00 C ATOM 803 C GLU B 33 1.431 -5.657 6.927 1.00 0.00 C ATOM 804 O GLU B 33 0.891 -4.603 6.648 1.00 0.00 O ATOM 805 CB GLU B 33 3.237 -5.766 8.466 1.00 0.00 C ATOM 806 CG GLU B 33 3.799 -4.356 8.129 1.00 0.00 C ATOM 807 CD GLU B 33 3.347 -3.167 8.968 1.00 0.00 C ATOM 808 OE1 GLU B 33 2.107 -2.734 8.619 1.00 0.00 O ATOM 809 OE2 GLU B 33 4.033 -2.642 9.835 1.00 0.00 O ATOM 0 H GLU B 33 1.938 -7.988 9.144 1.00 0.00 H new ATOM 0 HA GLU B 33 1.175 -5.339 9.117 1.00 0.00 H new ATOM 0 HB2 GLU B 33 3.574 -6.028 9.469 1.00 0.00 H new ATOM 0 HB3 GLU B 33 3.694 -6.479 7.780 1.00 0.00 H new ATOM 0 HG2 GLU B 33 4.886 -4.410 8.191 1.00 0.00 H new ATOM 0 HG3 GLU B 33 3.550 -4.141 7.090 1.00 0.00 H new ATOM 810 N LEU B 34 1.872 -6.514 5.976 1.00 0.00 N ATOM 811 CA LEU B 34 1.434 -6.510 4.571 1.00 0.00 C ATOM 812 C LEU B 34 -0.075 -6.180 4.505 1.00 0.00 C ATOM 813 O LEU B 34 -0.372 -5.206 3.838 1.00 0.00 O ATOM 814 CB LEU B 34 1.812 -7.860 3.894 1.00 0.00 C ATOM 815 CG LEU B 34 2.307 -7.881 2.430 1.00 0.00 C ATOM 816 CD1 LEU B 34 2.082 -9.202 1.688 1.00 0.00 C ATOM 817 CD2 LEU B 34 1.710 -6.790 1.527 1.00 0.00 C ATOM 0 H LEU B 34 2.558 -7.242 6.175 1.00 0.00 H new ATOM 0 HA LEU B 34 1.950 -5.733 4.006 1.00 0.00 H new ATOM 0 HB2 LEU B 34 2.588 -8.322 4.505 1.00 0.00 H new ATOM 0 HB3 LEU B 34 0.936 -8.506 3.949 1.00 0.00 H new ATOM 0 HG LEU B 34 3.372 -7.708 2.585 1.00 0.00 H new ATOM 0 HD11 LEU B 34 2.462 -9.117 0.670 1.00 0.00 H new ATOM 0 HD12 LEU B 34 2.608 -10.004 2.206 1.00 0.00 H new ATOM 0 HD13 LEU B 34 1.016 -9.426 1.659 1.00 0.00 H new ATOM 0 HD21 LEU B 34 2.118 -6.887 0.521 1.00 0.00 H new ATOM 0 HD22 LEU B 34 0.626 -6.900 1.491 1.00 0.00 H new ATOM 0 HD23 LEU B 34 1.962 -5.808 1.927 1.00 0.00 H new ATOM 818 N LEU B 35 -1.032 -6.843 5.215 1.00 0.00 N ATOM 819 CA LEU B 35 -2.440 -6.373 5.159 1.00 0.00 C ATOM 820 C LEU B 35 -2.681 -4.957 5.700 1.00 0.00 C ATOM 821 O LEU B 35 -3.292 -4.148 5.020 1.00 0.00 O ATOM 822 CB LEU B 35 -3.457 -7.322 5.829 1.00 0.00 C ATOM 823 CG LEU B 35 -4.039 -8.437 4.949 1.00 0.00 C ATOM 824 CD1 LEU B 35 -5.195 -9.045 5.733 1.00 0.00 C ATOM 825 CD2 LEU B 35 -4.589 -7.865 3.623 1.00 0.00 C ATOM 0 H LEU B 35 -0.866 -7.661 5.802 1.00 0.00 H new ATOM 0 HA LEU B 35 -2.613 -6.362 4.083 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -2.975 -7.784 6.691 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -4.283 -6.722 6.210 1.00 0.00 H new ATOM 0 HG LEU B 35 -3.268 -9.168 4.708 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -5.648 -9.847 5.150 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -4.824 -9.446 6.676 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -5.942 -8.277 5.934 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -4.995 -8.675 3.018 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -5.376 -7.142 3.837 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -3.784 -7.373 3.077 1.00 0.00 H new ATOM 826 N GLN B 36 -2.244 -4.686 6.916 1.00 0.00 N ATOM 827 CA GLN B 36 -2.410 -3.357 7.542 1.00 0.00 C ATOM 828 C GLN B 36 -1.657 -2.161 6.836 1.00 0.00 C ATOM 829 O GLN B 36 -2.216 -1.068 6.777 1.00 0.00 O ATOM 830 CB GLN B 36 -2.155 -3.610 9.052 1.00 0.00 C ATOM 831 CG GLN B 36 -2.834 -2.594 10.006 1.00 0.00 C ATOM 832 CD GLN B 36 -2.365 -1.142 9.965 1.00 0.00 C ATOM 833 OE1 GLN B 36 -3.135 -0.201 10.097 1.00 0.00 O ATOM 834 NE2 GLN B 36 -1.090 -0.919 9.828 1.00 0.00 N ATOM 0 H GLN B 36 -1.765 -5.366 7.507 1.00 0.00 H new ATOM 0 HA GLN B 36 -3.412 -2.951 7.406 1.00 0.00 H new ATOM 0 HB2 GLN B 36 -2.505 -4.612 9.302 1.00 0.00 H new ATOM 0 HB3 GLN B 36 -1.080 -3.594 9.232 1.00 0.00 H new ATOM 0 HG2 GLN B 36 -3.904 -2.604 9.797 1.00 0.00 H new ATOM 0 HG3 GLN B 36 -2.705 -2.957 11.026 1.00 0.00 H new ATOM 0 HE21 GLN B 36 -0.444 -1.701 9.718 1.00 0.00 H new ATOM 0 HE22 GLN B 36 -0.736 0.038 9.831 1.00 0.00 H new ATOM 835 N ILE B 37 -0.476 -2.351 6.221 1.00 0.00 N ATOM 836 CA ILE B 37 0.097 -1.419 5.205 1.00 0.00 C ATOM 837 C ILE B 37 -0.623 -1.425 3.814 1.00 0.00 C ATOM 838 O ILE B 37 -0.493 -0.438 3.138 1.00 0.00 O ATOM 839 CB ILE B 37 1.636 -1.698 5.043 1.00 0.00 C ATOM 840 CG1 ILE B 37 2.565 -0.516 4.663 1.00 0.00 C ATOM 841 CG2 ILE B 37 1.917 -2.846 4.071 1.00 0.00 C ATOM 842 CD1 ILE B 37 2.730 -0.089 3.186 1.00 0.00 C ATOM 0 H ILE B 37 0.120 -3.157 6.409 1.00 0.00 H new ATOM 0 HA ILE B 37 -0.072 -0.414 5.592 1.00 0.00 H new ATOM 0 HB ILE B 37 1.895 -1.949 6.072 1.00 0.00 H new ATOM 0 HG12 ILE B 37 2.215 0.358 5.213 1.00 0.00 H new ATOM 0 HG13 ILE B 37 3.559 -0.754 5.042 1.00 0.00 H new ATOM 0 HG21 ILE B 37 2.993 -3.001 3.992 1.00 0.00 H new ATOM 0 HG22 ILE B 37 1.445 -3.757 4.438 1.00 0.00 H new ATOM 0 HG23 ILE B 37 1.513 -2.599 3.089 1.00 0.00 H new ATOM 0 HD11 ILE B 37 3.419 0.754 3.126 1.00 0.00 H new ATOM 0 HD12 ILE B 37 3.126 -0.924 2.608 1.00 0.00 H new ATOM 0 HD13 ILE B 37 1.761 0.205 2.782 1.00 0.00 H new ATOM 843 N VAL B 38 -1.215 -2.514 3.312 1.00 0.00 N ATOM 844 CA VAL B 38 -1.911 -2.624 1.983 1.00 0.00 C ATOM 845 C VAL B 38 -3.368 -2.042 2.023 1.00 0.00 C ATOM 846 O VAL B 38 -3.759 -1.226 1.189 1.00 0.00 O ATOM 847 CB VAL B 38 -1.936 -4.137 1.589 1.00 0.00 C ATOM 848 CG1 VAL B 38 -3.025 -4.757 0.695 1.00 0.00 C ATOM 849 CG2 VAL B 38 -0.574 -4.556 1.006 1.00 0.00 C ATOM 0 H VAL B 38 -1.234 -3.394 3.828 1.00 0.00 H new ATOM 0 HA VAL B 38 -1.369 -2.035 1.244 1.00 0.00 H new ATOM 0 HB VAL B 38 -2.203 -4.541 2.566 1.00 0.00 H new ATOM 0 HG11 VAL B 38 -2.827 -5.821 0.565 1.00 0.00 H new ATOM 0 HG12 VAL B 38 -4.000 -4.625 1.164 1.00 0.00 H new ATOM 0 HG13 VAL B 38 -3.021 -4.265 -0.278 1.00 0.00 H new ATOM 0 HG21 VAL B 38 -0.603 -5.611 0.735 1.00 0.00 H new ATOM 0 HG22 VAL B 38 -0.359 -3.960 0.119 1.00 0.00 H new ATOM 0 HG23 VAL B 38 0.206 -4.394 1.750 1.00 0.00 H new ATOM 850 N GLN B 39 -4.153 -2.458 3.042 1.00 0.00 N ATOM 851 CA GLN B 39 -5.227 -1.638 3.653 1.00 0.00 C ATOM 852 C GLN B 39 -4.793 -0.174 3.985 1.00 0.00 C ATOM 853 O GLN B 39 -5.538 0.722 3.603 1.00 0.00 O ATOM 854 CB GLN B 39 -5.763 -2.378 4.913 1.00 0.00 C ATOM 855 CG GLN B 39 -6.502 -3.720 4.652 1.00 0.00 C ATOM 856 CD GLN B 39 -7.021 -4.452 5.890 1.00 0.00 C ATOM 857 OE1 GLN B 39 -8.200 -4.747 6.032 1.00 0.00 O ATOM 858 NE2 GLN B 39 -6.166 -4.798 6.817 1.00 0.00 N ATOM 0 H GLN B 39 -4.059 -3.380 3.468 1.00 0.00 H new ATOM 0 HA GLN B 39 -6.022 -1.527 2.916 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -4.923 -2.572 5.580 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -6.442 -1.709 5.441 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -7.345 -3.524 3.990 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -5.825 -4.387 4.118 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -5.179 -4.560 6.715 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -6.486 -5.306 7.642 1.00 0.00 H new ATOM 859 N ASP B 40 -3.578 0.107 4.523 1.00 0.00 N ATOM 860 CA ASP B 40 -2.934 1.447 4.348 1.00 0.00 C ATOM 861 C ASP B 40 -2.843 1.970 2.893 1.00 0.00 C ATOM 862 O ASP B 40 -3.271 3.090 2.592 1.00 0.00 O ATOM 863 CB ASP B 40 -1.664 1.759 5.193 1.00 0.00 C ATOM 864 CG ASP B 40 -1.305 3.247 5.320 1.00 0.00 C ATOM 865 OD1 ASP B 40 -0.849 3.908 4.394 1.00 0.00 O ATOM 866 OD2 ASP B 40 -1.548 3.751 6.557 1.00 0.00 O ATOM 0 H ASP B 40 -3.030 -0.556 5.071 1.00 0.00 H new ATOM 0 HA ASP B 40 -3.697 2.060 4.828 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -1.805 1.350 6.194 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -0.817 1.235 4.751 1.00 0.00 H new ATOM 867 N ALA B 41 -2.243 1.164 2.022 1.00 0.00 N ATOM 868 CA ALA B 41 -1.575 1.674 0.821 1.00 0.00 C ATOM 869 C ALA B 41 -2.497 2.168 -0.325 1.00 0.00 C ATOM 870 O ALA B 41 -2.204 3.168 -0.980 1.00 0.00 O ATOM 871 CB ALA B 41 -0.481 0.645 0.449 1.00 0.00 C ATOM 0 H ALA B 41 -2.204 0.150 2.123 1.00 0.00 H new ATOM 0 HA ALA B 41 -1.102 2.631 1.041 1.00 0.00 H new ATOM 0 HB1 ALA B 41 0.047 0.982 -0.443 1.00 0.00 H new ATOM 0 HB2 ALA B 41 0.225 0.550 1.274 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -0.943 -0.323 0.254 1.00 0.00 H new ATOM 872 N LEU B 42 -3.652 1.525 -0.473 1.00 0.00 N ATOM 873 CA LEU B 42 -4.838 2.141 -1.127 1.00 0.00 C ATOM 874 C LEU B 42 -6.025 2.618 -0.231 1.00 0.00 C ATOM 875 O LEU B 42 -6.879 3.328 -0.770 1.00 0.00 O ATOM 876 CB LEU B 42 -5.281 1.237 -2.317 1.00 0.00 C ATOM 877 CG LEU B 42 -5.415 -0.294 -2.088 1.00 0.00 C ATOM 878 CD1 LEU B 42 -6.371 -0.659 -0.952 1.00 0.00 C ATOM 879 CD2 LEU B 42 -5.863 -0.984 -3.381 1.00 0.00 C ATOM 0 H LEU B 42 -3.808 0.570 -0.151 1.00 0.00 H new ATOM 0 HA LEU B 42 -4.490 3.112 -1.479 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -6.246 1.603 -2.668 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -4.569 1.388 -3.128 1.00 0.00 H new ATOM 0 HG LEU B 42 -4.427 -0.646 -1.793 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -6.416 -1.743 -0.848 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -6.014 -0.220 -0.021 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -7.366 -0.274 -1.176 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -5.954 -2.056 -3.209 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -6.828 -0.584 -3.691 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -5.126 -0.803 -4.164 1.00 0.00 H new ATOM 880 N SER B 43 -6.118 2.325 1.085 1.00 0.00 N ATOM 881 CA SER B 43 -7.336 2.688 1.875 1.00 0.00 C ATOM 882 C SER B 43 -7.207 3.227 3.339 1.00 0.00 C ATOM 883 O SER B 43 -8.285 3.378 3.928 1.00 0.00 O ATOM 884 CB SER B 43 -8.320 1.487 1.779 1.00 0.00 C ATOM 885 OG SER B 43 -7.890 0.363 2.551 1.00 0.00 O ATOM 0 H SER B 43 -5.390 1.851 1.620 1.00 0.00 H new ATOM 0 HA SER B 43 -7.696 3.602 1.403 1.00 0.00 H new ATOM 0 HB2 SER B 43 -9.306 1.802 2.120 1.00 0.00 H new ATOM 0 HB3 SER B 43 -8.423 1.189 0.736 1.00 0.00 H new ATOM 0 HG SER B 43 -7.039 0.574 2.990 1.00 0.00 H new ATOM 886 N LYS B 44 -6.038 3.534 3.987 1.00 0.00 N ATOM 887 CA LYS B 44 -6.125 3.923 5.464 1.00 0.00 C ATOM 888 C LYS B 44 -6.900 5.276 5.751 1.00 0.00 C ATOM 889 O LYS B 44 -6.734 6.201 4.948 1.00 0.00 O ATOM 890 CB LYS B 44 -4.847 3.791 6.352 1.00 0.00 C ATOM 891 CG LYS B 44 -4.760 2.484 7.217 1.00 0.00 C ATOM 892 CD LYS B 44 -4.542 2.657 8.734 1.00 0.00 C ATOM 893 CE LYS B 44 -3.103 2.997 9.137 1.00 0.00 C ATOM 894 NZ LYS B 44 -2.998 3.015 10.607 1.00 0.00 N ATOM 0 H LYS B 44 -5.105 3.528 3.575 1.00 0.00 H new ATOM 0 HA LYS B 44 -6.745 3.097 5.811 1.00 0.00 H new ATOM 0 HB2 LYS B 44 -3.970 3.838 5.706 1.00 0.00 H new ATOM 0 HB3 LYS B 44 -4.798 4.652 7.019 1.00 0.00 H new ATOM 0 HG2 LYS B 44 -5.681 1.920 7.070 1.00 0.00 H new ATOM 0 HG3 LYS B 44 -3.946 1.873 6.826 1.00 0.00 H new ATOM 0 HD2 LYS B 44 -5.202 3.445 9.095 1.00 0.00 H new ATOM 0 HD3 LYS B 44 -4.839 1.737 9.238 1.00 0.00 H new ATOM 0 HE2 LYS B 44 -2.414 2.262 8.721 1.00 0.00 H new ATOM 0 HE3 LYS B 44 -2.819 3.967 8.729 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 -2.069 3.392 10.884 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 -3.748 3.618 11.001 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 -3.102 2.048 10.974 1.00 0.00 H new ATOM 895 N PRO B 45 -7.759 5.425 6.819 1.00 0.00 N ATOM 896 CA PRO B 45 -8.872 6.419 6.847 1.00 0.00 C ATOM 897 C PRO B 45 -8.616 7.900 6.446 1.00 0.00 C ATOM 898 O PRO B 45 -7.656 8.538 6.890 1.00 0.00 O ATOM 899 CB PRO B 45 -9.378 6.298 8.292 1.00 0.00 C ATOM 900 CG PRO B 45 -9.181 4.824 8.633 1.00 0.00 C ATOM 901 CD PRO B 45 -7.862 4.467 7.946 1.00 0.00 C ATOM 0 HA PRO B 45 -9.570 6.170 6.048 1.00 0.00 H new ATOM 0 HB2 PRO B 45 -8.814 6.942 8.967 1.00 0.00 H new ATOM 0 HB3 PRO B 45 -10.425 6.590 8.373 1.00 0.00 H new ATOM 0 HG2 PRO B 45 -9.127 4.666 9.710 1.00 0.00 H new ATOM 0 HG3 PRO B 45 -10.004 4.213 8.262 1.00 0.00 H new ATOM 0 HD2 PRO B 45 -7.019 4.566 8.630 1.00 0.00 H new ATOM 0 HD3 PRO B 45 -7.865 3.436 7.592 1.00 0.00 H new ATOM 902 N SER B 46 -9.488 8.413 5.569 1.00 0.00 N ATOM 903 CA SER B 46 -9.176 9.608 4.754 1.00 0.00 C ATOM 904 C SER B 46 -10.389 10.594 4.604 1.00 0.00 C ATOM 905 O SER B 46 -11.242 10.332 3.745 1.00 0.00 O ATOM 906 CB SER B 46 -8.642 9.092 3.397 1.00 0.00 C ATOM 907 OG SER B 46 -9.641 8.418 2.627 1.00 0.00 O ATOM 0 H SER B 46 -10.416 8.024 5.401 1.00 0.00 H new ATOM 0 HA SER B 46 -8.421 10.215 5.253 1.00 0.00 H new ATOM 0 HB2 SER B 46 -8.253 9.932 2.822 1.00 0.00 H new ATOM 0 HB3 SER B 46 -7.808 8.413 3.575 1.00 0.00 H new ATOM 0 HG SER B 46 -10.511 8.844 2.775 1.00 0.00 H new ATOM 908 N PRO B 47 -10.516 11.729 5.352 1.00 0.00 N ATOM 909 CA PRO B 47 -9.576 12.141 6.435 1.00 0.00 C ATOM 910 C PRO B 47 -9.793 11.461 7.834 1.00 0.00 C ATOM 911 O PRO B 47 -10.922 11.334 8.313 1.00 0.00 O ATOM 912 CB PRO B 47 -9.844 13.662 6.465 1.00 0.00 C ATOM 913 CG PRO B 47 -11.326 13.819 6.112 1.00 0.00 C ATOM 914 CD PRO B 47 -11.582 12.717 5.085 1.00 0.00 C ATOM 0 HA PRO B 47 -8.548 11.840 6.234 1.00 0.00 H new ATOM 0 HB2 PRO B 47 -9.628 14.080 7.448 1.00 0.00 H new ATOM 0 HB3 PRO B 47 -9.212 14.187 5.749 1.00 0.00 H new ATOM 0 HG2 PRO B 47 -11.960 13.700 6.991 1.00 0.00 H new ATOM 0 HG3 PRO B 47 -11.535 14.806 5.699 1.00 0.00 H new ATOM 0 HD2 PRO B 47 -12.573 12.279 5.207 1.00 0.00 H new ATOM 0 HD3 PRO B 47 -11.526 13.100 4.066 1.00 0.00 H new ATOM 915 N VAL B 48 -8.703 11.170 8.569 1.00 0.00 N ATOM 916 CA VAL B 48 -8.712 11.347 10.066 1.00 0.00 C ATOM 917 C VAL B 48 -8.602 12.869 10.485 1.00 0.00 C ATOM 918 O VAL B 48 -9.157 13.293 11.499 1.00 0.00 O ATOM 919 CB VAL B 48 -7.577 10.474 10.727 1.00 0.00 C ATOM 920 CG1 VAL B 48 -7.470 10.615 12.267 1.00 0.00 C ATOM 921 CG2 VAL B 48 -7.697 8.963 10.456 1.00 0.00 C ATOM 0 H VAL B 48 -7.825 10.822 8.184 1.00 0.00 H new ATOM 0 HA VAL B 48 -9.674 10.995 10.440 1.00 0.00 H new ATOM 0 HB VAL B 48 -6.691 10.884 10.242 1.00 0.00 H new ATOM 0 HG11 VAL B 48 -6.664 9.980 12.635 1.00 0.00 H new ATOM 0 HG12 VAL B 48 -7.260 11.653 12.524 1.00 0.00 H new ATOM 0 HG13 VAL B 48 -8.411 10.311 12.726 1.00 0.00 H new ATOM 0 HG21 VAL B 48 -6.877 8.439 10.947 1.00 0.00 H new ATOM 0 HG22 VAL B 48 -8.647 8.598 10.847 1.00 0.00 H new ATOM 0 HG23 VAL B 48 -7.652 8.781 9.382 1.00 0.00 H new ATOM 922 N THR B 49 -7.792 13.648 9.749 1.00 0.00 N ATOM 923 CA THR B 49 -7.147 14.909 10.222 1.00 0.00 C ATOM 924 C THR B 49 -6.543 15.652 8.993 1.00 0.00 C ATOM 925 O THR B 49 -7.101 16.589 8.422 1.00 0.00 O ATOM 926 CB THR B 49 -6.227 14.674 11.478 1.00 0.00 C ATOM 927 OG1 THR B 49 -5.529 15.863 11.826 1.00 0.00 O ATOM 928 CG2 THR B 49 -5.184 13.545 11.367 1.00 0.00 C ATOM 0 H THR B 49 -7.554 13.423 8.783 1.00 0.00 H new ATOM 0 HA THR B 49 -7.875 15.606 10.637 1.00 0.00 H new ATOM 0 HB THR B 49 -6.940 14.365 12.242 1.00 0.00 H new ATOM 0 HG1 THR B 49 -4.965 15.694 12.610 1.00 0.00 H new ATOM 0 HG21 THR B 49 -4.614 13.484 12.294 1.00 0.00 H new ATOM 0 HG22 THR B 49 -5.692 12.597 11.189 1.00 0.00 H new ATOM 0 HG23 THR B 49 -4.507 13.755 10.539 1.00 0.00 H new ATOM 929 N GLY B 50 -5.428 15.092 8.575 1.00 0.00 N ATOM 930 CA GLY B 50 -4.912 15.228 7.189 1.00 0.00 C ATOM 931 C GLY B 50 -3.442 14.781 6.989 1.00 0.00 C ATOM 932 O GLY B 50 -2.555 15.629 6.990 1.00 0.00 O ATOM 0 H GLY B 50 -4.834 14.521 9.176 1.00 0.00 H new ATOM 0 HA2 GLY B 50 -5.547 14.644 6.522 1.00 0.00 H new ATOM 0 HA3 GLY B 50 -5.003 16.271 6.884 1.00 0.00 H new ATOM 933 N TYR B 51 -3.003 13.544 6.716 1.00 0.00 N ATOM 934 CA TYR B 51 -3.738 12.248 6.857 1.00 0.00 C ATOM 935 C TYR B 51 -5.028 12.049 5.972 1.00 0.00 C ATOM 936 O TYR B 51 -6.142 11.947 6.496 1.00 0.00 O ATOM 937 CB TYR B 51 -3.922 11.820 8.351 1.00 0.00 C ATOM 938 CG TYR B 51 -2.729 11.516 9.303 1.00 0.00 C ATOM 939 CD1 TYR B 51 -1.417 11.981 9.119 1.00 0.00 C ATOM 940 CD2 TYR B 51 -2.990 10.675 10.396 1.00 0.00 C ATOM 941 CE1 TYR B 51 -0.392 11.577 9.972 1.00 0.00 C ATOM 942 CE2 TYR B 51 -1.965 10.277 11.251 1.00 0.00 C ATOM 943 CZ TYR B 51 -0.668 10.724 11.032 1.00 0.00 C ATOM 944 OH TYR B 51 0.350 10.304 11.844 1.00 0.00 O ATOM 0 H TYR B 51 -2.057 13.396 6.364 1.00 0.00 H new ATOM 0 HA TYR B 51 -3.056 11.532 6.398 1.00 0.00 H new ATOM 0 HB2 TYR B 51 -4.504 12.608 8.828 1.00 0.00 H new ATOM 0 HB3 TYR B 51 -4.545 10.925 8.341 1.00 0.00 H new ATOM 0 HD1 TYR B 51 -1.200 12.659 8.307 1.00 0.00 H new ATOM 0 HD2 TYR B 51 -3.998 10.332 10.576 1.00 0.00 H new ATOM 0 HE1 TYR B 51 0.617 11.927 9.809 1.00 0.00 H new ATOM 0 HE2 TYR B 51 -2.178 9.622 12.083 1.00 0.00 H new ATOM 0 HH TYR B 51 -0.008 9.713 12.539 1.00 0.00 H new ATOM 945 N ARG B 52 -4.869 11.975 4.637 1.00 0.00 N ATOM 946 CA ARG B 52 -5.973 11.665 3.670 1.00 0.00 C ATOM 947 C ARG B 52 -5.350 11.041 2.376 1.00 0.00 C ATOM 948 O ARG B 52 -4.622 11.740 1.676 1.00 0.00 O ATOM 949 CB ARG B 52 -6.818 12.961 3.449 1.00 0.00 C ATOM 950 CG ARG B 52 -7.940 12.998 2.376 1.00 0.00 C ATOM 951 CD ARG B 52 -7.452 13.319 0.947 1.00 0.00 C ATOM 952 NE ARG B 52 -8.607 13.608 0.057 1.00 0.00 N ATOM 953 CZ ARG B 52 -9.172 12.764 -0.797 1.00 0.00 C ATOM 954 NH1 ARG B 52 -8.791 11.537 -0.990 1.00 0.00 N ATOM 955 NH2 ARG B 52 -10.172 13.198 -1.477 1.00 0.00 N ATOM 0 H ARG B 52 -3.969 12.128 4.182 1.00 0.00 H new ATOM 0 HA ARG B 52 -6.669 10.917 4.049 1.00 0.00 H new ATOM 0 HB2 ARG B 52 -7.279 13.211 4.405 1.00 0.00 H new ATOM 0 HB3 ARG B 52 -6.120 13.764 3.212 1.00 0.00 H new ATOM 0 HG2 ARG B 52 -8.446 12.033 2.365 1.00 0.00 H new ATOM 0 HG3 ARG B 52 -8.680 13.742 2.669 1.00 0.00 H new ATOM 0 HD2 ARG B 52 -6.779 14.176 0.970 1.00 0.00 H new ATOM 0 HD3 ARG B 52 -6.883 12.477 0.553 1.00 0.00 H new ATOM 0 HE ARG B 52 -9.004 14.546 0.108 1.00 0.00 H new ATOM 0 HH11 ARG B 52 -8.003 11.159 -0.464 1.00 0.00 H new ATOM 0 HH12 ARG B 52 -9.280 10.952 -1.667 1.00 0.00 H new ATOM 0 HH21 ARG B 52 -10.499 14.155 -1.348 1.00 0.00 H new ATOM 0 HH22 ARG B 52 -10.638 12.585 -2.146 1.00 0.00 H new ATOM 956 N ASN B 53 -5.553 9.746 2.016 1.00 0.00 N ATOM 957 CA ASN B 53 -4.815 9.118 0.884 1.00 0.00 C ATOM 958 C ASN B 53 -5.279 9.683 -0.483 1.00 0.00 C ATOM 959 O ASN B 53 -6.449 9.595 -0.842 1.00 0.00 O ATOM 960 CB ASN B 53 -4.258 7.673 1.099 1.00 0.00 C ATOM 961 CG ASN B 53 -5.141 6.557 0.583 1.00 0.00 C ATOM 962 OD1 ASN B 53 -5.600 6.555 -0.553 1.00 0.00 O ATOM 963 ND2 ASN B 53 -5.268 5.505 1.315 1.00 0.00 N ATOM 0 H ASN B 53 -6.211 9.123 2.484 1.00 0.00 H new ATOM 0 HA ASN B 53 -3.776 9.446 0.848 1.00 0.00 H new ATOM 0 HB2 ASN B 53 -3.286 7.600 0.612 1.00 0.00 H new ATOM 0 HB3 ASN B 53 -4.093 7.520 2.165 1.00 0.00 H new ATOM 0 HD21 ASN B 53 -5.746 4.683 0.947 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -4.890 5.494 2.262 1.00 0.00 H new ATOM 964 N ASP B 54 -4.464 10.324 -1.335 1.00 0.00 N ATOM 965 CA ASP B 54 -2.946 10.410 -1.301 1.00 0.00 C ATOM 966 C ASP B 54 -2.182 9.042 -1.390 1.00 0.00 C ATOM 967 O ASP B 54 -0.970 8.931 -1.338 1.00 0.00 O ATOM 968 CB ASP B 54 -2.632 11.488 -2.400 1.00 0.00 C ATOM 969 CG ASP B 54 -1.511 12.549 -2.441 1.00 0.00 C ATOM 970 OD1 ASP B 54 -1.546 13.426 -1.431 1.00 0.00 O ATOM 971 OD2 ASP B 54 -0.725 12.661 -3.369 1.00 0.00 O ATOM 0 H ASP B 54 -4.846 10.839 -2.128 1.00 0.00 H new ATOM 0 HA ASP B 54 -2.557 10.712 -0.329 1.00 0.00 H new ATOM 0 HB2 ASP B 54 -2.507 10.917 -3.320 1.00 0.00 H new ATOM 0 HB3 ASP B 54 -3.556 12.057 -2.501 1.00 0.00 H new ATOM 972 N ALA B 55 -2.899 7.955 -1.589 1.00 0.00 N ATOM 973 CA ALA B 55 -2.440 6.559 -1.709 1.00 0.00 C ATOM 974 C ALA B 55 -2.912 5.878 -3.042 1.00 0.00 C ATOM 975 O ALA B 55 -2.227 5.167 -3.759 1.00 0.00 O ATOM 976 CB ALA B 55 -1.193 6.262 -0.874 1.00 0.00 C ATOM 0 H ALA B 55 -3.913 8.017 -1.681 1.00 0.00 H new ATOM 0 HA ALA B 55 -2.945 5.766 -1.157 1.00 0.00 H new ATOM 0 HB1 ALA B 55 -0.907 5.219 -1.006 1.00 0.00 H new ATOM 0 HB2 ALA B 55 -0.376 6.906 -1.198 1.00 0.00 H new ATOM 0 HB3 ALA B 55 -1.407 6.449 0.178 1.00 0.00 H new ATOM 977 N GLU B 56 -4.178 6.107 -3.395 1.00 0.00 N ATOM 978 CA GLU B 56 -4.572 7.206 -4.339 1.00 0.00 C ATOM 979 C GLU B 56 -3.535 8.271 -4.977 1.00 0.00 C ATOM 980 O GLU B 56 -3.644 8.661 -6.129 1.00 0.00 O ATOM 981 CB GLU B 56 -5.786 7.789 -3.563 1.00 0.00 C ATOM 982 CG GLU B 56 -6.674 8.813 -4.275 1.00 0.00 C ATOM 983 CD GLU B 56 -7.388 8.347 -5.543 1.00 0.00 C ATOM 984 OE1 GLU B 56 -6.823 8.155 -6.613 1.00 0.00 O ATOM 985 OE2 GLU B 56 -8.723 8.171 -5.354 1.00 0.00 O ATOM 0 H GLU B 56 -4.965 5.556 -3.052 1.00 0.00 H new ATOM 0 HA GLU B 56 -4.738 6.797 -5.335 1.00 0.00 H new ATOM 0 HB2 GLU B 56 -6.418 6.955 -3.258 1.00 0.00 H new ATOM 0 HB3 GLU B 56 -5.408 8.252 -2.652 1.00 0.00 H new ATOM 0 HG2 GLU B 56 -7.429 9.157 -3.568 1.00 0.00 H new ATOM 0 HG3 GLU B 56 -6.059 9.676 -4.530 1.00 0.00 H new ATOM 986 N ARG B 57 -2.501 8.757 -4.286 1.00 0.00 N ATOM 987 CA ARG B 57 -1.196 9.248 -4.843 1.00 0.00 C ATOM 988 C ARG B 57 -0.404 8.114 -5.507 1.00 0.00 C ATOM 989 O ARG B 57 0.174 8.288 -6.572 1.00 0.00 O ATOM 990 CB ARG B 57 -0.144 9.715 -3.811 1.00 0.00 C ATOM 991 CG ARG B 57 1.180 10.350 -4.288 1.00 0.00 C ATOM 992 CD ARG B 57 2.151 10.136 -3.139 1.00 0.00 C ATOM 993 NE ARG B 57 3.492 10.652 -3.498 1.00 0.00 N ATOM 994 CZ ARG B 57 4.483 9.968 -4.048 1.00 0.00 C ATOM 995 NH1 ARG B 57 4.452 8.693 -4.287 1.00 0.00 N ATOM 996 NH2 ARG B 57 5.545 10.624 -4.357 1.00 0.00 N ATOM 0 H ARG B 57 -2.533 8.831 -3.269 1.00 0.00 H new ATOM 0 HA ARG B 57 -1.543 10.058 -5.485 1.00 0.00 H new ATOM 0 HB2 ARG B 57 -0.632 10.437 -3.156 1.00 0.00 H new ATOM 0 HB3 ARG B 57 0.114 8.851 -3.198 1.00 0.00 H new ATOM 0 HG2 ARG B 57 1.539 9.877 -5.202 1.00 0.00 H new ATOM 0 HG3 ARG B 57 1.054 11.410 -4.507 1.00 0.00 H new ATOM 0 HD2 ARG B 57 1.786 10.643 -2.246 1.00 0.00 H new ATOM 0 HD3 ARG B 57 2.214 9.074 -2.900 1.00 0.00 H new ATOM 0 HE ARG B 57 3.671 11.637 -3.301 1.00 0.00 H new ATOM 0 HH11 ARG B 57 3.623 8.149 -4.047 1.00 0.00 H new ATOM 0 HH12 ARG B 57 5.257 8.235 -4.714 1.00 0.00 H new ATOM 0 HH21 ARG B 57 5.596 11.626 -4.176 1.00 0.00 H new ATOM 0 HH22 ARG B 57 6.336 10.142 -4.783 1.00 0.00 H new ATOM 997 N LEU B 58 -0.271 6.980 -4.795 1.00 0.00 N ATOM 998 CA LEU B 58 0.310 5.760 -5.463 1.00 0.00 C ATOM 999 C LEU B 58 -0.487 5.280 -6.732 1.00 0.00 C ATOM 1000 O LEU B 58 0.120 4.789 -7.689 1.00 0.00 O ATOM 1001 CB LEU B 58 0.659 4.618 -4.475 1.00 0.00 C ATOM 1002 CG LEU B 58 1.174 5.066 -3.093 1.00 0.00 C ATOM 1003 CD1 LEU B 58 1.235 3.941 -2.079 1.00 0.00 C ATOM 1004 CD2 LEU B 58 2.358 6.048 -3.063 1.00 0.00 C ATOM 0 H LEU B 58 -0.534 6.864 -3.816 1.00 0.00 H new ATOM 0 HA LEU B 58 1.269 6.095 -5.857 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -0.229 4.003 -4.330 1.00 0.00 H new ATOM 0 HB3 LEU B 58 1.415 3.982 -4.936 1.00 0.00 H new ATOM 0 HG LEU B 58 0.379 5.725 -2.745 1.00 0.00 H new ATOM 0 HD11 LEU B 58 1.606 4.327 -1.129 1.00 0.00 H new ATOM 0 HD12 LEU B 58 0.238 3.525 -1.937 1.00 0.00 H new ATOM 0 HD13 LEU B 58 1.905 3.161 -2.441 1.00 0.00 H new ATOM 0 HD21 LEU B 58 2.615 6.277 -2.029 1.00 0.00 H new ATOM 0 HD22 LEU B 58 3.217 5.597 -3.559 1.00 0.00 H new ATOM 0 HD23 LEU B 58 2.082 6.967 -3.580 1.00 0.00 H new ATOM 1005 N ALA B 59 -1.806 5.593 -6.846 1.00 0.00 N ATOM 1006 CA ALA B 59 -2.388 6.060 -8.136 1.00 0.00 C ATOM 1007 C ALA B 59 -1.540 7.109 -8.884 1.00 0.00 C ATOM 1008 O ALA B 59 -0.716 6.669 -9.673 1.00 0.00 O ATOM 1009 CB ALA B 59 -3.842 6.560 -7.979 1.00 0.00 C ATOM 0 H ALA B 59 -2.475 5.533 -6.078 1.00 0.00 H new ATOM 0 HA ALA B 59 -2.387 5.166 -8.760 1.00 0.00 H new ATOM 0 HB1 ALA B 59 -4.220 6.889 -8.947 1.00 0.00 H new ATOM 0 HB2 ALA B 59 -4.466 5.750 -7.602 1.00 0.00 H new ATOM 0 HB3 ALA B 59 -3.866 7.394 -7.277 1.00 0.00 H new ATOM 1010 N ASP B 60 -1.636 8.438 -8.691 1.00 0.00 N ATOM 1011 CA ASP B 60 -1.087 9.351 -9.742 1.00 0.00 C ATOM 1012 C ASP B 60 0.453 9.440 -9.960 1.00 0.00 C ATOM 1013 O ASP B 60 0.907 9.993 -10.962 1.00 0.00 O ATOM 1014 CB ASP B 60 -1.688 10.760 -9.572 1.00 0.00 C ATOM 1015 CG ASP B 60 -3.150 10.861 -10.007 1.00 0.00 C ATOM 1016 OD1 ASP B 60 -4.105 10.558 -9.298 1.00 0.00 O ATOM 1017 OD2 ASP B 60 -3.267 11.296 -11.288 1.00 0.00 O ATOM 0 H ASP B 60 -2.056 8.892 -7.880 1.00 0.00 H new ATOM 0 HA ASP B 60 -1.404 8.858 -10.661 1.00 0.00 H new ATOM 0 HB2 ASP B 60 -1.608 11.056 -8.526 1.00 0.00 H new ATOM 0 HB3 ASP B 60 -1.096 11.470 -10.150 1.00 0.00 H new ATOM 1018 N GLU B 61 1.235 8.790 -9.107 1.00 0.00 N ATOM 1019 CA GLU B 61 2.620 8.391 -9.456 1.00 0.00 C ATOM 1020 C GLU B 61 2.718 7.060 -10.255 1.00 0.00 C ATOM 1021 O GLU B 61 3.330 7.088 -11.327 1.00 0.00 O ATOM 1022 CB GLU B 61 3.519 8.478 -8.200 1.00 0.00 C ATOM 1023 CG GLU B 61 3.828 9.915 -7.699 1.00 0.00 C ATOM 1024 CD GLU B 61 4.633 10.806 -8.644 1.00 0.00 C ATOM 1025 OE1 GLU B 61 3.835 11.474 -9.525 1.00 0.00 O ATOM 1026 OE2 GLU B 61 5.855 10.899 -8.605 1.00 0.00 O ATOM 0 H GLU B 61 0.947 8.522 -8.166 1.00 0.00 H new ATOM 0 HA GLU B 61 3.012 9.108 -10.177 1.00 0.00 H new ATOM 0 HB2 GLU B 61 3.040 7.925 -7.392 1.00 0.00 H new ATOM 0 HB3 GLU B 61 4.462 7.976 -8.414 1.00 0.00 H new ATOM 0 HG2 GLU B 61 2.882 10.412 -7.483 1.00 0.00 H new ATOM 0 HG3 GLU B 61 4.370 9.839 -6.757 1.00 0.00 H new ATOM 1027 N GLN B 62 2.122 5.908 -9.853 1.00 0.00 N ATOM 1028 CA GLN B 62 2.171 4.714 -10.708 1.00 0.00 C ATOM 1029 C GLN B 62 1.141 4.880 -11.850 1.00 0.00 C ATOM 1030 O GLN B 62 1.586 5.208 -12.937 1.00 0.00 O ATOM 1031 CB GLN B 62 2.074 3.399 -9.900 1.00 0.00 C ATOM 1032 CG GLN B 62 3.200 2.421 -10.285 1.00 0.00 C ATOM 1033 CD GLN B 62 3.230 1.862 -11.722 1.00 0.00 C ATOM 1034 OE1 GLN B 62 3.001 0.688 -11.971 1.00 0.00 O ATOM 1035 NE2 GLN B 62 3.536 2.652 -12.726 1.00 0.00 N ATOM 0 H GLN B 62 1.621 5.790 -8.973 1.00 0.00 H new ATOM 0 HA GLN B 62 3.150 4.625 -11.178 1.00 0.00 H new ATOM 0 HB2 GLN B 62 2.130 3.620 -8.834 1.00 0.00 H new ATOM 0 HB3 GLN B 62 1.106 2.931 -10.078 1.00 0.00 H new ATOM 0 HG2 GLN B 62 4.151 2.923 -10.105 1.00 0.00 H new ATOM 0 HG3 GLN B 62 3.152 1.574 -9.601 1.00 0.00 H new ATOM 0 HE21 GLN B 62 3.734 3.638 -12.557 1.00 0.00 H new ATOM 0 HE22 GLN B 62 3.576 2.279 -13.675 1.00 0.00 H new ATOM 1036 N SER B 63 -0.168 4.838 -11.564 1.00 0.00 N ATOM 1037 CA SER B 63 -1.237 5.398 -12.423 1.00 0.00 C ATOM 1038 C SER B 63 -1.325 6.960 -12.620 1.00 0.00 C ATOM 1039 O SER B 63 -2.406 7.547 -12.668 1.00 0.00 O ATOM 1040 CB SER B 63 -2.514 4.625 -12.006 1.00 0.00 C ATOM 1041 OG SER B 63 -3.508 4.670 -13.028 1.00 0.00 O ATOM 0 H SER B 63 -0.527 4.406 -10.713 1.00 0.00 H new ATOM 0 HA SER B 63 -1.007 5.233 -13.476 1.00 0.00 H new ATOM 0 HB2 SER B 63 -2.259 3.587 -11.790 1.00 0.00 H new ATOM 0 HB3 SER B 63 -2.916 5.052 -11.087 1.00 0.00 H new ATOM 0 HG SER B 63 -3.951 3.798 -13.092 1.00 0.00 H new ATOM 1042 N GLU B 64 -0.187 7.654 -12.836 1.00 0.00 N ATOM 1043 CA GLU B 64 0.002 8.477 -14.068 1.00 0.00 C ATOM 1044 C GLU B 64 1.451 8.485 -14.704 1.00 0.00 C ATOM 1045 O GLU B 64 1.716 9.336 -15.552 1.00 0.00 O ATOM 1046 CB GLU B 64 -0.512 9.923 -13.812 1.00 0.00 C ATOM 1047 CG GLU B 64 -1.206 10.528 -15.060 1.00 0.00 C ATOM 1048 CD GLU B 64 -1.464 12.031 -15.022 1.00 0.00 C ATOM 1049 OE1 GLU B 64 -2.001 12.605 -14.079 1.00 0.00 O ATOM 1050 OE2 GLU B 64 -1.052 12.653 -16.168 1.00 0.00 O ATOM 0 H GLU B 64 0.605 7.667 -12.193 1.00 0.00 H new ATOM 0 HA GLU B 64 -0.595 7.978 -14.832 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -1.213 9.915 -12.977 1.00 0.00 H new ATOM 0 HB3 GLU B 64 0.325 10.558 -13.520 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -0.593 10.307 -15.934 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -2.160 10.020 -15.202 1.00 0.00 H new ATOM 1051 N LEU B 65 2.376 7.561 -14.385 1.00 0.00 N ATOM 1052 CA LEU B 65 3.642 7.347 -15.183 1.00 0.00 C ATOM 1053 C LEU B 65 3.655 6.037 -16.064 1.00 0.00 C ATOM 1054 O LEU B 65 4.208 6.021 -17.163 1.00 0.00 O ATOM 1055 CB LEU B 65 4.877 7.451 -14.240 1.00 0.00 C ATOM 1056 CG LEU B 65 4.997 8.752 -13.402 1.00 0.00 C ATOM 1057 CD1 LEU B 65 6.109 8.646 -12.349 1.00 0.00 C ATOM 1058 CD2 LEU B 65 5.202 10.018 -14.249 1.00 0.00 C ATOM 0 H LEU B 65 2.289 6.939 -13.581 1.00 0.00 H new ATOM 0 HA LEU B 65 3.689 8.146 -15.923 1.00 0.00 H new ATOM 0 HB2 LEU B 65 4.856 6.604 -13.555 1.00 0.00 H new ATOM 0 HB3 LEU B 65 5.778 7.350 -14.845 1.00 0.00 H new ATOM 0 HG LEU B 65 4.034 8.855 -12.902 1.00 0.00 H new ATOM 0 HD11 LEU B 65 6.163 9.575 -11.782 1.00 0.00 H new ATOM 0 HD12 LEU B 65 5.891 7.820 -11.672 1.00 0.00 H new ATOM 0 HD13 LEU B 65 7.063 8.467 -12.844 1.00 0.00 H new ATOM 0 HD21 LEU B 65 5.277 10.886 -13.594 1.00 0.00 H new ATOM 0 HD22 LEU B 65 6.119 9.922 -14.831 1.00 0.00 H new ATOM 0 HD23 LEU B 65 4.356 10.145 -14.924 1.00 0.00 H new ATOM 1059 N VAL B 66 3.050 4.950 -15.564 1.00 0.00 N ATOM 1060 CA VAL B 66 2.271 3.927 -16.335 1.00 0.00 C ATOM 1061 C VAL B 66 1.939 4.044 -17.871 1.00 0.00 C ATOM 1062 O VAL B 66 1.915 5.105 -18.491 1.00 0.00 O ATOM 1063 CB VAL B 66 0.933 3.821 -15.497 1.00 0.00 C ATOM 1064 CG1 VAL B 66 0.050 5.097 -15.586 1.00 0.00 C ATOM 1065 CG2 VAL B 66 0.024 2.597 -15.637 1.00 0.00 C ATOM 0 H VAL B 66 3.082 4.735 -14.567 1.00 0.00 H new ATOM 0 HA VAL B 66 2.938 3.069 -16.421 1.00 0.00 H new ATOM 0 HB VAL B 66 1.390 3.693 -14.516 1.00 0.00 H new ATOM 0 HG11 VAL B 66 -0.851 4.958 -14.989 1.00 0.00 H new ATOM 0 HG12 VAL B 66 0.608 5.953 -15.206 1.00 0.00 H new ATOM 0 HG13 VAL B 66 -0.227 5.276 -16.625 1.00 0.00 H new ATOM 0 HG21 VAL B 66 -0.841 2.710 -14.984 1.00 0.00 H new ATOM 0 HG22 VAL B 66 -0.311 2.509 -16.671 1.00 0.00 H new ATOM 0 HG23 VAL B 66 0.576 1.700 -15.357 1.00 0.00 H new TER 1066 VAL B 66