USER MOD reduce.3.24.130724 H: found=0, std=0, add=1028, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1029 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 123 TYR OH : rot 180:sc= 0.131 USER MOD Set 1.2: A 127 ASN :FLIP amide:sc= -1.32 F(o=-1.7,f=-1.1) USER MOD Set 1.3: A 144 ASN :FLIP amide:sc= 0.0512 F(o=-1.7,f=-1.1) USER MOD Set 2.1: A 68 CYS SG : rot 66:sc= -2.57! USER MOD Set 2.2: A 119 HIS : no HD1:sc= 0.996 K(o=-0.35,f=-11!) USER MOD Set 2.3: A 131 HIS : no HD1:sc= -0.17 K(o=-0.35,f=-11!) USER MOD Set 2.4: A 141 SER OG : rot 63:sc= 1.4 USER MOD Set 3.1: A 41 LYS NZ :NH3+ 152:sc= 1.26 (180deg=0) USER MOD Set 3.2: A 126 ASN : amide:sc= 0.951 K(o=2.2,f=-7.7!) USER MOD Single : A 36 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 SER OG : rot 77:sc= 0.415 USER MOD Single : A 45 MET CE :methyl 140:sc= -0.844 (180deg=-3.76!) USER MOD Single : A 47 GLN : amide:sc= -3.37! C(o=-3.4!,f=-4.6!) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 11:sc= -0.486! USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.476 USER MOD Single : A 63 LYS NZ :NH3+ -161:sc= 0.698 (180deg=-0.13!) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot 130:sc= -0.538 USER MOD Single : A 73 GLN :FLIP amide:sc= -5.25! C(o=-6.5!,f=-5.2!) USER MOD Single : A 75 THR OG1 : rot 71:sc= 0.955 USER MOD Single : A 79 GLN : amide:sc= -1.36 K(o=-1.4,f=-5.2!) USER MOD Single : A 87 SER OG : rot 11:sc= 0.614 USER MOD Single : A 88 THR OG1 : rot -160:sc= -0.0019 USER MOD Single : A 89 TYR OH : rot 80:sc= 1.41 USER MOD Single : A 91 GLN : amide:sc= 0.561 K(o=0.56,f=-3.4!) USER MOD Single : A 92 GLN :FLIP amide:sc= -1.22 F(o=-2.8,f=-1.2) USER MOD Single : A 94 MET CE :methyl -162:sc= -0.118 (180deg=-0.575) USER MOD Single : A 96 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0249) USER MOD Single : A 97 SER OG : rot 28:sc= 0.0444 USER MOD Single : A 99 SER OG : rot 49:sc= 0.274 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 ASN : amide:sc= 0 X(o=0,f=-0.022) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 4:sc= 1.21 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 128 GLN :FLIP amide:sc=-0.00175 F(o=-0.92,f=-0.0018) USER MOD Single : A 133 SER OG : rot 180:sc= -0.211 USER MOD Single : A 134 THR OG1 : rot 180:sc= -0.177 USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 143 MET CE :methyl -126:sc= -0.437 (180deg=-2.53) USER MOD Single : A 147 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 TYR OH : rot 150:sc= -0.236 USER MOD Single : A 153 ASN :FLIP amide:sc= -1.03 F(o=-1.9!,f=-1) USER MOD Single : A 160 SER OG : rot 180:sc= 0 USER MOD Single : A 162 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 36 -15.330 -17.791 9.748 1.00 65.42 N ATOM 2 CA MET A 36 -15.095 -16.456 9.133 1.00 1.55 C ATOM 3 C MET A 36 -14.014 -16.530 8.042 1.00 2.41 C ATOM 4 O MET A 36 -12.824 -16.656 8.341 1.00 3.13 O ATOM 5 CB MET A 36 -14.683 -15.438 10.208 1.00 61.00 C ATOM 6 CG MET A 36 -14.442 -14.032 9.667 1.00 32.45 C ATOM 7 SD MET A 36 -13.953 -12.863 10.954 1.00 32.52 S ATOM 8 CE MET A 36 -13.811 -11.346 10.009 1.00 12.05 C ATOM 0 HA MET A 36 -16.027 -16.132 8.671 1.00 1.55 H new ATOM 0 HB2 MET A 36 -15.460 -15.395 10.971 1.00 61.00 H new ATOM 0 HB3 MET A 36 -13.775 -15.789 10.698 1.00 61.00 H new ATOM 0 HG2 MET A 36 -13.666 -14.070 8.902 1.00 32.45 H new ATOM 0 HG3 MET A 36 -15.350 -13.673 9.182 1.00 32.45 H new ATOM 0 HE1 MET A 36 -13.515 -10.532 10.670 1.00 12.05 H new ATOM 0 HE2 MET A 36 -13.060 -11.472 9.229 1.00 12.05 H new ATOM 0 HE3 MET A 36 -14.772 -11.111 9.552 1.00 12.05 H new ATOM 20 N ASN A 37 -14.432 -16.459 6.778 1.00 22.32 N ATOM 21 CA ASN A 37 -13.495 -16.458 5.650 1.00 53.52 C ATOM 22 C ASN A 37 -12.651 -15.175 5.628 1.00 11.02 C ATOM 23 O ASN A 37 -13.038 -14.168 5.032 1.00 60.03 O ATOM 24 CB ASN A 37 -14.249 -16.615 4.321 1.00 21.32 C ATOM 25 CG ASN A 37 -14.959 -17.949 4.212 1.00 45.34 C ATOM 26 OD1 ASN A 37 -16.097 -18.103 4.642 1.00 42.50 O ATOM 27 ND2 ASN A 37 -14.295 -18.925 3.629 1.00 73.20 N ATOM 0 H ASN A 37 -15.414 -16.401 6.508 1.00 22.32 H new ATOM 0 HA ASN A 37 -12.823 -17.306 5.778 1.00 53.52 H new ATOM 0 HB2 ASN A 37 -14.977 -15.810 4.223 1.00 21.32 H new ATOM 0 HB3 ASN A 37 -13.547 -16.512 3.494 1.00 21.32 H new ATOM 0 HD21 ASN A 37 -14.726 -19.843 3.524 1.00 73.20 H new ATOM 0 HD22 ASN A 37 -13.350 -18.763 3.282 1.00 73.20 H new ATOM 34 N VAL A 38 -11.515 -15.210 6.319 1.00 41.35 N ATOM 35 CA VAL A 38 -10.598 -14.069 6.355 1.00 62.11 C ATOM 36 C VAL A 38 -9.859 -13.911 5.013 1.00 31.13 C ATOM 37 O VAL A 38 -8.733 -14.384 4.842 1.00 53.14 O ATOM 38 CB VAL A 38 -9.573 -14.198 7.518 1.00 44.21 C ATOM 39 CG1 VAL A 38 -8.653 -12.977 7.581 1.00 62.43 C ATOM 40 CG2 VAL A 38 -10.295 -14.401 8.850 1.00 65.22 C ATOM 0 H VAL A 38 -11.205 -16.015 6.863 1.00 41.35 H new ATOM 0 HA VAL A 38 -11.200 -13.177 6.529 1.00 62.11 H new ATOM 0 HB VAL A 38 -8.953 -15.073 7.325 1.00 44.21 H new ATOM 0 HG11 VAL A 38 -7.947 -13.095 8.403 1.00 62.43 H new ATOM 0 HG12 VAL A 38 -8.105 -12.885 6.643 1.00 62.43 H new ATOM 0 HG13 VAL A 38 -9.250 -12.079 7.742 1.00 62.43 H new ATOM 0 HG21 VAL A 38 -9.562 -14.489 9.652 1.00 65.22 H new ATOM 0 HG22 VAL A 38 -10.945 -13.548 9.045 1.00 65.22 H new ATOM 0 HG23 VAL A 38 -10.894 -15.311 8.804 1.00 65.22 H new ATOM 50 N ASP A 39 -10.523 -13.272 4.052 1.00 51.10 N ATOM 51 CA ASP A 39 -9.936 -13.024 2.733 1.00 71.41 C ATOM 52 C ASP A 39 -9.022 -11.787 2.764 1.00 55.10 C ATOM 53 O ASP A 39 -9.404 -10.734 3.282 1.00 54.03 O ATOM 54 CB ASP A 39 -11.052 -12.840 1.695 1.00 54.12 C ATOM 55 CG ASP A 39 -10.516 -12.598 0.294 1.00 10.44 C ATOM 56 OD1 ASP A 39 -10.058 -13.567 -0.348 1.00 4.03 O ATOM 57 OD2 ASP A 39 -10.546 -11.435 -0.166 1.00 3.52 O ATOM 0 H ASP A 39 -11.472 -12.914 4.161 1.00 51.10 H new ATOM 0 HA ASP A 39 -9.328 -13.884 2.454 1.00 71.41 H new ATOM 0 HB2 ASP A 39 -11.686 -13.726 1.689 1.00 54.12 H new ATOM 0 HB3 ASP A 39 -11.681 -12.000 1.989 1.00 54.12 H new ATOM 62 N VAL A 40 -7.820 -11.926 2.203 1.00 21.05 N ATOM 63 CA VAL A 40 -6.834 -10.835 2.191 1.00 63.44 C ATOM 64 C VAL A 40 -7.409 -9.551 1.566 1.00 15.15 C ATOM 65 O VAL A 40 -7.529 -8.523 2.236 1.00 21.42 O ATOM 66 CB VAL A 40 -5.544 -11.244 1.433 1.00 53.22 C ATOM 67 CG1 VAL A 40 -4.526 -10.100 1.419 1.00 44.11 C ATOM 68 CG2 VAL A 40 -4.937 -12.507 2.047 1.00 72.22 C ATOM 0 H VAL A 40 -7.502 -12.783 1.750 1.00 21.05 H new ATOM 0 HA VAL A 40 -6.584 -10.633 3.233 1.00 63.44 H new ATOM 0 HB VAL A 40 -5.814 -11.461 0.399 1.00 53.22 H new ATOM 0 HG11 VAL A 40 -3.632 -10.415 0.881 1.00 44.11 H new ATOM 0 HG12 VAL A 40 -4.961 -9.232 0.923 1.00 44.11 H new ATOM 0 HG13 VAL A 40 -4.260 -9.837 2.443 1.00 44.11 H new ATOM 0 HG21 VAL A 40 -4.033 -12.778 1.502 1.00 72.22 H new ATOM 0 HG22 VAL A 40 -4.688 -12.320 3.092 1.00 72.22 H new ATOM 0 HG23 VAL A 40 -5.657 -13.323 1.985 1.00 72.22 H new ATOM 78 N LYS A 41 -7.784 -9.628 0.290 1.00 2.34 N ATOM 79 CA LYS A 41 -8.319 -8.470 -0.442 1.00 74.24 C ATOM 80 C LYS A 41 -9.504 -7.826 0.301 1.00 73.20 C ATOM 81 O LYS A 41 -9.569 -6.605 0.461 1.00 72.45 O ATOM 82 CB LYS A 41 -8.758 -8.901 -1.851 1.00 11.14 C ATOM 83 CG LYS A 41 -9.335 -7.767 -2.700 1.00 62.00 C ATOM 84 CD LYS A 41 -9.801 -8.259 -4.070 1.00 62.22 C ATOM 85 CE LYS A 41 -10.335 -7.120 -4.931 1.00 42.24 C ATOM 86 NZ LYS A 41 -10.834 -7.606 -6.244 1.00 40.40 N ATOM 0 H LYS A 41 -7.729 -10.482 -0.265 1.00 2.34 H new ATOM 0 HA LYS A 41 -7.526 -7.725 -0.515 1.00 74.24 H new ATOM 0 HB2 LYS A 41 -7.902 -9.330 -2.371 1.00 11.14 H new ATOM 0 HB3 LYS A 41 -9.505 -9.690 -1.762 1.00 11.14 H new ATOM 0 HG2 LYS A 41 -10.174 -7.311 -2.174 1.00 62.00 H new ATOM 0 HG3 LYS A 41 -8.580 -6.991 -2.831 1.00 62.00 H new ATOM 0 HD2 LYS A 41 -8.971 -8.744 -4.583 1.00 62.22 H new ATOM 0 HD3 LYS A 41 -10.579 -9.012 -3.940 1.00 62.22 H new ATOM 0 HE2 LYS A 41 -11.141 -6.612 -4.402 1.00 42.24 H new ATOM 0 HE3 LYS A 41 -9.546 -6.385 -5.092 1.00 42.24 H new ATOM 0 HZ1 LYS A 41 -11.580 -6.969 -6.590 1.00 40.40 H new ATOM 0 HZ2 LYS A 41 -10.051 -7.625 -6.928 1.00 40.40 H new ATOM 0 HZ3 LYS A 41 -11.222 -8.565 -6.135 1.00 40.40 H new ATOM 100 N SER A 42 -10.424 -8.663 0.769 1.00 74.05 N ATOM 101 CA SER A 42 -11.620 -8.193 1.477 1.00 43.42 C ATOM 102 C SER A 42 -11.273 -7.483 2.796 1.00 62.13 C ATOM 103 O SER A 42 -11.896 -6.482 3.151 1.00 4.30 O ATOM 104 CB SER A 42 -12.575 -9.360 1.751 1.00 73.42 C ATOM 105 OG SER A 42 -13.045 -9.941 0.543 1.00 71.43 O ATOM 0 H SER A 42 -10.368 -9.677 0.672 1.00 74.05 H new ATOM 0 HA SER A 42 -12.109 -7.467 0.828 1.00 43.42 H new ATOM 0 HB2 SER A 42 -12.065 -10.117 2.346 1.00 73.42 H new ATOM 0 HB3 SER A 42 -13.422 -9.008 2.341 1.00 73.42 H new ATOM 0 HG SER A 42 -12.341 -10.501 0.154 1.00 71.43 H new ATOM 111 N ARG A 43 -10.285 -8.003 3.524 1.00 14.44 N ATOM 112 CA ARG A 43 -9.851 -7.384 4.785 1.00 13.22 C ATOM 113 C ARG A 43 -9.137 -6.041 4.547 1.00 45.13 C ATOM 114 O ARG A 43 -9.265 -5.108 5.346 1.00 11.53 O ATOM 115 CB ARG A 43 -8.941 -8.340 5.576 1.00 22.44 C ATOM 116 CG ARG A 43 -9.634 -9.062 6.735 1.00 60.14 C ATOM 117 CD ARG A 43 -10.577 -10.185 6.285 1.00 21.11 C ATOM 118 NE ARG A 43 -11.781 -9.715 5.592 1.00 41.32 N ATOM 119 CZ ARG A 43 -12.765 -9.055 6.161 1.00 21.31 C ATOM 120 NH1 ARG A 43 -12.670 -8.636 7.383 1.00 71.32 N ATOM 121 NH2 ARG A 43 -13.847 -8.809 5.495 1.00 13.33 N ATOM 0 H ARG A 43 -9.770 -8.846 3.268 1.00 14.44 H new ATOM 0 HA ARG A 43 -10.747 -7.184 5.372 1.00 13.22 H new ATOM 0 HB2 ARG A 43 -8.535 -9.085 4.891 1.00 22.44 H new ATOM 0 HB3 ARG A 43 -8.096 -7.775 5.970 1.00 22.44 H new ATOM 0 HG2 ARG A 43 -8.875 -9.480 7.397 1.00 60.14 H new ATOM 0 HG3 ARG A 43 -10.200 -8.335 7.318 1.00 60.14 H new ATOM 0 HD2 ARG A 43 -10.032 -10.860 5.626 1.00 21.11 H new ATOM 0 HD3 ARG A 43 -10.876 -10.765 7.158 1.00 21.11 H new ATOM 0 HE ARG A 43 -11.861 -9.915 4.595 1.00 41.32 H new ATOM 0 HH11 ARG A 43 -11.822 -8.817 7.920 1.00 71.32 H new ATOM 0 HH12 ARG A 43 -13.444 -8.125 7.809 1.00 71.32 H new ATOM 0 HH21 ARG A 43 -13.935 -9.127 4.530 1.00 13.33 H new ATOM 0 HH22 ARG A 43 -14.612 -8.297 5.935 1.00 13.33 H new ATOM 135 N ILE A 44 -8.380 -5.942 3.456 1.00 33.00 N ATOM 136 CA ILE A 44 -7.722 -4.681 3.093 1.00 1.21 C ATOM 137 C ILE A 44 -8.768 -3.600 2.765 1.00 34.41 C ATOM 138 O ILE A 44 -8.661 -2.455 3.211 1.00 35.11 O ATOM 139 CB ILE A 44 -6.765 -4.868 1.887 1.00 73.15 C ATOM 140 CG1 ILE A 44 -5.746 -5.983 2.179 1.00 21.33 C ATOM 141 CG2 ILE A 44 -6.047 -3.556 1.561 1.00 62.03 C ATOM 142 CD1 ILE A 44 -4.861 -6.333 0.999 1.00 40.44 C ATOM 0 H ILE A 44 -8.206 -6.712 2.810 1.00 33.00 H new ATOM 0 HA ILE A 44 -7.132 -4.360 3.952 1.00 1.21 H new ATOM 0 HB ILE A 44 -7.357 -5.159 1.019 1.00 73.15 H new ATOM 0 HG12 ILE A 44 -5.116 -5.676 3.014 1.00 21.33 H new ATOM 0 HG13 ILE A 44 -6.282 -6.877 2.496 1.00 21.33 H new ATOM 0 HG21 ILE A 44 -5.380 -3.707 0.712 1.00 62.03 H new ATOM 0 HG22 ILE A 44 -6.782 -2.791 1.313 1.00 62.03 H new ATOM 0 HG23 ILE A 44 -5.466 -3.234 2.426 1.00 62.03 H new ATOM 0 HD11 ILE A 44 -4.170 -7.126 1.285 1.00 40.44 H new ATOM 0 HD12 ILE A 44 -5.480 -6.672 0.168 1.00 40.44 H new ATOM 0 HD13 ILE A 44 -4.296 -5.452 0.694 1.00 40.44 H new ATOM 154 N MET A 45 -9.791 -3.979 1.997 1.00 32.22 N ATOM 155 CA MET A 45 -10.923 -3.085 1.713 1.00 53.11 C ATOM 156 C MET A 45 -11.700 -2.755 3.003 1.00 65.33 C ATOM 157 O MET A 45 -12.193 -1.639 3.180 1.00 21.12 O ATOM 158 CB MET A 45 -11.858 -3.726 0.679 1.00 12.14 C ATOM 159 CG MET A 45 -11.217 -3.988 -0.685 1.00 12.52 C ATOM 160 SD MET A 45 -10.882 -2.481 -1.635 1.00 4.04 S ATOM 161 CE MET A 45 -9.285 -1.963 -0.998 1.00 33.13 C ATOM 0 H MET A 45 -9.862 -4.898 1.559 1.00 32.22 H new ATOM 0 HA MET A 45 -10.529 -2.154 1.305 1.00 53.11 H new ATOM 0 HB2 MET A 45 -12.228 -4.670 1.079 1.00 12.14 H new ATOM 0 HB3 MET A 45 -12.723 -3.078 0.540 1.00 12.14 H new ATOM 0 HG2 MET A 45 -10.283 -4.530 -0.539 1.00 12.52 H new ATOM 0 HG3 MET A 45 -11.874 -4.635 -1.267 1.00 12.52 H new ATOM 0 HE1 MET A 45 -8.667 -1.598 -1.818 1.00 33.13 H new ATOM 0 HE2 MET A 45 -9.426 -1.166 -0.267 1.00 33.13 H new ATOM 0 HE3 MET A 45 -8.792 -2.810 -0.521 1.00 33.13 H new ATOM 171 N ASP A 46 -11.791 -3.740 3.898 1.00 1.30 N ATOM 172 CA ASP A 46 -12.420 -3.566 5.212 1.00 33.15 C ATOM 173 C ASP A 46 -11.720 -2.453 6.023 1.00 61.11 C ATOM 174 O ASP A 46 -12.367 -1.689 6.744 1.00 72.31 O ATOM 175 CB ASP A 46 -12.371 -4.902 5.971 1.00 74.44 C ATOM 176 CG ASP A 46 -13.075 -4.859 7.316 1.00 4.12 C ATOM 177 OD1 ASP A 46 -14.319 -4.809 7.339 1.00 14.14 O ATOM 178 OD2 ASP A 46 -12.390 -4.912 8.362 1.00 45.34 O ATOM 0 H ASP A 46 -11.432 -4.681 3.734 1.00 1.30 H new ATOM 0 HA ASP A 46 -13.458 -3.263 5.072 1.00 33.15 H new ATOM 0 HB2 ASP A 46 -12.827 -5.678 5.356 1.00 74.44 H new ATOM 0 HB3 ASP A 46 -11.330 -5.187 6.123 1.00 74.44 H new ATOM 183 N GLN A 47 -10.395 -2.369 5.886 1.00 41.14 N ATOM 184 CA GLN A 47 -9.607 -1.313 6.540 1.00 21.51 C ATOM 185 C GLN A 47 -9.765 0.033 5.810 1.00 74.44 C ATOM 186 O GLN A 47 -9.940 1.083 6.433 1.00 13.43 O ATOM 187 CB GLN A 47 -8.123 -1.711 6.580 1.00 61.11 C ATOM 188 CG GLN A 47 -7.216 -0.681 7.256 1.00 23.14 C ATOM 189 CD GLN A 47 -7.418 -0.588 8.765 1.00 71.13 C ATOM 190 OE1 GLN A 47 -8.498 -0.833 9.288 1.00 54.35 O ATOM 191 NE2 GLN A 47 -6.374 -0.211 9.480 1.00 14.54 N ATOM 0 H GLN A 47 -9.841 -3.019 5.328 1.00 41.14 H new ATOM 0 HA GLN A 47 -9.980 -1.196 7.558 1.00 21.51 H new ATOM 0 HB2 GLN A 47 -8.027 -2.662 7.104 1.00 61.11 H new ATOM 0 HB3 GLN A 47 -7.774 -1.872 5.560 1.00 61.11 H new ATOM 0 HG2 GLN A 47 -6.176 -0.935 7.052 1.00 23.14 H new ATOM 0 HG3 GLN A 47 -7.398 0.298 6.812 1.00 23.14 H new ATOM 0 HE21 GLN A 47 -5.485 -0.013 9.020 1.00 14.54 H new ATOM 0 HE22 GLN A 47 -6.456 -0.118 10.492 1.00 14.54 H new ATOM 200 N TYR A 48 -9.698 -0.006 4.480 1.00 41.13 N ATOM 201 CA TYR A 48 -9.872 1.195 3.654 1.00 13.22 C ATOM 202 C TYR A 48 -11.208 1.902 3.954 1.00 51.31 C ATOM 203 O TYR A 48 -11.266 3.129 4.029 1.00 54.12 O ATOM 204 CB TYR A 48 -9.782 0.817 2.168 1.00 5.01 C ATOM 205 CG TYR A 48 -10.153 1.936 1.205 1.00 23.31 C ATOM 206 CD1 TYR A 48 -9.708 3.242 1.404 1.00 52.35 C ATOM 207 CD2 TYR A 48 -10.954 1.682 0.097 1.00 31.22 C ATOM 208 CE1 TYR A 48 -10.050 4.255 0.525 1.00 64.32 C ATOM 209 CE2 TYR A 48 -11.297 2.690 -0.782 1.00 30.43 C ATOM 210 CZ TYR A 48 -10.844 3.973 -0.566 1.00 53.21 C ATOM 211 OH TYR A 48 -11.196 4.980 -1.443 1.00 60.34 O ATOM 0 H TYR A 48 -9.524 -0.858 3.947 1.00 41.13 H new ATOM 0 HA TYR A 48 -9.073 1.896 3.897 1.00 13.22 H new ATOM 0 HB2 TYR A 48 -8.765 0.491 1.951 1.00 5.01 H new ATOM 0 HB3 TYR A 48 -10.436 -0.035 1.983 1.00 5.01 H new ATOM 0 HD1 TYR A 48 -9.086 3.467 2.258 1.00 52.35 H new ATOM 0 HD2 TYR A 48 -11.314 0.679 -0.079 1.00 31.22 H new ATOM 0 HE1 TYR A 48 -9.696 5.262 0.693 1.00 64.32 H new ATOM 0 HE2 TYR A 48 -11.919 2.473 -1.638 1.00 30.43 H new ATOM 0 HH TYR A 48 -11.757 4.611 -2.157 1.00 60.34 H new ATOM 221 N ALA A 49 -12.270 1.120 4.141 1.00 34.24 N ATOM 222 CA ALA A 49 -13.589 1.670 4.480 1.00 12.34 C ATOM 223 C ALA A 49 -13.577 2.409 5.832 1.00 74.23 C ATOM 224 O ALA A 49 -14.436 3.248 6.101 1.00 52.51 O ATOM 225 CB ALA A 49 -14.629 0.555 4.503 1.00 5.10 C ATOM 0 H ALA A 49 -12.247 0.103 4.064 1.00 34.24 H new ATOM 0 HA ALA A 49 -13.849 2.397 3.711 1.00 12.34 H new ATOM 0 HB1 ALA A 49 -15.604 0.972 4.755 1.00 5.10 H new ATOM 0 HB2 ALA A 49 -14.679 0.084 3.521 1.00 5.10 H new ATOM 0 HB3 ALA A 49 -14.349 -0.189 5.249 1.00 5.10 H new ATOM 231 N ASP A 50 -12.598 2.087 6.674 1.00 0.51 N ATOM 232 CA ASP A 50 -12.467 2.707 7.995 1.00 13.23 C ATOM 233 C ASP A 50 -11.709 4.044 7.920 1.00 72.52 C ATOM 234 O ASP A 50 -12.084 5.025 8.566 1.00 24.24 O ATOM 235 CB ASP A 50 -11.737 1.744 8.932 1.00 22.33 C ATOM 236 CG ASP A 50 -11.652 2.266 10.356 1.00 42.41 C ATOM 237 OD1 ASP A 50 -12.708 2.408 11.004 1.00 32.32 O ATOM 238 OD2 ASP A 50 -10.533 2.559 10.825 1.00 54.31 O ATOM 0 H ASP A 50 -11.878 1.396 6.465 1.00 0.51 H new ATOM 0 HA ASP A 50 -13.466 2.916 8.378 1.00 13.23 H new ATOM 0 HB2 ASP A 50 -12.251 0.783 8.931 1.00 22.33 H new ATOM 0 HB3 ASP A 50 -10.730 1.567 8.553 1.00 22.33 H new ATOM 243 N TRP A 51 -10.632 4.071 7.140 1.00 63.22 N ATOM 244 CA TRP A 51 -9.811 5.277 6.994 1.00 22.02 C ATOM 245 C TRP A 51 -10.407 6.249 5.964 1.00 23.25 C ATOM 246 O TRP A 51 -10.582 7.434 6.253 1.00 63.13 O ATOM 247 CB TRP A 51 -8.371 4.890 6.630 1.00 22.32 C ATOM 248 CG TRP A 51 -7.670 4.194 7.765 1.00 54.24 C ATOM 249 CD1 TRP A 51 -7.843 2.901 8.170 1.00 53.42 C ATOM 250 CD2 TRP A 51 -6.709 4.766 8.661 1.00 64.32 C ATOM 251 NE1 TRP A 51 -7.054 2.641 9.264 1.00 31.50 N ATOM 252 CE2 TRP A 51 -6.345 3.765 9.581 1.00 61.41 C ATOM 253 CE3 TRP A 51 -6.121 6.026 8.773 1.00 14.25 C ATOM 254 CZ2 TRP A 51 -5.423 3.990 10.601 1.00 62.32 C ATOM 255 CZ3 TRP A 51 -5.206 6.247 9.783 1.00 30.02 C ATOM 256 CH2 TRP A 51 -4.864 5.234 10.685 1.00 12.10 C ATOM 0 H TRP A 51 -10.304 3.272 6.597 1.00 63.22 H new ATOM 0 HA TRP A 51 -9.800 5.800 7.950 1.00 22.02 H new ATOM 0 HB2 TRP A 51 -8.381 4.239 5.756 1.00 22.32 H new ATOM 0 HB3 TRP A 51 -7.814 5.785 6.354 1.00 22.32 H new ATOM 0 HD1 TRP A 51 -8.503 2.188 7.699 1.00 53.42 H new ATOM 0 HE1 TRP A 51 -7.005 1.751 9.760 1.00 31.50 H new ATOM 0 HE3 TRP A 51 -6.377 6.815 8.082 1.00 14.25 H new ATOM 0 HZ2 TRP A 51 -5.160 3.210 11.300 1.00 62.32 H new ATOM 0 HZ3 TRP A 51 -4.746 7.219 9.878 1.00 30.02 H new ATOM 0 HH2 TRP A 51 -4.144 5.439 11.463 1.00 12.10 H new ATOM 267 N LYS A 52 -10.729 5.736 4.781 1.00 2.03 N ATOM 268 CA LYS A 52 -11.387 6.528 3.723 1.00 62.24 C ATOM 269 C LYS A 52 -10.757 7.917 3.479 1.00 20.14 C ATOM 270 O LYS A 52 -11.209 8.925 4.026 1.00 11.50 O ATOM 271 CB LYS A 52 -12.878 6.673 4.053 1.00 5.12 C ATOM 272 CG LYS A 52 -13.698 5.432 3.717 1.00 22.21 C ATOM 273 CD LYS A 52 -14.081 5.394 2.239 1.00 75.44 C ATOM 274 CE LYS A 52 -15.022 6.543 1.883 1.00 12.12 C ATOM 275 NZ LYS A 52 -15.261 6.650 0.419 1.00 23.11 N ATOM 0 H LYS A 52 -10.547 4.767 4.520 1.00 2.03 H new ATOM 0 HA LYS A 52 -11.245 5.978 2.793 1.00 62.24 H new ATOM 0 HB2 LYS A 52 -12.987 6.895 5.115 1.00 5.12 H new ATOM 0 HB3 LYS A 52 -13.282 7.525 3.506 1.00 5.12 H new ATOM 0 HG2 LYS A 52 -13.126 4.539 3.968 1.00 22.21 H new ATOM 0 HG3 LYS A 52 -14.601 5.415 4.328 1.00 22.21 H new ATOM 0 HD2 LYS A 52 -13.182 5.454 1.626 1.00 75.44 H new ATOM 0 HD3 LYS A 52 -14.561 4.443 2.009 1.00 75.44 H new ATOM 0 HE2 LYS A 52 -15.974 6.400 2.394 1.00 12.12 H new ATOM 0 HE3 LYS A 52 -14.601 7.480 2.249 1.00 12.12 H new ATOM 0 HZ1 LYS A 52 -15.905 7.444 0.230 1.00 23.11 H new ATOM 0 HZ2 LYS A 52 -14.357 6.813 -0.069 1.00 23.11 H new ATOM 0 HZ3 LYS A 52 -15.688 5.768 0.071 1.00 23.11 H new ATOM 289 N GLY A 53 -9.716 7.958 2.646 1.00 63.51 N ATOM 290 CA GLY A 53 -9.143 9.229 2.202 1.00 72.34 C ATOM 291 C GLY A 53 -8.560 10.106 3.311 1.00 54.22 C ATOM 292 O GLY A 53 -8.698 11.330 3.268 1.00 21.14 O ATOM 0 H GLY A 53 -9.255 7.131 2.267 1.00 63.51 H new ATOM 0 HA2 GLY A 53 -8.358 9.020 1.476 1.00 72.34 H new ATOM 0 HA3 GLY A 53 -9.916 9.795 1.682 1.00 72.34 H new ATOM 296 N VAL A 54 -7.907 9.498 4.301 1.00 53.32 N ATOM 297 CA VAL A 54 -7.186 10.267 5.323 1.00 21.24 C ATOM 298 C VAL A 54 -5.958 10.957 4.704 1.00 31.02 C ATOM 299 O VAL A 54 -5.185 10.325 3.983 1.00 54.10 O ATOM 300 CB VAL A 54 -6.743 9.371 6.513 1.00 71.12 C ATOM 301 CG1 VAL A 54 -5.964 10.181 7.547 1.00 52.51 C ATOM 302 CG2 VAL A 54 -7.957 8.701 7.157 1.00 2.42 C ATOM 0 H VAL A 54 -7.860 8.486 4.420 1.00 53.32 H new ATOM 0 HA VAL A 54 -7.872 11.022 5.708 1.00 21.24 H new ATOM 0 HB VAL A 54 -6.082 8.595 6.127 1.00 71.12 H new ATOM 0 HG11 VAL A 54 -5.666 9.531 8.369 1.00 52.51 H new ATOM 0 HG12 VAL A 54 -5.076 10.607 7.081 1.00 52.51 H new ATOM 0 HG13 VAL A 54 -6.594 10.984 7.930 1.00 52.51 H new ATOM 0 HG21 VAL A 54 -7.630 8.077 7.989 1.00 2.42 H new ATOM 0 HG22 VAL A 54 -8.642 9.465 7.524 1.00 2.42 H new ATOM 0 HG23 VAL A 54 -8.466 8.082 6.418 1.00 2.42 H new ATOM 312 N ARG A 55 -5.801 12.251 4.976 1.00 41.14 N ATOM 313 CA ARG A 55 -4.743 13.066 4.358 1.00 55.11 C ATOM 314 C ARG A 55 -3.324 12.594 4.734 1.00 63.20 C ATOM 315 O ARG A 55 -3.108 11.989 5.783 1.00 72.53 O ATOM 316 CB ARG A 55 -4.924 14.541 4.745 1.00 1.23 C ATOM 317 CG ARG A 55 -4.643 14.845 6.217 1.00 23.02 C ATOM 318 CD ARG A 55 -4.937 16.303 6.559 1.00 20.12 C ATOM 319 NE ARG A 55 -4.308 17.233 5.620 1.00 31.30 N ATOM 320 CZ ARG A 55 -3.426 18.141 5.947 1.00 10.11 C ATOM 321 NH1 ARG A 55 -3.023 18.267 7.176 1.00 64.34 N ATOM 322 NH2 ARG A 55 -2.944 18.922 5.035 1.00 33.24 N ATOM 0 H ARG A 55 -6.396 12.766 5.625 1.00 41.14 H new ATOM 0 HA ARG A 55 -4.841 12.947 3.279 1.00 55.11 H new ATOM 0 HB2 ARG A 55 -4.263 15.150 4.128 1.00 1.23 H new ATOM 0 HB3 ARG A 55 -5.945 14.843 4.512 1.00 1.23 H new ATOM 0 HG2 ARG A 55 -5.251 14.194 6.845 1.00 23.02 H new ATOM 0 HG3 ARG A 55 -3.600 14.622 6.442 1.00 23.02 H new ATOM 0 HD2 ARG A 55 -6.015 16.463 6.558 1.00 20.12 H new ATOM 0 HD3 ARG A 55 -4.584 16.515 7.568 1.00 20.12 H new ATOM 0 HE ARG A 55 -4.578 17.168 4.638 1.00 31.30 H new ATOM 0 HH11 ARG A 55 -3.395 17.653 7.900 1.00 64.34 H new ATOM 0 HH12 ARG A 55 -2.334 18.980 7.416 1.00 64.34 H new ATOM 0 HH21 ARG A 55 -3.252 18.827 4.067 1.00 33.24 H new ATOM 0 HH22 ARG A 55 -2.256 19.632 5.284 1.00 33.24 H new ATOM 336 N TYR A 56 -2.362 12.910 3.869 1.00 3.44 N ATOM 337 CA TYR A 56 -0.960 12.500 4.041 1.00 13.34 C ATOM 338 C TYR A 56 -0.300 13.203 5.246 1.00 5.13 C ATOM 339 O TYR A 56 -0.213 14.433 5.294 1.00 11.52 O ATOM 340 CB TYR A 56 -0.187 12.821 2.752 1.00 62.31 C ATOM 341 CG TYR A 56 1.234 12.278 2.694 1.00 14.35 C ATOM 342 CD1 TYR A 56 2.306 13.004 3.207 1.00 32.12 C ATOM 343 CD2 TYR A 56 1.506 11.047 2.102 1.00 12.31 C ATOM 344 CE1 TYR A 56 3.597 12.517 3.138 1.00 1.44 C ATOM 345 CE2 TYR A 56 2.797 10.557 2.028 1.00 10.43 C ATOM 346 CZ TYR A 56 3.838 11.295 2.548 1.00 12.22 C ATOM 347 OH TYR A 56 5.128 10.811 2.476 1.00 71.15 O ATOM 0 H TYR A 56 -2.528 13.459 3.025 1.00 3.44 H new ATOM 0 HA TYR A 56 -0.934 11.429 4.240 1.00 13.34 H new ATOM 0 HB2 TYR A 56 -0.745 12.423 1.904 1.00 62.31 H new ATOM 0 HB3 TYR A 56 -0.150 13.904 2.630 1.00 62.31 H new ATOM 0 HD1 TYR A 56 2.125 13.964 3.667 1.00 32.12 H new ATOM 0 HD2 TYR A 56 0.694 10.464 1.693 1.00 12.31 H new ATOM 0 HE1 TYR A 56 4.415 13.092 3.545 1.00 1.44 H new ATOM 0 HE2 TYR A 56 2.988 9.600 1.565 1.00 10.43 H new ATOM 0 HH TYR A 56 5.125 9.937 2.032 1.00 71.15 H new ATOM 357 N ARG A 57 0.162 12.415 6.215 1.00 74.32 N ATOM 358 CA ARG A 57 0.869 12.943 7.393 1.00 12.20 C ATOM 359 C ARG A 57 2.094 12.076 7.726 1.00 20.15 C ATOM 360 O ARG A 57 1.968 10.876 7.953 1.00 72.11 O ATOM 361 CB ARG A 57 -0.071 13.000 8.601 1.00 74.45 C ATOM 362 CG ARG A 57 0.601 13.458 9.893 1.00 72.32 C ATOM 363 CD ARG A 57 -0.356 13.422 11.081 1.00 23.51 C ATOM 364 NE ARG A 57 -1.444 14.394 10.955 1.00 53.31 N ATOM 365 CZ ARG A 57 -1.651 15.369 11.797 1.00 25.01 C ATOM 366 NH1 ARG A 57 -0.849 15.553 12.801 1.00 71.03 N ATOM 367 NH2 ARG A 57 -2.654 16.170 11.632 1.00 70.53 N ATOM 0 H ARG A 57 0.061 11.400 6.212 1.00 74.32 H new ATOM 0 HA ARG A 57 1.208 13.952 7.159 1.00 12.20 H new ATOM 0 HB2 ARG A 57 -0.896 13.675 8.374 1.00 74.45 H new ATOM 0 HB3 ARG A 57 -0.502 12.012 8.759 1.00 74.45 H new ATOM 0 HG2 ARG A 57 1.460 12.820 10.100 1.00 72.32 H new ATOM 0 HG3 ARG A 57 0.981 14.472 9.764 1.00 72.32 H new ATOM 0 HD2 ARG A 57 -0.777 12.421 11.174 1.00 23.51 H new ATOM 0 HD3 ARG A 57 0.200 13.621 11.997 1.00 23.51 H new ATOM 0 HE ARG A 57 -2.078 14.303 10.161 1.00 53.31 H new ATOM 0 HH11 ARG A 57 -0.050 14.933 12.936 1.00 71.03 H new ATOM 0 HH12 ARG A 57 -1.018 16.317 13.455 1.00 71.03 H new ATOM 0 HH21 ARG A 57 -3.286 16.040 10.842 1.00 70.53 H new ATOM 0 HH22 ARG A 57 -2.813 16.931 12.292 1.00 70.53 H new ATOM 381 N LEU A 58 3.269 12.697 7.778 1.00 71.04 N ATOM 382 CA LEU A 58 4.525 11.966 7.984 1.00 34.20 C ATOM 383 C LEU A 58 4.640 11.399 9.412 1.00 43.34 C ATOM 384 O LEU A 58 4.711 12.149 10.393 1.00 64.31 O ATOM 385 CB LEU A 58 5.737 12.874 7.690 1.00 51.04 C ATOM 386 CG LEU A 58 5.882 13.368 6.232 1.00 50.14 C ATOM 387 CD1 LEU A 58 4.799 14.387 5.879 1.00 71.14 C ATOM 388 CD2 LEU A 58 7.272 13.958 5.992 1.00 63.11 C ATOM 0 H LEU A 58 3.382 13.706 7.681 1.00 71.04 H new ATOM 0 HA LEU A 58 4.520 11.127 7.288 1.00 34.20 H new ATOM 0 HB2 LEU A 58 5.679 13.745 8.343 1.00 51.04 H new ATOM 0 HB3 LEU A 58 6.644 12.333 7.960 1.00 51.04 H new ATOM 0 HG LEU A 58 5.756 12.505 5.578 1.00 50.14 H new ATOM 0 HD11 LEU A 58 4.930 14.714 4.847 1.00 71.14 H new ATOM 0 HD12 LEU A 58 3.817 13.928 5.993 1.00 71.14 H new ATOM 0 HD13 LEU A 58 4.877 15.246 6.545 1.00 71.14 H new ATOM 0 HD21 LEU A 58 7.349 14.298 4.959 1.00 63.11 H new ATOM 0 HD22 LEU A 58 7.431 14.801 6.665 1.00 63.11 H new ATOM 0 HD23 LEU A 58 8.028 13.196 6.180 1.00 63.11 H new ATOM 400 N GLY A 59 4.634 10.071 9.524 1.00 51.41 N ATOM 401 CA GLY A 59 4.891 9.413 10.802 1.00 12.44 C ATOM 402 C GLY A 59 3.667 9.308 11.707 1.00 22.31 C ATOM 403 O GLY A 59 3.301 8.214 12.145 1.00 1.44 O ATOM 0 H GLY A 59 4.455 9.433 8.748 1.00 51.41 H new ATOM 0 HA2 GLY A 59 5.275 8.411 10.611 1.00 12.44 H new ATOM 0 HA3 GLY A 59 5.673 9.960 11.329 1.00 12.44 H new ATOM 407 N GLY A 60 3.044 10.446 12.010 1.00 34.13 N ATOM 408 CA GLY A 60 1.889 10.462 12.903 1.00 72.31 C ATOM 409 C GLY A 60 0.674 9.737 12.329 1.00 71.15 C ATOM 410 O GLY A 60 -0.225 10.364 11.779 1.00 72.31 O ATOM 0 H GLY A 60 3.318 11.361 11.653 1.00 34.13 H new ATOM 0 HA2 GLY A 60 2.165 10.001 13.851 1.00 72.31 H new ATOM 0 HA3 GLY A 60 1.619 11.496 13.118 1.00 72.31 H new ATOM 414 N SER A 61 0.651 8.413 12.468 1.00 22.41 N ATOM 415 CA SER A 61 -0.424 7.590 11.901 1.00 24.10 C ATOM 416 C SER A 61 -1.712 7.677 12.736 1.00 2.41 C ATOM 417 O SER A 61 -1.773 7.186 13.867 1.00 13.52 O ATOM 418 CB SER A 61 0.025 6.124 11.789 1.00 73.55 C ATOM 419 OG SER A 61 0.177 5.514 13.067 1.00 4.11 O ATOM 0 H SER A 61 1.364 7.883 12.969 1.00 22.41 H new ATOM 0 HA SER A 61 -0.641 7.980 10.907 1.00 24.10 H new ATOM 0 HB2 SER A 61 -0.706 5.565 11.205 1.00 73.55 H new ATOM 0 HB3 SER A 61 0.970 6.075 11.249 1.00 73.55 H new ATOM 0 HG SER A 61 -0.208 6.096 13.755 1.00 4.11 H new ATOM 425 N THR A 62 -2.737 8.316 12.175 1.00 50.32 N ATOM 426 CA THR A 62 -4.038 8.459 12.850 1.00 45.31 C ATOM 427 C THR A 62 -5.124 8.954 11.882 1.00 21.01 C ATOM 428 O THR A 62 -4.843 9.296 10.736 1.00 44.11 O ATOM 429 CB THR A 62 -3.948 9.441 14.048 1.00 10.35 C ATOM 430 OG1 THR A 62 -5.240 9.622 14.651 1.00 63.42 O ATOM 431 CG2 THR A 62 -3.391 10.795 13.614 1.00 23.41 C ATOM 0 H THR A 62 -2.697 8.747 11.251 1.00 50.32 H new ATOM 0 HA THR A 62 -4.309 7.468 13.215 1.00 45.31 H new ATOM 0 HB THR A 62 -3.268 9.005 14.779 1.00 10.35 H new ATOM 0 HG1 THR A 62 -5.165 10.243 15.406 1.00 63.42 H new ATOM 0 HG21 THR A 62 -3.340 11.461 14.476 1.00 23.41 H new ATOM 0 HG22 THR A 62 -2.392 10.661 13.199 1.00 23.41 H new ATOM 0 HG23 THR A 62 -4.043 11.231 12.857 1.00 23.41 H new ATOM 439 N LYS A 63 -6.372 8.994 12.347 1.00 53.43 N ATOM 440 CA LYS A 63 -7.484 9.501 11.528 1.00 31.03 C ATOM 441 C LYS A 63 -7.373 11.024 11.308 1.00 22.22 C ATOM 442 O LYS A 63 -8.141 11.615 10.547 1.00 25.13 O ATOM 443 CB LYS A 63 -8.828 9.142 12.177 1.00 54.51 C ATOM 444 CG LYS A 63 -9.110 7.640 12.213 1.00 22.52 C ATOM 445 CD LYS A 63 -9.139 7.033 10.808 1.00 3.42 C ATOM 446 CE LYS A 63 -9.444 5.535 10.833 1.00 40.10 C ATOM 447 NZ LYS A 63 -10.833 5.240 11.278 1.00 50.01 N ATOM 0 H LYS A 63 -6.643 8.684 13.280 1.00 53.43 H new ATOM 0 HA LYS A 63 -7.428 9.023 10.550 1.00 31.03 H new ATOM 0 HB2 LYS A 63 -8.845 9.531 13.195 1.00 54.51 H new ATOM 0 HB3 LYS A 63 -9.630 9.640 11.632 1.00 54.51 H new ATOM 0 HG2 LYS A 63 -8.346 7.141 12.809 1.00 22.52 H new ATOM 0 HG3 LYS A 63 -10.066 7.461 12.706 1.00 22.52 H new ATOM 0 HD2 LYS A 63 -9.891 7.545 10.208 1.00 3.42 H new ATOM 0 HD3 LYS A 63 -8.177 7.198 10.323 1.00 3.42 H new ATOM 0 HE2 LYS A 63 -9.290 5.120 9.837 1.00 40.10 H new ATOM 0 HE3 LYS A 63 -8.740 5.036 11.499 1.00 40.10 H new ATOM 0 HZ1 LYS A 63 -10.896 4.248 11.585 1.00 50.01 H new ATOM 0 HZ2 LYS A 63 -11.084 5.865 12.071 1.00 50.01 H new ATOM 0 HZ3 LYS A 63 -11.492 5.400 10.489 1.00 50.01 H new ATOM 461 N LYS A 64 -6.412 11.648 11.988 1.00 13.42 N ATOM 462 CA LYS A 64 -6.098 13.068 11.781 1.00 41.53 C ATOM 463 C LYS A 64 -4.967 13.237 10.747 1.00 31.03 C ATOM 464 O LYS A 64 -4.449 14.338 10.543 1.00 61.21 O ATOM 465 CB LYS A 64 -5.697 13.713 13.114 1.00 40.23 C ATOM 466 CG LYS A 64 -6.798 13.677 14.172 1.00 22.45 C ATOM 467 CD LYS A 64 -8.025 14.480 13.741 1.00 41.51 C ATOM 468 CE LYS A 64 -9.126 14.465 14.797 1.00 12.23 C ATOM 469 NZ LYS A 64 -10.278 15.324 14.409 1.00 43.33 N ATOM 0 H LYS A 64 -5.832 11.192 12.692 1.00 13.42 H new ATOM 0 HA LYS A 64 -6.988 13.565 11.395 1.00 41.53 H new ATOM 0 HB2 LYS A 64 -4.815 13.203 13.503 1.00 40.23 H new ATOM 0 HB3 LYS A 64 -5.412 14.750 12.934 1.00 40.23 H new ATOM 0 HG2 LYS A 64 -7.088 12.643 14.360 1.00 22.45 H new ATOM 0 HG3 LYS A 64 -6.414 14.076 15.111 1.00 22.45 H new ATOM 0 HD2 LYS A 64 -7.730 15.510 13.541 1.00 41.51 H new ATOM 0 HD3 LYS A 64 -8.414 14.073 12.808 1.00 41.51 H new ATOM 0 HE2 LYS A 64 -9.470 13.442 14.948 1.00 12.23 H new ATOM 0 HE3 LYS A 64 -8.721 14.809 15.749 1.00 12.23 H new ATOM 0 HZ1 LYS A 64 -11.005 15.287 15.152 1.00 43.33 H new ATOM 0 HZ2 LYS A 64 -9.955 16.305 14.290 1.00 43.33 H new ATOM 0 HZ3 LYS A 64 -10.681 14.981 13.514 1.00 43.33 H new ATOM 483 N GLY A 65 -4.591 12.135 10.103 1.00 40.31 N ATOM 484 CA GLY A 65 -3.531 12.164 9.100 1.00 55.50 C ATOM 485 C GLY A 65 -2.656 10.912 9.131 1.00 60.22 C ATOM 486 O GLY A 65 -2.384 10.365 10.198 1.00 63.11 O ATOM 0 H GLY A 65 -5.003 11.215 10.257 1.00 40.31 H new ATOM 0 HA2 GLY A 65 -3.976 12.267 8.110 1.00 55.50 H new ATOM 0 HA3 GLY A 65 -2.907 13.043 9.262 1.00 55.50 H new ATOM 490 N ILE A 66 -2.210 10.462 7.961 1.00 74.34 N ATOM 491 CA ILE A 66 -1.343 9.283 7.859 1.00 62.45 C ATOM 492 C ILE A 66 -0.654 9.226 6.480 1.00 43.22 C ATOM 493 O ILE A 66 -1.281 9.478 5.453 1.00 61.22 O ATOM 494 CB ILE A 66 -2.155 7.982 8.114 1.00 72.12 C ATOM 495 CG1 ILE A 66 -1.222 6.773 8.261 1.00 62.34 C ATOM 496 CG2 ILE A 66 -3.175 7.740 7.000 1.00 20.24 C ATOM 497 CD1 ILE A 66 -1.929 5.520 8.739 1.00 45.33 C ATOM 0 H ILE A 66 -2.434 10.895 7.065 1.00 74.34 H new ATOM 0 HA ILE A 66 -0.571 9.364 8.624 1.00 62.45 H new ATOM 0 HB ILE A 66 -2.700 8.110 9.049 1.00 72.12 H new ATOM 0 HG12 ILE A 66 -0.749 6.570 7.300 1.00 62.34 H new ATOM 0 HG13 ILE A 66 -0.425 7.022 8.962 1.00 62.34 H new ATOM 0 HG21 ILE A 66 -3.728 6.823 7.206 1.00 20.24 H new ATOM 0 HG22 ILE A 66 -3.869 8.579 6.953 1.00 20.24 H new ATOM 0 HG23 ILE A 66 -2.656 7.645 6.046 1.00 20.24 H new ATOM 0 HD11 ILE A 66 -1.210 4.705 8.820 1.00 45.33 H new ATOM 0 HD12 ILE A 66 -2.379 5.706 9.714 1.00 45.33 H new ATOM 0 HD13 ILE A 66 -2.707 5.247 8.026 1.00 45.33 H new ATOM 509 N ASP A 67 0.647 8.935 6.460 1.00 75.12 N ATOM 510 CA ASP A 67 1.411 8.917 5.203 1.00 12.14 C ATOM 511 C ASP A 67 1.312 7.565 4.476 1.00 35.23 C ATOM 512 O ASP A 67 0.695 6.617 4.966 1.00 21.53 O ATOM 513 CB ASP A 67 2.883 9.262 5.470 1.00 30.42 C ATOM 514 CG ASP A 67 3.592 8.210 6.300 1.00 54.13 C ATOM 515 OD1 ASP A 67 3.454 8.229 7.537 1.00 3.12 O ATOM 516 OD2 ASP A 67 4.284 7.352 5.710 1.00 62.44 O ATOM 0 H ASP A 67 1.194 8.710 7.291 1.00 75.12 H new ATOM 0 HA ASP A 67 0.971 9.671 4.550 1.00 12.14 H new ATOM 0 HB2 ASP A 67 3.402 9.378 4.519 1.00 30.42 H new ATOM 0 HB3 ASP A 67 2.939 10.222 5.983 1.00 30.42 H new ATOM 521 N CYS A 68 1.931 7.496 3.296 1.00 32.34 N ATOM 522 CA CYS A 68 1.954 6.275 2.480 1.00 50.31 C ATOM 523 C CYS A 68 2.446 5.058 3.281 1.00 71.31 C ATOM 524 O CYS A 68 1.739 4.051 3.399 1.00 51.00 O ATOM 525 CB CYS A 68 2.851 6.482 1.255 1.00 13.40 C ATOM 526 SG CYS A 68 3.137 4.986 0.284 1.00 51.01 S ATOM 0 H CYS A 68 2.430 8.281 2.878 1.00 32.34 H new ATOM 0 HA CYS A 68 0.931 6.074 2.162 1.00 50.31 H new ATOM 0 HB2 CYS A 68 2.400 7.238 0.612 1.00 13.40 H new ATOM 0 HB3 CYS A 68 3.812 6.876 1.585 1.00 13.40 H new ATOM 0 HG CYS A 68 2.018 4.596 -0.251 1.00 51.01 H new ATOM 532 N SER A 69 3.652 5.162 3.838 1.00 73.42 N ATOM 533 CA SER A 69 4.241 4.072 4.629 1.00 25.34 C ATOM 534 C SER A 69 3.435 3.827 5.911 1.00 71.24 C ATOM 535 O SER A 69 3.296 2.691 6.370 1.00 14.34 O ATOM 536 CB SER A 69 5.695 4.396 4.995 1.00 74.41 C ATOM 537 OG SER A 69 6.470 4.685 3.841 1.00 23.44 O ATOM 0 H SER A 69 4.244 5.989 3.758 1.00 73.42 H new ATOM 0 HA SER A 69 4.216 3.169 4.019 1.00 25.34 H new ATOM 0 HB2 SER A 69 5.719 5.249 5.674 1.00 74.41 H new ATOM 0 HB3 SER A 69 6.134 3.552 5.527 1.00 74.41 H new ATOM 0 HG SER A 69 6.957 5.525 3.976 1.00 23.44 H new ATOM 543 N GLY A 70 2.908 4.906 6.482 1.00 61.22 N ATOM 544 CA GLY A 70 2.083 4.806 7.674 1.00 65.23 C ATOM 545 C GLY A 70 0.822 3.976 7.461 1.00 1.35 C ATOM 546 O GLY A 70 0.483 3.122 8.285 1.00 32.41 O ATOM 0 H GLY A 70 3.039 5.857 6.137 1.00 61.22 H new ATOM 0 HA2 GLY A 70 2.670 4.364 8.479 1.00 65.23 H new ATOM 0 HA3 GLY A 70 1.801 5.808 7.998 1.00 65.23 H new ATOM 550 N PHE A 71 0.122 4.221 6.354 1.00 73.30 N ATOM 551 CA PHE A 71 -1.124 3.512 6.061 1.00 43.45 C ATOM 552 C PHE A 71 -0.888 2.010 5.853 1.00 4.22 C ATOM 553 O PHE A 71 -1.585 1.177 6.438 1.00 54.55 O ATOM 554 CB PHE A 71 -1.819 4.108 4.828 1.00 14.03 C ATOM 555 CG PHE A 71 -3.104 3.399 4.472 1.00 62.43 C ATOM 556 CD1 PHE A 71 -4.233 3.538 5.268 1.00 71.13 C ATOM 557 CD2 PHE A 71 -3.177 2.581 3.353 1.00 35.13 C ATOM 558 CE1 PHE A 71 -5.405 2.881 4.954 1.00 63.44 C ATOM 559 CE2 PHE A 71 -4.347 1.920 3.037 1.00 2.14 C ATOM 560 CZ PHE A 71 -5.463 2.069 3.837 1.00 24.35 C ATOM 0 H PHE A 71 0.395 4.903 5.647 1.00 73.30 H new ATOM 0 HA PHE A 71 -1.773 3.637 6.928 1.00 43.45 H new ATOM 0 HB2 PHE A 71 -2.031 5.161 5.011 1.00 14.03 H new ATOM 0 HB3 PHE A 71 -1.139 4.063 3.978 1.00 14.03 H new ATOM 0 HD1 PHE A 71 -4.193 4.168 6.144 1.00 71.13 H new ATOM 0 HD2 PHE A 71 -2.309 2.460 2.722 1.00 35.13 H new ATOM 0 HE1 PHE A 71 -6.276 3.001 5.581 1.00 63.44 H new ATOM 0 HE2 PHE A 71 -4.390 1.286 2.164 1.00 2.14 H new ATOM 0 HZ PHE A 71 -6.379 1.552 3.590 1.00 24.35 H new ATOM 570 N VAL A 72 0.094 1.666 5.022 1.00 35.13 N ATOM 571 CA VAL A 72 0.373 0.262 4.712 1.00 1.03 C ATOM 572 C VAL A 72 0.745 -0.547 5.970 1.00 64.35 C ATOM 573 O VAL A 72 0.149 -1.594 6.232 1.00 51.11 O ATOM 574 CB VAL A 72 1.479 0.113 3.629 1.00 64.50 C ATOM 575 CG1 VAL A 72 2.761 0.822 4.041 1.00 25.04 C ATOM 576 CG2 VAL A 72 1.747 -1.357 3.329 1.00 12.11 C ATOM 0 H VAL A 72 0.707 2.333 4.553 1.00 35.13 H new ATOM 0 HA VAL A 72 -0.553 -0.149 4.309 1.00 1.03 H new ATOM 0 HB VAL A 72 1.116 0.589 2.718 1.00 64.50 H new ATOM 0 HG11 VAL A 72 3.512 0.697 3.261 1.00 25.04 H new ATOM 0 HG12 VAL A 72 2.560 1.884 4.185 1.00 25.04 H new ATOM 0 HG13 VAL A 72 3.131 0.393 4.973 1.00 25.04 H new ATOM 0 HG21 VAL A 72 2.524 -1.437 2.569 1.00 12.11 H new ATOM 0 HG22 VAL A 72 2.076 -1.860 4.238 1.00 12.11 H new ATOM 0 HG23 VAL A 72 0.833 -1.827 2.965 1.00 12.11 H new ATOM 586 N GLN A 73 1.696 -0.046 6.767 1.00 52.30 N ATOM 587 CA GLN A 73 2.131 -0.755 7.980 1.00 34.11 C ATOM 588 C GLN A 73 0.953 -0.997 8.937 1.00 24.23 C ATOM 589 O GLN A 73 0.823 -2.074 9.530 1.00 53.12 O ATOM 590 CB GLN A 73 3.247 0.021 8.707 1.00 13.11 C ATOM 591 CG GLN A 73 2.812 1.374 9.267 1.00 44.01 C ATOM 592 CD GLN A 73 3.880 2.054 10.108 1.00 22.24 C ATOM 593 OE1 GLN A 73 3.870 3.369 10.132 1.00 51.24 O flip ATOM 594 NE2 GLN A 73 4.700 1.407 10.741 1.00 1.51 N flip ATOM 0 H GLN A 73 2.176 0.838 6.598 1.00 52.30 H new ATOM 0 HA GLN A 73 2.526 -1.721 7.665 1.00 34.11 H new ATOM 0 HB2 GLN A 73 3.626 -0.592 9.525 1.00 13.11 H new ATOM 0 HB3 GLN A 73 4.075 0.177 8.015 1.00 13.11 H new ATOM 0 HG2 GLN A 73 2.540 2.030 8.440 1.00 44.01 H new ATOM 0 HG3 GLN A 73 1.916 1.237 9.873 1.00 44.01 H new ATOM 0 HE21 GLN A 73 4.684 0.388 10.704 1.00 1.51 H new ATOM 0 HE22 GLN A 73 5.401 1.886 11.307 1.00 1.51 H new ATOM 603 N ARG A 74 0.081 0.006 9.080 1.00 42.14 N ATOM 604 CA ARG A 74 -1.070 -0.127 9.969 1.00 35.51 C ATOM 605 C ARG A 74 -2.121 -1.081 9.401 1.00 52.00 C ATOM 606 O ARG A 74 -2.572 -1.973 10.101 1.00 62.44 O ATOM 607 CB ARG A 74 -1.699 1.229 10.294 1.00 64.10 C ATOM 608 CG ARG A 74 -0.769 2.151 11.080 1.00 3.41 C ATOM 609 CD ARG A 74 -1.539 3.106 11.983 1.00 72.33 C ATOM 610 NE ARG A 74 -2.195 2.412 13.088 1.00 40.11 N ATOM 611 CZ ARG A 74 -2.327 2.907 14.287 1.00 65.34 C ATOM 612 NH1 ARG A 74 -1.813 4.059 14.588 1.00 22.44 N ATOM 613 NH2 ARG A 74 -2.950 2.226 15.196 1.00 0.54 N ATOM 0 H ARG A 74 0.150 0.903 8.599 1.00 42.14 H new ATOM 0 HA ARG A 74 -0.694 -0.555 10.898 1.00 35.51 H new ATOM 0 HB2 ARG A 74 -1.987 1.721 9.365 1.00 64.10 H new ATOM 0 HB3 ARG A 74 -2.612 1.070 10.867 1.00 64.10 H new ATOM 0 HG2 ARG A 74 -0.089 1.550 11.684 1.00 3.41 H new ATOM 0 HG3 ARG A 74 -0.156 2.725 10.385 1.00 3.41 H new ATOM 0 HD2 ARG A 74 -0.856 3.856 12.382 1.00 72.33 H new ATOM 0 HD3 ARG A 74 -2.287 3.637 11.394 1.00 72.33 H new ATOM 0 HE ARG A 74 -2.574 1.482 12.911 1.00 40.11 H new ATOM 0 HH11 ARG A 74 -1.299 4.588 13.883 1.00 22.44 H new ATOM 0 HH12 ARG A 74 -1.923 4.436 15.529 1.00 22.44 H new ATOM 0 HH21 ARG A 74 -3.334 1.308 14.972 1.00 0.54 H new ATOM 0 HH22 ARG A 74 -3.057 2.608 16.136 1.00 0.54 H new ATOM 627 N THR A 75 -2.495 -0.911 8.139 1.00 62.13 N ATOM 628 CA THR A 75 -3.500 -1.786 7.507 1.00 40.54 C ATOM 629 C THR A 75 -3.221 -3.271 7.797 1.00 4.31 C ATOM 630 O THR A 75 -4.120 -4.024 8.185 1.00 51.10 O ATOM 631 CB THR A 75 -3.561 -1.571 5.974 1.00 51.11 C ATOM 632 OG1 THR A 75 -3.929 -0.213 5.687 1.00 35.30 O ATOM 633 CG2 THR A 75 -4.559 -2.521 5.309 1.00 31.30 C ATOM 0 H THR A 75 -2.126 -0.182 7.528 1.00 62.13 H new ATOM 0 HA THR A 75 -4.462 -1.514 7.942 1.00 40.54 H new ATOM 0 HB THR A 75 -2.571 -1.783 5.570 1.00 51.11 H new ATOM 0 HG1 THR A 75 -3.183 0.382 5.911 1.00 35.30 H new ATOM 0 HG21 THR A 75 -4.573 -2.340 4.234 1.00 31.30 H new ATOM 0 HG22 THR A 75 -4.262 -3.552 5.499 1.00 31.30 H new ATOM 0 HG23 THR A 75 -5.554 -2.349 5.719 1.00 31.30 H new ATOM 641 N PHE A 76 -1.961 -3.676 7.639 1.00 75.01 N ATOM 642 CA PHE A 76 -1.554 -5.060 7.893 1.00 41.05 C ATOM 643 C PHE A 76 -1.639 -5.440 9.386 1.00 1.21 C ATOM 644 O PHE A 76 -2.131 -6.519 9.720 1.00 70.15 O ATOM 645 CB PHE A 76 -0.139 -5.307 7.350 1.00 33.32 C ATOM 646 CG PHE A 76 -0.090 -5.477 5.851 1.00 32.25 C ATOM 647 CD1 PHE A 76 -0.373 -6.708 5.278 1.00 22.52 C ATOM 648 CD2 PHE A 76 0.228 -4.415 5.019 1.00 2.31 C ATOM 649 CE1 PHE A 76 -0.339 -6.877 3.907 1.00 64.53 C ATOM 650 CE2 PHE A 76 0.260 -4.577 3.647 1.00 3.12 C ATOM 651 CZ PHE A 76 -0.022 -5.810 3.089 1.00 73.22 C ATOM 0 H PHE A 76 -1.203 -3.065 7.336 1.00 75.01 H new ATOM 0 HA PHE A 76 -2.258 -5.703 7.366 1.00 41.05 H new ATOM 0 HB2 PHE A 76 0.501 -4.472 7.634 1.00 33.32 H new ATOM 0 HB3 PHE A 76 0.272 -6.199 7.822 1.00 33.32 H new ATOM 0 HD1 PHE A 76 -0.623 -7.546 5.912 1.00 22.52 H new ATOM 0 HD2 PHE A 76 0.453 -3.450 5.448 1.00 2.31 H new ATOM 0 HE1 PHE A 76 -0.560 -7.842 3.476 1.00 64.53 H new ATOM 0 HE2 PHE A 76 0.505 -3.740 3.010 1.00 3.12 H new ATOM 0 HZ PHE A 76 0.005 -5.939 2.017 1.00 73.22 H new ATOM 661 N ARG A 77 -1.170 -4.572 10.287 1.00 11.01 N ATOM 662 CA ARG A 77 -1.205 -4.894 11.728 1.00 35.04 C ATOM 663 C ARG A 77 -2.633 -4.809 12.313 1.00 31.43 C ATOM 664 O ARG A 77 -3.040 -5.676 13.084 1.00 20.32 O ATOM 665 CB ARG A 77 -0.257 -3.994 12.534 1.00 65.41 C ATOM 666 CG ARG A 77 -0.674 -2.531 12.585 1.00 23.41 C ATOM 667 CD ARG A 77 0.135 -1.743 13.607 1.00 75.53 C ATOM 668 NE ARG A 77 0.053 -2.343 14.937 1.00 31.13 N ATOM 669 CZ ARG A 77 -0.449 -1.754 15.989 1.00 10.24 C ATOM 670 NH1 ARG A 77 -1.007 -0.589 15.893 1.00 33.11 N ATOM 671 NH2 ARG A 77 -0.427 -2.361 17.129 1.00 1.13 N ATOM 0 H ARG A 77 -0.770 -3.662 10.059 1.00 11.01 H new ATOM 0 HA ARG A 77 -0.865 -5.926 11.815 1.00 35.04 H new ATOM 0 HB2 ARG A 77 -0.190 -4.376 13.553 1.00 65.41 H new ATOM 0 HB3 ARG A 77 0.742 -4.060 12.103 1.00 65.41 H new ATOM 0 HG2 ARG A 77 -0.548 -2.083 11.599 1.00 23.41 H new ATOM 0 HG3 ARG A 77 -1.734 -2.464 12.832 1.00 23.41 H new ATOM 0 HD2 ARG A 77 1.177 -1.699 13.291 1.00 75.53 H new ATOM 0 HD3 ARG A 77 -0.230 -0.717 13.647 1.00 75.53 H new ATOM 0 HE ARG A 77 0.414 -3.290 15.052 1.00 31.13 H new ATOM 0 HH11 ARG A 77 -1.058 -0.121 14.988 1.00 33.11 H new ATOM 0 HH12 ARG A 77 -1.395 -0.140 16.722 1.00 33.11 H new ATOM 0 HH21 ARG A 77 -0.020 -3.293 17.203 1.00 1.13 H new ATOM 0 HH22 ARG A 77 -0.817 -1.908 17.956 1.00 1.13 H new ATOM 685 N GLU A 78 -3.384 -3.768 11.944 1.00 31.50 N ATOM 686 CA GLU A 78 -4.756 -3.572 12.445 1.00 54.43 C ATOM 687 C GLU A 78 -5.665 -4.752 12.047 1.00 14.01 C ATOM 688 O GLU A 78 -6.537 -5.167 12.814 1.00 51.12 O ATOM 689 CB GLU A 78 -5.361 -2.263 11.898 1.00 43.03 C ATOM 690 CG GLU A 78 -4.510 -1.004 12.102 1.00 3.30 C ATOM 691 CD GLU A 78 -4.325 -0.598 13.556 1.00 72.51 C ATOM 692 OE1 GLU A 78 -5.323 -0.580 14.303 1.00 14.13 O ATOM 693 OE2 GLU A 78 -3.183 -0.248 13.940 1.00 54.13 O ATOM 0 H GLU A 78 -3.068 -3.044 11.299 1.00 31.50 H new ATOM 0 HA GLU A 78 -4.698 -3.515 13.532 1.00 54.43 H new ATOM 0 HB2 GLU A 78 -5.545 -2.387 10.831 1.00 43.03 H new ATOM 0 HB3 GLU A 78 -6.330 -2.106 12.372 1.00 43.03 H new ATOM 0 HG2 GLU A 78 -3.529 -1.167 11.656 1.00 3.30 H new ATOM 0 HG3 GLU A 78 -4.972 -0.177 11.563 1.00 3.30 H new ATOM 700 N GLN A 79 -5.463 -5.275 10.833 1.00 64.41 N ATOM 701 CA GLN A 79 -6.250 -6.413 10.334 1.00 55.13 C ATOM 702 C GLN A 79 -5.543 -7.763 10.579 1.00 5.43 C ATOM 703 O GLN A 79 -5.978 -8.564 11.405 1.00 14.21 O ATOM 704 CB GLN A 79 -6.521 -6.251 8.828 1.00 64.00 C ATOM 705 CG GLN A 79 -7.296 -4.985 8.449 1.00 25.52 C ATOM 706 CD GLN A 79 -8.744 -4.986 8.922 1.00 21.03 C ATOM 707 OE1 GLN A 79 -9.084 -5.557 9.955 1.00 3.33 O ATOM 708 NE2 GLN A 79 -9.616 -4.360 8.160 1.00 41.24 N ATOM 0 H GLN A 79 -4.762 -4.930 10.177 1.00 64.41 H new ATOM 0 HA GLN A 79 -7.189 -6.418 10.887 1.00 55.13 H new ATOM 0 HB2 GLN A 79 -5.568 -6.249 8.299 1.00 64.00 H new ATOM 0 HB3 GLN A 79 -7.078 -7.120 8.477 1.00 64.00 H new ATOM 0 HG2 GLN A 79 -6.786 -4.118 8.870 1.00 25.52 H new ATOM 0 HG3 GLN A 79 -7.278 -4.870 7.365 1.00 25.52 H new ATOM 0 HE21 GLN A 79 -9.306 -3.894 7.307 1.00 41.24 H new ATOM 0 HE22 GLN A 79 -10.602 -4.341 8.422 1.00 41.24 H new ATOM 717 N PHE A 80 -4.443 -7.994 9.862 1.00 32.24 N ATOM 718 CA PHE A 80 -3.763 -9.302 9.858 1.00 43.40 C ATOM 719 C PHE A 80 -2.846 -9.501 11.078 1.00 22.22 C ATOM 720 O PHE A 80 -2.530 -10.635 11.445 1.00 20.23 O ATOM 721 CB PHE A 80 -2.942 -9.456 8.570 1.00 65.45 C ATOM 722 CG PHE A 80 -3.755 -9.264 7.310 1.00 52.30 C ATOM 723 CD1 PHE A 80 -4.471 -10.318 6.760 1.00 52.10 C ATOM 724 CD2 PHE A 80 -3.805 -8.027 6.683 1.00 43.32 C ATOM 725 CE1 PHE A 80 -5.218 -10.142 5.609 1.00 65.30 C ATOM 726 CE2 PHE A 80 -4.550 -7.846 5.534 1.00 60.34 C ATOM 727 CZ PHE A 80 -5.257 -8.906 4.996 1.00 41.50 C ATOM 0 H PHE A 80 -3.997 -7.292 9.271 1.00 32.24 H new ATOM 0 HA PHE A 80 -4.540 -10.065 9.909 1.00 43.40 H new ATOM 0 HB2 PHE A 80 -2.126 -8.733 8.580 1.00 65.45 H new ATOM 0 HB3 PHE A 80 -2.489 -10.447 8.553 1.00 65.45 H new ATOM 0 HD1 PHE A 80 -4.445 -11.287 7.236 1.00 52.10 H new ATOM 0 HD2 PHE A 80 -3.255 -7.196 7.098 1.00 43.32 H new ATOM 0 HE1 PHE A 80 -5.770 -10.971 5.191 1.00 65.30 H new ATOM 0 HE2 PHE A 80 -4.580 -6.878 5.056 1.00 60.34 H new ATOM 0 HZ PHE A 80 -5.839 -8.767 4.097 1.00 41.50 H new ATOM 737 N GLY A 81 -2.422 -8.405 11.698 1.00 72.21 N ATOM 738 CA GLY A 81 -1.470 -8.489 12.807 1.00 31.45 C ATOM 739 C GLY A 81 -0.021 -8.516 12.329 1.00 23.43 C ATOM 740 O GLY A 81 0.868 -9.024 13.014 1.00 53.04 O ATOM 0 H GLY A 81 -2.716 -7.458 11.458 1.00 72.21 H new ATOM 0 HA2 GLY A 81 -1.615 -7.637 13.472 1.00 31.45 H new ATOM 0 HA3 GLY A 81 -1.674 -9.387 13.390 1.00 31.45 H new ATOM 744 N LEU A 82 0.212 -7.972 11.138 1.00 62.12 N ATOM 745 CA LEU A 82 1.550 -7.938 10.539 1.00 74.54 C ATOM 746 C LEU A 82 2.171 -6.534 10.663 1.00 52.40 C ATOM 747 O LEU A 82 1.645 -5.564 10.117 1.00 3.01 O ATOM 748 CB LEU A 82 1.459 -8.349 9.063 1.00 0.23 C ATOM 749 CG LEU A 82 2.802 -8.467 8.318 1.00 21.02 C ATOM 750 CD1 LEU A 82 3.564 -9.704 8.782 1.00 34.21 C ATOM 751 CD2 LEU A 82 2.580 -8.500 6.808 1.00 64.05 C ATOM 0 H LEU A 82 -0.513 -7.544 10.562 1.00 62.12 H new ATOM 0 HA LEU A 82 2.192 -8.639 11.073 1.00 74.54 H new ATOM 0 HB2 LEU A 82 0.946 -9.309 9.003 1.00 0.23 H new ATOM 0 HB3 LEU A 82 0.837 -7.622 8.540 1.00 0.23 H new ATOM 0 HG LEU A 82 3.403 -7.589 8.552 1.00 21.02 H new ATOM 0 HD11 LEU A 82 4.510 -9.771 8.245 1.00 34.21 H new ATOM 0 HD12 LEU A 82 3.758 -9.631 9.852 1.00 34.21 H new ATOM 0 HD13 LEU A 82 2.969 -10.595 8.581 1.00 34.21 H new ATOM 0 HD21 LEU A 82 3.541 -8.584 6.301 1.00 64.05 H new ATOM 0 HD22 LEU A 82 1.958 -9.357 6.550 1.00 64.05 H new ATOM 0 HD23 LEU A 82 2.082 -7.583 6.493 1.00 64.05 H new ATOM 763 N GLU A 83 3.285 -6.427 11.384 1.00 11.11 N ATOM 764 CA GLU A 83 3.941 -5.129 11.611 1.00 54.33 C ATOM 765 C GLU A 83 5.039 -4.843 10.571 1.00 32.34 C ATOM 766 O GLU A 83 5.917 -5.674 10.332 1.00 73.24 O ATOM 767 CB GLU A 83 4.538 -5.063 13.027 1.00 13.34 C ATOM 768 CG GLU A 83 3.497 -4.998 14.141 1.00 42.33 C ATOM 769 CD GLU A 83 4.120 -4.860 15.523 1.00 34.12 C ATOM 770 OE1 GLU A 83 4.940 -3.937 15.726 1.00 44.21 O ATOM 771 OE2 GLU A 83 3.800 -5.670 16.416 1.00 32.51 O ATOM 0 H GLU A 83 3.756 -7.218 11.823 1.00 11.11 H new ATOM 0 HA GLU A 83 3.172 -4.364 11.505 1.00 54.33 H new ATOM 0 HB2 GLU A 83 5.169 -5.938 13.185 1.00 13.34 H new ATOM 0 HB3 GLU A 83 5.184 -4.188 13.097 1.00 13.34 H new ATOM 0 HG2 GLU A 83 2.832 -4.154 13.961 1.00 42.33 H new ATOM 0 HG3 GLU A 83 2.884 -5.899 14.112 1.00 42.33 H new ATOM 778 N LEU A 84 4.983 -3.656 9.966 1.00 41.52 N ATOM 779 CA LEU A 84 5.988 -3.215 8.985 1.00 53.33 C ATOM 780 C LEU A 84 6.661 -1.902 9.444 1.00 53.31 C ATOM 781 O LEU A 84 6.120 -1.191 10.291 1.00 41.13 O ATOM 782 CB LEU A 84 5.321 -3.021 7.612 1.00 23.41 C ATOM 783 CG LEU A 84 4.685 -4.284 7.001 1.00 62.40 C ATOM 784 CD1 LEU A 84 3.975 -3.951 5.690 1.00 21.42 C ATOM 785 CD2 LEU A 84 5.741 -5.371 6.789 1.00 2.32 C ATOM 0 H LEU A 84 4.245 -2.973 10.138 1.00 41.52 H new ATOM 0 HA LEU A 84 6.759 -3.981 8.904 1.00 53.33 H new ATOM 0 HB2 LEU A 84 4.550 -2.256 7.707 1.00 23.41 H new ATOM 0 HB3 LEU A 84 6.067 -2.637 6.916 1.00 23.41 H new ATOM 0 HG LEU A 84 3.941 -4.666 7.700 1.00 62.40 H new ATOM 0 HD11 LEU A 84 3.533 -4.857 5.275 1.00 21.42 H new ATOM 0 HD12 LEU A 84 3.191 -3.217 5.877 1.00 21.42 H new ATOM 0 HD13 LEU A 84 4.694 -3.541 4.981 1.00 21.42 H new ATOM 0 HD21 LEU A 84 5.272 -6.255 6.357 1.00 2.32 H new ATOM 0 HD22 LEU A 84 6.512 -5.002 6.113 1.00 2.32 H new ATOM 0 HD23 LEU A 84 6.192 -5.631 7.746 1.00 2.32 H new ATOM 797 N PRO A 85 7.858 -1.572 8.910 1.00 43.21 N ATOM 798 CA PRO A 85 8.572 -0.321 9.260 1.00 50.41 C ATOM 799 C PRO A 85 7.881 0.954 8.729 1.00 73.11 C ATOM 800 O PRO A 85 7.099 0.908 7.778 1.00 43.23 O ATOM 801 CB PRO A 85 9.949 -0.512 8.615 1.00 21.13 C ATOM 802 CG PRO A 85 9.715 -1.466 7.491 1.00 61.14 C ATOM 803 CD PRO A 85 8.626 -2.396 7.958 1.00 14.22 C ATOM 0 HA PRO A 85 8.605 -0.167 10.339 1.00 50.41 H new ATOM 0 HB2 PRO A 85 10.351 0.434 8.253 1.00 21.13 H new ATOM 0 HB3 PRO A 85 10.669 -0.912 9.330 1.00 21.13 H new ATOM 0 HG2 PRO A 85 9.416 -0.937 6.586 1.00 61.14 H new ATOM 0 HG3 PRO A 85 10.624 -2.018 7.252 1.00 61.14 H new ATOM 0 HD2 PRO A 85 8.005 -2.736 7.129 1.00 14.22 H new ATOM 0 HD3 PRO A 85 9.035 -3.286 8.436 1.00 14.22 H new ATOM 811 N ARG A 86 8.224 2.104 9.319 1.00 43.40 N ATOM 812 CA ARG A 86 7.499 3.366 9.077 1.00 22.14 C ATOM 813 C ARG A 86 8.044 4.165 7.875 1.00 4.33 C ATOM 814 O ARG A 86 7.867 5.383 7.801 1.00 13.43 O ATOM 815 CB ARG A 86 7.554 4.237 10.345 1.00 70.25 C ATOM 816 CG ARG A 86 7.064 3.518 11.598 1.00 63.51 C ATOM 817 CD ARG A 86 7.056 4.426 12.824 1.00 73.34 C ATOM 818 NE ARG A 86 6.672 3.692 14.028 1.00 20.43 N ATOM 819 CZ ARG A 86 5.560 3.881 14.685 1.00 34.41 C ATOM 820 NH1 ARG A 86 4.746 4.829 14.353 1.00 5.31 N ATOM 821 NH2 ARG A 86 5.280 3.141 15.701 1.00 24.23 N ATOM 0 H ARG A 86 9.003 2.192 9.972 1.00 43.40 H new ATOM 0 HA ARG A 86 6.471 3.099 8.833 1.00 22.14 H new ATOM 0 HB2 ARG A 86 8.580 4.569 10.504 1.00 70.25 H new ATOM 0 HB3 ARG A 86 6.950 5.131 10.189 1.00 70.25 H new ATOM 0 HG2 ARG A 86 6.058 3.137 11.425 1.00 63.51 H new ATOM 0 HG3 ARG A 86 7.702 2.656 11.792 1.00 63.51 H new ATOM 0 HD2 ARG A 86 8.045 4.862 12.962 1.00 73.34 H new ATOM 0 HD3 ARG A 86 6.363 5.252 12.663 1.00 73.34 H new ATOM 0 HE ARG A 86 7.317 2.984 14.379 1.00 20.43 H new ATOM 0 HH11 ARG A 86 4.969 5.441 13.568 1.00 5.31 H new ATOM 0 HH12 ARG A 86 3.881 4.965 14.876 1.00 5.31 H new ATOM 0 HH21 ARG A 86 5.927 2.408 15.992 1.00 24.23 H new ATOM 0 HH22 ARG A 86 4.411 3.288 16.215 1.00 24.23 H new ATOM 835 N SER A 87 8.685 3.489 6.923 1.00 72.43 N ATOM 836 CA SER A 87 9.209 4.163 5.718 1.00 24.14 C ATOM 837 C SER A 87 9.338 3.204 4.528 1.00 63.53 C ATOM 838 O SER A 87 9.703 2.038 4.695 1.00 13.43 O ATOM 839 CB SER A 87 10.578 4.810 5.990 1.00 1.24 C ATOM 840 OG SER A 87 10.471 5.953 6.830 1.00 72.00 O ATOM 0 H SER A 87 8.857 2.484 6.954 1.00 72.43 H new ATOM 0 HA SER A 87 8.484 4.937 5.464 1.00 24.14 H new ATOM 0 HB2 SER A 87 11.238 4.079 6.456 1.00 1.24 H new ATOM 0 HB3 SER A 87 11.037 5.097 5.044 1.00 1.24 H new ATOM 0 HG SER A 87 9.567 6.000 7.205 1.00 72.00 H new ATOM 846 N THR A 88 9.046 3.713 3.328 1.00 32.12 N ATOM 847 CA THR A 88 9.224 2.954 2.076 1.00 24.22 C ATOM 848 C THR A 88 10.627 2.372 1.968 1.00 61.41 C ATOM 849 O THR A 88 10.802 1.185 1.698 1.00 70.10 O ATOM 850 CB THR A 88 8.996 3.843 0.832 1.00 14.23 C ATOM 851 OG1 THR A 88 9.816 5.019 0.908 1.00 33.40 O ATOM 852 CG2 THR A 88 7.542 4.243 0.706 1.00 34.23 C ATOM 0 H THR A 88 8.682 4.656 3.192 1.00 32.12 H new ATOM 0 HA THR A 88 8.485 2.153 2.106 1.00 24.22 H new ATOM 0 HB THR A 88 9.272 3.264 -0.050 1.00 14.23 H new ATOM 0 HG1 THR A 88 9.455 5.709 0.313 1.00 33.40 H new ATOM 0 HG21 THR A 88 7.412 4.868 -0.178 1.00 34.23 H new ATOM 0 HG22 THR A 88 6.925 3.349 0.612 1.00 34.23 H new ATOM 0 HG23 THR A 88 7.240 4.801 1.592 1.00 34.23 H new ATOM 860 N TYR A 89 11.619 3.225 2.185 1.00 43.52 N ATOM 861 CA TYR A 89 13.022 2.834 2.072 1.00 52.42 C ATOM 862 C TYR A 89 13.329 1.598 2.930 1.00 30.13 C ATOM 863 O TYR A 89 14.094 0.720 2.531 1.00 53.31 O ATOM 864 CB TYR A 89 13.928 4.003 2.475 1.00 12.44 C ATOM 865 CG TYR A 89 13.716 5.244 1.634 1.00 14.33 C ATOM 866 CD1 TYR A 89 12.700 6.146 1.933 1.00 34.21 C ATOM 867 CD2 TYR A 89 14.522 5.508 0.534 1.00 10.05 C ATOM 868 CE1 TYR A 89 12.496 7.274 1.164 1.00 2.12 C ATOM 869 CE2 TYR A 89 14.324 6.631 -0.240 1.00 1.42 C ATOM 870 CZ TYR A 89 13.312 7.510 0.078 1.00 15.13 C ATOM 871 OH TYR A 89 13.108 8.622 -0.705 1.00 43.12 O ATOM 0 H TYR A 89 11.478 4.202 2.443 1.00 43.52 H new ATOM 0 HA TYR A 89 13.218 2.573 1.032 1.00 52.42 H new ATOM 0 HB2 TYR A 89 13.749 4.248 3.522 1.00 12.44 H new ATOM 0 HB3 TYR A 89 14.969 3.691 2.394 1.00 12.44 H new ATOM 0 HD1 TYR A 89 12.059 5.960 2.782 1.00 34.21 H new ATOM 0 HD2 TYR A 89 15.317 4.822 0.281 1.00 10.05 H new ATOM 0 HE1 TYR A 89 11.704 7.966 1.411 1.00 2.12 H new ATOM 0 HE2 TYR A 89 14.960 6.821 -1.092 1.00 1.42 H new ATOM 0 HH TYR A 89 13.502 9.406 -0.269 1.00 43.12 H new ATOM 881 N GLU A 90 12.707 1.540 4.104 1.00 32.52 N ATOM 882 CA GLU A 90 12.829 0.390 5.002 1.00 23.45 C ATOM 883 C GLU A 90 12.069 -0.825 4.439 1.00 1.23 C ATOM 884 O GLU A 90 12.570 -1.951 4.440 1.00 65.34 O ATOM 885 CB GLU A 90 12.263 0.750 6.382 1.00 1.31 C ATOM 886 CG GLU A 90 12.871 1.998 7.017 1.00 44.23 C ATOM 887 CD GLU A 90 14.330 1.822 7.400 1.00 30.14 C ATOM 888 OE1 GLU A 90 14.598 1.218 8.457 1.00 44.10 O ATOM 889 OE2 GLU A 90 15.208 2.301 6.657 1.00 50.25 O ATOM 0 H GLU A 90 12.107 2.283 4.461 1.00 32.52 H new ATOM 0 HA GLU A 90 13.884 0.132 5.091 1.00 23.45 H new ATOM 0 HB2 GLU A 90 11.186 0.893 6.292 1.00 1.31 H new ATOM 0 HB3 GLU A 90 12.417 -0.094 7.054 1.00 1.31 H new ATOM 0 HG2 GLU A 90 12.783 2.832 6.321 1.00 44.23 H new ATOM 0 HG3 GLU A 90 12.298 2.262 7.906 1.00 44.23 H new ATOM 896 N GLN A 91 10.850 -0.580 3.954 1.00 73.05 N ATOM 897 CA GLN A 91 9.990 -1.639 3.406 1.00 53.32 C ATOM 898 C GLN A 91 10.575 -2.250 2.119 1.00 55.25 C ATOM 899 O GLN A 91 10.231 -3.370 1.748 1.00 12.22 O ATOM 900 CB GLN A 91 8.579 -1.091 3.151 1.00 73.10 C ATOM 901 CG GLN A 91 7.828 -0.717 4.429 1.00 75.50 C ATOM 902 CD GLN A 91 6.479 -0.070 4.168 1.00 75.41 C ATOM 903 OE1 GLN A 91 5.837 -0.320 3.155 1.00 71.01 O ATOM 904 NE2 GLN A 91 6.028 0.757 5.091 1.00 65.33 N ATOM 0 H GLN A 91 10.431 0.349 3.928 1.00 73.05 H new ATOM 0 HA GLN A 91 9.936 -2.439 4.145 1.00 53.32 H new ATOM 0 HB2 GLN A 91 8.650 -0.212 2.511 1.00 73.10 H new ATOM 0 HB3 GLN A 91 8.002 -1.837 2.605 1.00 73.10 H new ATOM 0 HG2 GLN A 91 7.682 -1.614 5.032 1.00 75.50 H new ATOM 0 HG3 GLN A 91 8.442 -0.035 5.016 1.00 75.50 H new ATOM 0 HE21 GLN A 91 6.586 0.945 5.924 1.00 65.33 H new ATOM 0 HE22 GLN A 91 5.121 1.209 4.972 1.00 65.33 H new ATOM 913 N GLN A 92 11.466 -1.515 1.455 1.00 51.34 N ATOM 914 CA GLN A 92 12.188 -2.031 0.280 1.00 13.33 C ATOM 915 C GLN A 92 12.950 -3.326 0.611 1.00 42.42 C ATOM 916 O GLN A 92 13.186 -4.165 -0.263 1.00 22.12 O ATOM 917 CB GLN A 92 13.182 -0.979 -0.235 1.00 43.33 C ATOM 918 CG GLN A 92 12.529 0.281 -0.798 1.00 63.32 C ATOM 919 CD GLN A 92 13.538 1.354 -1.187 1.00 33.21 C ATOM 920 OE1 GLN A 92 14.636 1.445 -0.459 1.00 74.34 O flip ATOM 921 NE2 GLN A 92 13.329 2.107 -2.129 1.00 11.10 N flip ATOM 0 H GLN A 92 11.710 -0.557 1.707 1.00 51.34 H new ATOM 0 HA GLN A 92 11.448 -2.251 -0.489 1.00 13.33 H new ATOM 0 HB2 GLN A 92 13.848 -0.696 0.580 1.00 43.33 H new ATOM 0 HB3 GLN A 92 13.801 -1.430 -1.010 1.00 43.33 H new ATOM 0 HG2 GLN A 92 11.935 0.015 -1.672 1.00 63.32 H new ATOM 0 HG3 GLN A 92 11.841 0.689 -0.057 1.00 63.32 H new ATOM 0 HE21 GLN A 92 12.472 2.015 -2.675 1.00 11.10 H new ATOM 0 HE22 GLN A 92 14.011 2.826 -2.368 1.00 11.10 H new ATOM 930 N GLU A 93 13.342 -3.471 1.875 1.00 43.13 N ATOM 931 CA GLU A 93 14.083 -4.651 2.333 1.00 52.34 C ATOM 932 C GLU A 93 13.138 -5.765 2.817 1.00 24.13 C ATOM 933 O GLU A 93 13.521 -6.935 2.881 1.00 22.11 O ATOM 934 CB GLU A 93 15.040 -4.252 3.466 1.00 33.54 C ATOM 935 CG GLU A 93 15.989 -3.109 3.104 1.00 33.42 C ATOM 936 CD GLU A 93 16.873 -3.428 1.907 1.00 75.30 C ATOM 937 OE1 GLU A 93 17.894 -4.122 2.089 1.00 45.52 O ATOM 938 OE2 GLU A 93 16.551 -2.991 0.781 1.00 1.12 O ATOM 0 H GLU A 93 13.159 -2.784 2.606 1.00 43.13 H new ATOM 0 HA GLU A 93 14.650 -5.040 1.487 1.00 52.34 H new ATOM 0 HB2 GLU A 93 14.454 -3.962 4.338 1.00 33.54 H new ATOM 0 HB3 GLU A 93 15.629 -5.123 3.754 1.00 33.54 H new ATOM 0 HG2 GLU A 93 15.406 -2.214 2.890 1.00 33.42 H new ATOM 0 HG3 GLU A 93 16.619 -2.881 3.964 1.00 33.42 H new ATOM 945 N MET A 94 11.900 -5.396 3.134 1.00 12.53 N ATOM 946 CA MET A 94 10.915 -6.344 3.674 1.00 73.41 C ATOM 947 C MET A 94 10.346 -7.262 2.581 1.00 21.22 C ATOM 948 O MET A 94 10.080 -6.825 1.464 1.00 33.12 O ATOM 949 CB MET A 94 9.770 -5.585 4.358 1.00 45.13 C ATOM 950 CG MET A 94 10.224 -4.689 5.501 1.00 12.50 C ATOM 951 SD MET A 94 11.008 -5.603 6.845 1.00 31.11 S ATOM 952 CE MET A 94 9.661 -6.666 7.366 1.00 71.12 C ATOM 0 H MET A 94 11.549 -4.444 3.028 1.00 12.53 H new ATOM 0 HA MET A 94 11.430 -6.969 4.404 1.00 73.41 H new ATOM 0 HB2 MET A 94 9.255 -4.977 3.615 1.00 45.13 H new ATOM 0 HB3 MET A 94 9.046 -6.305 4.739 1.00 45.13 H new ATOM 0 HG2 MET A 94 10.924 -3.947 5.117 1.00 12.50 H new ATOM 0 HG3 MET A 94 9.364 -4.145 5.892 1.00 12.50 H new ATOM 0 HE1 MET A 94 9.867 -7.052 8.364 1.00 71.12 H new ATOM 0 HE2 MET A 94 8.732 -6.095 7.382 1.00 71.12 H new ATOM 0 HE3 MET A 94 9.563 -7.498 6.669 1.00 71.12 H new ATOM 962 N GLY A 95 10.156 -8.535 2.917 1.00 43.34 N ATOM 963 CA GLY A 95 9.615 -9.497 1.960 1.00 0.32 C ATOM 964 C GLY A 95 10.573 -9.818 0.812 1.00 30.21 C ATOM 965 O GLY A 95 11.760 -9.489 0.865 1.00 11.23 O ATOM 0 H GLY A 95 10.366 -8.923 3.837 1.00 43.34 H new ATOM 0 HA2 GLY A 95 9.367 -10.420 2.485 1.00 0.32 H new ATOM 0 HA3 GLY A 95 8.685 -9.105 1.548 1.00 0.32 H new ATOM 969 N LYS A 96 10.059 -10.467 -0.231 1.00 13.55 N ATOM 970 CA LYS A 96 10.881 -10.832 -1.393 1.00 32.21 C ATOM 971 C LYS A 96 10.507 -10.017 -2.635 1.00 62.51 C ATOM 972 O LYS A 96 9.349 -9.640 -2.829 1.00 12.31 O ATOM 973 CB LYS A 96 10.767 -12.334 -1.679 1.00 22.03 C ATOM 974 CG LYS A 96 11.262 -13.203 -0.527 1.00 63.42 C ATOM 975 CD LYS A 96 12.722 -12.911 -0.177 1.00 24.04 C ATOM 976 CE LYS A 96 13.154 -13.619 1.104 1.00 12.54 C ATOM 977 NZ LYS A 96 13.000 -15.095 1.015 1.00 4.53 N ATOM 0 H LYS A 96 9.082 -10.752 -0.300 1.00 13.55 H new ATOM 0 HA LYS A 96 11.917 -10.597 -1.149 1.00 32.21 H new ATOM 0 HB2 LYS A 96 9.726 -12.579 -1.890 1.00 22.03 H new ATOM 0 HB3 LYS A 96 11.338 -12.571 -2.576 1.00 22.03 H new ATOM 0 HG2 LYS A 96 10.638 -13.033 0.350 1.00 63.42 H new ATOM 0 HG3 LYS A 96 11.156 -14.254 -0.794 1.00 63.42 H new ATOM 0 HD2 LYS A 96 13.363 -13.227 -1.000 1.00 24.04 H new ATOM 0 HD3 LYS A 96 12.859 -11.836 -0.061 1.00 24.04 H new ATOM 0 HE2 LYS A 96 14.195 -13.377 1.316 1.00 12.54 H new ATOM 0 HE3 LYS A 96 12.563 -13.244 1.940 1.00 12.54 H new ATOM 0 HZ1 LYS A 96 13.384 -15.537 1.875 1.00 4.53 H new ATOM 0 HZ2 LYS A 96 11.992 -15.334 0.924 1.00 4.53 H new ATOM 0 HZ3 LYS A 96 13.516 -15.448 0.184 1.00 4.53 H new ATOM 991 N SER A 97 11.507 -9.762 -3.472 1.00 51.22 N ATOM 992 CA SER A 97 11.349 -8.907 -4.657 1.00 60.33 C ATOM 993 C SER A 97 10.687 -9.652 -5.822 1.00 13.54 C ATOM 994 O SER A 97 11.075 -10.777 -6.152 1.00 61.22 O ATOM 995 CB SER A 97 12.717 -8.381 -5.112 1.00 30.14 C ATOM 996 OG SER A 97 13.610 -9.448 -5.395 1.00 63.33 O ATOM 0 H SER A 97 12.448 -10.137 -3.355 1.00 51.22 H new ATOM 0 HA SER A 97 10.701 -8.079 -4.371 1.00 60.33 H new ATOM 0 HB2 SER A 97 12.594 -7.761 -6.000 1.00 30.14 H new ATOM 0 HB3 SER A 97 13.141 -7.745 -4.335 1.00 30.14 H new ATOM 0 HG SER A 97 13.100 -10.235 -5.680 1.00 63.33 H new ATOM 1002 N VAL A 98 9.698 -9.015 -6.456 1.00 11.44 N ATOM 1003 CA VAL A 98 8.985 -9.618 -7.598 1.00 74.10 C ATOM 1004 C VAL A 98 8.549 -8.580 -8.649 1.00 24.34 C ATOM 1005 O VAL A 98 8.586 -7.370 -8.408 1.00 1.34 O ATOM 1006 CB VAL A 98 7.733 -10.405 -7.135 1.00 31.14 C ATOM 1007 CG1 VAL A 98 8.126 -11.747 -6.530 1.00 72.04 C ATOM 1008 CG2 VAL A 98 6.910 -9.580 -6.146 1.00 60.22 C ATOM 0 H VAL A 98 9.370 -8.083 -6.202 1.00 11.44 H new ATOM 0 HA VAL A 98 9.703 -10.297 -8.059 1.00 74.10 H new ATOM 0 HB VAL A 98 7.114 -10.601 -8.010 1.00 31.14 H new ATOM 0 HG11 VAL A 98 7.229 -12.280 -6.213 1.00 72.04 H new ATOM 0 HG12 VAL A 98 8.656 -12.340 -7.275 1.00 72.04 H new ATOM 0 HG13 VAL A 98 8.774 -11.582 -5.669 1.00 72.04 H new ATOM 0 HG21 VAL A 98 6.036 -10.152 -5.834 1.00 60.22 H new ATOM 0 HG22 VAL A 98 7.519 -9.344 -5.274 1.00 60.22 H new ATOM 0 HG23 VAL A 98 6.587 -8.655 -6.624 1.00 60.22 H new ATOM 1018 N SER A 99 8.140 -9.085 -9.818 1.00 61.11 N ATOM 1019 CA SER A 99 7.619 -8.251 -10.915 1.00 61.34 C ATOM 1020 C SER A 99 6.147 -8.595 -11.219 1.00 74.13 C ATOM 1021 O SER A 99 5.522 -9.373 -10.495 1.00 3.13 O ATOM 1022 CB SER A 99 8.478 -8.441 -12.174 1.00 4.11 C ATOM 1023 OG SER A 99 8.027 -7.615 -13.240 1.00 53.55 O ATOM 0 H SER A 99 8.159 -10.082 -10.034 1.00 61.11 H new ATOM 0 HA SER A 99 7.667 -7.207 -10.604 1.00 61.34 H new ATOM 0 HB2 SER A 99 9.518 -8.207 -11.945 1.00 4.11 H new ATOM 0 HB3 SER A 99 8.447 -9.486 -12.483 1.00 4.11 H new ATOM 0 HG SER A 99 7.908 -6.698 -12.916 1.00 53.55 H new ATOM 1029 N ARG A 100 5.607 -8.036 -12.308 1.00 43.44 N ATOM 1030 CA ARG A 100 4.182 -8.194 -12.663 1.00 70.25 C ATOM 1031 C ARG A 100 3.714 -9.661 -12.641 1.00 30.54 C ATOM 1032 O ARG A 100 2.766 -10.012 -11.940 1.00 45.14 O ATOM 1033 CB ARG A 100 3.913 -7.605 -14.055 1.00 34.23 C ATOM 1034 CG ARG A 100 4.225 -6.117 -14.181 1.00 73.13 C ATOM 1035 CD ARG A 100 3.369 -5.263 -13.249 1.00 53.52 C ATOM 1036 NE ARG A 100 1.933 -5.500 -13.421 1.00 53.34 N ATOM 1037 CZ ARG A 100 1.171 -4.855 -14.268 1.00 34.53 C ATOM 1038 NH1 ARG A 100 1.674 -4.000 -15.102 1.00 33.23 N ATOM 1039 NH2 ARG A 100 -0.099 -5.090 -14.302 1.00 44.34 N ATOM 0 H ARG A 100 6.136 -7.465 -12.967 1.00 43.44 H new ATOM 0 HA ARG A 100 3.616 -7.656 -11.903 1.00 70.25 H new ATOM 0 HB2 ARG A 100 4.506 -8.151 -14.788 1.00 34.23 H new ATOM 0 HB3 ARG A 100 2.865 -7.767 -14.308 1.00 34.23 H new ATOM 0 HG2 ARG A 100 5.279 -5.949 -13.958 1.00 73.13 H new ATOM 0 HG3 ARG A 100 4.063 -5.800 -15.211 1.00 73.13 H new ATOM 0 HD2 ARG A 100 3.646 -5.472 -12.216 1.00 53.52 H new ATOM 0 HD3 ARG A 100 3.583 -4.210 -13.430 1.00 53.52 H new ATOM 0 HE ARG A 100 1.497 -6.217 -12.841 1.00 53.34 H new ATOM 0 HH11 ARG A 100 2.678 -3.821 -15.105 1.00 33.23 H new ATOM 0 HH12 ARG A 100 1.066 -3.506 -15.755 1.00 33.23 H new ATOM 0 HH21 ARG A 100 -0.508 -5.778 -13.669 1.00 44.34 H new ATOM 0 HH22 ARG A 100 -0.693 -4.588 -14.962 1.00 44.34 H new ATOM 1053 N SER A 101 4.388 -10.510 -13.414 1.00 34.11 N ATOM 1054 CA SER A 101 3.987 -11.922 -13.567 1.00 61.24 C ATOM 1055 C SER A 101 4.126 -12.723 -12.264 1.00 23.05 C ATOM 1056 O SER A 101 3.640 -13.851 -12.166 1.00 72.13 O ATOM 1057 CB SER A 101 4.828 -12.604 -14.657 1.00 72.35 C ATOM 1058 OG SER A 101 4.744 -11.914 -15.892 1.00 53.34 O ATOM 0 H SER A 101 5.217 -10.252 -13.949 1.00 34.11 H new ATOM 0 HA SER A 101 2.934 -11.912 -13.848 1.00 61.24 H new ATOM 0 HB2 SER A 101 5.869 -12.652 -14.337 1.00 72.35 H new ATOM 0 HB3 SER A 101 4.488 -13.631 -14.790 1.00 72.35 H new ATOM 0 HG SER A 101 5.292 -12.374 -16.562 1.00 53.34 H new ATOM 1064 N ASN A 102 4.792 -12.147 -11.268 1.00 71.10 N ATOM 1065 CA ASN A 102 5.081 -12.859 -10.016 1.00 1.41 C ATOM 1066 C ASN A 102 4.206 -12.356 -8.847 1.00 71.15 C ATOM 1067 O ASN A 102 4.257 -12.903 -7.744 1.00 63.20 O ATOM 1068 CB ASN A 102 6.564 -12.684 -9.668 1.00 0.52 C ATOM 1069 CG ASN A 102 7.476 -12.994 -10.843 1.00 5.13 C ATOM 1070 OD1 ASN A 102 7.789 -12.120 -11.645 1.00 72.33 O ATOM 1071 ND2 ASN A 102 7.914 -14.230 -10.953 1.00 71.34 N ATOM 0 H ASN A 102 5.144 -11.190 -11.298 1.00 71.10 H new ATOM 0 HA ASN A 102 4.848 -13.913 -10.166 1.00 1.41 H new ATOM 0 HB2 ASN A 102 6.738 -11.660 -9.337 1.00 0.52 H new ATOM 0 HB3 ASN A 102 6.818 -13.337 -8.833 1.00 0.52 H new ATOM 0 HD21 ASN A 102 8.533 -14.485 -11.722 1.00 71.34 H new ATOM 0 HD22 ASN A 102 7.635 -14.933 -10.269 1.00 71.34 H new ATOM 1078 N LEU A 103 3.403 -11.323 -9.096 1.00 31.52 N ATOM 1079 CA LEU A 103 2.584 -10.696 -8.044 1.00 3.20 C ATOM 1080 C LEU A 103 1.540 -11.656 -7.442 1.00 13.54 C ATOM 1081 O LEU A 103 1.016 -12.542 -8.119 1.00 23.31 O ATOM 1082 CB LEU A 103 1.867 -9.451 -8.592 1.00 11.42 C ATOM 1083 CG LEU A 103 2.781 -8.324 -9.101 1.00 21.43 C ATOM 1084 CD1 LEU A 103 1.956 -7.140 -9.601 1.00 21.13 C ATOM 1085 CD2 LEU A 103 3.756 -7.879 -8.015 1.00 22.32 C ATOM 0 H LEU A 103 3.298 -10.897 -10.017 1.00 31.52 H new ATOM 0 HA LEU A 103 3.273 -10.416 -7.247 1.00 3.20 H new ATOM 0 HB2 LEU A 103 1.214 -9.760 -9.408 1.00 11.42 H new ATOM 0 HB3 LEU A 103 1.227 -9.048 -7.807 1.00 11.42 H new ATOM 0 HG LEU A 103 3.360 -8.715 -9.938 1.00 21.43 H new ATOM 0 HD11 LEU A 103 2.624 -6.355 -9.956 1.00 21.13 H new ATOM 0 HD12 LEU A 103 1.311 -7.465 -10.418 1.00 21.13 H new ATOM 0 HD13 LEU A 103 1.343 -6.754 -8.787 1.00 21.13 H new ATOM 0 HD21 LEU A 103 4.391 -7.081 -8.401 1.00 22.32 H new ATOM 0 HD22 LEU A 103 3.198 -7.514 -7.153 1.00 22.32 H new ATOM 0 HD23 LEU A 103 4.376 -8.723 -7.715 1.00 22.32 H new ATOM 1097 N ARG A 104 1.259 -11.468 -6.154 1.00 23.42 N ATOM 1098 CA ARG A 104 0.188 -12.188 -5.452 1.00 71.54 C ATOM 1099 C ARG A 104 -0.859 -11.177 -4.947 1.00 60.33 C ATOM 1100 O ARG A 104 -0.959 -10.064 -5.461 1.00 1.50 O ATOM 1101 CB ARG A 104 0.767 -12.963 -4.253 1.00 42.04 C ATOM 1102 CG ARG A 104 1.954 -13.868 -4.580 1.00 21.23 C ATOM 1103 CD ARG A 104 1.571 -15.043 -5.476 1.00 54.44 C ATOM 1104 NE ARG A 104 2.688 -15.972 -5.646 1.00 14.41 N ATOM 1105 CZ ARG A 104 2.732 -16.934 -6.531 1.00 72.20 C ATOM 1106 NH1 ARG A 104 1.739 -17.149 -7.333 1.00 31.21 N ATOM 1107 NH2 ARG A 104 3.771 -17.700 -6.601 1.00 32.45 N ATOM 0 H ARG A 104 1.767 -10.811 -5.562 1.00 23.42 H new ATOM 0 HA ARG A 104 -0.278 -12.893 -6.140 1.00 71.54 H new ATOM 0 HB2 ARG A 104 1.075 -12.247 -3.491 1.00 42.04 H new ATOM 0 HB3 ARG A 104 -0.025 -13.572 -3.817 1.00 42.04 H new ATOM 0 HG2 ARG A 104 2.729 -13.280 -5.071 1.00 21.23 H new ATOM 0 HG3 ARG A 104 2.382 -14.248 -3.652 1.00 21.23 H new ATOM 0 HD2 ARG A 104 0.720 -15.570 -5.044 1.00 54.44 H new ATOM 0 HD3 ARG A 104 1.254 -14.671 -6.450 1.00 54.44 H new ATOM 0 HE ARG A 104 3.492 -15.861 -5.029 1.00 14.41 H new ATOM 0 HH11 ARG A 104 0.905 -16.564 -7.281 1.00 31.21 H new ATOM 0 HH12 ARG A 104 1.790 -17.904 -8.017 1.00 31.21 H new ATOM 0 HH21 ARG A 104 4.556 -17.554 -5.966 1.00 32.45 H new ATOM 0 HH22 ARG A 104 3.806 -18.450 -7.291 1.00 32.45 H new ATOM 1121 N THR A 105 -1.650 -11.568 -3.950 1.00 51.03 N ATOM 1122 CA THR A 105 -2.567 -10.633 -3.284 1.00 51.43 C ATOM 1123 C THR A 105 -1.993 -10.181 -1.932 1.00 63.30 C ATOM 1124 O THR A 105 -2.030 -10.923 -0.950 1.00 71.13 O ATOM 1125 CB THR A 105 -3.972 -11.256 -3.066 1.00 65.20 C ATOM 1126 OG1 THR A 105 -4.567 -11.582 -4.334 1.00 45.42 O ATOM 1127 CG2 THR A 105 -4.893 -10.307 -2.303 1.00 72.11 C ATOM 0 H THR A 105 -1.678 -12.520 -3.584 1.00 51.03 H new ATOM 0 HA THR A 105 -2.674 -9.770 -3.942 1.00 51.43 H new ATOM 0 HB THR A 105 -3.845 -12.161 -2.472 1.00 65.20 H new ATOM 0 HG1 THR A 105 -5.452 -11.976 -4.188 1.00 45.42 H new ATOM 0 HG21 THR A 105 -5.868 -10.776 -2.168 1.00 72.11 H new ATOM 0 HG22 THR A 105 -4.459 -10.085 -1.328 1.00 72.11 H new ATOM 0 HG23 THR A 105 -5.010 -9.382 -2.867 1.00 72.11 H new ATOM 1135 N GLY A 106 -1.453 -8.962 -1.893 1.00 2.44 N ATOM 1136 CA GLY A 106 -0.836 -8.444 -0.670 1.00 1.44 C ATOM 1137 C GLY A 106 0.599 -7.954 -0.867 1.00 33.42 C ATOM 1138 O GLY A 106 1.284 -7.623 0.104 1.00 35.23 O ATOM 0 H GLY A 106 -1.430 -8.320 -2.685 1.00 2.44 H new ATOM 0 HA2 GLY A 106 -1.442 -7.623 -0.287 1.00 1.44 H new ATOM 0 HA3 GLY A 106 -0.843 -9.226 0.089 1.00 1.44 H new ATOM 1142 N ASP A 107 1.064 -7.917 -2.116 1.00 51.41 N ATOM 1143 CA ASP A 107 2.406 -7.413 -2.428 1.00 42.11 C ATOM 1144 C ASP A 107 2.493 -5.883 -2.301 1.00 41.44 C ATOM 1145 O ASP A 107 1.620 -5.151 -2.773 1.00 35.52 O ATOM 1146 CB ASP A 107 2.826 -7.833 -3.843 1.00 3.24 C ATOM 1147 CG ASP A 107 3.202 -9.301 -3.930 1.00 22.03 C ATOM 1148 OD1 ASP A 107 2.297 -10.150 -3.911 1.00 13.30 O ATOM 1149 OD2 ASP A 107 4.415 -9.608 -4.015 1.00 12.15 O ATOM 0 H ASP A 107 0.533 -8.229 -2.929 1.00 51.41 H new ATOM 0 HA ASP A 107 3.086 -7.853 -1.699 1.00 42.11 H new ATOM 0 HB2 ASP A 107 2.009 -7.630 -4.536 1.00 3.24 H new ATOM 0 HB3 ASP A 107 3.673 -7.226 -4.162 1.00 3.24 H new ATOM 1154 N LEU A 108 3.557 -5.413 -1.657 1.00 12.13 N ATOM 1155 CA LEU A 108 3.849 -3.983 -1.568 1.00 41.24 C ATOM 1156 C LEU A 108 4.499 -3.497 -2.870 1.00 61.52 C ATOM 1157 O LEU A 108 5.635 -3.856 -3.174 1.00 3.43 O ATOM 1158 CB LEU A 108 4.794 -3.705 -0.387 1.00 53.32 C ATOM 1159 CG LEU A 108 4.346 -4.271 0.970 1.00 35.35 C ATOM 1160 CD1 LEU A 108 5.289 -3.814 2.083 1.00 14.13 C ATOM 1161 CD2 LEU A 108 2.902 -3.873 1.272 1.00 34.11 C ATOM 0 H LEU A 108 4.238 -6.007 -1.184 1.00 12.13 H new ATOM 0 HA LEU A 108 2.913 -3.447 -1.410 1.00 41.24 H new ATOM 0 HB2 LEU A 108 5.775 -4.116 -0.626 1.00 53.32 H new ATOM 0 HB3 LEU A 108 4.915 -2.626 -0.288 1.00 53.32 H new ATOM 0 HG LEU A 108 4.389 -5.359 0.920 1.00 35.35 H new ATOM 0 HD11 LEU A 108 4.954 -4.225 3.035 1.00 14.13 H new ATOM 0 HD12 LEU A 108 6.299 -4.165 1.871 1.00 14.13 H new ATOM 0 HD13 LEU A 108 5.287 -2.725 2.137 1.00 14.13 H new ATOM 0 HD21 LEU A 108 2.605 -4.284 2.237 1.00 34.11 H new ATOM 0 HD22 LEU A 108 2.823 -2.786 1.301 1.00 34.11 H new ATOM 0 HD23 LEU A 108 2.246 -4.264 0.494 1.00 34.11 H new ATOM 1173 N VAL A 109 3.776 -2.689 -3.637 1.00 33.25 N ATOM 1174 CA VAL A 109 4.270 -2.211 -4.932 1.00 54.11 C ATOM 1175 C VAL A 109 4.932 -0.824 -4.814 1.00 23.32 C ATOM 1176 O VAL A 109 4.299 0.155 -4.413 1.00 32.21 O ATOM 1177 CB VAL A 109 3.134 -2.175 -5.993 1.00 73.02 C ATOM 1178 CG1 VAL A 109 2.713 -3.592 -6.376 1.00 20.15 C ATOM 1179 CG2 VAL A 109 1.926 -1.384 -5.489 1.00 1.33 C ATOM 0 H VAL A 109 2.847 -2.349 -3.389 1.00 33.25 H new ATOM 0 HA VAL A 109 5.029 -2.921 -5.262 1.00 54.11 H new ATOM 0 HB VAL A 109 3.523 -1.671 -6.878 1.00 73.02 H new ATOM 0 HG11 VAL A 109 1.917 -3.547 -7.119 1.00 20.15 H new ATOM 0 HG12 VAL A 109 3.568 -4.126 -6.791 1.00 20.15 H new ATOM 0 HG13 VAL A 109 2.353 -4.116 -5.491 1.00 20.15 H new ATOM 0 HG21 VAL A 109 1.150 -1.378 -6.254 1.00 1.33 H new ATOM 0 HG22 VAL A 109 1.538 -1.850 -4.583 1.00 1.33 H new ATOM 0 HG23 VAL A 109 2.227 -0.360 -5.270 1.00 1.33 H new ATOM 1189 N LEU A 110 6.220 -0.766 -5.155 1.00 52.31 N ATOM 1190 CA LEU A 110 7.009 0.468 -5.059 1.00 75.33 C ATOM 1191 C LEU A 110 6.949 1.281 -6.363 1.00 52.34 C ATOM 1192 O LEU A 110 7.286 0.779 -7.439 1.00 2.32 O ATOM 1193 CB LEU A 110 8.471 0.125 -4.732 1.00 12.32 C ATOM 1194 CG LEU A 110 8.694 -0.575 -3.380 1.00 12.41 C ATOM 1195 CD1 LEU A 110 10.137 -1.070 -3.261 1.00 21.04 C ATOM 1196 CD2 LEU A 110 8.338 0.362 -2.223 1.00 23.31 C ATOM 0 H LEU A 110 6.746 -1.567 -5.504 1.00 52.31 H new ATOM 0 HA LEU A 110 6.583 1.077 -4.262 1.00 75.33 H new ATOM 0 HB2 LEU A 110 8.863 -0.515 -5.523 1.00 12.32 H new ATOM 0 HB3 LEU A 110 9.055 1.045 -4.747 1.00 12.32 H new ATOM 0 HG LEU A 110 8.035 -1.442 -3.327 1.00 12.41 H new ATOM 0 HD11 LEU A 110 10.275 -1.562 -2.298 1.00 21.04 H new ATOM 0 HD12 LEU A 110 10.346 -1.778 -4.063 1.00 21.04 H new ATOM 0 HD13 LEU A 110 10.819 -0.223 -3.337 1.00 21.04 H new ATOM 0 HD21 LEU A 110 8.502 -0.151 -1.275 1.00 23.31 H new ATOM 0 HD22 LEU A 110 8.967 1.251 -2.268 1.00 23.31 H new ATOM 0 HD23 LEU A 110 7.291 0.654 -2.301 1.00 23.31 H new ATOM 1208 N PHE A 111 6.524 2.536 -6.256 1.00 52.03 N ATOM 1209 CA PHE A 111 6.463 3.447 -7.403 1.00 52.41 C ATOM 1210 C PHE A 111 7.496 4.578 -7.279 1.00 63.13 C ATOM 1211 O PHE A 111 7.732 5.111 -6.192 1.00 32.32 O ATOM 1212 CB PHE A 111 5.055 4.039 -7.538 1.00 44.34 C ATOM 1213 CG PHE A 111 3.999 3.009 -7.850 1.00 24.31 C ATOM 1214 CD1 PHE A 111 3.830 2.544 -9.146 1.00 62.13 C ATOM 1215 CD2 PHE A 111 3.179 2.503 -6.851 1.00 61.54 C ATOM 1216 CE1 PHE A 111 2.870 1.595 -9.438 1.00 64.22 C ATOM 1217 CE2 PHE A 111 2.219 1.557 -7.139 1.00 11.42 C ATOM 1218 CZ PHE A 111 2.063 1.100 -8.434 1.00 42.32 C ATOM 0 H PHE A 111 6.213 2.952 -5.378 1.00 52.03 H new ATOM 0 HA PHE A 111 6.699 2.870 -8.297 1.00 52.41 H new ATOM 0 HB2 PHE A 111 4.793 4.548 -6.611 1.00 44.34 H new ATOM 0 HB3 PHE A 111 5.060 4.793 -8.325 1.00 44.34 H new ATOM 0 HD1 PHE A 111 4.457 2.929 -9.937 1.00 62.13 H new ATOM 0 HD2 PHE A 111 3.295 2.855 -5.836 1.00 61.54 H new ATOM 0 HE1 PHE A 111 2.751 1.241 -10.451 1.00 64.22 H new ATOM 0 HE2 PHE A 111 1.588 1.172 -6.352 1.00 11.42 H new ATOM 0 HZ PHE A 111 1.312 0.358 -8.660 1.00 42.32 H new ATOM 1228 N ARG A 112 8.105 4.934 -8.405 1.00 13.23 N ATOM 1229 CA ARG A 112 9.098 6.009 -8.457 1.00 64.23 C ATOM 1230 C ARG A 112 8.437 7.355 -8.800 1.00 74.31 C ATOM 1231 O ARG A 112 8.193 7.661 -9.969 1.00 35.12 O ATOM 1232 CB ARG A 112 10.173 5.660 -9.496 1.00 71.11 C ATOM 1233 CG ARG A 112 10.894 4.345 -9.205 1.00 75.21 C ATOM 1234 CD ARG A 112 11.772 3.905 -10.372 1.00 42.22 C ATOM 1235 NE ARG A 112 12.810 4.887 -10.692 1.00 42.41 N ATOM 1236 CZ ARG A 112 13.546 4.845 -11.770 1.00 13.03 C ATOM 1237 NH1 ARG A 112 13.369 3.910 -12.649 1.00 52.21 N ATOM 1238 NH2 ARG A 112 14.451 5.750 -11.973 1.00 43.14 N ATOM 0 H ARG A 112 7.927 4.490 -9.306 1.00 13.23 H new ATOM 0 HA ARG A 112 9.561 6.107 -7.475 1.00 64.23 H new ATOM 0 HB2 ARG A 112 9.710 5.602 -10.481 1.00 71.11 H new ATOM 0 HB3 ARG A 112 10.905 6.466 -9.535 1.00 71.11 H new ATOM 0 HG2 ARG A 112 11.508 4.458 -8.312 1.00 75.21 H new ATOM 0 HG3 ARG A 112 10.160 3.568 -8.991 1.00 75.21 H new ATOM 0 HD2 ARG A 112 12.241 2.951 -10.131 1.00 42.22 H new ATOM 0 HD3 ARG A 112 11.148 3.741 -11.251 1.00 42.22 H new ATOM 0 HE ARG A 112 12.968 5.650 -10.033 1.00 42.41 H new ATOM 0 HH11 ARG A 112 12.651 3.201 -12.501 1.00 52.21 H new ATOM 0 HH12 ARG A 112 13.947 3.883 -13.489 1.00 52.21 H new ATOM 0 HH21 ARG A 112 14.589 6.496 -11.291 1.00 43.14 H new ATOM 0 HH22 ARG A 112 15.026 5.717 -12.815 1.00 43.14 H new ATOM 1252 N ALA A 113 8.159 8.160 -7.779 1.00 3.12 N ATOM 1253 CA ALA A 113 7.456 9.433 -7.962 1.00 51.32 C ATOM 1254 C ALA A 113 8.443 10.594 -8.170 1.00 72.10 C ATOM 1255 O ALA A 113 9.315 10.850 -7.333 1.00 31.20 O ATOM 1256 CB ALA A 113 6.545 9.705 -6.765 1.00 51.41 C ATOM 0 H ALA A 113 8.409 7.955 -6.812 1.00 3.12 H new ATOM 0 HA ALA A 113 6.845 9.358 -8.861 1.00 51.32 H new ATOM 0 HB1 ALA A 113 6.027 10.653 -6.910 1.00 51.41 H new ATOM 0 HB2 ALA A 113 5.814 8.902 -6.674 1.00 51.41 H new ATOM 0 HB3 ALA A 113 7.144 9.754 -5.856 1.00 51.41 H new ATOM 1262 N GLY A 114 8.300 11.291 -9.299 1.00 55.22 N ATOM 1263 CA GLY A 114 9.241 12.343 -9.667 1.00 50.50 C ATOM 1264 C GLY A 114 10.646 11.804 -9.924 1.00 20.21 C ATOM 1265 O GLY A 114 11.016 11.527 -11.065 1.00 31.24 O ATOM 0 H GLY A 114 7.545 11.145 -9.969 1.00 55.22 H new ATOM 0 HA2 GLY A 114 8.881 12.852 -10.561 1.00 50.50 H new ATOM 0 HA3 GLY A 114 9.280 13.086 -8.871 1.00 50.50 H new ATOM 1269 N SER A 115 11.416 11.651 -8.853 1.00 31.20 N ATOM 1270 CA SER A 115 12.770 11.071 -8.915 1.00 22.43 C ATOM 1271 C SER A 115 13.257 10.689 -7.515 1.00 52.21 C ATOM 1272 O SER A 115 13.855 9.631 -7.320 1.00 54.13 O ATOM 1273 CB SER A 115 13.784 12.039 -9.555 1.00 74.40 C ATOM 1274 OG SER A 115 13.567 12.181 -10.955 1.00 73.35 O ATOM 0 H SER A 115 11.128 11.923 -7.913 1.00 31.20 H new ATOM 0 HA SER A 115 12.703 10.180 -9.540 1.00 22.43 H new ATOM 0 HB2 SER A 115 13.709 13.014 -9.075 1.00 74.40 H new ATOM 0 HB3 SER A 115 14.796 11.674 -9.379 1.00 74.40 H new ATOM 0 HG SER A 115 12.768 11.677 -11.215 1.00 73.35 H new ATOM 1280 N THR A 116 13.003 11.562 -6.544 1.00 61.04 N ATOM 1281 CA THR A 116 13.442 11.337 -5.158 1.00 53.21 C ATOM 1282 C THR A 116 12.307 10.823 -4.264 1.00 1.23 C ATOM 1283 O THR A 116 12.482 10.669 -3.054 1.00 64.14 O ATOM 1284 CB THR A 116 14.003 12.640 -4.543 1.00 62.32 C ATOM 1285 OG1 THR A 116 12.957 13.618 -4.419 1.00 2.04 O ATOM 1286 CG2 THR A 116 15.127 13.204 -5.407 1.00 35.40 C ATOM 0 H THR A 116 12.495 12.435 -6.686 1.00 61.04 H new ATOM 0 HA THR A 116 14.221 10.576 -5.203 1.00 53.21 H new ATOM 0 HB THR A 116 14.401 12.407 -3.555 1.00 62.32 H new ATOM 0 HG1 THR A 116 13.322 14.439 -4.027 1.00 2.04 H new ATOM 0 HG21 THR A 116 15.507 14.121 -4.956 1.00 35.40 H new ATOM 0 HG22 THR A 116 15.933 12.473 -5.479 1.00 35.40 H new ATOM 0 HG23 THR A 116 14.745 13.422 -6.404 1.00 35.40 H new ATOM 1294 N GLY A 117 11.147 10.548 -4.856 1.00 51.42 N ATOM 1295 CA GLY A 117 9.991 10.108 -4.082 1.00 64.22 C ATOM 1296 C GLY A 117 9.730 8.607 -4.168 1.00 34.23 C ATOM 1297 O GLY A 117 9.297 8.101 -5.205 1.00 52.11 O ATOM 0 H GLY A 117 10.984 10.621 -5.860 1.00 51.42 H new ATOM 0 HA2 GLY A 117 10.138 10.383 -3.038 1.00 64.22 H new ATOM 0 HA3 GLY A 117 9.107 10.642 -4.431 1.00 64.22 H new ATOM 1301 N ARG A 118 10.011 7.887 -3.085 1.00 52.22 N ATOM 1302 CA ARG A 118 9.669 6.462 -2.990 1.00 2.34 C ATOM 1303 C ARG A 118 8.274 6.281 -2.384 1.00 12.32 C ATOM 1304 O ARG A 118 8.062 6.556 -1.204 1.00 33.05 O ATOM 1305 CB ARG A 118 10.712 5.699 -2.152 1.00 72.40 C ATOM 1306 CG ARG A 118 11.870 5.113 -2.962 1.00 24.51 C ATOM 1307 CD ARG A 118 12.525 6.131 -3.892 1.00 24.43 C ATOM 1308 NE ARG A 118 13.139 7.242 -3.167 1.00 34.33 N ATOM 1309 CZ ARG A 118 14.180 7.909 -3.587 1.00 64.23 C ATOM 1310 NH1 ARG A 118 14.765 7.600 -4.699 1.00 62.25 N ATOM 1311 NH2 ARG A 118 14.639 8.888 -2.889 1.00 72.10 N ATOM 0 H ARG A 118 10.475 8.263 -2.258 1.00 52.22 H new ATOM 0 HA ARG A 118 9.670 6.050 -3.999 1.00 2.34 H new ATOM 0 HB2 ARG A 118 11.117 6.373 -1.398 1.00 72.40 H new ATOM 0 HB3 ARG A 118 10.211 4.890 -1.620 1.00 72.40 H new ATOM 0 HG2 ARG A 118 12.621 4.719 -2.278 1.00 24.51 H new ATOM 0 HG3 ARG A 118 11.504 4.273 -3.552 1.00 24.51 H new ATOM 0 HD2 ARG A 118 13.284 5.632 -4.494 1.00 24.43 H new ATOM 0 HD3 ARG A 118 11.777 6.522 -4.582 1.00 24.43 H new ATOM 0 HE ARG A 118 12.727 7.514 -2.274 1.00 34.33 H new ATOM 0 HH11 ARG A 118 14.414 6.825 -5.262 1.00 62.25 H new ATOM 0 HH12 ARG A 118 15.577 8.131 -5.013 1.00 62.25 H new ATOM 0 HH21 ARG A 118 14.190 9.142 -2.009 1.00 72.10 H new ATOM 0 HH22 ARG A 118 15.452 9.410 -3.216 1.00 72.10 H new ATOM 1325 N HIS A 119 7.332 5.821 -3.203 1.00 61.23 N ATOM 1326 CA HIS A 119 5.941 5.624 -2.774 1.00 34.34 C ATOM 1327 C HIS A 119 5.565 4.130 -2.826 1.00 61.01 C ATOM 1328 O HIS A 119 6.099 3.384 -3.648 1.00 71.24 O ATOM 1329 CB HIS A 119 5.019 6.450 -3.684 1.00 54.10 C ATOM 1330 CG HIS A 119 3.587 6.483 -3.248 1.00 41.23 C ATOM 1331 ND1 HIS A 119 3.141 7.397 -2.326 1.00 45.35 N ATOM 1332 CD2 HIS A 119 2.547 5.710 -3.639 1.00 74.11 C ATOM 1333 CE1 HIS A 119 1.853 7.164 -2.178 1.00 35.30 C ATOM 1334 NE2 HIS A 119 1.448 6.151 -2.950 1.00 3.14 N ATOM 0 H HIS A 119 7.505 5.574 -4.178 1.00 61.23 H new ATOM 0 HA HIS A 119 5.825 5.958 -1.743 1.00 34.34 H new ATOM 0 HB2 HIS A 119 5.395 7.472 -3.731 1.00 54.10 H new ATOM 0 HB3 HIS A 119 5.069 6.045 -4.695 1.00 54.10 H new ATOM 0 HD2 HIS A 119 2.578 4.902 -4.355 1.00 74.11 H new ATOM 0 HE1 HIS A 119 1.206 7.721 -1.517 1.00 35.30 H new ATOM 0 HE2 HIS A 119 0.501 5.777 -3.014 1.00 3.14 H new ATOM 1342 N VAL A 120 4.654 3.689 -1.953 1.00 11.21 N ATOM 1343 CA VAL A 120 4.254 2.272 -1.909 1.00 72.14 C ATOM 1344 C VAL A 120 2.725 2.096 -1.811 1.00 62.21 C ATOM 1345 O VAL A 120 2.027 2.906 -1.198 1.00 3.44 O ATOM 1346 CB VAL A 120 4.934 1.534 -0.722 1.00 43.04 C ATOM 1347 CG1 VAL A 120 4.484 2.104 0.623 1.00 51.14 C ATOM 1348 CG2 VAL A 120 4.672 0.029 -0.792 1.00 44.31 C ATOM 0 H VAL A 120 4.181 4.283 -1.272 1.00 11.21 H new ATOM 0 HA VAL A 120 4.587 1.832 -2.849 1.00 72.14 H new ATOM 0 HB VAL A 120 6.009 1.696 -0.806 1.00 43.04 H new ATOM 0 HG11 VAL A 120 4.979 1.565 1.431 1.00 51.14 H new ATOM 0 HG12 VAL A 120 4.748 3.160 0.677 1.00 51.14 H new ATOM 0 HG13 VAL A 120 3.404 1.994 0.722 1.00 51.14 H new ATOM 0 HG21 VAL A 120 5.158 -0.465 0.049 1.00 44.31 H new ATOM 0 HG22 VAL A 120 3.599 -0.156 -0.750 1.00 44.31 H new ATOM 0 HG23 VAL A 120 5.072 -0.367 -1.725 1.00 44.31 H new ATOM 1358 N GLY A 121 2.214 1.033 -2.432 1.00 44.43 N ATOM 1359 CA GLY A 121 0.791 0.715 -2.347 1.00 74.11 C ATOM 1360 C GLY A 121 0.534 -0.764 -2.068 1.00 32.43 C ATOM 1361 O GLY A 121 1.377 -1.615 -2.364 1.00 64.44 O ATOM 0 H GLY A 121 2.761 0.382 -2.996 1.00 44.43 H new ATOM 0 HA2 GLY A 121 0.335 1.314 -1.558 1.00 74.11 H new ATOM 0 HA3 GLY A 121 0.304 0.994 -3.281 1.00 74.11 H new ATOM 1365 N ILE A 122 -0.628 -1.078 -1.497 1.00 72.10 N ATOM 1366 CA ILE A 122 -0.987 -2.470 -1.184 1.00 54.12 C ATOM 1367 C ILE A 122 -1.741 -3.125 -2.353 1.00 25.32 C ATOM 1368 O ILE A 122 -2.925 -2.849 -2.567 1.00 71.01 O ATOM 1369 CB ILE A 122 -1.874 -2.553 0.085 1.00 25.34 C ATOM 1370 CG1 ILE A 122 -1.226 -1.791 1.253 1.00 32.43 C ATOM 1371 CG2 ILE A 122 -2.122 -4.012 0.470 1.00 2.34 C ATOM 1372 CD1 ILE A 122 -2.075 -1.759 2.510 1.00 34.52 C ATOM 0 H ILE A 122 -1.339 -0.393 -1.240 1.00 72.10 H new ATOM 0 HA ILE A 122 -0.053 -3.003 -1.008 1.00 54.12 H new ATOM 0 HB ILE A 122 -2.833 -2.086 -0.138 1.00 25.34 H new ATOM 0 HG12 ILE A 122 -0.266 -2.251 1.486 1.00 32.43 H new ATOM 0 HG13 ILE A 122 -1.021 -0.768 0.938 1.00 32.43 H new ATOM 0 HG21 ILE A 122 -2.746 -4.052 1.363 1.00 2.34 H new ATOM 0 HG22 ILE A 122 -2.627 -4.524 -0.349 1.00 2.34 H new ATOM 0 HG23 ILE A 122 -1.169 -4.502 0.671 1.00 2.34 H new ATOM 0 HD11 ILE A 122 -1.551 -1.204 3.289 1.00 34.52 H new ATOM 0 HD12 ILE A 122 -3.026 -1.272 2.294 1.00 34.52 H new ATOM 0 HD13 ILE A 122 -2.258 -2.778 2.851 1.00 34.52 H new ATOM 1384 N TYR A 123 -1.055 -3.985 -3.109 1.00 71.12 N ATOM 1385 CA TYR A 123 -1.666 -4.653 -4.265 1.00 1.21 C ATOM 1386 C TYR A 123 -2.727 -5.680 -3.825 1.00 62.05 C ATOM 1387 O TYR A 123 -2.404 -6.790 -3.400 1.00 5.12 O ATOM 1388 CB TYR A 123 -0.584 -5.325 -5.127 1.00 23.33 C ATOM 1389 CG TYR A 123 -1.100 -5.880 -6.446 1.00 50.14 C ATOM 1390 CD1 TYR A 123 -1.275 -5.051 -7.552 1.00 2.55 C ATOM 1391 CD2 TYR A 123 -1.416 -7.229 -6.586 1.00 5.31 C ATOM 1392 CE1 TYR A 123 -1.742 -5.550 -8.754 1.00 62.10 C ATOM 1393 CE2 TYR A 123 -1.884 -7.734 -7.786 1.00 2.55 C ATOM 1394 CZ TYR A 123 -2.047 -6.891 -8.867 1.00 70.13 C ATOM 1395 OH TYR A 123 -2.518 -7.390 -10.064 1.00 22.01 O ATOM 0 H TYR A 123 -0.080 -4.236 -2.944 1.00 71.12 H new ATOM 0 HA TYR A 123 -2.170 -3.895 -4.864 1.00 1.21 H new ATOM 0 HB2 TYR A 123 0.204 -4.600 -5.333 1.00 23.33 H new ATOM 0 HB3 TYR A 123 -0.131 -6.135 -4.556 1.00 23.33 H new ATOM 0 HD1 TYR A 123 -1.042 -4.000 -7.469 1.00 2.55 H new ATOM 0 HD2 TYR A 123 -1.294 -7.893 -5.743 1.00 5.31 H new ATOM 0 HE1 TYR A 123 -1.868 -4.892 -9.601 1.00 62.10 H new ATOM 0 HE2 TYR A 123 -2.121 -8.784 -7.877 1.00 2.55 H new ATOM 0 HH TYR A 123 -2.683 -8.352 -9.975 1.00 22.01 H new ATOM 1405 N ILE A 124 -3.996 -5.286 -3.925 1.00 55.25 N ATOM 1406 CA ILE A 124 -5.114 -6.147 -3.518 1.00 5.04 C ATOM 1407 C ILE A 124 -5.484 -7.156 -4.617 1.00 2.12 C ATOM 1408 O ILE A 124 -6.096 -8.190 -4.350 1.00 54.22 O ATOM 1409 CB ILE A 124 -6.368 -5.308 -3.154 1.00 5.22 C ATOM 1410 CG1 ILE A 124 -6.913 -4.572 -4.393 1.00 3.42 C ATOM 1411 CG2 ILE A 124 -6.044 -4.318 -2.037 1.00 15.30 C ATOM 1412 CD1 ILE A 124 -8.156 -3.744 -4.127 1.00 12.42 C ATOM 0 H ILE A 124 -4.279 -4.375 -4.285 1.00 55.25 H new ATOM 0 HA ILE A 124 -4.780 -6.694 -2.637 1.00 5.04 H new ATOM 0 HB ILE A 124 -7.142 -5.988 -2.797 1.00 5.22 H new ATOM 0 HG12 ILE A 124 -6.133 -3.920 -4.787 1.00 3.42 H new ATOM 0 HG13 ILE A 124 -7.137 -5.305 -5.168 1.00 3.42 H new ATOM 0 HG21 ILE A 124 -6.935 -3.738 -1.795 1.00 15.30 H new ATOM 0 HG22 ILE A 124 -5.714 -4.863 -1.152 1.00 15.30 H new ATOM 0 HG23 ILE A 124 -5.252 -3.645 -2.365 1.00 15.30 H new ATOM 0 HD11 ILE A 124 -8.475 -3.259 -5.050 1.00 12.42 H new ATOM 0 HD12 ILE A 124 -8.954 -4.392 -3.763 1.00 12.42 H new ATOM 0 HD13 ILE A 124 -7.934 -2.985 -3.376 1.00 12.42 H new ATOM 1424 N GLY A 125 -5.112 -6.841 -5.856 1.00 21.41 N ATOM 1425 CA GLY A 125 -5.424 -7.708 -6.988 1.00 23.50 C ATOM 1426 C GLY A 125 -6.159 -6.975 -8.103 1.00 34.22 C ATOM 1427 O GLY A 125 -6.558 -5.822 -7.936 1.00 24.54 O ATOM 0 H GLY A 125 -4.596 -5.995 -6.100 1.00 21.41 H new ATOM 0 HA2 GLY A 125 -4.500 -8.130 -7.383 1.00 23.50 H new ATOM 0 HA3 GLY A 125 -6.034 -8.543 -6.644 1.00 23.50 H new ATOM 1431 N ASN A 126 -6.318 -7.637 -9.250 1.00 33.23 N ATOM 1432 CA ASN A 126 -7.036 -7.067 -10.403 1.00 44.45 C ATOM 1433 C ASN A 126 -6.362 -5.780 -10.913 1.00 21.30 C ATOM 1434 O ASN A 126 -7.021 -4.924 -11.509 1.00 21.40 O ATOM 1435 CB ASN A 126 -8.497 -6.767 -10.029 1.00 45.34 C ATOM 1436 CG ASN A 126 -9.209 -7.970 -9.451 1.00 20.45 C ATOM 1437 OD1 ASN A 126 -9.241 -8.166 -8.243 1.00 54.33 O ATOM 1438 ND2 ASN A 126 -9.777 -8.791 -10.307 1.00 45.10 N ATOM 0 H ASN A 126 -5.957 -8.577 -9.411 1.00 33.23 H new ATOM 0 HA ASN A 126 -7.007 -7.808 -11.202 1.00 44.45 H new ATOM 0 HB2 ASN A 126 -8.523 -5.952 -9.306 1.00 45.34 H new ATOM 0 HB3 ASN A 126 -9.032 -6.424 -10.915 1.00 45.34 H new ATOM 0 HD21 ASN A 126 -10.264 -9.622 -9.971 1.00 45.10 H new ATOM 0 HD22 ASN A 126 -9.731 -8.597 -11.307 1.00 45.10 H new ATOM 1445 N ASN A 127 -5.045 -5.663 -10.701 1.00 4.32 N ATOM 1446 CA ASN A 127 -4.297 -4.437 -11.033 1.00 32.42 C ATOM 1447 C ASN A 127 -4.774 -3.243 -10.192 1.00 32.41 C ATOM 1448 O ASN A 127 -4.597 -2.094 -10.581 1.00 11.34 O ATOM 1449 CB ASN A 127 -4.409 -4.110 -12.532 1.00 45.44 C ATOM 1450 CG ASN A 127 -3.722 -5.138 -13.411 1.00 51.35 C ATOM 1451 OD1 ASN A 127 -4.251 -5.345 -14.600 1.00 35.33 O flip ATOM 1452 ND2 ASN A 127 -2.723 -5.737 -13.027 1.00 64.20 N flip ATOM 0 H ASN A 127 -4.471 -6.404 -10.299 1.00 4.32 H new ATOM 0 HA ASN A 127 -3.250 -4.623 -10.796 1.00 32.42 H new ATOM 0 HB2 ASN A 127 -5.462 -4.048 -12.808 1.00 45.44 H new ATOM 0 HB3 ASN A 127 -3.972 -3.129 -12.719 1.00 45.44 H new ATOM 0 HD21 ASN A 127 -2.342 -5.550 -12.100 1.00 64.20 H new ATOM 0 HD22 ASN A 127 -2.274 -6.422 -13.635 1.00 64.20 H new ATOM 1459 N GLN A 128 -5.363 -3.518 -9.033 1.00 71.42 N ATOM 1460 CA GLN A 128 -5.812 -2.460 -8.119 1.00 3.34 C ATOM 1461 C GLN A 128 -5.031 -2.486 -6.801 1.00 3.22 C ATOM 1462 O GLN A 128 -4.583 -3.544 -6.341 1.00 70.43 O ATOM 1463 CB GLN A 128 -7.311 -2.595 -7.826 1.00 63.44 C ATOM 1464 CG GLN A 128 -8.198 -2.436 -9.054 1.00 13.50 C ATOM 1465 CD GLN A 128 -9.683 -2.519 -8.728 1.00 31.02 C ATOM 1466 OE1 GLN A 128 -10.078 -2.041 -7.561 1.00 63.35 O flip ATOM 1467 NE2 GLN A 128 -10.482 -2.993 -9.530 1.00 31.12 N flip ATOM 0 H GLN A 128 -5.543 -4.465 -8.699 1.00 71.42 H new ATOM 0 HA GLN A 128 -5.625 -1.507 -8.614 1.00 3.34 H new ATOM 0 HB2 GLN A 128 -7.497 -3.572 -7.380 1.00 63.44 H new ATOM 0 HB3 GLN A 128 -7.595 -1.847 -7.086 1.00 63.44 H new ATOM 0 HG2 GLN A 128 -7.988 -1.476 -9.526 1.00 13.50 H new ATOM 0 HG3 GLN A 128 -7.947 -3.209 -9.780 1.00 13.50 H new ATOM 0 HE21 GLN A 128 -10.152 -3.356 -10.425 1.00 31.12 H new ATOM 0 HE22 GLN A 128 -11.476 -3.024 -9.302 1.00 31.12 H new ATOM 1476 N PHE A 129 -4.880 -1.314 -6.193 1.00 23.14 N ATOM 1477 CA PHE A 129 -4.167 -1.187 -4.918 1.00 15.32 C ATOM 1478 C PHE A 129 -4.595 0.068 -4.142 1.00 73.15 C ATOM 1479 O PHE A 129 -4.970 1.087 -4.729 1.00 11.43 O ATOM 1480 CB PHE A 129 -2.646 -1.185 -5.149 1.00 42.55 C ATOM 1481 CG PHE A 129 -2.188 -0.283 -6.266 1.00 64.21 C ATOM 1482 CD1 PHE A 129 -2.198 -0.735 -7.579 1.00 32.25 C ATOM 1483 CD2 PHE A 129 -1.747 1.008 -6.010 1.00 75.33 C ATOM 1484 CE1 PHE A 129 -1.784 0.078 -8.609 1.00 42.02 C ATOM 1485 CE2 PHE A 129 -1.329 1.827 -7.041 1.00 21.22 C ATOM 1486 CZ PHE A 129 -1.348 1.362 -8.344 1.00 31.01 C ATOM 0 H PHE A 129 -5.241 -0.434 -6.560 1.00 23.14 H new ATOM 0 HA PHE A 129 -4.432 -2.052 -4.310 1.00 15.32 H new ATOM 0 HB2 PHE A 129 -2.151 -0.881 -4.227 1.00 42.55 H new ATOM 0 HB3 PHE A 129 -2.322 -2.203 -5.364 1.00 42.55 H new ATOM 0 HD1 PHE A 129 -2.535 -1.738 -7.795 1.00 32.25 H new ATOM 0 HD2 PHE A 129 -1.730 1.376 -4.995 1.00 75.33 H new ATOM 0 HE1 PHE A 129 -1.800 -0.288 -9.625 1.00 42.02 H new ATOM 0 HE2 PHE A 129 -0.988 2.830 -6.830 1.00 21.22 H new ATOM 0 HZ PHE A 129 -1.023 2.001 -9.152 1.00 31.01 H new ATOM 1496 N VAL A 130 -4.552 -0.029 -2.812 1.00 20.14 N ATOM 1497 CA VAL A 130 -4.872 1.102 -1.929 1.00 71.35 C ATOM 1498 C VAL A 130 -3.592 1.726 -1.349 1.00 40.20 C ATOM 1499 O VAL A 130 -2.641 1.014 -1.009 1.00 24.50 O ATOM 1500 CB VAL A 130 -5.812 0.674 -0.767 1.00 73.13 C ATOM 1501 CG1 VAL A 130 -5.160 -0.399 0.105 1.00 21.32 C ATOM 1502 CG2 VAL A 130 -6.235 1.884 0.069 1.00 31.34 C ATOM 0 H VAL A 130 -4.297 -0.884 -2.317 1.00 20.14 H new ATOM 0 HA VAL A 130 -5.389 1.844 -2.537 1.00 71.35 H new ATOM 0 HB VAL A 130 -6.710 0.241 -1.207 1.00 73.13 H new ATOM 0 HG11 VAL A 130 -5.841 -0.678 0.909 1.00 21.32 H new ATOM 0 HG12 VAL A 130 -4.937 -1.276 -0.503 1.00 21.32 H new ATOM 0 HG13 VAL A 130 -4.236 -0.009 0.532 1.00 21.32 H new ATOM 0 HG21 VAL A 130 -6.892 1.558 0.875 1.00 31.34 H new ATOM 0 HG22 VAL A 130 -5.351 2.361 0.492 1.00 31.34 H new ATOM 0 HG23 VAL A 130 -6.764 2.597 -0.564 1.00 31.34 H new ATOM 1512 N HIS A 131 -3.568 3.051 -1.245 1.00 42.10 N ATOM 1513 CA HIS A 131 -2.386 3.760 -0.745 1.00 53.23 C ATOM 1514 C HIS A 131 -2.745 5.160 -0.232 1.00 75.14 C ATOM 1515 O HIS A 131 -3.805 5.697 -0.549 1.00 44.03 O ATOM 1516 CB HIS A 131 -1.333 3.870 -1.854 1.00 3.44 C ATOM 1517 CG HIS A 131 -1.811 4.606 -3.073 1.00 75.41 C ATOM 1518 ND1 HIS A 131 -1.309 5.838 -3.404 1.00 11.40 N ATOM 1519 CD2 HIS A 131 -2.721 4.238 -4.006 1.00 65.30 C ATOM 1520 CE1 HIS A 131 -1.911 6.188 -4.523 1.00 43.13 C ATOM 1521 NE2 HIS A 131 -2.775 5.249 -4.931 1.00 51.42 N ATOM 0 H HIS A 131 -4.348 3.657 -1.498 1.00 42.10 H new ATOM 0 HA HIS A 131 -1.982 3.187 0.090 1.00 53.23 H new ATOM 0 HB2 HIS A 131 -0.453 4.376 -1.457 1.00 3.44 H new ATOM 0 HB3 HIS A 131 -1.020 2.867 -2.146 1.00 3.44 H new ATOM 0 HD2 HIS A 131 -3.295 3.323 -4.019 1.00 65.30 H new ATOM 0 HE1 HIS A 131 -1.730 7.116 -5.046 1.00 43.13 H new ATOM 0 HE2 HIS A 131 -3.359 5.280 -5.767 1.00 51.42 H new ATOM 1529 N ALA A 132 -1.853 5.743 0.567 1.00 73.11 N ATOM 1530 CA ALA A 132 -2.034 7.108 1.065 1.00 41.40 C ATOM 1531 C ALA A 132 -1.169 8.099 0.273 1.00 1.04 C ATOM 1532 O ALA A 132 0.012 8.293 0.568 1.00 54.44 O ATOM 1533 CB ALA A 132 -1.719 7.182 2.558 1.00 73.05 C ATOM 0 H ALA A 132 -0.995 5.291 0.885 1.00 73.11 H new ATOM 0 HA ALA A 132 -3.078 7.387 0.923 1.00 41.40 H new ATOM 0 HB1 ALA A 132 -1.859 8.204 2.909 1.00 73.05 H new ATOM 0 HB2 ALA A 132 -2.387 6.516 3.104 1.00 73.05 H new ATOM 0 HB3 ALA A 132 -0.686 6.879 2.727 1.00 73.05 H new ATOM 1539 N SER A 133 -1.758 8.701 -0.759 1.00 34.40 N ATOM 1540 CA SER A 133 -1.043 9.671 -1.600 1.00 73.32 C ATOM 1541 C SER A 133 -0.912 11.033 -0.908 1.00 14.41 C ATOM 1542 O SER A 133 -1.603 11.320 0.071 1.00 1.21 O ATOM 1543 CB SER A 133 -1.751 9.847 -2.949 1.00 63.15 C ATOM 1544 OG SER A 133 -1.103 10.829 -3.741 1.00 52.14 O ATOM 0 H SER A 133 -2.726 8.538 -1.036 1.00 34.40 H new ATOM 0 HA SER A 133 -0.042 9.273 -1.767 1.00 73.32 H new ATOM 0 HB2 SER A 133 -1.765 8.897 -3.482 1.00 63.15 H new ATOM 0 HB3 SER A 133 -2.789 10.136 -2.784 1.00 63.15 H new ATOM 0 HG SER A 133 -1.572 10.921 -4.596 1.00 52.14 H new ATOM 1550 N THR A 134 -0.046 11.884 -1.448 1.00 51.11 N ATOM 1551 CA THR A 134 0.253 13.189 -0.844 1.00 32.23 C ATOM 1552 C THR A 134 -0.960 14.132 -0.877 1.00 61.44 C ATOM 1553 O THR A 134 -1.522 14.481 0.161 1.00 35.14 O ATOM 1554 CB THR A 134 1.442 13.869 -1.562 1.00 50.15 C ATOM 1555 OG1 THR A 134 1.127 14.062 -2.950 1.00 4.32 O ATOM 1556 CG2 THR A 134 2.709 13.024 -1.436 1.00 2.05 C ATOM 0 H THR A 134 0.467 11.696 -2.309 1.00 51.11 H new ATOM 0 HA THR A 134 0.513 12.998 0.197 1.00 32.23 H new ATOM 0 HB THR A 134 1.621 14.835 -1.090 1.00 50.15 H new ATOM 0 HG1 THR A 134 1.883 14.495 -3.400 1.00 4.32 H new ATOM 0 HG21 THR A 134 3.531 13.523 -1.949 1.00 2.05 H new ATOM 0 HG22 THR A 134 2.960 12.900 -0.383 1.00 2.05 H new ATOM 0 HG23 THR A 134 2.540 12.046 -1.887 1.00 2.05 H new ATOM 1564 N SER A 135 -1.365 14.532 -2.078 1.00 4.32 N ATOM 1565 CA SER A 135 -2.481 15.475 -2.254 1.00 11.20 C ATOM 1566 C SER A 135 -3.835 14.760 -2.370 1.00 63.22 C ATOM 1567 O SER A 135 -4.852 15.389 -2.671 1.00 14.14 O ATOM 1568 CB SER A 135 -2.249 16.332 -3.509 1.00 0.12 C ATOM 1569 OG SER A 135 -2.177 15.527 -4.679 1.00 43.11 O ATOM 0 H SER A 135 -0.940 14.220 -2.951 1.00 4.32 H new ATOM 0 HA SER A 135 -2.513 16.106 -1.366 1.00 11.20 H new ATOM 0 HB2 SER A 135 -3.058 17.056 -3.612 1.00 0.12 H new ATOM 0 HB3 SER A 135 -1.325 16.900 -3.398 1.00 0.12 H new ATOM 0 HG SER A 135 -2.031 16.099 -5.461 1.00 43.11 H new ATOM 1575 N SER A 136 -3.856 13.451 -2.124 1.00 5.41 N ATOM 1576 CA SER A 136 -5.093 12.662 -2.272 1.00 65.40 C ATOM 1577 C SER A 136 -5.448 11.870 -1.003 1.00 21.23 C ATOM 1578 O SER A 136 -6.624 11.609 -0.736 1.00 34.25 O ATOM 1579 CB SER A 136 -4.961 11.695 -3.456 1.00 73.21 C ATOM 1580 OG SER A 136 -4.688 12.390 -4.666 1.00 35.53 O ATOM 0 H SER A 136 -3.043 12.913 -1.824 1.00 5.41 H new ATOM 0 HA SER A 136 -5.900 13.372 -2.451 1.00 65.40 H new ATOM 0 HB2 SER A 136 -4.162 10.981 -3.257 1.00 73.21 H new ATOM 0 HB3 SER A 136 -5.882 11.122 -3.564 1.00 73.21 H new ATOM 0 HG SER A 136 -4.608 11.747 -5.401 1.00 35.53 H new ATOM 1586 N GLY A 137 -4.437 11.486 -0.228 1.00 10.05 N ATOM 1587 CA GLY A 137 -4.670 10.677 0.967 1.00 35.24 C ATOM 1588 C GLY A 137 -4.941 9.207 0.649 1.00 71.40 C ATOM 1589 O GLY A 137 -4.504 8.697 -0.381 1.00 34.22 O ATOM 0 H GLY A 137 -3.459 11.718 -0.402 1.00 10.05 H new ATOM 0 HA2 GLY A 137 -3.801 10.747 1.622 1.00 35.24 H new ATOM 0 HA3 GLY A 137 -5.518 11.086 1.517 1.00 35.24 H new ATOM 1593 N VAL A 138 -5.652 8.524 1.542 1.00 34.11 N ATOM 1594 CA VAL A 138 -5.987 7.103 1.357 1.00 40.15 C ATOM 1595 C VAL A 138 -6.984 6.885 0.195 1.00 14.12 C ATOM 1596 O VAL A 138 -8.199 7.009 0.373 1.00 15.34 O ATOM 1597 CB VAL A 138 -6.576 6.508 2.667 1.00 74.14 C ATOM 1598 CG1 VAL A 138 -6.983 5.047 2.480 1.00 73.44 C ATOM 1599 CG2 VAL A 138 -5.583 6.659 3.821 1.00 2.54 C ATOM 0 H VAL A 138 -6.012 8.928 2.407 1.00 34.11 H new ATOM 0 HA VAL A 138 -5.060 6.588 1.104 1.00 40.15 H new ATOM 0 HB VAL A 138 -7.477 7.069 2.916 1.00 74.14 H new ATOM 0 HG11 VAL A 138 -7.391 4.661 3.414 1.00 73.44 H new ATOM 0 HG12 VAL A 138 -7.739 4.977 1.698 1.00 73.44 H new ATOM 0 HG13 VAL A 138 -6.110 4.460 2.195 1.00 73.44 H new ATOM 0 HG21 VAL A 138 -6.013 6.237 4.729 1.00 2.54 H new ATOM 0 HG22 VAL A 138 -4.660 6.132 3.578 1.00 2.54 H new ATOM 0 HG23 VAL A 138 -5.367 7.716 3.979 1.00 2.54 H new ATOM 1609 N ILE A 139 -6.465 6.566 -0.997 1.00 34.00 N ATOM 1610 CA ILE A 139 -7.317 6.351 -2.185 1.00 34.32 C ATOM 1611 C ILE A 139 -6.967 5.046 -2.926 1.00 11.42 C ATOM 1612 O ILE A 139 -6.092 4.288 -2.502 1.00 54.21 O ATOM 1613 CB ILE A 139 -7.237 7.537 -3.200 1.00 13.14 C ATOM 1614 CG1 ILE A 139 -5.930 7.508 -4.024 1.00 44.31 C ATOM 1615 CG2 ILE A 139 -7.379 8.876 -2.482 1.00 11.04 C ATOM 1616 CD1 ILE A 139 -4.670 7.754 -3.221 1.00 72.30 C ATOM 0 H ILE A 139 -5.466 6.450 -1.170 1.00 34.00 H new ATOM 0 HA ILE A 139 -8.333 6.283 -1.797 1.00 34.32 H new ATOM 0 HB ILE A 139 -8.068 7.419 -3.895 1.00 13.14 H new ATOM 0 HG12 ILE A 139 -5.848 6.539 -4.515 1.00 44.31 H new ATOM 0 HG13 ILE A 139 -5.996 8.260 -4.811 1.00 44.31 H new ATOM 0 HG21 ILE A 139 -7.320 9.686 -3.209 1.00 11.04 H new ATOM 0 HG22 ILE A 139 -8.341 8.915 -1.972 1.00 11.04 H new ATOM 0 HG23 ILE A 139 -6.577 8.984 -1.752 1.00 11.04 H new ATOM 0 HD11 ILE A 139 -3.804 7.715 -3.882 1.00 72.30 H new ATOM 0 HD12 ILE A 139 -4.724 8.736 -2.751 1.00 72.30 H new ATOM 0 HD13 ILE A 139 -4.574 6.988 -2.451 1.00 72.30 H new ATOM 1628 N ILE A 140 -7.668 4.800 -4.038 1.00 72.11 N ATOM 1629 CA ILE A 140 -7.424 3.622 -4.887 1.00 60.41 C ATOM 1630 C ILE A 140 -6.921 4.035 -6.285 1.00 62.41 C ATOM 1631 O ILE A 140 -7.406 5.006 -6.871 1.00 34.10 O ATOM 1632 CB ILE A 140 -8.715 2.774 -5.069 1.00 44.14 C ATOM 1633 CG1 ILE A 140 -9.324 2.392 -3.708 1.00 44.44 C ATOM 1634 CG2 ILE A 140 -8.425 1.519 -5.896 1.00 45.24 C ATOM 1635 CD1 ILE A 140 -8.458 1.463 -2.879 1.00 4.50 C ATOM 0 H ILE A 140 -8.416 5.405 -4.376 1.00 72.11 H new ATOM 0 HA ILE A 140 -6.664 3.029 -4.379 1.00 60.41 H new ATOM 0 HB ILE A 140 -9.442 3.383 -5.606 1.00 44.14 H new ATOM 0 HG12 ILE A 140 -9.511 3.302 -3.138 1.00 44.44 H new ATOM 0 HG13 ILE A 140 -10.291 1.917 -3.875 1.00 44.44 H new ATOM 0 HG21 ILE A 140 -9.341 0.940 -6.012 1.00 45.24 H new ATOM 0 HG22 ILE A 140 -8.052 1.809 -6.879 1.00 45.24 H new ATOM 0 HG23 ILE A 140 -7.675 0.914 -5.388 1.00 45.24 H new ATOM 0 HD11 ILE A 140 -8.959 1.243 -1.936 1.00 4.50 H new ATOM 0 HD12 ILE A 140 -8.292 0.535 -3.427 1.00 4.50 H new ATOM 0 HD13 ILE A 140 -7.500 1.942 -2.677 1.00 4.50 H new ATOM 1647 N SER A 141 -5.949 3.295 -6.817 1.00 52.41 N ATOM 1648 CA SER A 141 -5.490 3.490 -8.202 1.00 31.11 C ATOM 1649 C SER A 141 -5.123 2.148 -8.849 1.00 24.40 C ATOM 1650 O SER A 141 -4.955 1.141 -8.159 1.00 43.43 O ATOM 1651 CB SER A 141 -4.302 4.467 -8.264 1.00 4.44 C ATOM 1652 OG SER A 141 -3.223 4.041 -7.450 1.00 21.32 O ATOM 0 H SER A 141 -5.461 2.554 -6.314 1.00 52.41 H new ATOM 0 HA SER A 141 -6.313 3.929 -8.766 1.00 31.11 H new ATOM 0 HB2 SER A 141 -3.963 4.561 -9.296 1.00 4.44 H new ATOM 0 HB3 SER A 141 -4.629 5.456 -7.944 1.00 4.44 H new ATOM 0 HG SER A 141 -2.886 3.181 -7.777 1.00 21.32 H new ATOM 1658 N SER A 142 -5.011 2.131 -10.179 1.00 35.30 N ATOM 1659 CA SER A 142 -4.784 0.878 -10.920 1.00 52.54 C ATOM 1660 C SER A 142 -3.410 0.829 -11.605 1.00 75.22 C ATOM 1661 O SER A 142 -2.917 1.833 -12.112 1.00 63.01 O ATOM 1662 CB SER A 142 -5.875 0.683 -11.983 1.00 61.21 C ATOM 1663 OG SER A 142 -7.176 0.672 -11.409 1.00 31.41 O ATOM 0 H SER A 142 -5.073 2.963 -10.766 1.00 35.30 H new ATOM 0 HA SER A 142 -4.819 0.076 -10.183 1.00 52.54 H new ATOM 0 HB2 SER A 142 -5.810 1.482 -12.721 1.00 61.21 H new ATOM 0 HB3 SER A 142 -5.703 -0.254 -12.512 1.00 61.21 H new ATOM 0 HG SER A 142 -7.844 0.548 -12.115 1.00 31.41 H new ATOM 1669 N MET A 143 -2.813 -0.366 -11.631 1.00 72.33 N ATOM 1670 CA MET A 143 -1.555 -0.615 -12.355 1.00 32.11 C ATOM 1671 C MET A 143 -1.701 -0.298 -13.851 1.00 64.34 C ATOM 1672 O MET A 143 -0.740 0.082 -14.513 1.00 13.54 O ATOM 1673 CB MET A 143 -1.137 -2.087 -12.200 1.00 73.01 C ATOM 1674 CG MET A 143 -0.896 -2.518 -10.760 1.00 53.34 C ATOM 1675 SD MET A 143 0.563 -1.748 -10.033 1.00 73.14 S ATOM 1676 CE MET A 143 1.857 -2.430 -11.066 1.00 2.20 C ATOM 0 H MET A 143 -3.183 -1.188 -11.154 1.00 72.33 H new ATOM 0 HA MET A 143 -0.794 0.038 -11.927 1.00 32.11 H new ATOM 0 HB2 MET A 143 -1.911 -2.721 -12.632 1.00 73.01 H new ATOM 0 HB3 MET A 143 -0.227 -2.257 -12.776 1.00 73.01 H new ATOM 0 HG2 MET A 143 -1.770 -2.267 -10.160 1.00 53.34 H new ATOM 0 HG3 MET A 143 -0.785 -3.602 -10.724 1.00 53.34 H new ATOM 0 HE1 MET A 143 2.612 -2.903 -10.438 1.00 2.20 H new ATOM 0 HE2 MET A 143 1.430 -3.171 -11.742 1.00 2.20 H new ATOM 0 HE3 MET A 143 2.317 -1.631 -11.647 1.00 2.20 H new ATOM 1686 N ASN A 144 -2.914 -0.478 -14.374 1.00 62.22 N ATOM 1687 CA ASN A 144 -3.204 -0.228 -15.792 1.00 41.45 C ATOM 1688 C ASN A 144 -3.136 1.267 -16.143 1.00 14.41 C ATOM 1689 O ASN A 144 -2.989 1.626 -17.313 1.00 53.53 O ATOM 1690 CB ASN A 144 -4.585 -0.789 -16.148 1.00 40.13 C ATOM 1691 CG ASN A 144 -4.650 -2.302 -16.018 1.00 70.32 C ATOM 1692 OD1 ASN A 144 -3.576 -2.982 -16.366 1.00 45.02 O flip ATOM 1693 ND2 ASN A 144 -5.670 -2.861 -15.627 1.00 33.13 N flip ATOM 0 H ASN A 144 -3.719 -0.798 -13.835 1.00 62.22 H new ATOM 0 HA ASN A 144 -2.438 -0.735 -16.379 1.00 41.45 H new ATOM 0 HB2 ASN A 144 -5.335 -0.339 -15.497 1.00 40.13 H new ATOM 0 HB3 ASN A 144 -4.837 -0.504 -17.170 1.00 40.13 H new ATOM 0 HD21 ASN A 144 -6.486 -2.308 -15.364 1.00 33.13 H new ATOM 0 HD22 ASN A 144 -5.702 -3.879 -15.565 1.00 33.13 H new ATOM 1700 N GLU A 145 -3.238 2.131 -15.134 1.00 74.52 N ATOM 1701 CA GLU A 145 -3.135 3.578 -15.341 1.00 43.30 C ATOM 1702 C GLU A 145 -1.729 3.965 -15.828 1.00 21.13 C ATOM 1703 O GLU A 145 -0.756 3.824 -15.086 1.00 2.05 O ATOM 1704 CB GLU A 145 -3.456 4.322 -14.036 1.00 10.14 C ATOM 1705 CG GLU A 145 -4.900 4.171 -13.573 1.00 34.24 C ATOM 1706 CD GLU A 145 -5.890 4.832 -14.521 1.00 41.44 C ATOM 1707 OE1 GLU A 145 -5.949 6.077 -14.544 1.00 43.41 O ATOM 1708 OE2 GLU A 145 -6.604 4.112 -15.255 1.00 2.43 O ATOM 0 H GLU A 145 -3.392 1.856 -14.164 1.00 74.52 H new ATOM 0 HA GLU A 145 -3.856 3.864 -16.107 1.00 43.30 H new ATOM 0 HB2 GLU A 145 -2.794 3.958 -13.250 1.00 10.14 H new ATOM 0 HB3 GLU A 145 -3.238 5.381 -14.171 1.00 10.14 H new ATOM 0 HG2 GLU A 145 -5.140 3.112 -13.483 1.00 34.24 H new ATOM 0 HG3 GLU A 145 -5.007 4.607 -12.580 1.00 34.24 H new ATOM 1715 N PRO A 146 -1.605 4.460 -17.081 1.00 15.11 N ATOM 1716 CA PRO A 146 -0.304 4.813 -17.688 1.00 23.31 C ATOM 1717 C PRO A 146 0.635 5.579 -16.742 1.00 52.42 C ATOM 1718 O PRO A 146 1.845 5.346 -16.735 1.00 10.51 O ATOM 1719 CB PRO A 146 -0.714 5.686 -18.876 1.00 25.32 C ATOM 1720 CG PRO A 146 -2.038 5.134 -19.290 1.00 55.30 C ATOM 1721 CD PRO A 146 -2.725 4.710 -18.015 1.00 1.32 C ATOM 0 HA PRO A 146 0.270 3.926 -17.955 1.00 23.31 H new ATOM 0 HB2 PRO A 146 -0.790 6.736 -18.592 1.00 25.32 H new ATOM 0 HB3 PRO A 146 0.014 5.626 -19.685 1.00 25.32 H new ATOM 0 HG2 PRO A 146 -2.626 5.884 -19.820 1.00 55.30 H new ATOM 0 HG3 PRO A 146 -1.915 4.289 -19.967 1.00 55.30 H new ATOM 0 HD2 PRO A 146 -3.392 5.487 -17.642 1.00 1.32 H new ATOM 0 HD3 PRO A 146 -3.330 3.815 -18.164 1.00 1.32 H new ATOM 1729 N TYR A 147 0.069 6.481 -15.941 1.00 61.24 N ATOM 1730 CA TYR A 147 0.850 7.263 -14.977 1.00 21.01 C ATOM 1731 C TYR A 147 1.613 6.356 -13.997 1.00 64.01 C ATOM 1732 O TYR A 147 2.817 6.507 -13.809 1.00 61.34 O ATOM 1733 CB TYR A 147 -0.072 8.209 -14.196 1.00 33.41 C ATOM 1734 CG TYR A 147 0.668 9.131 -13.243 1.00 4.42 C ATOM 1735 CD1 TYR A 147 1.211 10.327 -13.697 1.00 13.13 C ATOM 1736 CD2 TYR A 147 0.819 8.813 -11.897 1.00 11.54 C ATOM 1737 CE1 TYR A 147 1.881 11.177 -12.843 1.00 72.45 C ATOM 1738 CE2 TYR A 147 1.485 9.661 -11.035 1.00 45.01 C ATOM 1739 CZ TYR A 147 2.015 10.844 -11.514 1.00 32.44 C ATOM 1740 OH TYR A 147 2.669 11.704 -10.660 1.00 61.44 O ATOM 0 H TYR A 147 -0.929 6.690 -15.939 1.00 61.24 H new ATOM 0 HA TYR A 147 1.582 7.844 -15.538 1.00 21.01 H new ATOM 0 HB2 TYR A 147 -0.642 8.812 -14.903 1.00 33.41 H new ATOM 0 HB3 TYR A 147 -0.791 7.617 -13.630 1.00 33.41 H new ATOM 0 HD1 TYR A 147 1.106 10.595 -14.738 1.00 13.13 H new ATOM 0 HD2 TYR A 147 0.409 7.888 -11.520 1.00 11.54 H new ATOM 0 HE1 TYR A 147 2.299 12.101 -13.215 1.00 72.45 H new ATOM 0 HE2 TYR A 147 1.591 9.401 -9.992 1.00 45.01 H new ATOM 0 HH TYR A 147 2.678 11.324 -9.757 1.00 61.44 H new ATOM 1750 N TRP A 148 0.903 5.407 -13.391 1.00 14.45 N ATOM 1751 CA TRP A 148 1.489 4.518 -12.373 1.00 42.02 C ATOM 1752 C TRP A 148 2.240 3.346 -13.017 1.00 60.43 C ATOM 1753 O TRP A 148 3.287 2.916 -12.527 1.00 33.01 O ATOM 1754 CB TRP A 148 0.387 3.989 -11.446 1.00 44.12 C ATOM 1755 CG TRP A 148 -0.298 5.078 -10.671 1.00 44.32 C ATOM 1756 CD1 TRP A 148 -1.400 5.791 -11.049 1.00 71.40 C ATOM 1757 CD2 TRP A 148 0.086 5.583 -9.391 1.00 31.13 C ATOM 1758 NE1 TRP A 148 -1.720 6.711 -10.080 1.00 72.20 N ATOM 1759 CE2 TRP A 148 -0.823 6.602 -9.051 1.00 2.53 C ATOM 1760 CE3 TRP A 148 1.113 5.270 -8.499 1.00 70.45 C ATOM 1761 CZ2 TRP A 148 -0.732 7.311 -7.856 1.00 53.20 C ATOM 1762 CZ3 TRP A 148 1.203 5.973 -7.313 1.00 41.31 C ATOM 1763 CH2 TRP A 148 0.286 6.984 -7.002 1.00 30.32 C ATOM 0 H TRP A 148 -0.083 5.228 -13.584 1.00 14.45 H new ATOM 0 HA TRP A 148 2.207 5.097 -11.792 1.00 42.02 H new ATOM 0 HB2 TRP A 148 -0.353 3.452 -12.039 1.00 44.12 H new ATOM 0 HB3 TRP A 148 0.819 3.271 -10.749 1.00 44.12 H new ATOM 0 HD1 TRP A 148 -1.940 5.652 -11.974 1.00 71.40 H new ATOM 0 HE1 TRP A 148 -2.499 7.368 -10.120 1.00 72.20 H new ATOM 0 HE3 TRP A 148 1.825 4.492 -8.732 1.00 70.45 H new ATOM 0 HZ2 TRP A 148 -1.439 8.090 -7.612 1.00 53.20 H new ATOM 0 HZ3 TRP A 148 1.993 5.739 -6.615 1.00 41.31 H new ATOM 0 HH2 TRP A 148 0.384 7.517 -6.068 1.00 30.32 H new ATOM 1774 N LYS A 149 1.704 2.855 -14.126 1.00 30.12 N ATOM 1775 CA LYS A 149 2.287 1.729 -14.861 1.00 22.14 C ATOM 1776 C LYS A 149 3.761 1.981 -15.227 1.00 43.54 C ATOM 1777 O LYS A 149 4.584 1.060 -15.202 1.00 52.50 O ATOM 1778 CB LYS A 149 1.458 1.480 -16.124 1.00 2.14 C ATOM 1779 CG LYS A 149 1.885 0.262 -16.932 1.00 12.41 C ATOM 1780 CD LYS A 149 0.921 -0.014 -18.081 1.00 23.03 C ATOM 1781 CE LYS A 149 0.749 1.199 -18.990 1.00 13.14 C ATOM 1782 NZ LYS A 149 -0.171 0.918 -20.119 1.00 73.40 N ATOM 0 H LYS A 149 0.851 3.224 -14.546 1.00 30.12 H new ATOM 0 HA LYS A 149 2.266 0.849 -14.219 1.00 22.14 H new ATOM 0 HB2 LYS A 149 0.412 1.363 -15.839 1.00 2.14 H new ATOM 0 HB3 LYS A 149 1.518 2.362 -16.762 1.00 2.14 H new ATOM 0 HG2 LYS A 149 2.888 0.420 -17.328 1.00 12.41 H new ATOM 0 HG3 LYS A 149 1.934 -0.610 -16.279 1.00 12.41 H new ATOM 0 HD2 LYS A 149 1.288 -0.856 -18.667 1.00 23.03 H new ATOM 0 HD3 LYS A 149 -0.049 -0.305 -17.678 1.00 23.03 H new ATOM 0 HE2 LYS A 149 0.365 2.037 -18.408 1.00 13.14 H new ATOM 0 HE3 LYS A 149 1.721 1.501 -19.380 1.00 13.14 H new ATOM 0 HZ1 LYS A 149 -0.261 1.767 -20.713 1.00 73.40 H new ATOM 0 HZ2 LYS A 149 0.208 0.135 -20.689 1.00 73.40 H new ATOM 0 HZ3 LYS A 149 -1.106 0.655 -19.748 1.00 73.40 H new ATOM 1796 N LYS A 150 4.094 3.226 -15.565 1.00 53.31 N ATOM 1797 CA LYS A 150 5.479 3.595 -15.902 1.00 64.44 C ATOM 1798 C LYS A 150 6.317 3.892 -14.643 1.00 75.32 C ATOM 1799 O LYS A 150 7.546 3.940 -14.702 1.00 15.33 O ATOM 1800 CB LYS A 150 5.498 4.805 -16.850 1.00 23.34 C ATOM 1801 CG LYS A 150 4.873 6.070 -16.262 1.00 14.44 C ATOM 1802 CD LYS A 150 4.894 7.232 -17.254 1.00 55.34 C ATOM 1803 CE LYS A 150 4.086 6.920 -18.511 1.00 44.21 C ATOM 1804 NZ LYS A 150 4.107 8.045 -19.481 1.00 0.42 N ATOM 0 H LYS A 150 3.430 3.998 -15.614 1.00 53.31 H new ATOM 0 HA LYS A 150 5.930 2.740 -16.405 1.00 64.44 H new ATOM 0 HB2 LYS A 150 6.530 5.018 -17.128 1.00 23.34 H new ATOM 0 HB3 LYS A 150 4.968 4.543 -17.766 1.00 23.34 H new ATOM 0 HG2 LYS A 150 3.844 5.863 -15.967 1.00 14.44 H new ATOM 0 HG3 LYS A 150 5.412 6.355 -15.358 1.00 14.44 H new ATOM 0 HD2 LYS A 150 4.492 8.125 -16.776 1.00 55.34 H new ATOM 0 HD3 LYS A 150 5.924 7.455 -17.531 1.00 55.34 H new ATOM 0 HE2 LYS A 150 4.486 6.024 -18.986 1.00 44.21 H new ATOM 0 HE3 LYS A 150 3.055 6.700 -18.234 1.00 44.21 H new ATOM 0 HZ1 LYS A 150 3.546 7.791 -20.319 1.00 0.42 H new ATOM 0 HZ2 LYS A 150 3.701 8.894 -19.037 1.00 0.42 H new ATOM 0 HZ3 LYS A 150 5.088 8.239 -19.766 1.00 0.42 H new ATOM 1818 N ARG A 151 5.651 4.088 -13.503 1.00 71.31 N ATOM 1819 CA ARG A 151 6.345 4.389 -12.241 1.00 11.43 C ATOM 1820 C ARG A 151 6.704 3.113 -11.463 1.00 24.31 C ATOM 1821 O ARG A 151 7.536 3.145 -10.557 1.00 1.23 O ATOM 1822 CB ARG A 151 5.477 5.298 -11.356 1.00 2.00 C ATOM 1823 CG ARG A 151 5.120 6.638 -11.996 1.00 15.40 C ATOM 1824 CD ARG A 151 6.358 7.425 -12.397 1.00 23.33 C ATOM 1825 NE ARG A 151 6.033 8.738 -12.950 1.00 11.42 N ATOM 1826 CZ ARG A 151 6.826 9.770 -12.879 1.00 54.11 C ATOM 1827 NH1 ARG A 151 7.944 9.691 -12.229 1.00 23.41 N ATOM 1828 NH2 ARG A 151 6.487 10.886 -13.434 1.00 0.22 N ATOM 0 H ARG A 151 4.635 4.045 -13.424 1.00 71.31 H new ATOM 0 HA ARG A 151 7.272 4.901 -12.500 1.00 11.43 H new ATOM 0 HB2 ARG A 151 4.556 4.771 -11.106 1.00 2.00 H new ATOM 0 HB3 ARG A 151 6.003 5.484 -10.419 1.00 2.00 H new ATOM 0 HG2 ARG A 151 4.499 6.466 -12.875 1.00 15.40 H new ATOM 0 HG3 ARG A 151 4.526 7.227 -11.297 1.00 15.40 H new ATOM 0 HD2 ARG A 151 7.002 7.550 -11.527 1.00 23.33 H new ATOM 0 HD3 ARG A 151 6.924 6.855 -13.133 1.00 23.33 H new ATOM 0 HE ARG A 151 5.134 8.853 -13.418 1.00 11.42 H new ATOM 0 HH11 ARG A 151 8.207 8.819 -11.770 1.00 23.41 H new ATOM 0 HH12 ARG A 151 8.561 10.501 -12.176 1.00 23.41 H new ATOM 0 HH21 ARG A 151 5.598 10.960 -13.928 1.00 0.22 H new ATOM 0 HH22 ARG A 151 7.108 11.693 -13.378 1.00 0.22 H new ATOM 1842 N TYR A 152 6.064 2.001 -11.814 1.00 45.23 N ATOM 1843 CA TYR A 152 6.277 0.726 -11.117 1.00 54.43 C ATOM 1844 C TYR A 152 7.745 0.263 -11.173 1.00 60.24 C ATOM 1845 O TYR A 152 8.286 -0.018 -12.246 1.00 72.23 O ATOM 1846 CB TYR A 152 5.358 -0.354 -11.702 1.00 61.50 C ATOM 1847 CG TYR A 152 5.505 -1.712 -11.032 1.00 33.42 C ATOM 1848 CD1 TYR A 152 5.126 -1.903 -9.704 1.00 52.31 C ATOM 1849 CD2 TYR A 152 6.035 -2.797 -11.723 1.00 43.20 C ATOM 1850 CE1 TYR A 152 5.267 -3.133 -9.092 1.00 52.22 C ATOM 1851 CE2 TYR A 152 6.180 -4.031 -11.115 1.00 50.32 C ATOM 1852 CZ TYR A 152 5.794 -4.192 -9.800 1.00 11.45 C ATOM 1853 OH TYR A 152 5.940 -5.416 -9.192 1.00 4.15 O ATOM 0 H TYR A 152 5.391 1.952 -12.579 1.00 45.23 H new ATOM 0 HA TYR A 152 6.031 0.887 -10.067 1.00 54.43 H new ATOM 0 HB2 TYR A 152 4.323 -0.025 -11.612 1.00 61.50 H new ATOM 0 HB3 TYR A 152 5.568 -0.459 -12.766 1.00 61.50 H new ATOM 0 HD1 TYR A 152 4.715 -1.075 -9.145 1.00 52.31 H new ATOM 0 HD2 TYR A 152 6.339 -2.674 -12.752 1.00 43.20 H new ATOM 0 HE1 TYR A 152 4.966 -3.265 -8.063 1.00 52.22 H new ATOM 0 HE2 TYR A 152 6.593 -4.863 -11.666 1.00 50.32 H new ATOM 0 HH TYR A 152 5.856 -6.126 -9.862 1.00 4.15 H new ATOM 1863 N ASN A 153 8.376 0.183 -10.004 1.00 10.43 N ATOM 1864 CA ASN A 153 9.756 -0.295 -9.887 1.00 45.41 C ATOM 1865 C ASN A 153 9.791 -1.812 -9.612 1.00 0.54 C ATOM 1866 O ASN A 153 10.332 -2.579 -10.409 1.00 33.21 O ATOM 1867 CB ASN A 153 10.484 0.492 -8.785 1.00 23.50 C ATOM 1868 CG ASN A 153 11.942 0.100 -8.639 1.00 34.24 C ATOM 1869 OD1 ASN A 153 12.245 -0.669 -7.619 1.00 55.21 O flip ATOM 1870 ND2 ASN A 153 12.790 0.522 -9.413 1.00 14.31 N flip ATOM 0 H ASN A 153 7.951 0.445 -9.115 1.00 10.43 H new ATOM 0 HA ASN A 153 10.273 -0.126 -10.832 1.00 45.41 H new ATOM 0 HB2 ASN A 153 10.421 1.558 -9.005 1.00 23.50 H new ATOM 0 HB3 ASN A 153 9.974 0.332 -7.835 1.00 23.50 H new ATOM 0 HD21 ASN A 153 12.516 1.117 -10.195 1.00 14.31 H new ATOM 0 HD22 ASN A 153 13.771 0.278 -9.277 1.00 14.31 H new ATOM 1877 N GLU A 154 9.200 -2.234 -8.490 1.00 72.53 N ATOM 1878 CA GLU A 154 9.089 -3.665 -8.145 1.00 3.43 C ATOM 1879 C GLU A 154 8.219 -3.851 -6.886 1.00 52.31 C ATOM 1880 O GLU A 154 7.867 -2.873 -6.225 1.00 13.12 O ATOM 1881 CB GLU A 154 10.479 -4.289 -7.931 1.00 32.23 C ATOM 1882 CG GLU A 154 11.231 -3.732 -6.730 1.00 22.10 C ATOM 1883 CD GLU A 154 12.690 -4.158 -6.704 1.00 74.04 C ATOM 1884 OE1 GLU A 154 12.982 -5.264 -6.214 1.00 73.32 O ATOM 1885 OE2 GLU A 154 13.551 -3.383 -7.168 1.00 31.44 O ATOM 0 H GLU A 154 8.788 -1.607 -7.799 1.00 72.53 H new ATOM 0 HA GLU A 154 8.610 -4.177 -8.980 1.00 3.43 H new ATOM 0 HB2 GLU A 154 10.367 -5.366 -7.809 1.00 32.23 H new ATOM 0 HB3 GLU A 154 11.079 -4.131 -8.827 1.00 32.23 H new ATOM 0 HG2 GLU A 154 11.174 -2.644 -6.744 1.00 22.10 H new ATOM 0 HG3 GLU A 154 10.743 -4.065 -5.814 1.00 22.10 H new ATOM 1892 N ALA A 155 7.869 -5.096 -6.558 1.00 45.13 N ATOM 1893 CA ALA A 155 6.974 -5.371 -5.422 1.00 23.44 C ATOM 1894 C ALA A 155 7.621 -6.255 -4.337 1.00 10.43 C ATOM 1895 O ALA A 155 8.708 -6.811 -4.528 1.00 51.32 O ATOM 1896 CB ALA A 155 5.688 -6.016 -5.924 1.00 53.11 C ATOM 0 H ALA A 155 8.187 -5.928 -7.056 1.00 45.13 H new ATOM 0 HA ALA A 155 6.757 -4.412 -4.951 1.00 23.44 H new ATOM 0 HB1 ALA A 155 5.029 -6.218 -5.080 1.00 53.11 H new ATOM 0 HB2 ALA A 155 5.190 -5.341 -6.620 1.00 53.11 H new ATOM 0 HB3 ALA A 155 5.924 -6.951 -6.432 1.00 53.11 H new ATOM 1902 N ARG A 156 6.938 -6.353 -3.189 1.00 50.02 N ATOM 1903 CA ARG A 156 7.385 -7.184 -2.058 1.00 41.32 C ATOM 1904 C ARG A 156 6.218 -7.958 -1.420 1.00 13.35 C ATOM 1905 O ARG A 156 5.325 -7.362 -0.821 1.00 61.12 O ATOM 1906 CB ARG A 156 8.017 -6.315 -0.965 1.00 24.52 C ATOM 1907 CG ARG A 156 9.285 -5.584 -1.375 1.00 25.20 C ATOM 1908 CD ARG A 156 10.434 -6.554 -1.608 1.00 33.34 C ATOM 1909 NE ARG A 156 11.695 -5.857 -1.796 1.00 1.55 N ATOM 1910 CZ ARG A 156 12.150 -5.476 -2.949 1.00 14.55 C ATOM 1911 NH1 ARG A 156 11.463 -5.689 -4.026 1.00 50.04 N ATOM 1912 NH2 ARG A 156 13.283 -4.863 -3.021 1.00 31.35 N ATOM 0 H ARG A 156 6.062 -5.861 -3.016 1.00 50.02 H new ATOM 0 HA ARG A 156 8.113 -7.888 -2.461 1.00 41.32 H new ATOM 0 HB2 ARG A 156 7.282 -5.580 -0.637 1.00 24.52 H new ATOM 0 HB3 ARG A 156 8.242 -6.946 -0.105 1.00 24.52 H new ATOM 0 HG2 ARG A 156 9.099 -5.012 -2.284 1.00 25.20 H new ATOM 0 HG3 ARG A 156 9.562 -4.869 -0.600 1.00 25.20 H new ATOM 0 HD2 ARG A 156 10.516 -7.232 -0.759 1.00 33.34 H new ATOM 0 HD3 ARG A 156 10.222 -7.166 -2.485 1.00 33.34 H new ATOM 0 HE ARG A 156 12.257 -5.655 -0.969 1.00 1.55 H new ATOM 0 HH11 ARG A 156 10.559 -6.159 -3.970 1.00 50.04 H new ATOM 0 HH12 ARG A 156 11.826 -5.387 -4.930 1.00 50.04 H new ATOM 0 HH21 ARG A 156 13.818 -4.679 -2.172 1.00 31.35 H new ATOM 0 HH22 ARG A 156 13.643 -4.562 -3.927 1.00 31.35 H new ATOM 1926 N ARG A 157 6.231 -9.279 -1.533 1.00 62.20 N ATOM 1927 CA ARG A 157 5.262 -10.115 -0.803 1.00 22.12 C ATOM 1928 C ARG A 157 5.673 -10.254 0.674 1.00 75.04 C ATOM 1929 O ARG A 157 6.627 -10.961 1.002 1.00 1.35 O ATOM 1930 CB ARG A 157 5.118 -11.510 -1.444 1.00 52.02 C ATOM 1931 CG ARG A 157 6.448 -12.214 -1.719 1.00 15.32 C ATOM 1932 CD ARG A 157 6.889 -12.062 -3.173 1.00 0.44 C ATOM 1933 NE ARG A 157 6.435 -13.181 -4.000 1.00 21.22 N ATOM 1934 CZ ARG A 157 5.530 -13.103 -4.940 1.00 65.03 C ATOM 1935 NH1 ARG A 157 4.834 -12.024 -5.123 1.00 55.22 N ATOM 1936 NH2 ARG A 157 5.305 -14.133 -5.687 1.00 45.41 N ATOM 0 H ARG A 157 6.889 -9.799 -2.113 1.00 62.20 H new ATOM 0 HA ARG A 157 4.294 -9.617 -0.859 1.00 22.12 H new ATOM 0 HB2 ARG A 157 4.516 -12.139 -0.788 1.00 52.02 H new ATOM 0 HB3 ARG A 157 4.571 -11.412 -2.382 1.00 52.02 H new ATOM 0 HG2 ARG A 157 7.216 -11.805 -1.063 1.00 15.32 H new ATOM 0 HG3 ARG A 157 6.354 -13.273 -1.478 1.00 15.32 H new ATOM 0 HD2 ARG A 157 6.495 -11.129 -3.576 1.00 0.44 H new ATOM 0 HD3 ARG A 157 7.976 -11.995 -3.218 1.00 0.44 H new ATOM 0 HE ARG A 157 6.858 -14.093 -3.829 1.00 21.22 H new ATOM 0 HH11 ARG A 157 4.987 -11.211 -4.526 1.00 55.22 H new ATOM 0 HH12 ARG A 157 4.134 -11.988 -5.864 1.00 55.22 H new ATOM 0 HH21 ARG A 157 5.831 -14.994 -5.540 1.00 45.41 H new ATOM 0 HH22 ARG A 157 4.601 -14.085 -6.424 1.00 45.41 H new ATOM 1950 N VAL A 158 4.961 -9.564 1.562 1.00 62.34 N ATOM 1951 CA VAL A 158 5.293 -9.572 2.998 1.00 12.32 C ATOM 1952 C VAL A 158 4.362 -10.483 3.819 1.00 42.13 C ATOM 1953 O VAL A 158 4.524 -10.608 5.033 1.00 33.11 O ATOM 1954 CB VAL A 158 5.252 -8.139 3.591 1.00 73.41 C ATOM 1955 CG1 VAL A 158 6.316 -7.257 2.943 1.00 70.12 C ATOM 1956 CG2 VAL A 158 3.864 -7.518 3.428 1.00 61.44 C ATOM 0 H VAL A 158 4.152 -8.992 1.321 1.00 62.34 H new ATOM 0 HA VAL A 158 6.305 -9.971 3.068 1.00 12.32 H new ATOM 0 HB VAL A 158 5.467 -8.209 4.657 1.00 73.41 H new ATOM 0 HG11 VAL A 158 6.270 -6.256 3.373 1.00 70.12 H new ATOM 0 HG12 VAL A 158 7.302 -7.685 3.123 1.00 70.12 H new ATOM 0 HG13 VAL A 158 6.136 -7.199 1.869 1.00 70.12 H new ATOM 0 HG21 VAL A 158 3.863 -6.514 3.852 1.00 61.44 H new ATOM 0 HG22 VAL A 158 3.611 -7.465 2.369 1.00 61.44 H new ATOM 0 HG23 VAL A 158 3.128 -8.132 3.947 1.00 61.44 H new ATOM 1966 N LEU A 159 3.396 -11.119 3.161 1.00 43.42 N ATOM 1967 CA LEU A 159 2.447 -12.006 3.850 1.00 44.32 C ATOM 1968 C LEU A 159 2.979 -13.445 3.955 1.00 11.45 C ATOM 1969 O LEU A 159 3.083 -14.157 2.953 1.00 3.23 O ATOM 1970 CB LEU A 159 1.090 -12.004 3.131 1.00 33.12 C ATOM 1971 CG LEU A 159 0.290 -10.694 3.244 1.00 2.15 C ATOM 1972 CD1 LEU A 159 -0.995 -10.769 2.421 1.00 63.42 C ATOM 1973 CD2 LEU A 159 -0.023 -10.380 4.708 1.00 71.02 C ATOM 0 H LEU A 159 3.245 -11.041 2.155 1.00 43.42 H new ATOM 0 HA LEU A 159 2.322 -11.620 4.862 1.00 44.32 H new ATOM 0 HB2 LEU A 159 1.256 -12.220 2.076 1.00 33.12 H new ATOM 0 HB3 LEU A 159 0.484 -12.817 3.531 1.00 33.12 H new ATOM 0 HG LEU A 159 0.902 -9.886 2.843 1.00 2.15 H new ATOM 0 HD11 LEU A 159 -1.543 -9.832 2.516 1.00 63.42 H new ATOM 0 HD12 LEU A 159 -0.747 -10.939 1.373 1.00 63.42 H new ATOM 0 HD13 LEU A 159 -1.613 -11.590 2.785 1.00 63.42 H new ATOM 0 HD21 LEU A 159 -0.589 -9.450 4.768 1.00 71.02 H new ATOM 0 HD22 LEU A 159 -0.612 -11.191 5.136 1.00 71.02 H new ATOM 0 HD23 LEU A 159 0.908 -10.274 5.265 1.00 71.02 H new ATOM 1985 N SER A 160 3.309 -13.865 5.174 1.00 62.04 N ATOM 1986 CA SER A 160 3.757 -15.240 5.425 1.00 33.13 C ATOM 1987 C SER A 160 2.585 -16.232 5.364 1.00 11.41 C ATOM 1988 O SER A 160 1.906 -16.473 6.366 1.00 42.25 O ATOM 1989 CB SER A 160 4.462 -15.347 6.789 1.00 1.24 C ATOM 1990 OG SER A 160 5.693 -14.639 6.799 1.00 55.20 O ATOM 0 H SER A 160 3.276 -13.276 6.006 1.00 62.04 H new ATOM 0 HA SER A 160 4.467 -15.498 4.639 1.00 33.13 H new ATOM 0 HB2 SER A 160 3.809 -14.954 7.568 1.00 1.24 H new ATOM 0 HB3 SER A 160 4.643 -16.396 7.024 1.00 1.24 H new ATOM 0 HG SER A 160 6.113 -14.726 7.680 1.00 55.20 H new ATOM 1996 N ARG A 161 2.335 -16.778 4.174 1.00 22.22 N ATOM 1997 CA ARG A 161 1.286 -17.791 3.980 1.00 13.34 C ATOM 1998 C ARG A 161 1.619 -19.111 4.699 1.00 61.32 C ATOM 1999 O ARG A 161 2.662 -19.718 4.452 1.00 1.14 O ATOM 2000 CB ARG A 161 1.059 -18.054 2.487 1.00 10.15 C ATOM 2001 CG ARG A 161 2.336 -18.257 1.686 1.00 35.40 C ATOM 2002 CD ARG A 161 2.027 -18.799 0.300 1.00 11.45 C ATOM 2003 NE ARG A 161 1.877 -20.256 0.306 1.00 55.54 N ATOM 2004 CZ ARG A 161 1.138 -20.932 -0.534 1.00 30.30 C ATOM 2005 NH1 ARG A 161 0.448 -20.332 -1.452 1.00 32.01 N ATOM 2006 NH2 ARG A 161 1.097 -22.219 -0.455 1.00 22.32 N ATOM 0 H ARG A 161 2.845 -16.537 3.324 1.00 22.22 H new ATOM 0 HA ARG A 161 0.371 -17.393 4.419 1.00 13.34 H new ATOM 0 HB2 ARG A 161 0.431 -18.938 2.377 1.00 10.15 H new ATOM 0 HB3 ARG A 161 0.507 -17.216 2.062 1.00 10.15 H new ATOM 0 HG2 ARG A 161 2.870 -17.311 1.600 1.00 35.40 H new ATOM 0 HG3 ARG A 161 2.994 -18.948 2.213 1.00 35.40 H new ATOM 0 HD2 ARG A 161 1.111 -18.341 -0.073 1.00 11.45 H new ATOM 0 HD3 ARG A 161 2.826 -18.519 -0.386 1.00 11.45 H new ATOM 0 HE ARG A 161 2.386 -20.781 1.017 1.00 55.54 H new ATOM 0 HH11 ARG A 161 0.476 -19.315 -1.528 1.00 32.01 H new ATOM 0 HH12 ARG A 161 -0.123 -20.876 -2.099 1.00 32.01 H new ATOM 0 HH21 ARG A 161 1.639 -22.704 0.260 1.00 22.32 H new ATOM 0 HH22 ARG A 161 0.522 -22.752 -1.108 1.00 22.32 H new ATOM 2020 N SER A 162 0.722 -19.561 5.572 1.00 51.21 N ATOM 2021 CA SER A 162 0.921 -20.822 6.308 1.00 62.44 C ATOM 2022 C SER A 162 0.483 -22.045 5.484 1.00 20.34 C ATOM 2023 O SER A 162 0.418 -23.166 5.996 1.00 54.53 O ATOM 2024 CB SER A 162 0.164 -20.786 7.642 1.00 63.31 C ATOM 2025 OG SER A 162 0.630 -19.724 8.470 1.00 72.14 O ATOM 0 H SER A 162 -0.149 -19.079 5.792 1.00 51.21 H new ATOM 0 HA SER A 162 1.989 -20.920 6.502 1.00 62.44 H new ATOM 0 HB2 SER A 162 -0.903 -20.663 7.455 1.00 63.31 H new ATOM 0 HB3 SER A 162 0.289 -21.737 8.160 1.00 63.31 H new ATOM 0 HG SER A 162 0.130 -19.723 9.313 1.00 72.14 H new ATOM 2031 N LEU A 163 0.194 -21.828 4.202 1.00 62.42 N ATOM 2032 CA LEU A 163 -0.204 -22.907 3.293 1.00 54.13 C ATOM 2033 C LEU A 163 1.002 -23.438 2.500 1.00 4.04 C ATOM 2034 O LEU A 163 1.893 -22.673 2.121 1.00 61.15 O ATOM 2035 CB LEU A 163 -1.290 -22.405 2.329 1.00 51.15 C ATOM 2036 CG LEU A 163 -1.817 -23.443 1.320 1.00 35.02 C ATOM 2037 CD1 LEU A 163 -2.411 -24.655 2.035 1.00 50.34 C ATOM 2038 CD2 LEU A 163 -2.849 -22.812 0.390 1.00 4.32 C ATOM 0 H LEU A 163 0.228 -20.907 3.764 1.00 62.42 H new ATOM 0 HA LEU A 163 -0.603 -23.727 3.891 1.00 54.13 H new ATOM 0 HB2 LEU A 163 -2.131 -22.037 2.917 1.00 51.15 H new ATOM 0 HB3 LEU A 163 -0.893 -21.555 1.774 1.00 51.15 H new ATOM 0 HG LEU A 163 -0.973 -23.786 0.721 1.00 35.02 H new ATOM 0 HD11 LEU A 163 -2.775 -25.370 1.297 1.00 50.34 H new ATOM 0 HD12 LEU A 163 -1.645 -25.126 2.650 1.00 50.34 H new ATOM 0 HD13 LEU A 163 -3.238 -24.335 2.668 1.00 50.34 H new ATOM 0 HD21 LEU A 163 -3.209 -23.561 -0.315 1.00 4.32 H new ATOM 0 HD22 LEU A 163 -3.686 -22.435 0.978 1.00 4.32 H new ATOM 0 HD23 LEU A 163 -2.390 -21.989 -0.158 1.00 4.32 H new ATOM 2050 N GLU A 164 1.026 -24.744 2.251 1.00 54.41 N ATOM 2051 CA GLU A 164 2.117 -25.380 1.492 1.00 34.04 C ATOM 2052 C GLU A 164 2.049 -25.041 -0.013 1.00 22.11 C ATOM 2053 O GLU A 164 3.083 -24.618 -0.576 1.00 38.46 O ATOM 2054 CB GLU A 164 2.102 -26.904 1.699 1.00 1.50 C ATOM 2055 CG GLU A 164 0.755 -27.564 1.419 1.00 73.24 C ATOM 2056 CD GLU A 164 0.812 -29.076 1.562 1.00 21.22 C ATOM 2057 OE1 GLU A 164 0.895 -29.564 2.707 1.00 34.32 O ATOM 2058 OE2 GLU A 164 0.784 -29.783 0.528 1.00 35.24 O ATOM 0 H GLU A 164 0.302 -25.392 2.562 1.00 54.41 H new ATOM 0 HA GLU A 164 3.055 -24.979 1.876 1.00 34.04 H new ATOM 0 HB2 GLU A 164 2.855 -27.354 1.052 1.00 1.50 H new ATOM 0 HB3 GLU A 164 2.393 -27.122 2.726 1.00 1.50 H new ATOM 0 HG2 GLU A 164 0.008 -27.164 2.105 1.00 73.24 H new ATOM 0 HG3 GLU A 164 0.431 -27.309 0.410 1.00 73.24 H new TER 2065 GLU A 164