USER MOD reduce.3.24.130724 H: found=0, std=0, add=987, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 981 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 79 THR OG1 : rot -49:sc= -0.0378! USER MOD Set 1.2: A 80 HIS : no HE2:sc= -13.7! C(o=-45!,f=-51!) USER MOD Set 1.3: A 102 HIS : no HD1:sc= -31.6! C(o=-45!,f=-46!) USER MOD Set 2.1: A 47 TYR OH : rot -8:sc= -1.6 USER MOD Set 2.2: A 49 CYS SG : rot 168:sc= -1.67 USER MOD Set 3.1: A 22 THR OG1 : rot 180:sc= 0.0322 USER MOD Set 3.2: A 25 ASN : amide:sc= -1.28 X(o=-1.2,f=-1.3) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 26:sc= 0.8 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 45:sc= 0.629 USER MOD Single : A 12 CYS SG : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -0.0622 K(o=-0.062,f=-0.6) USER MOD Single : A 14 SER OG : rot 50:sc= 1.22 USER MOD Single : A 16 ASN : amide:sc= 0.46 K(o=0.46,f=-6!) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 ASN : amide:sc= -0.202 K(o=-0.2,f=-1) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 CYS SG : rot 37:sc= 1.08 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 154:sc= 0.932 (180deg=-0.273!) USER MOD Single : A 64 ASN : amide:sc= -0.16 K(o=-0.16,f=-0.98) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= -0.363 K(o=-0.36,f=-3!) USER MOD Single : A 73 GLN : amide:sc= -0.0556 K(o=-0.056,f=-0.99) USER MOD Single : A 75 ASN : amide:sc= 0.114 X(o=0.11,f=-0.27) USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 ASN : amide:sc= -0.224 K(o=-0.22,f=1.1) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 SER OG : rot 142:sc= -0.865 USER MOD Single : A 99 HIS : no HD1:sc= 0.0227 X(o=0.023,f=-0.18) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 CYS SG : rot -157:sc= -4.37! USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 TYR OH : rot 180:sc= -0.0147 USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 124 TYR OH : rot 29:sc= -0.68! USER MOD Single : A 126 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -39.775 25.033 -21.573 1.00 0.00 N ATOM 2 CA GLY A 1 -39.609 26.132 -20.637 1.00 0.00 C ATOM 3 C GLY A 1 -38.984 25.647 -19.328 1.00 0.00 C ATOM 4 O GLY A 1 -39.656 25.021 -18.510 1.00 0.00 O ATOM 0 H1 GLY A 1 -40.201 25.388 -22.453 1.00 0.00 H new ATOM 0 H2 GLY A 1 -38.847 24.612 -21.782 1.00 0.00 H new ATOM 0 H3 GLY A 1 -40.396 24.311 -21.154 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -38.978 26.901 -21.082 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -40.577 26.591 -20.434 1.00 0.00 H new ATOM 8 N SER A 2 -37.706 25.955 -19.170 1.00 0.00 N ATOM 9 CA SER A 2 -36.982 25.559 -17.973 1.00 0.00 C ATOM 10 C SER A 2 -35.735 26.428 -17.804 1.00 0.00 C ATOM 11 O SER A 2 -35.246 27.013 -18.769 1.00 0.00 O ATOM 12 CB SER A 2 -36.595 24.080 -18.029 1.00 0.00 C ATOM 13 OG SER A 2 -37.671 23.231 -17.638 1.00 0.00 O ATOM 0 H SER A 2 -37.152 26.475 -19.851 1.00 0.00 H new ATOM 0 HA SER A 2 -37.636 25.704 -17.113 1.00 0.00 H new ATOM 0 HB2 SER A 2 -36.282 23.825 -19.042 1.00 0.00 H new ATOM 0 HB3 SER A 2 -35.739 23.904 -17.377 1.00 0.00 H new ATOM 0 HG SER A 2 -38.523 23.684 -17.807 1.00 0.00 H new ATOM 19 N SER A 3 -35.255 26.485 -16.570 1.00 0.00 N ATOM 20 CA SER A 3 -34.074 27.273 -16.262 1.00 0.00 C ATOM 21 C SER A 3 -33.712 27.116 -14.783 1.00 0.00 C ATOM 22 O SER A 3 -33.934 28.026 -13.986 1.00 0.00 O ATOM 23 CB SER A 3 -34.292 28.749 -16.601 1.00 0.00 C ATOM 24 OG SER A 3 -33.128 29.532 -16.351 1.00 0.00 O ATOM 0 H SER A 3 -35.663 25.998 -15.772 1.00 0.00 H new ATOM 0 HA SER A 3 -33.249 26.906 -16.873 1.00 0.00 H new ATOM 0 HB2 SER A 3 -34.573 28.842 -17.650 1.00 0.00 H new ATOM 0 HB3 SER A 3 -35.123 29.137 -16.012 1.00 0.00 H new ATOM 0 HG SER A 3 -33.307 30.468 -16.581 1.00 0.00 H new ATOM 30 N GLY A 4 -33.160 25.956 -14.462 1.00 0.00 N ATOM 31 CA GLY A 4 -32.765 25.668 -13.094 1.00 0.00 C ATOM 32 C GLY A 4 -31.262 25.393 -13.003 1.00 0.00 C ATOM 33 O GLY A 4 -30.754 24.481 -13.653 1.00 0.00 O ATOM 0 H GLY A 4 -32.977 25.204 -15.126 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -33.024 26.510 -12.452 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -33.319 24.805 -12.726 1.00 0.00 H new ATOM 37 N SER A 5 -30.593 26.200 -12.192 1.00 0.00 N ATOM 38 CA SER A 5 -29.159 26.055 -12.008 1.00 0.00 C ATOM 39 C SER A 5 -28.656 27.082 -10.992 1.00 0.00 C ATOM 40 O SER A 5 -29.313 28.093 -10.749 1.00 0.00 O ATOM 41 CB SER A 5 -28.415 26.212 -13.335 1.00 0.00 C ATOM 42 OG SER A 5 -27.099 25.669 -13.277 1.00 0.00 O ATOM 0 H SER A 5 -31.018 26.956 -11.655 1.00 0.00 H new ATOM 0 HA SER A 5 -28.962 25.052 -11.629 1.00 0.00 H new ATOM 0 HB2 SER A 5 -28.977 25.716 -14.127 1.00 0.00 H new ATOM 0 HB3 SER A 5 -28.360 27.269 -13.597 1.00 0.00 H new ATOM 0 HG SER A 5 -26.658 25.787 -14.144 1.00 0.00 H new ATOM 48 N SER A 6 -27.494 26.788 -10.427 1.00 0.00 N ATOM 49 CA SER A 6 -26.895 27.674 -9.443 1.00 0.00 C ATOM 50 C SER A 6 -25.520 27.144 -9.032 1.00 0.00 C ATOM 51 O SER A 6 -25.218 25.969 -9.231 1.00 0.00 O ATOM 52 CB SER A 6 -27.795 27.823 -8.215 1.00 0.00 C ATOM 53 OG SER A 6 -27.950 26.592 -7.514 1.00 0.00 O ATOM 0 H SER A 6 -26.951 25.949 -10.632 1.00 0.00 H new ATOM 0 HA SER A 6 -26.778 28.659 -9.895 1.00 0.00 H new ATOM 0 HB2 SER A 6 -27.372 28.571 -7.544 1.00 0.00 H new ATOM 0 HB3 SER A 6 -28.774 28.189 -8.525 1.00 0.00 H new ATOM 0 HG SER A 6 -28.530 26.729 -6.736 1.00 0.00 H new ATOM 59 N GLY A 7 -24.722 28.038 -8.465 1.00 0.00 N ATOM 60 CA GLY A 7 -23.386 27.676 -8.024 1.00 0.00 C ATOM 61 C GLY A 7 -22.427 28.861 -8.151 1.00 0.00 C ATOM 62 O GLY A 7 -22.587 29.703 -9.033 1.00 0.00 O ATOM 0 H GLY A 7 -24.976 29.012 -8.301 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -23.420 27.340 -6.988 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -23.017 26.840 -8.618 1.00 0.00 H new ATOM 66 N SER A 8 -21.450 28.889 -7.256 1.00 0.00 N ATOM 67 CA SER A 8 -20.465 29.957 -7.256 1.00 0.00 C ATOM 68 C SER A 8 -19.438 29.722 -6.147 1.00 0.00 C ATOM 69 O SER A 8 -19.799 29.371 -5.025 1.00 0.00 O ATOM 70 CB SER A 8 -21.133 31.322 -7.079 1.00 0.00 C ATOM 71 OG SER A 8 -20.203 32.393 -7.216 1.00 0.00 O ATOM 0 H SER A 8 -21.320 28.189 -6.526 1.00 0.00 H new ATOM 0 HA SER A 8 -19.957 29.953 -8.220 1.00 0.00 H new ATOM 0 HB2 SER A 8 -21.928 31.435 -7.817 1.00 0.00 H new ATOM 0 HB3 SER A 8 -21.601 31.372 -6.096 1.00 0.00 H new ATOM 0 HG SER A 8 -20.668 33.247 -7.098 1.00 0.00 H new ATOM 77 N GLU A 9 -18.177 29.924 -6.500 1.00 0.00 N ATOM 78 CA GLU A 9 -17.094 29.737 -5.549 1.00 0.00 C ATOM 79 C GLU A 9 -15.742 29.825 -6.259 1.00 0.00 C ATOM 80 O GLU A 9 -15.568 29.266 -7.342 1.00 0.00 O ATOM 81 CB GLU A 9 -17.239 28.407 -4.807 1.00 0.00 C ATOM 82 CG GLU A 9 -17.368 28.631 -3.299 1.00 0.00 C ATOM 83 CD GLU A 9 -16.492 27.647 -2.521 1.00 0.00 C ATOM 84 OE1 GLU A 9 -16.314 26.520 -3.031 1.00 0.00 O ATOM 85 OE2 GLU A 9 -16.019 28.045 -1.435 1.00 0.00 O ATOM 0 H GLU A 9 -17.881 30.215 -7.432 1.00 0.00 H new ATOM 0 HA GLU A 9 -17.145 30.535 -4.809 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -18.116 27.875 -5.175 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -16.374 27.776 -5.012 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -17.079 29.653 -3.054 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -18.409 28.513 -2.998 1.00 0.00 H new ATOM 92 N SER A 10 -14.819 30.530 -5.622 1.00 0.00 N ATOM 93 CA SER A 10 -13.488 30.698 -6.180 1.00 0.00 C ATOM 94 C SER A 10 -12.637 31.565 -5.250 1.00 0.00 C ATOM 95 O SER A 10 -12.632 32.789 -5.369 1.00 0.00 O ATOM 96 CB SER A 10 -13.550 31.320 -7.576 1.00 0.00 C ATOM 97 OG SER A 10 -14.223 32.576 -7.572 1.00 0.00 O ATOM 0 H SER A 10 -14.967 30.992 -4.724 1.00 0.00 H new ATOM 0 HA SER A 10 -13.029 29.714 -6.271 1.00 0.00 H new ATOM 0 HB2 SER A 10 -12.538 31.452 -7.959 1.00 0.00 H new ATOM 0 HB3 SER A 10 -14.061 30.637 -8.255 1.00 0.00 H new ATOM 0 HG SER A 10 -13.907 33.114 -6.816 1.00 0.00 H new ATOM 103 N ILE A 11 -11.937 30.896 -4.346 1.00 0.00 N ATOM 104 CA ILE A 11 -11.083 31.590 -3.396 1.00 0.00 C ATOM 105 C ILE A 11 -10.292 30.564 -2.583 1.00 0.00 C ATOM 106 O ILE A 11 -10.868 29.632 -2.024 1.00 0.00 O ATOM 107 CB ILE A 11 -11.908 32.551 -2.538 1.00 0.00 C ATOM 108 CG1 ILE A 11 -11.005 33.388 -1.630 1.00 0.00 C ATOM 109 CG2 ILE A 11 -12.978 31.797 -1.745 1.00 0.00 C ATOM 110 CD1 ILE A 11 -11.335 34.877 -1.750 1.00 0.00 C ATOM 0 H ILE A 11 -11.943 29.880 -4.251 1.00 0.00 H new ATOM 0 HA ILE A 11 -10.356 32.210 -3.920 1.00 0.00 H new ATOM 0 HB ILE A 11 -12.427 33.243 -3.202 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -11.126 33.067 -0.595 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -9.961 33.221 -1.895 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -13.550 32.503 -1.143 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -13.647 31.282 -2.435 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -12.500 31.068 -1.091 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -10.679 35.449 -1.094 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -11.189 35.200 -2.781 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -12.372 35.044 -1.461 1.00 0.00 H new ATOM 122 N CYS A 12 -8.983 30.769 -2.544 1.00 0.00 N ATOM 123 CA CYS A 12 -8.107 29.873 -1.809 1.00 0.00 C ATOM 124 C CYS A 12 -6.748 30.556 -1.648 1.00 0.00 C ATOM 125 O CYS A 12 -6.336 31.338 -2.504 1.00 0.00 O ATOM 126 CB CYS A 12 -7.984 28.512 -2.497 1.00 0.00 C ATOM 127 SG CYS A 12 -7.526 28.737 -4.254 1.00 0.00 S ATOM 0 H CYS A 12 -8.508 31.543 -3.010 1.00 0.00 H new ATOM 0 HA CYS A 12 -8.530 29.672 -0.825 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -7.232 27.907 -1.991 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -8.928 27.972 -2.425 1.00 0.00 H new ATOM 0 HG CYS A 12 -7.422 27.575 -4.828 1.00 0.00 H new ATOM 133 N ASN A 13 -6.087 30.235 -0.545 1.00 0.00 N ATOM 134 CA ASN A 13 -4.783 30.808 -0.260 1.00 0.00 C ATOM 135 C ASN A 13 -4.223 30.182 1.019 1.00 0.00 C ATOM 136 O ASN A 13 -4.498 30.660 2.119 1.00 0.00 O ATOM 137 CB ASN A 13 -4.880 32.320 -0.044 1.00 0.00 C ATOM 138 CG ASN A 13 -3.537 32.897 0.406 1.00 0.00 C ATOM 139 OD1 ASN A 13 -2.474 32.402 0.067 1.00 0.00 O ATOM 140 ND2 ASN A 13 -3.642 33.969 1.187 1.00 0.00 N ATOM 0 H ASN A 13 -6.431 29.585 0.162 1.00 0.00 H new ATOM 0 HA ASN A 13 -4.134 30.607 -1.112 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -5.196 32.803 -0.968 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -5.642 32.536 0.705 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -2.802 34.427 1.540 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -4.563 34.333 1.433 1.00 0.00 H new ATOM 147 N SER A 14 -3.449 29.123 0.832 1.00 0.00 N ATOM 148 CA SER A 14 -2.849 28.427 1.957 1.00 0.00 C ATOM 149 C SER A 14 -2.110 27.180 1.468 1.00 0.00 C ATOM 150 O SER A 14 -2.622 26.441 0.628 1.00 0.00 O ATOM 151 CB SER A 14 -3.906 28.045 2.995 1.00 0.00 C ATOM 152 OG SER A 14 -4.049 29.041 4.004 1.00 0.00 O ATOM 0 H SER A 14 -3.224 28.730 -0.082 1.00 0.00 H new ATOM 0 HA SER A 14 -2.136 29.099 2.434 1.00 0.00 H new ATOM 0 HB2 SER A 14 -4.864 27.893 2.498 1.00 0.00 H new ATOM 0 HB3 SER A 14 -3.633 27.097 3.458 1.00 0.00 H new ATOM 0 HG SER A 14 -4.155 29.920 3.583 1.00 0.00 H new ATOM 158 N LEU A 15 -0.919 26.985 2.013 1.00 0.00 N ATOM 159 CA LEU A 15 -0.104 25.840 1.643 1.00 0.00 C ATOM 160 C LEU A 15 -0.593 24.605 2.401 1.00 0.00 C ATOM 161 O LEU A 15 -1.018 23.625 1.791 1.00 0.00 O ATOM 162 CB LEU A 15 1.379 26.146 1.857 1.00 0.00 C ATOM 163 CG LEU A 15 2.222 26.302 0.589 1.00 0.00 C ATOM 164 CD1 LEU A 15 2.473 27.778 0.276 1.00 0.00 C ATOM 165 CD2 LEU A 15 3.526 25.509 0.697 1.00 0.00 C ATOM 0 H LEU A 15 -0.498 27.601 2.709 1.00 0.00 H new ATOM 0 HA LEU A 15 -0.211 25.625 0.580 1.00 0.00 H new ATOM 0 HB2 LEU A 15 1.460 27.064 2.438 1.00 0.00 H new ATOM 0 HB3 LEU A 15 1.811 25.348 2.461 1.00 0.00 H new ATOM 0 HG LEU A 15 1.661 25.886 -0.248 1.00 0.00 H new ATOM 0 HD11 LEU A 15 3.074 27.861 -0.629 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.520 28.285 0.127 1.00 0.00 H new ATOM 0 HD13 LEU A 15 3.004 28.241 1.108 1.00 0.00 H new ATOM 0 HD21 LEU A 15 4.106 25.637 -0.217 1.00 0.00 H new ATOM 0 HD22 LEU A 15 4.103 25.872 1.547 1.00 0.00 H new ATOM 0 HD23 LEU A 15 3.299 24.452 0.838 1.00 0.00 H new ATOM 177 N ASN A 16 -0.517 24.692 3.721 1.00 0.00 N ATOM 178 CA ASN A 16 -0.947 23.593 4.569 1.00 0.00 C ATOM 179 C ASN A 16 -0.090 22.361 4.273 1.00 0.00 C ATOM 180 O ASN A 16 0.613 22.317 3.265 1.00 0.00 O ATOM 181 CB ASN A 16 -2.408 23.228 4.301 1.00 0.00 C ATOM 182 CG ASN A 16 -3.117 22.815 5.592 1.00 0.00 C ATOM 183 OD1 ASN A 16 -2.583 22.096 6.421 1.00 0.00 O ATOM 184 ND2 ASN A 16 -4.345 23.310 5.717 1.00 0.00 N ATOM 0 H ASN A 16 -0.164 25.506 4.224 1.00 0.00 H new ATOM 0 HA ASN A 16 -0.839 23.907 5.607 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -2.923 24.079 3.856 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -2.456 22.413 3.579 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -4.900 23.094 6.545 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -4.732 23.906 4.985 1.00 0.00 H new ATOM 191 N SER A 17 -0.176 21.390 5.171 1.00 0.00 N ATOM 192 CA SER A 17 0.583 20.161 5.019 1.00 0.00 C ATOM 193 C SER A 17 -0.367 18.963 4.956 1.00 0.00 C ATOM 194 O SER A 17 -1.339 18.898 5.707 1.00 0.00 O ATOM 195 CB SER A 17 1.583 19.985 6.164 1.00 0.00 C ATOM 196 OG SER A 17 2.473 21.093 6.270 1.00 0.00 O ATOM 0 H SER A 17 -0.760 21.430 6.006 1.00 0.00 H new ATOM 0 HA SER A 17 1.145 20.220 4.087 1.00 0.00 H new ATOM 0 HB2 SER A 17 1.042 19.863 7.102 1.00 0.00 H new ATOM 0 HB3 SER A 17 2.158 19.072 6.007 1.00 0.00 H new ATOM 0 HG SER A 17 3.094 20.944 7.013 1.00 0.00 H new ATOM 202 N LYS A 18 -0.053 18.046 4.053 1.00 0.00 N ATOM 203 CA LYS A 18 -0.867 16.854 3.883 1.00 0.00 C ATOM 204 C LYS A 18 -1.043 16.164 5.237 1.00 0.00 C ATOM 205 O LYS A 18 -0.536 16.641 6.251 1.00 0.00 O ATOM 206 CB LYS A 18 -0.272 15.948 2.804 1.00 0.00 C ATOM 207 CG LYS A 18 -0.336 16.618 1.429 1.00 0.00 C ATOM 208 CD LYS A 18 -1.785 16.775 0.963 1.00 0.00 C ATOM 209 CE LYS A 18 -1.861 16.893 -0.560 1.00 0.00 C ATOM 210 NZ LYS A 18 -3.216 17.313 -0.980 1.00 0.00 N ATOM 0 H LYS A 18 0.754 18.104 3.431 1.00 0.00 H new ATOM 0 HA LYS A 18 -1.863 17.121 3.529 1.00 0.00 H new ATOM 0 HB2 LYS A 18 0.764 15.714 3.051 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -0.815 15.003 2.778 1.00 0.00 H new ATOM 0 HG2 LYS A 18 0.143 17.596 1.474 1.00 0.00 H new ATOM 0 HG3 LYS A 18 0.221 16.024 0.704 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -2.372 15.919 1.295 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -2.225 17.660 1.422 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -1.125 17.615 -0.912 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -1.612 15.936 -1.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -3.250 17.388 -2.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -3.912 16.609 -0.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -3.439 18.237 -0.558 1.00 0.00 H new ATOM 224 N LEU A 19 -1.763 15.052 5.209 1.00 0.00 N ATOM 225 CA LEU A 19 -2.011 14.291 6.422 1.00 0.00 C ATOM 226 C LEU A 19 -0.927 13.223 6.581 1.00 0.00 C ATOM 227 O LEU A 19 0.106 13.279 5.915 1.00 0.00 O ATOM 228 CB LEU A 19 -3.434 13.727 6.419 1.00 0.00 C ATOM 229 CG LEU A 19 -4.424 14.398 7.373 1.00 0.00 C ATOM 230 CD1 LEU A 19 -5.305 15.405 6.630 1.00 0.00 C ATOM 231 CD2 LEU A 19 -5.253 13.355 8.125 1.00 0.00 C ATOM 0 H LEU A 19 -2.182 14.660 4.366 1.00 0.00 H new ATOM 0 HA LEU A 19 -1.951 14.939 7.296 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -3.830 13.800 5.406 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -3.384 12.667 6.666 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.857 14.956 8.118 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -6.000 15.868 7.331 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -4.678 16.174 6.180 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -5.866 14.891 5.849 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -5.949 13.858 8.796 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -5.811 12.750 7.411 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -4.590 12.712 8.705 1.00 0.00 H new ATOM 243 N GLU A 20 -1.199 12.276 7.466 1.00 0.00 N ATOM 244 CA GLU A 20 -0.260 11.197 7.721 1.00 0.00 C ATOM 245 C GLU A 20 -0.341 10.149 6.609 1.00 0.00 C ATOM 246 O GLU A 20 -1.390 9.976 5.990 1.00 0.00 O ATOM 247 CB GLU A 20 -0.510 10.564 9.091 1.00 0.00 C ATOM 248 CG GLU A 20 0.732 10.670 9.979 1.00 0.00 C ATOM 249 CD GLU A 20 1.061 9.322 10.624 1.00 0.00 C ATOM 250 OE1 GLU A 20 0.812 8.297 9.955 1.00 0.00 O ATOM 251 OE2 GLU A 20 1.553 9.348 11.773 1.00 0.00 O ATOM 0 H GLU A 20 -2.057 12.233 8.016 1.00 0.00 H new ATOM 0 HA GLU A 20 0.748 11.613 7.729 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -1.352 11.059 9.576 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -0.784 9.516 8.967 1.00 0.00 H new ATOM 0 HG2 GLU A 20 1.580 11.010 9.385 1.00 0.00 H new ATOM 0 HG3 GLU A 20 0.566 11.418 10.755 1.00 0.00 H new ATOM 258 N PRO A 21 0.809 9.459 6.384 1.00 0.00 N ATOM 259 CA PRO A 21 0.877 8.432 5.358 1.00 0.00 C ATOM 260 C PRO A 21 0.160 7.158 5.809 1.00 0.00 C ATOM 261 O PRO A 21 0.749 6.079 5.814 1.00 0.00 O ATOM 262 CB PRO A 21 2.362 8.222 5.110 1.00 0.00 C ATOM 263 CG PRO A 21 3.073 8.796 6.325 1.00 0.00 C ATOM 264 CD PRO A 21 2.070 9.637 7.098 1.00 0.00 C ATOM 0 HA PRO A 21 0.370 8.722 4.438 1.00 0.00 H new ATOM 0 HB2 PRO A 21 2.592 7.164 4.987 1.00 0.00 H new ATOM 0 HB3 PRO A 21 2.681 8.725 4.197 1.00 0.00 H new ATOM 0 HG2 PRO A 21 3.463 7.995 6.953 1.00 0.00 H new ATOM 0 HG3 PRO A 21 3.924 9.404 6.018 1.00 0.00 H new ATOM 0 HD2 PRO A 21 1.989 9.305 8.133 1.00 0.00 H new ATOM 0 HD3 PRO A 21 2.367 10.685 7.122 1.00 0.00 H new ATOM 272 N THR A 22 -1.102 7.326 6.177 1.00 0.00 N ATOM 273 CA THR A 22 -1.905 6.203 6.629 1.00 0.00 C ATOM 274 C THR A 22 -2.962 5.848 5.581 1.00 0.00 C ATOM 275 O THR A 22 -3.224 6.630 4.668 1.00 0.00 O ATOM 276 CB THR A 22 -2.499 6.564 7.992 1.00 0.00 C ATOM 277 OG1 THR A 22 -3.036 7.870 7.802 1.00 0.00 O ATOM 278 CG2 THR A 22 -1.426 6.754 9.066 1.00 0.00 C ATOM 0 H THR A 22 -1.588 8.223 6.171 1.00 0.00 H new ATOM 0 HA THR A 22 -1.298 5.306 6.750 1.00 0.00 H new ATOM 0 HB THR A 22 -3.191 5.782 8.305 1.00 0.00 H new ATOM 0 HG1 THR A 22 -3.443 8.181 8.637 1.00 0.00 H new ATOM 0 HG21 THR A 22 -1.901 7.009 10.014 1.00 0.00 H new ATOM 0 HG22 THR A 22 -0.859 5.830 9.181 1.00 0.00 H new ATOM 0 HG23 THR A 22 -0.753 7.558 8.770 1.00 0.00 H new ATOM 286 N LEU A 23 -3.540 4.667 5.746 1.00 0.00 N ATOM 287 CA LEU A 23 -4.563 4.199 4.826 1.00 0.00 C ATOM 288 C LEU A 23 -5.731 5.186 4.824 1.00 0.00 C ATOM 289 O LEU A 23 -6.058 5.765 3.788 1.00 0.00 O ATOM 290 CB LEU A 23 -4.971 2.764 5.164 1.00 0.00 C ATOM 291 CG LEU A 23 -4.863 1.750 4.023 1.00 0.00 C ATOM 292 CD1 LEU A 23 -5.858 2.073 2.907 1.00 0.00 C ATOM 293 CD2 LEU A 23 -3.427 1.661 3.502 1.00 0.00 C ATOM 0 H LEU A 23 -3.319 4.020 6.503 1.00 0.00 H new ATOM 0 HA LEU A 23 -4.173 4.164 3.809 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -4.353 2.417 5.992 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -6.002 2.774 5.518 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.125 0.767 4.414 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -5.761 1.337 2.109 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -6.872 2.045 3.305 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -5.651 3.067 2.511 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -3.378 0.933 2.692 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -3.113 2.637 3.132 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -2.765 1.349 4.310 1.00 0.00 H new ATOM 305 N GLU A 24 -6.330 5.348 5.995 1.00 0.00 N ATOM 306 CA GLU A 24 -7.455 6.256 6.141 1.00 0.00 C ATOM 307 C GLU A 24 -7.172 7.574 5.417 1.00 0.00 C ATOM 308 O GLU A 24 -8.098 8.267 4.998 1.00 0.00 O ATOM 309 CB GLU A 24 -7.776 6.499 7.617 1.00 0.00 C ATOM 310 CG GLU A 24 -8.665 5.386 8.176 1.00 0.00 C ATOM 311 CD GLU A 24 -8.480 5.244 9.688 1.00 0.00 C ATOM 312 OE1 GLU A 24 -7.396 4.765 10.085 1.00 0.00 O ATOM 313 OE2 GLU A 24 -9.428 5.617 10.412 1.00 0.00 O ATOM 0 H GLU A 24 -6.057 4.866 6.851 1.00 0.00 H new ATOM 0 HA GLU A 24 -8.330 5.794 5.684 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -6.850 6.552 8.190 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -8.277 7.461 7.730 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -9.710 5.603 7.953 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -8.424 4.443 7.686 1.00 0.00 H new ATOM 320 N ASN A 25 -5.889 7.880 5.292 1.00 0.00 N ATOM 321 CA ASN A 25 -5.473 9.102 4.627 1.00 0.00 C ATOM 322 C ASN A 25 -4.572 8.751 3.441 1.00 0.00 C ATOM 323 O ASN A 25 -3.418 9.173 3.386 1.00 0.00 O ATOM 324 CB ASN A 25 -4.677 10.002 5.574 1.00 0.00 C ATOM 325 CG ASN A 25 -5.408 10.178 6.907 1.00 0.00 C ATOM 326 OD1 ASN A 25 -6.625 10.153 6.984 1.00 0.00 O ATOM 327 ND2 ASN A 25 -4.600 10.356 7.948 1.00 0.00 N ATOM 0 H ASN A 25 -5.124 7.302 5.640 1.00 0.00 H new ATOM 0 HA ASN A 25 -6.369 9.628 4.298 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -3.692 9.570 5.750 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -4.520 10.976 5.110 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -4.991 10.482 8.882 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -3.589 10.366 7.813 1.00 0.00 H new ATOM 334 N LEU A 26 -5.133 7.980 2.521 1.00 0.00 N ATOM 335 CA LEU A 26 -4.395 7.567 1.339 1.00 0.00 C ATOM 336 C LEU A 26 -4.519 8.646 0.262 1.00 0.00 C ATOM 337 O LEU A 26 -3.537 8.988 -0.395 1.00 0.00 O ATOM 338 CB LEU A 26 -4.854 6.182 0.878 1.00 0.00 C ATOM 339 CG LEU A 26 -3.750 5.228 0.417 1.00 0.00 C ATOM 340 CD1 LEU A 26 -4.298 4.188 -0.561 1.00 0.00 C ATOM 341 CD2 LEU A 26 -2.568 6.002 -0.172 1.00 0.00 C ATOM 0 H LEU A 26 -6.090 7.630 2.570 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.334 7.466 1.568 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -5.396 5.710 1.697 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -5.562 6.310 0.059 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.379 4.687 1.288 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -3.493 3.523 -0.873 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -5.081 3.607 -0.073 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -4.711 4.692 -1.435 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -1.797 5.301 -0.492 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -2.906 6.586 -1.028 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -2.158 6.671 0.584 1.00 0.00 H new ATOM 353 N GLU A 27 -5.734 9.153 0.115 1.00 0.00 N ATOM 354 CA GLU A 27 -5.999 10.187 -0.871 1.00 0.00 C ATOM 355 C GLU A 27 -5.363 11.509 -0.438 1.00 0.00 C ATOM 356 O GLU A 27 -5.262 12.443 -1.232 1.00 0.00 O ATOM 357 CB GLU A 27 -7.502 10.351 -1.104 1.00 0.00 C ATOM 358 CG GLU A 27 -8.133 9.035 -1.564 1.00 0.00 C ATOM 359 CD GLU A 27 -9.360 9.292 -2.440 1.00 0.00 C ATOM 360 OE1 GLU A 27 -9.950 10.384 -2.285 1.00 0.00 O ATOM 361 OE2 GLU A 27 -9.681 8.392 -3.246 1.00 0.00 O ATOM 0 H GLU A 27 -6.546 8.867 0.662 1.00 0.00 H new ATOM 0 HA GLU A 27 -5.550 9.883 -1.817 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -7.982 10.686 -0.184 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -7.675 11.123 -1.854 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -7.400 8.451 -2.121 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -8.420 8.442 -0.696 1.00 0.00 H new ATOM 368 N ASN A 28 -4.952 11.547 0.821 1.00 0.00 N ATOM 369 CA ASN A 28 -4.329 12.739 1.370 1.00 0.00 C ATOM 370 C ASN A 28 -2.849 12.460 1.636 1.00 0.00 C ATOM 371 O ASN A 28 -2.091 13.371 1.968 1.00 0.00 O ATOM 372 CB ASN A 28 -4.980 13.141 2.695 1.00 0.00 C ATOM 373 CG ASN A 28 -5.806 14.419 2.535 1.00 0.00 C ATOM 374 OD1 ASN A 28 -5.479 15.308 1.767 1.00 0.00 O ATOM 375 ND2 ASN A 28 -6.892 14.460 3.301 1.00 0.00 N ATOM 0 H ASN A 28 -5.038 10.771 1.477 1.00 0.00 H new ATOM 0 HA ASN A 28 -4.453 13.546 0.648 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -5.619 12.333 3.050 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -4.210 13.294 3.451 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -7.510 15.271 3.267 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -7.107 13.680 3.923 1.00 0.00 H new ATOM 382 N LEU A 29 -2.480 11.197 1.480 1.00 0.00 N ATOM 383 CA LEU A 29 -1.104 10.786 1.699 1.00 0.00 C ATOM 384 C LEU A 29 -0.220 11.371 0.597 1.00 0.00 C ATOM 385 O LEU A 29 -0.545 11.267 -0.585 1.00 0.00 O ATOM 386 CB LEU A 29 -1.012 9.264 1.819 1.00 0.00 C ATOM 387 CG LEU A 29 0.245 8.620 1.229 1.00 0.00 C ATOM 388 CD1 LEU A 29 0.218 8.663 -0.300 1.00 0.00 C ATOM 389 CD2 LEU A 29 1.510 9.265 1.799 1.00 0.00 C ATOM 0 H LEU A 29 -3.111 10.444 1.204 1.00 0.00 H new ATOM 0 HA LEU A 29 -0.735 11.180 2.646 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.071 8.998 2.874 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.883 8.827 1.331 1.00 0.00 H new ATOM 0 HG LEU A 29 0.260 7.570 1.520 1.00 0.00 H new ATOM 0 HD11 LEU A 29 1.123 8.199 -0.693 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -0.655 8.121 -0.664 1.00 0.00 H new ATOM 0 HD13 LEU A 29 0.167 9.699 -0.634 1.00 0.00 H new ATOM 0 HD21 LEU A 29 2.389 8.789 1.364 1.00 0.00 H new ATOM 0 HD22 LEU A 29 1.516 10.328 1.559 1.00 0.00 H new ATOM 0 HD23 LEU A 29 1.527 9.138 2.881 1.00 0.00 H new ATOM 401 N ASP A 30 0.881 11.974 1.022 1.00 0.00 N ATOM 402 CA ASP A 30 1.814 12.576 0.085 1.00 0.00 C ATOM 403 C ASP A 30 2.959 11.597 -0.188 1.00 0.00 C ATOM 404 O ASP A 30 3.977 11.620 0.502 1.00 0.00 O ATOM 405 CB ASP A 30 2.417 13.861 0.657 1.00 0.00 C ATOM 406 CG ASP A 30 3.535 14.481 -0.184 1.00 0.00 C ATOM 407 OD1 ASP A 30 3.681 14.042 -1.345 1.00 0.00 O ATOM 408 OD2 ASP A 30 4.217 15.380 0.353 1.00 0.00 O ATOM 0 H ASP A 30 1.148 12.058 2.003 1.00 0.00 H new ATOM 0 HA ASP A 30 1.270 12.809 -0.830 1.00 0.00 H new ATOM 0 HB2 ASP A 30 1.621 14.597 0.775 1.00 0.00 H new ATOM 0 HB3 ASP A 30 2.806 13.650 1.653 1.00 0.00 H new ATOM 413 N VAL A 31 2.752 10.761 -1.195 1.00 0.00 N ATOM 414 CA VAL A 31 3.754 9.777 -1.567 1.00 0.00 C ATOM 415 C VAL A 31 5.097 10.478 -1.781 1.00 0.00 C ATOM 416 O VAL A 31 6.149 9.916 -1.483 1.00 0.00 O ATOM 417 CB VAL A 31 3.286 8.993 -2.795 1.00 0.00 C ATOM 418 CG1 VAL A 31 2.815 9.938 -3.902 1.00 0.00 C ATOM 419 CG2 VAL A 31 4.388 8.061 -3.303 1.00 0.00 C ATOM 0 H VAL A 31 1.906 10.745 -1.764 1.00 0.00 H new ATOM 0 HA VAL A 31 3.891 9.050 -0.766 1.00 0.00 H new ATOM 0 HB VAL A 31 2.438 8.378 -2.496 1.00 0.00 H new ATOM 0 HG11 VAL A 31 2.488 9.355 -4.763 1.00 0.00 H new ATOM 0 HG12 VAL A 31 1.985 10.542 -3.536 1.00 0.00 H new ATOM 0 HG13 VAL A 31 3.636 10.591 -4.197 1.00 0.00 H new ATOM 0 HG21 VAL A 31 4.030 7.516 -4.176 1.00 0.00 H new ATOM 0 HG22 VAL A 31 5.264 8.649 -3.577 1.00 0.00 H new ATOM 0 HG23 VAL A 31 4.657 7.354 -2.518 1.00 0.00 H new ATOM 429 N SER A 32 5.017 11.696 -2.297 1.00 0.00 N ATOM 430 CA SER A 32 6.213 12.479 -2.555 1.00 0.00 C ATOM 431 C SER A 32 6.891 12.850 -1.234 1.00 0.00 C ATOM 432 O SER A 32 8.003 13.375 -1.229 1.00 0.00 O ATOM 433 CB SER A 32 5.883 13.742 -3.354 1.00 0.00 C ATOM 434 OG SER A 32 6.760 13.915 -4.464 1.00 0.00 O ATOM 0 H SER A 32 4.142 12.159 -2.543 1.00 0.00 H new ATOM 0 HA SER A 32 6.896 11.873 -3.150 1.00 0.00 H new ATOM 0 HB2 SER A 32 4.854 13.688 -3.710 1.00 0.00 H new ATOM 0 HB3 SER A 32 5.949 14.612 -2.701 1.00 0.00 H new ATOM 0 HG SER A 32 6.516 14.731 -4.950 1.00 0.00 H new ATOM 440 N ALA A 33 6.192 12.562 -0.146 1.00 0.00 N ATOM 441 CA ALA A 33 6.712 12.858 1.178 1.00 0.00 C ATOM 442 C ALA A 33 7.760 11.809 1.556 1.00 0.00 C ATOM 443 O ALA A 33 8.831 12.148 2.055 1.00 0.00 O ATOM 444 CB ALA A 33 5.557 12.916 2.179 1.00 0.00 C ATOM 0 H ALA A 33 5.270 12.127 -0.154 1.00 0.00 H new ATOM 0 HA ALA A 33 7.202 13.832 1.189 1.00 0.00 H new ATOM 0 HB1 ALA A 33 5.947 13.138 3.172 1.00 0.00 H new ATOM 0 HB2 ALA A 33 4.857 13.696 1.881 1.00 0.00 H new ATOM 0 HB3 ALA A 33 5.043 11.955 2.198 1.00 0.00 H new ATOM 450 N PHE A 34 7.413 10.555 1.303 1.00 0.00 N ATOM 451 CA PHE A 34 8.310 9.454 1.611 1.00 0.00 C ATOM 452 C PHE A 34 9.716 9.726 1.072 1.00 0.00 C ATOM 453 O PHE A 34 9.892 9.967 -0.121 1.00 0.00 O ATOM 454 CB PHE A 34 7.745 8.211 0.922 1.00 0.00 C ATOM 455 CG PHE A 34 6.377 7.774 1.450 1.00 0.00 C ATOM 456 CD1 PHE A 34 6.221 7.473 2.767 1.00 0.00 C ATOM 457 CD2 PHE A 34 5.316 7.687 0.603 1.00 0.00 C ATOM 458 CE1 PHE A 34 4.951 7.069 3.258 1.00 0.00 C ATOM 459 CE2 PHE A 34 4.047 7.283 1.093 1.00 0.00 C ATOM 460 CZ PHE A 34 3.891 6.982 2.410 1.00 0.00 C ATOM 0 H PHE A 34 6.523 10.277 0.888 1.00 0.00 H new ATOM 0 HA PHE A 34 8.382 9.323 2.691 1.00 0.00 H new ATOM 0 HB2 PHE A 34 7.665 8.406 -0.147 1.00 0.00 H new ATOM 0 HB3 PHE A 34 8.450 7.389 1.044 1.00 0.00 H new ATOM 0 HD1 PHE A 34 7.063 7.541 3.440 1.00 0.00 H new ATOM 0 HD2 PHE A 34 5.440 7.926 -0.443 1.00 0.00 H new ATOM 0 HE1 PHE A 34 4.827 6.831 4.304 1.00 0.00 H new ATOM 0 HE2 PHE A 34 3.205 7.215 0.420 1.00 0.00 H new ATOM 0 HZ PHE A 34 2.925 6.674 2.783 1.00 0.00 H new ATOM 470 N GLN A 35 10.682 9.677 1.978 1.00 0.00 N ATOM 471 CA GLN A 35 12.067 9.915 1.609 1.00 0.00 C ATOM 472 C GLN A 35 12.737 8.605 1.190 1.00 0.00 C ATOM 473 O GLN A 35 13.927 8.584 0.880 1.00 0.00 O ATOM 474 CB GLN A 35 12.833 10.581 2.754 1.00 0.00 C ATOM 475 CG GLN A 35 11.956 11.604 3.479 1.00 0.00 C ATOM 476 CD GLN A 35 12.714 12.251 4.640 1.00 0.00 C ATOM 477 OE1 GLN A 35 13.196 13.369 4.554 1.00 0.00 O ATOM 478 NE2 GLN A 35 12.790 11.489 5.727 1.00 0.00 N ATOM 0 H GLN A 35 10.533 9.476 2.967 1.00 0.00 H new ATOM 0 HA GLN A 35 12.084 10.597 0.759 1.00 0.00 H new ATOM 0 HB2 GLN A 35 13.172 9.822 3.459 1.00 0.00 H new ATOM 0 HB3 GLN A 35 13.724 11.073 2.363 1.00 0.00 H new ATOM 0 HG2 GLN A 35 11.633 12.373 2.778 1.00 0.00 H new ATOM 0 HG3 GLN A 35 11.056 11.116 3.854 1.00 0.00 H new ATOM 0 HE21 GLN A 35 12.364 10.562 5.731 1.00 0.00 H new ATOM 0 HE22 GLN A 35 13.274 11.831 6.557 1.00 0.00 H new ATOM 487 N ALA A 36 11.943 7.544 1.193 1.00 0.00 N ATOM 488 CA ALA A 36 12.445 6.234 0.817 1.00 0.00 C ATOM 489 C ALA A 36 13.281 6.359 -0.459 1.00 0.00 C ATOM 490 O ALA A 36 13.239 7.386 -1.134 1.00 0.00 O ATOM 491 CB ALA A 36 11.271 5.266 0.652 1.00 0.00 C ATOM 0 H ALA A 36 10.956 7.565 1.450 1.00 0.00 H new ATOM 0 HA ALA A 36 13.092 5.833 1.597 1.00 0.00 H new ATOM 0 HB1 ALA A 36 11.647 4.283 0.370 1.00 0.00 H new ATOM 0 HB2 ALA A 36 10.727 5.190 1.593 1.00 0.00 H new ATOM 0 HB3 ALA A 36 10.602 5.635 -0.125 1.00 0.00 H new ATOM 497 N PRO A 37 14.040 5.271 -0.758 1.00 0.00 N ATOM 498 CA PRO A 37 14.884 5.249 -1.940 1.00 0.00 C ATOM 499 C PRO A 37 14.049 5.058 -3.207 1.00 0.00 C ATOM 500 O PRO A 37 12.935 4.540 -3.148 1.00 0.00 O ATOM 501 CB PRO A 37 15.868 4.116 -1.700 1.00 0.00 C ATOM 502 CG PRO A 37 15.250 3.250 -0.614 1.00 0.00 C ATOM 503 CD PRO A 37 14.114 4.037 0.019 1.00 0.00 C ATOM 0 HA PRO A 37 15.411 6.190 -2.098 1.00 0.00 H new ATOM 0 HB2 PRO A 37 16.032 3.541 -2.612 1.00 0.00 H new ATOM 0 HB3 PRO A 37 16.838 4.501 -1.387 1.00 0.00 H new ATOM 0 HG2 PRO A 37 14.879 2.316 -1.036 1.00 0.00 H new ATOM 0 HG3 PRO A 37 15.996 2.987 0.136 1.00 0.00 H new ATOM 0 HD2 PRO A 37 13.176 3.484 -0.026 1.00 0.00 H new ATOM 0 HD3 PRO A 37 14.313 4.243 1.071 1.00 0.00 H new ATOM 511 N GLU A 38 14.619 5.486 -4.324 1.00 0.00 N ATOM 512 CA GLU A 38 13.940 5.368 -5.603 1.00 0.00 C ATOM 513 C GLU A 38 13.964 3.915 -6.084 1.00 0.00 C ATOM 514 O GLU A 38 13.383 3.591 -7.119 1.00 0.00 O ATOM 515 CB GLU A 38 14.565 6.300 -6.643 1.00 0.00 C ATOM 516 CG GLU A 38 13.893 7.674 -6.621 1.00 0.00 C ATOM 517 CD GLU A 38 13.190 7.962 -7.950 1.00 0.00 C ATOM 518 OE1 GLU A 38 12.435 7.072 -8.397 1.00 0.00 O ATOM 519 OE2 GLU A 38 13.424 9.066 -8.488 1.00 0.00 O ATOM 0 H GLU A 38 15.543 5.915 -4.370 1.00 0.00 H new ATOM 0 HA GLU A 38 12.901 5.670 -5.471 1.00 0.00 H new ATOM 0 HB2 GLU A 38 15.631 6.409 -6.445 1.00 0.00 H new ATOM 0 HB3 GLU A 38 14.469 5.860 -7.636 1.00 0.00 H new ATOM 0 HG2 GLU A 38 13.170 7.716 -5.806 1.00 0.00 H new ATOM 0 HG3 GLU A 38 14.639 8.445 -6.425 1.00 0.00 H new ATOM 526 N ASP A 39 14.641 3.080 -5.311 1.00 0.00 N ATOM 527 CA ASP A 39 14.748 1.670 -5.645 1.00 0.00 C ATOM 528 C ASP A 39 14.257 0.832 -4.463 1.00 0.00 C ATOM 529 O ASP A 39 14.585 -0.349 -4.356 1.00 0.00 O ATOM 530 CB ASP A 39 16.200 1.280 -5.931 1.00 0.00 C ATOM 531 CG ASP A 39 17.085 2.417 -6.445 1.00 0.00 C ATOM 532 OD1 ASP A 39 16.705 3.010 -7.477 1.00 0.00 O ATOM 533 OD2 ASP A 39 18.123 2.667 -5.793 1.00 0.00 O ATOM 0 H ASP A 39 15.121 3.353 -4.454 1.00 0.00 H new ATOM 0 HA ASP A 39 14.144 1.487 -6.534 1.00 0.00 H new ATOM 0 HB2 ASP A 39 16.640 0.882 -5.017 1.00 0.00 H new ATOM 0 HB3 ASP A 39 16.206 0.474 -6.665 1.00 0.00 H new ATOM 538 N LEU A 40 13.479 1.475 -3.605 1.00 0.00 N ATOM 539 CA LEU A 40 12.939 0.803 -2.435 1.00 0.00 C ATOM 540 C LEU A 40 12.514 -0.616 -2.818 1.00 0.00 C ATOM 541 O LEU A 40 13.014 -1.590 -2.259 1.00 0.00 O ATOM 542 CB LEU A 40 11.817 1.634 -1.810 1.00 0.00 C ATOM 543 CG LEU A 40 11.157 1.040 -0.564 1.00 0.00 C ATOM 544 CD1 LEU A 40 12.194 0.758 0.525 1.00 0.00 C ATOM 545 CD2 LEU A 40 10.026 1.940 -0.061 1.00 0.00 C ATOM 0 H LEU A 40 13.209 2.454 -3.697 1.00 0.00 H new ATOM 0 HA LEU A 40 13.703 0.710 -1.663 1.00 0.00 H new ATOM 0 HB2 LEU A 40 12.218 2.614 -1.552 1.00 0.00 H new ATOM 0 HB3 LEU A 40 11.046 1.793 -2.564 1.00 0.00 H new ATOM 0 HG LEU A 40 10.710 0.084 -0.837 1.00 0.00 H new ATOM 0 HD11 LEU A 40 11.698 0.336 1.399 1.00 0.00 H new ATOM 0 HD12 LEU A 40 12.932 0.049 0.150 1.00 0.00 H new ATOM 0 HD13 LEU A 40 12.692 1.687 0.803 1.00 0.00 H new ATOM 0 HD21 LEU A 40 9.574 1.495 0.825 1.00 0.00 H new ATOM 0 HD22 LEU A 40 10.427 2.922 0.190 1.00 0.00 H new ATOM 0 HD23 LEU A 40 9.271 2.045 -0.840 1.00 0.00 H new ATOM 557 N LEU A 41 11.594 -0.687 -3.770 1.00 0.00 N ATOM 558 CA LEU A 41 11.095 -1.971 -4.234 1.00 0.00 C ATOM 559 C LEU A 41 11.815 -2.354 -5.528 1.00 0.00 C ATOM 560 O LEU A 41 11.174 -2.650 -6.535 1.00 0.00 O ATOM 561 CB LEU A 41 9.571 -1.938 -4.364 1.00 0.00 C ATOM 562 CG LEU A 41 8.833 -1.035 -3.374 1.00 0.00 C ATOM 563 CD1 LEU A 41 7.568 -0.448 -4.006 1.00 0.00 C ATOM 564 CD2 LEU A 41 8.531 -1.779 -2.072 1.00 0.00 C ATOM 0 H LEU A 41 11.182 0.123 -4.232 1.00 0.00 H new ATOM 0 HA LEU A 41 11.312 -2.751 -3.505 1.00 0.00 H new ATOM 0 HB2 LEU A 41 9.319 -1.617 -5.375 1.00 0.00 H new ATOM 0 HB3 LEU A 41 9.194 -2.954 -4.249 1.00 0.00 H new ATOM 0 HG LEU A 41 9.486 -0.199 -3.122 1.00 0.00 H new ATOM 0 HD11 LEU A 41 7.062 0.190 -3.282 1.00 0.00 H new ATOM 0 HD12 LEU A 41 7.839 0.141 -4.882 1.00 0.00 H new ATOM 0 HD13 LEU A 41 6.902 -1.257 -4.305 1.00 0.00 H new ATOM 0 HD21 LEU A 41 8.006 -1.114 -1.386 1.00 0.00 H new ATOM 0 HD22 LEU A 41 7.907 -2.647 -2.285 1.00 0.00 H new ATOM 0 HD23 LEU A 41 9.465 -2.107 -1.616 1.00 0.00 H new ATOM 576 N ASP A 42 13.138 -2.338 -5.459 1.00 0.00 N ATOM 577 CA ASP A 42 13.952 -2.680 -6.613 1.00 0.00 C ATOM 578 C ASP A 42 13.696 -4.139 -6.998 1.00 0.00 C ATOM 579 O ASP A 42 13.807 -5.034 -6.162 1.00 0.00 O ATOM 580 CB ASP A 42 15.442 -2.529 -6.301 1.00 0.00 C ATOM 581 CG ASP A 42 16.376 -3.349 -7.193 1.00 0.00 C ATOM 582 OD1 ASP A 42 16.302 -3.151 -8.425 1.00 0.00 O ATOM 583 OD2 ASP A 42 17.144 -4.154 -6.623 1.00 0.00 O ATOM 0 H ASP A 42 13.667 -2.093 -4.622 1.00 0.00 H new ATOM 0 HA ASP A 42 13.684 -2.006 -7.426 1.00 0.00 H new ATOM 0 HB2 ASP A 42 15.711 -1.476 -6.389 1.00 0.00 H new ATOM 0 HB3 ASP A 42 15.611 -2.815 -5.263 1.00 0.00 H new ATOM 588 N GLY A 43 13.356 -4.333 -8.264 1.00 0.00 N ATOM 589 CA GLY A 43 13.083 -5.667 -8.769 1.00 0.00 C ATOM 590 C GLY A 43 12.077 -6.397 -7.876 1.00 0.00 C ATOM 591 O GLY A 43 12.209 -7.596 -7.637 1.00 0.00 O ATOM 0 H GLY A 43 13.263 -3.588 -8.955 1.00 0.00 H new ATOM 0 HA2 GLY A 43 12.693 -5.602 -9.785 1.00 0.00 H new ATOM 0 HA3 GLY A 43 14.011 -6.237 -8.820 1.00 0.00 H new ATOM 595 N CYS A 44 11.095 -5.642 -7.407 1.00 0.00 N ATOM 596 CA CYS A 44 10.067 -6.201 -6.545 1.00 0.00 C ATOM 597 C CYS A 44 8.707 -5.963 -7.202 1.00 0.00 C ATOM 598 O CYS A 44 8.231 -4.830 -7.259 1.00 0.00 O ATOM 599 CB CYS A 44 10.131 -5.613 -5.134 1.00 0.00 C ATOM 600 SG CYS A 44 11.791 -5.889 -4.415 1.00 0.00 S ATOM 0 H CYS A 44 10.989 -4.648 -7.607 1.00 0.00 H new ATOM 0 HA CYS A 44 10.230 -7.272 -6.428 1.00 0.00 H new ATOM 0 HB2 CYS A 44 9.912 -4.546 -5.166 1.00 0.00 H new ATOM 0 HB3 CYS A 44 9.371 -6.075 -4.504 1.00 0.00 H new ATOM 0 HG CYS A 44 12.692 -5.767 -5.344 1.00 0.00 H new ATOM 606 N ARG A 45 8.118 -7.049 -7.682 1.00 0.00 N ATOM 607 CA ARG A 45 6.822 -6.972 -8.333 1.00 0.00 C ATOM 608 C ARG A 45 5.701 -7.066 -7.296 1.00 0.00 C ATOM 609 O ARG A 45 5.663 -8.005 -6.502 1.00 0.00 O ATOM 610 CB ARG A 45 6.653 -8.093 -9.360 1.00 0.00 C ATOM 611 CG ARG A 45 7.680 -7.963 -10.487 1.00 0.00 C ATOM 612 CD ARG A 45 7.774 -9.259 -11.295 1.00 0.00 C ATOM 613 NE ARG A 45 9.130 -9.839 -11.165 1.00 0.00 N ATOM 614 CZ ARG A 45 10.253 -9.215 -11.548 1.00 0.00 C ATOM 615 NH1 ARG A 45 10.189 -7.990 -12.085 1.00 0.00 N ATOM 616 NH2 ARG A 45 11.440 -9.818 -11.392 1.00 0.00 N ATOM 0 H ARG A 45 8.515 -7.987 -7.633 1.00 0.00 H new ATOM 0 HA ARG A 45 6.766 -6.013 -8.848 1.00 0.00 H new ATOM 0 HB2 ARG A 45 6.766 -9.060 -8.870 1.00 0.00 H new ATOM 0 HB3 ARG A 45 5.646 -8.062 -9.775 1.00 0.00 H new ATOM 0 HG2 ARG A 45 7.401 -7.140 -11.145 1.00 0.00 H new ATOM 0 HG3 ARG A 45 8.656 -7.720 -10.068 1.00 0.00 H new ATOM 0 HD2 ARG A 45 7.029 -9.972 -10.942 1.00 0.00 H new ATOM 0 HD3 ARG A 45 7.553 -9.060 -12.344 1.00 0.00 H new ATOM 0 HE ARG A 45 9.215 -10.771 -10.759 1.00 0.00 H new ATOM 0 HH11 ARG A 45 9.286 -7.531 -12.203 1.00 0.00 H new ATOM 0 HH12 ARG A 45 11.044 -7.516 -12.376 1.00 0.00 H new ATOM 0 HH21 ARG A 45 11.488 -10.751 -10.982 1.00 0.00 H new ATOM 0 HH22 ARG A 45 12.295 -9.344 -11.683 1.00 0.00 H new ATOM 630 N ILE A 46 4.815 -6.082 -7.338 1.00 0.00 N ATOM 631 CA ILE A 46 3.696 -6.042 -6.412 1.00 0.00 C ATOM 632 C ILE A 46 2.391 -5.926 -7.201 1.00 0.00 C ATOM 633 O ILE A 46 2.340 -5.250 -8.228 1.00 0.00 O ATOM 634 CB ILE A 46 3.893 -4.929 -5.380 1.00 0.00 C ATOM 635 CG1 ILE A 46 5.329 -4.919 -4.851 1.00 0.00 C ATOM 636 CG2 ILE A 46 2.866 -5.040 -4.251 1.00 0.00 C ATOM 637 CD1 ILE A 46 6.007 -3.577 -5.130 1.00 0.00 C ATOM 0 H ILE A 46 4.849 -5.306 -7.999 1.00 0.00 H new ATOM 0 HA ILE A 46 3.642 -6.968 -5.840 1.00 0.00 H new ATOM 0 HB ILE A 46 3.726 -3.972 -5.874 1.00 0.00 H new ATOM 0 HG12 ILE A 46 5.326 -5.113 -3.778 1.00 0.00 H new ATOM 0 HG13 ILE A 46 5.898 -5.722 -5.319 1.00 0.00 H new ATOM 0 HG21 ILE A 46 3.028 -4.237 -3.531 1.00 0.00 H new ATOM 0 HG22 ILE A 46 1.861 -4.959 -4.664 1.00 0.00 H new ATOM 0 HG23 ILE A 46 2.977 -6.003 -3.752 1.00 0.00 H new ATOM 0 HD11 ILE A 46 7.026 -3.597 -4.744 1.00 0.00 H new ATOM 0 HD12 ILE A 46 6.030 -3.397 -6.205 1.00 0.00 H new ATOM 0 HD13 ILE A 46 5.449 -2.779 -4.640 1.00 0.00 H new ATOM 649 N TYR A 47 1.366 -6.594 -6.691 1.00 0.00 N ATOM 650 CA TYR A 47 0.064 -6.574 -7.335 1.00 0.00 C ATOM 651 C TYR A 47 -0.949 -5.788 -6.500 1.00 0.00 C ATOM 652 O TYR A 47 -1.235 -6.152 -5.360 1.00 0.00 O ATOM 653 CB TYR A 47 -0.387 -8.033 -7.421 1.00 0.00 C ATOM 654 CG TYR A 47 -1.836 -8.211 -7.877 1.00 0.00 C ATOM 655 CD1 TYR A 47 -2.131 -8.294 -9.223 1.00 0.00 C ATOM 656 CD2 TYR A 47 -2.849 -8.288 -6.943 1.00 0.00 C ATOM 657 CE1 TYR A 47 -3.495 -8.462 -9.652 1.00 0.00 C ATOM 658 CE2 TYR A 47 -4.213 -8.455 -7.372 1.00 0.00 C ATOM 659 CZ TYR A 47 -4.469 -8.534 -8.706 1.00 0.00 C ATOM 660 OH TYR A 47 -5.757 -8.692 -9.112 1.00 0.00 O ATOM 0 H TYR A 47 1.411 -7.153 -5.839 1.00 0.00 H new ATOM 0 HA TYR A 47 0.128 -6.098 -8.313 1.00 0.00 H new ATOM 0 HB2 TYR A 47 0.268 -8.565 -8.111 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -0.265 -8.498 -6.443 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -1.339 -8.233 -9.954 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -2.618 -8.223 -5.890 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -3.739 -8.529 -10.702 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -5.015 -8.516 -6.651 1.00 0.00 H new ATOM 0 HH TYR A 47 -5.806 -8.604 -10.087 1.00 0.00 H new ATOM 670 N LEU A 48 -1.463 -4.724 -7.099 1.00 0.00 N ATOM 671 CA LEU A 48 -2.438 -3.883 -6.424 1.00 0.00 C ATOM 672 C LEU A 48 -3.829 -4.501 -6.576 1.00 0.00 C ATOM 673 O LEU A 48 -4.222 -4.894 -7.674 1.00 0.00 O ATOM 674 CB LEU A 48 -2.346 -2.443 -6.932 1.00 0.00 C ATOM 675 CG LEU A 48 -1.136 -1.638 -6.450 1.00 0.00 C ATOM 676 CD1 LEU A 48 -1.154 -0.222 -7.030 1.00 0.00 C ATOM 677 CD2 LEU A 48 -1.055 -1.632 -4.922 1.00 0.00 C ATOM 0 H LEU A 48 -1.223 -4.425 -8.044 1.00 0.00 H new ATOM 0 HA LEU A 48 -2.225 -3.834 -5.356 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -2.333 -2.463 -8.022 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -3.251 -1.915 -6.633 1.00 0.00 H new ATOM 0 HG LEU A 48 -0.233 -2.125 -6.818 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -0.284 0.329 -6.672 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -1.128 -0.274 -8.118 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -2.063 0.290 -6.713 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -0.187 -1.054 -4.606 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -1.959 -1.183 -4.511 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -0.961 -2.655 -4.559 1.00 0.00 H new ATOM 689 N CYS A 49 -4.537 -4.568 -5.459 1.00 0.00 N ATOM 690 CA CYS A 49 -5.877 -5.131 -5.454 1.00 0.00 C ATOM 691 C CYS A 49 -6.751 -4.282 -4.529 1.00 0.00 C ATOM 692 O CYS A 49 -6.324 -3.904 -3.439 1.00 0.00 O ATOM 693 CB CYS A 49 -5.870 -6.604 -5.040 1.00 0.00 C ATOM 694 SG CYS A 49 -7.250 -7.489 -5.852 1.00 0.00 S ATOM 0 H CYS A 49 -4.208 -4.242 -4.550 1.00 0.00 H new ATOM 0 HA CYS A 49 -6.288 -5.107 -6.463 1.00 0.00 H new ATOM 0 HB2 CYS A 49 -4.921 -7.063 -5.315 1.00 0.00 H new ATOM 0 HB3 CYS A 49 -5.962 -6.686 -3.957 1.00 0.00 H new ATOM 0 HG CYS A 49 -7.090 -8.771 -5.705 1.00 0.00 H new ATOM 700 N GLY A 50 -7.960 -4.009 -4.996 1.00 0.00 N ATOM 701 CA GLY A 50 -8.899 -3.212 -4.224 1.00 0.00 C ATOM 702 C GLY A 50 -8.398 -1.775 -4.066 1.00 0.00 C ATOM 703 O GLY A 50 -8.261 -1.281 -2.948 1.00 0.00 O ATOM 0 H GLY A 50 -8.312 -4.325 -5.900 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -9.871 -3.210 -4.717 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -9.041 -3.662 -3.241 1.00 0.00 H new ATOM 707 N PHE A 51 -8.138 -1.144 -5.202 1.00 0.00 N ATOM 708 CA PHE A 51 -7.655 0.226 -5.204 1.00 0.00 C ATOM 709 C PHE A 51 -8.146 0.979 -6.442 1.00 0.00 C ATOM 710 O PHE A 51 -8.073 0.463 -7.556 1.00 0.00 O ATOM 711 CB PHE A 51 -6.127 0.162 -5.234 1.00 0.00 C ATOM 712 CG PHE A 51 -5.488 -0.101 -3.868 1.00 0.00 C ATOM 713 CD1 PHE A 51 -5.766 0.717 -2.819 1.00 0.00 C ATOM 714 CD2 PHE A 51 -4.642 -1.154 -3.705 1.00 0.00 C ATOM 715 CE1 PHE A 51 -5.174 0.473 -1.551 1.00 0.00 C ATOM 716 CE2 PHE A 51 -4.050 -1.398 -2.438 1.00 0.00 C ATOM 717 CZ PHE A 51 -4.328 -0.580 -1.388 1.00 0.00 C ATOM 0 H PHE A 51 -8.253 -1.557 -6.128 1.00 0.00 H new ATOM 0 HA PHE A 51 -8.023 0.751 -4.323 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -5.820 -0.623 -5.925 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -5.742 1.102 -5.629 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -6.437 1.553 -2.949 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -4.421 -1.804 -4.539 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -5.395 1.123 -0.717 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -3.378 -2.234 -2.308 1.00 0.00 H new ATOM 0 HZ PHE A 51 -3.877 -0.766 -0.424 1.00 0.00 H new ATOM 727 N SER A 52 -8.636 2.187 -6.205 1.00 0.00 N ATOM 728 CA SER A 52 -9.139 3.016 -7.287 1.00 0.00 C ATOM 729 C SER A 52 -9.061 4.493 -6.895 1.00 0.00 C ATOM 730 O SER A 52 -8.872 4.818 -5.724 1.00 0.00 O ATOM 731 CB SER A 52 -10.577 2.638 -7.648 1.00 0.00 C ATOM 732 OG SER A 52 -10.658 1.997 -8.918 1.00 0.00 O ATOM 0 H SER A 52 -8.695 2.611 -5.279 1.00 0.00 H new ATOM 0 HA SER A 52 -8.516 2.846 -8.165 1.00 0.00 H new ATOM 0 HB2 SER A 52 -10.981 1.977 -6.882 1.00 0.00 H new ATOM 0 HB3 SER A 52 -11.197 3.535 -7.654 1.00 0.00 H new ATOM 0 HG SER A 52 -11.592 1.770 -9.111 1.00 0.00 H new ATOM 738 N GLY A 53 -9.210 5.347 -7.897 1.00 0.00 N ATOM 739 CA GLY A 53 -9.159 6.781 -7.671 1.00 0.00 C ATOM 740 C GLY A 53 -7.754 7.221 -7.253 1.00 0.00 C ATOM 741 O GLY A 53 -6.791 7.017 -7.990 1.00 0.00 O ATOM 0 H GLY A 53 -9.366 5.073 -8.867 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -9.453 7.307 -8.579 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -9.875 7.056 -6.897 1.00 0.00 H new ATOM 745 N ARG A 54 -7.682 7.816 -6.071 1.00 0.00 N ATOM 746 CA ARG A 54 -6.411 8.285 -5.546 1.00 0.00 C ATOM 747 C ARG A 54 -5.665 7.140 -4.858 1.00 0.00 C ATOM 748 O ARG A 54 -4.478 6.931 -5.104 1.00 0.00 O ATOM 749 CB ARG A 54 -6.615 9.426 -4.547 1.00 0.00 C ATOM 750 CG ARG A 54 -6.650 10.779 -5.259 1.00 0.00 C ATOM 751 CD ARG A 54 -7.645 11.727 -4.586 1.00 0.00 C ATOM 752 NE ARG A 54 -8.618 12.229 -5.582 1.00 0.00 N ATOM 753 CZ ARG A 54 -8.280 12.917 -6.682 1.00 0.00 C ATOM 754 NH1 ARG A 54 -6.992 13.188 -6.933 1.00 0.00 N ATOM 755 NH2 ARG A 54 -9.230 13.333 -7.530 1.00 0.00 N ATOM 0 H ARG A 54 -8.483 7.984 -5.462 1.00 0.00 H new ATOM 0 HA ARG A 54 -5.821 8.654 -6.385 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -7.546 9.274 -4.001 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -5.810 9.419 -3.812 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -5.655 11.224 -5.250 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -6.927 10.637 -6.304 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -8.169 11.208 -3.783 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -7.113 12.563 -4.131 1.00 0.00 H new ATOM 0 HE ARG A 54 -9.607 12.040 -5.422 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -6.269 12.871 -6.287 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -6.735 13.711 -7.770 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -10.210 13.126 -7.339 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -8.973 13.856 -8.367 1.00 0.00 H new ATOM 769 N LYS A 55 -6.392 6.429 -4.009 1.00 0.00 N ATOM 770 CA LYS A 55 -5.814 5.311 -3.283 1.00 0.00 C ATOM 771 C LYS A 55 -4.885 4.530 -4.214 1.00 0.00 C ATOM 772 O LYS A 55 -3.766 4.185 -3.835 1.00 0.00 O ATOM 773 CB LYS A 55 -6.914 4.455 -2.653 1.00 0.00 C ATOM 774 CG LYS A 55 -7.690 5.248 -1.599 1.00 0.00 C ATOM 775 CD LYS A 55 -8.113 4.347 -0.437 1.00 0.00 C ATOM 776 CE LYS A 55 -7.895 5.047 0.906 1.00 0.00 C ATOM 777 NZ LYS A 55 -9.185 5.232 1.609 1.00 0.00 N ATOM 0 H LYS A 55 -7.376 6.605 -3.808 1.00 0.00 H new ATOM 0 HA LYS A 55 -5.206 5.670 -2.452 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -7.597 4.107 -3.428 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -6.473 3.569 -2.195 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -7.072 6.064 -1.225 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -8.572 5.699 -2.054 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -9.164 4.078 -0.545 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -7.542 3.419 -0.465 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -7.218 4.458 1.525 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -7.419 6.015 0.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -9.019 5.708 2.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -9.819 5.813 1.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -9.624 4.305 1.779 1.00 0.00 H new ATOM 791 N LEU A 56 -5.382 4.273 -5.415 1.00 0.00 N ATOM 792 CA LEU A 56 -4.610 3.539 -6.404 1.00 0.00 C ATOM 793 C LEU A 56 -3.482 4.430 -6.928 1.00 0.00 C ATOM 794 O LEU A 56 -2.307 4.086 -6.807 1.00 0.00 O ATOM 795 CB LEU A 56 -5.525 2.996 -7.503 1.00 0.00 C ATOM 796 CG LEU A 56 -4.845 2.164 -8.592 1.00 0.00 C ATOM 797 CD1 LEU A 56 -3.898 1.130 -7.980 1.00 0.00 C ATOM 798 CD2 LEU A 56 -5.880 1.517 -9.515 1.00 0.00 C ATOM 0 H LEU A 56 -6.310 4.560 -5.726 1.00 0.00 H new ATOM 0 HA LEU A 56 -4.142 2.665 -5.950 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -6.298 2.385 -7.036 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -6.028 3.838 -7.978 1.00 0.00 H new ATOM 0 HG LEU A 56 -4.240 2.832 -9.205 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -3.428 0.552 -8.775 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -3.130 1.640 -7.399 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -4.461 0.461 -7.330 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -5.370 0.931 -10.280 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -6.530 0.865 -8.932 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -6.478 2.293 -9.992 1.00 0.00 H new ATOM 810 N ASP A 57 -3.878 5.558 -7.499 1.00 0.00 N ATOM 811 CA ASP A 57 -2.915 6.501 -8.042 1.00 0.00 C ATOM 812 C ASP A 57 -1.704 6.579 -7.111 1.00 0.00 C ATOM 813 O ASP A 57 -0.562 6.541 -7.568 1.00 0.00 O ATOM 814 CB ASP A 57 -3.518 7.903 -8.152 1.00 0.00 C ATOM 815 CG ASP A 57 -2.537 8.997 -8.574 1.00 0.00 C ATOM 816 OD1 ASP A 57 -2.400 9.195 -9.801 1.00 0.00 O ATOM 817 OD2 ASP A 57 -1.945 9.612 -7.661 1.00 0.00 O ATOM 0 H ASP A 57 -4.853 5.840 -7.597 1.00 0.00 H new ATOM 0 HA ASP A 57 -2.626 6.154 -9.034 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -4.338 7.874 -8.870 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -3.948 8.174 -7.188 1.00 0.00 H new ATOM 822 N LYS A 58 -1.994 6.685 -5.823 1.00 0.00 N ATOM 823 CA LYS A 58 -0.942 6.769 -4.824 1.00 0.00 C ATOM 824 C LYS A 58 -0.021 5.554 -4.956 1.00 0.00 C ATOM 825 O LYS A 58 1.125 5.683 -5.383 1.00 0.00 O ATOM 826 CB LYS A 58 -1.543 6.936 -3.426 1.00 0.00 C ATOM 827 CG LYS A 58 -2.195 8.311 -3.271 1.00 0.00 C ATOM 828 CD LYS A 58 -1.143 9.422 -3.282 1.00 0.00 C ATOM 829 CE LYS A 58 -1.769 10.774 -2.933 1.00 0.00 C ATOM 830 NZ LYS A 58 -0.754 11.848 -3.004 1.00 0.00 N ATOM 0 H LYS A 58 -2.942 6.715 -5.448 1.00 0.00 H new ATOM 0 HA LYS A 58 -0.328 7.654 -4.990 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -2.284 6.156 -3.249 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -0.764 6.812 -2.674 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -2.908 8.472 -4.080 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -2.758 8.347 -2.338 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -0.354 9.187 -2.568 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -0.677 9.476 -4.266 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -2.586 10.992 -3.621 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -2.197 10.736 -1.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -1.222 12.755 -3.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -0.251 11.911 -2.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -0.074 11.634 -3.762 1.00 0.00 H new ATOM 844 N LEU A 59 -0.557 4.402 -4.581 1.00 0.00 N ATOM 845 CA LEU A 59 0.202 3.165 -4.653 1.00 0.00 C ATOM 846 C LEU A 59 1.006 3.139 -5.955 1.00 0.00 C ATOM 847 O LEU A 59 2.198 2.836 -5.947 1.00 0.00 O ATOM 848 CB LEU A 59 -0.721 1.958 -4.476 1.00 0.00 C ATOM 849 CG LEU A 59 -0.702 1.295 -3.097 1.00 0.00 C ATOM 850 CD1 LEU A 59 -0.129 2.243 -2.041 1.00 0.00 C ATOM 851 CD2 LEU A 59 -2.093 0.785 -2.715 1.00 0.00 C ATOM 0 H LEU A 59 -1.508 4.299 -4.226 1.00 0.00 H new ATOM 0 HA LEU A 59 0.919 3.111 -3.834 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -1.742 2.272 -4.692 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -0.453 1.209 -5.221 1.00 0.00 H new ATOM 0 HG LEU A 59 -0.043 0.428 -3.143 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -0.127 1.748 -1.070 1.00 0.00 H new ATOM 0 HD12 LEU A 59 0.891 2.515 -2.312 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -0.743 3.142 -1.988 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -2.052 0.318 -1.731 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -2.793 1.620 -2.692 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -2.427 0.053 -3.450 1.00 0.00 H new ATOM 863 N ARG A 60 0.320 3.462 -7.042 1.00 0.00 N ATOM 864 CA ARG A 60 0.955 3.479 -8.349 1.00 0.00 C ATOM 865 C ARG A 60 2.224 4.333 -8.311 1.00 0.00 C ATOM 866 O ARG A 60 3.258 3.939 -8.849 1.00 0.00 O ATOM 867 CB ARG A 60 0.007 4.033 -9.414 1.00 0.00 C ATOM 868 CG ARG A 60 -1.233 3.148 -9.560 1.00 0.00 C ATOM 869 CD ARG A 60 -2.268 3.800 -10.478 1.00 0.00 C ATOM 870 NE ARG A 60 -2.892 2.776 -11.345 1.00 0.00 N ATOM 871 CZ ARG A 60 -3.566 3.053 -12.470 1.00 0.00 C ATOM 872 NH1 ARG A 60 -3.708 4.324 -12.870 1.00 0.00 N ATOM 873 NH2 ARG A 60 -4.099 2.059 -13.193 1.00 0.00 N ATOM 0 H ARG A 60 -0.668 3.714 -7.044 1.00 0.00 H new ATOM 0 HA ARG A 60 1.212 2.452 -8.607 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -0.294 5.046 -9.146 1.00 0.00 H new ATOM 0 HB3 ARG A 60 0.527 4.097 -10.370 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -0.945 2.177 -9.963 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -1.673 2.969 -8.579 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -3.032 4.298 -9.882 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -1.792 4.566 -11.090 1.00 0.00 H new ATOM 0 HE ARG A 60 -2.804 1.798 -11.069 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -3.303 5.080 -12.318 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -4.221 4.535 -13.726 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -3.992 1.092 -12.887 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -4.612 2.269 -14.049 1.00 0.00 H new ATOM 887 N ARG A 61 2.104 5.487 -7.671 1.00 0.00 N ATOM 888 CA ARG A 61 3.228 6.400 -7.557 1.00 0.00 C ATOM 889 C ARG A 61 4.251 5.858 -6.556 1.00 0.00 C ATOM 890 O ARG A 61 5.448 6.109 -6.690 1.00 0.00 O ATOM 891 CB ARG A 61 2.768 7.787 -7.104 1.00 0.00 C ATOM 892 CG ARG A 61 2.148 8.565 -8.266 1.00 0.00 C ATOM 893 CD ARG A 61 1.966 10.040 -7.904 1.00 0.00 C ATOM 894 NE ARG A 61 1.564 10.810 -9.102 1.00 0.00 N ATOM 895 CZ ARG A 61 1.572 12.148 -9.173 1.00 0.00 C ATOM 896 NH1 ARG A 61 1.962 12.873 -8.115 1.00 0.00 N ATOM 897 NH2 ARG A 61 1.190 12.762 -10.301 1.00 0.00 N ATOM 0 H ARG A 61 1.245 5.810 -7.226 1.00 0.00 H new ATOM 0 HA ARG A 61 3.687 6.486 -8.542 1.00 0.00 H new ATOM 0 HB2 ARG A 61 2.040 7.688 -6.299 1.00 0.00 H new ATOM 0 HB3 ARG A 61 3.615 8.342 -6.701 1.00 0.00 H new ATOM 0 HG2 ARG A 61 2.785 8.479 -9.147 1.00 0.00 H new ATOM 0 HG3 ARG A 61 1.183 8.129 -8.526 1.00 0.00 H new ATOM 0 HD2 ARG A 61 1.209 10.141 -7.126 1.00 0.00 H new ATOM 0 HD3 ARG A 61 2.895 10.441 -7.499 1.00 0.00 H new ATOM 0 HE ARG A 61 1.262 10.289 -9.926 1.00 0.00 H new ATOM 0 HH11 ARG A 61 2.253 12.406 -7.256 1.00 0.00 H new ATOM 0 HH12 ARG A 61 1.968 13.892 -8.169 1.00 0.00 H new ATOM 0 HH21 ARG A 61 0.893 12.211 -11.106 1.00 0.00 H new ATOM 0 HH22 ARG A 61 1.196 13.781 -10.354 1.00 0.00 H new ATOM 911 N LEU A 62 3.743 5.126 -5.576 1.00 0.00 N ATOM 912 CA LEU A 62 4.598 4.547 -4.554 1.00 0.00 C ATOM 913 C LEU A 62 5.462 3.450 -5.179 1.00 0.00 C ATOM 914 O LEU A 62 6.677 3.604 -5.298 1.00 0.00 O ATOM 915 CB LEU A 62 3.763 4.069 -3.365 1.00 0.00 C ATOM 916 CG LEU A 62 3.455 5.119 -2.295 1.00 0.00 C ATOM 917 CD1 LEU A 62 2.124 5.818 -2.580 1.00 0.00 C ATOM 918 CD2 LEU A 62 3.492 4.503 -0.895 1.00 0.00 C ATOM 0 H LEU A 62 2.750 4.920 -5.468 1.00 0.00 H new ATOM 0 HA LEU A 62 5.278 5.300 -4.155 1.00 0.00 H new ATOM 0 HB2 LEU A 62 2.819 3.678 -3.744 1.00 0.00 H new ATOM 0 HB3 LEU A 62 4.285 3.238 -2.891 1.00 0.00 H new ATOM 0 HG LEU A 62 4.233 5.882 -2.331 1.00 0.00 H new ATOM 0 HD11 LEU A 62 1.929 6.559 -1.805 1.00 0.00 H new ATOM 0 HD12 LEU A 62 2.173 6.312 -3.550 1.00 0.00 H new ATOM 0 HD13 LEU A 62 1.321 5.081 -2.588 1.00 0.00 H new ATOM 0 HD21 LEU A 62 3.270 5.271 -0.154 1.00 0.00 H new ATOM 0 HD22 LEU A 62 2.750 3.708 -0.828 1.00 0.00 H new ATOM 0 HD23 LEU A 62 4.483 4.091 -0.705 1.00 0.00 H new ATOM 930 N ILE A 63 4.802 2.367 -5.562 1.00 0.00 N ATOM 931 CA ILE A 63 5.494 1.244 -6.172 1.00 0.00 C ATOM 932 C ILE A 63 6.575 1.771 -7.118 1.00 0.00 C ATOM 933 O ILE A 63 7.743 1.404 -6.998 1.00 0.00 O ATOM 934 CB ILE A 63 4.496 0.299 -6.843 1.00 0.00 C ATOM 935 CG1 ILE A 63 3.729 -0.518 -5.802 1.00 0.00 C ATOM 936 CG2 ILE A 63 5.192 -0.593 -7.872 1.00 0.00 C ATOM 937 CD1 ILE A 63 2.288 -0.766 -6.252 1.00 0.00 C ATOM 0 H ILE A 63 3.795 2.243 -5.462 1.00 0.00 H new ATOM 0 HA ILE A 63 5.998 0.648 -5.411 1.00 0.00 H new ATOM 0 HB ILE A 63 3.765 0.902 -7.382 1.00 0.00 H new ATOM 0 HG12 ILE A 63 4.232 -1.471 -5.640 1.00 0.00 H new ATOM 0 HG13 ILE A 63 3.730 0.009 -4.848 1.00 0.00 H new ATOM 0 HG21 ILE A 63 4.460 -1.255 -8.334 1.00 0.00 H new ATOM 0 HG22 ILE A 63 5.654 0.029 -8.639 1.00 0.00 H new ATOM 0 HG23 ILE A 63 5.959 -1.189 -7.377 1.00 0.00 H new ATOM 0 HD11 ILE A 63 1.765 -1.349 -5.494 1.00 0.00 H new ATOM 0 HD12 ILE A 63 1.780 0.189 -6.390 1.00 0.00 H new ATOM 0 HD13 ILE A 63 2.290 -1.315 -7.194 1.00 0.00 H new ATOM 949 N ASN A 64 6.147 2.622 -8.039 1.00 0.00 N ATOM 950 CA ASN A 64 7.063 3.203 -9.005 1.00 0.00 C ATOM 951 C ASN A 64 8.157 3.974 -8.265 1.00 0.00 C ATOM 952 O ASN A 64 9.337 3.850 -8.589 1.00 0.00 O ATOM 953 CB ASN A 64 6.339 4.181 -9.932 1.00 0.00 C ATOM 954 CG ASN A 64 6.480 3.757 -11.395 1.00 0.00 C ATOM 955 OD1 ASN A 64 7.468 3.170 -11.806 1.00 0.00 O ATOM 956 ND2 ASN A 64 5.441 4.088 -12.157 1.00 0.00 N ATOM 0 H ASN A 64 5.177 2.923 -8.136 1.00 0.00 H new ATOM 0 HA ASN A 64 7.487 2.392 -9.597 1.00 0.00 H new ATOM 0 HB2 ASN A 64 5.284 4.228 -9.664 1.00 0.00 H new ATOM 0 HB3 ASN A 64 6.747 5.183 -9.799 1.00 0.00 H new ATOM 0 HD21 ASN A 64 5.440 3.851 -13.149 1.00 0.00 H new ATOM 0 HD22 ASN A 64 4.645 4.579 -11.749 1.00 0.00 H new ATOM 963 N SER A 65 7.726 4.754 -7.284 1.00 0.00 N ATOM 964 CA SER A 65 8.654 5.546 -6.495 1.00 0.00 C ATOM 965 C SER A 65 9.678 4.632 -5.818 1.00 0.00 C ATOM 966 O SER A 65 10.802 5.049 -5.544 1.00 0.00 O ATOM 967 CB SER A 65 7.914 6.381 -5.448 1.00 0.00 C ATOM 968 OG SER A 65 8.812 7.057 -4.572 1.00 0.00 O ATOM 0 H SER A 65 6.746 4.854 -7.018 1.00 0.00 H new ATOM 0 HA SER A 65 9.174 6.231 -7.165 1.00 0.00 H new ATOM 0 HB2 SER A 65 7.279 7.111 -5.950 1.00 0.00 H new ATOM 0 HB3 SER A 65 7.258 5.734 -4.866 1.00 0.00 H new ATOM 0 HG SER A 65 8.301 7.580 -3.920 1.00 0.00 H new ATOM 974 N GLY A 66 9.251 3.403 -5.568 1.00 0.00 N ATOM 975 CA GLY A 66 10.116 2.426 -4.928 1.00 0.00 C ATOM 976 C GLY A 66 10.942 1.662 -5.965 1.00 0.00 C ATOM 977 O GLY A 66 11.956 1.052 -5.630 1.00 0.00 O ATOM 0 H GLY A 66 8.318 3.061 -5.797 1.00 0.00 H new ATOM 0 HA2 GLY A 66 10.782 2.929 -4.226 1.00 0.00 H new ATOM 0 HA3 GLY A 66 9.514 1.725 -4.350 1.00 0.00 H new ATOM 981 N GLY A 67 10.476 1.720 -7.204 1.00 0.00 N ATOM 982 CA GLY A 67 11.158 1.041 -8.293 1.00 0.00 C ATOM 983 C GLY A 67 10.525 -0.324 -8.569 1.00 0.00 C ATOM 984 O GLY A 67 10.950 -1.036 -9.478 1.00 0.00 O ATOM 0 H GLY A 67 9.634 2.227 -7.478 1.00 0.00 H new ATOM 0 HA2 GLY A 67 11.115 1.655 -9.193 1.00 0.00 H new ATOM 0 HA3 GLY A 67 12.212 0.914 -8.044 1.00 0.00 H new ATOM 988 N GLY A 68 9.521 -0.648 -7.769 1.00 0.00 N ATOM 989 CA GLY A 68 8.825 -1.915 -7.916 1.00 0.00 C ATOM 990 C GLY A 68 7.892 -1.891 -9.129 1.00 0.00 C ATOM 991 O GLY A 68 7.633 -0.831 -9.695 1.00 0.00 O ATOM 0 H GLY A 68 9.172 -0.055 -7.016 1.00 0.00 H new ATOM 0 HA2 GLY A 68 9.550 -2.721 -8.026 1.00 0.00 H new ATOM 0 HA3 GLY A 68 8.250 -2.125 -7.014 1.00 0.00 H new ATOM 995 N VAL A 69 7.414 -3.073 -9.491 1.00 0.00 N ATOM 996 CA VAL A 69 6.516 -3.200 -10.626 1.00 0.00 C ATOM 997 C VAL A 69 5.102 -3.493 -10.121 1.00 0.00 C ATOM 998 O VAL A 69 4.916 -4.319 -9.228 1.00 0.00 O ATOM 999 CB VAL A 69 7.039 -4.267 -11.590 1.00 0.00 C ATOM 1000 CG1 VAL A 69 5.968 -4.657 -12.610 1.00 0.00 C ATOM 1001 CG2 VAL A 69 8.316 -3.795 -12.289 1.00 0.00 C ATOM 0 H VAL A 69 7.632 -3.950 -9.019 1.00 0.00 H new ATOM 0 HA VAL A 69 6.475 -2.266 -11.187 1.00 0.00 H new ATOM 0 HB VAL A 69 7.284 -5.154 -11.007 1.00 0.00 H new ATOM 0 HG11 VAL A 69 6.366 -5.417 -13.283 1.00 0.00 H new ATOM 0 HG12 VAL A 69 5.097 -5.054 -12.089 1.00 0.00 H new ATOM 0 HG13 VAL A 69 5.677 -3.779 -13.186 1.00 0.00 H new ATOM 0 HG21 VAL A 69 8.667 -4.572 -12.969 1.00 0.00 H new ATOM 0 HG22 VAL A 69 8.107 -2.886 -12.853 1.00 0.00 H new ATOM 0 HG23 VAL A 69 9.085 -3.591 -11.544 1.00 0.00 H new ATOM 1011 N ARG A 70 4.141 -2.801 -10.714 1.00 0.00 N ATOM 1012 CA ARG A 70 2.749 -2.976 -10.336 1.00 0.00 C ATOM 1013 C ARG A 70 2.019 -3.828 -11.377 1.00 0.00 C ATOM 1014 O ARG A 70 1.752 -3.366 -12.485 1.00 0.00 O ATOM 1015 CB ARG A 70 2.040 -1.627 -10.203 1.00 0.00 C ATOM 1016 CG ARG A 70 0.565 -1.816 -9.840 1.00 0.00 C ATOM 1017 CD ARG A 70 -0.307 -0.762 -10.524 1.00 0.00 C ATOM 1018 NE ARG A 70 -0.570 -1.155 -11.927 1.00 0.00 N ATOM 1019 CZ ARG A 70 0.114 -0.685 -12.979 1.00 0.00 C ATOM 1020 NH1 ARG A 70 1.105 0.198 -12.794 1.00 0.00 N ATOM 1021 NH2 ARG A 70 -0.194 -1.098 -14.216 1.00 0.00 N ATOM 0 H ARG A 70 4.299 -2.117 -11.454 1.00 0.00 H new ATOM 0 HA ARG A 70 2.729 -3.480 -9.370 1.00 0.00 H new ATOM 0 HB2 ARG A 70 2.533 -1.027 -9.438 1.00 0.00 H new ATOM 0 HB3 ARG A 70 2.120 -1.076 -11.140 1.00 0.00 H new ATOM 0 HG2 ARG A 70 0.238 -2.812 -10.138 1.00 0.00 H new ATOM 0 HG3 ARG A 70 0.441 -1.750 -8.759 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -1.249 -0.652 -9.986 1.00 0.00 H new ATOM 0 HD3 ARG A 70 0.191 0.207 -10.496 1.00 0.00 H new ATOM 0 HE ARG A 70 -1.318 -1.825 -12.104 1.00 0.00 H new ATOM 0 HH11 ARG A 70 1.339 0.512 -11.852 1.00 0.00 H new ATOM 0 HH12 ARG A 70 1.626 0.556 -13.595 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -0.949 -1.770 -14.356 1.00 0.00 H new ATOM 0 HH22 ARG A 70 0.326 -0.741 -15.017 1.00 0.00 H new ATOM 1035 N PHE A 71 1.717 -5.057 -10.983 1.00 0.00 N ATOM 1036 CA PHE A 71 1.024 -5.977 -11.868 1.00 0.00 C ATOM 1037 C PHE A 71 -0.492 -5.797 -11.768 1.00 0.00 C ATOM 1038 O PHE A 71 -1.110 -6.233 -10.797 1.00 0.00 O ATOM 1039 CB PHE A 71 1.388 -7.392 -11.417 1.00 0.00 C ATOM 1040 CG PHE A 71 2.475 -8.056 -12.265 1.00 0.00 C ATOM 1041 CD1 PHE A 71 3.674 -7.439 -12.439 1.00 0.00 C ATOM 1042 CD2 PHE A 71 2.240 -9.263 -12.847 1.00 0.00 C ATOM 1043 CE1 PHE A 71 4.682 -8.055 -13.226 1.00 0.00 C ATOM 1044 CE2 PHE A 71 3.249 -9.879 -13.634 1.00 0.00 C ATOM 1045 CZ PHE A 71 4.448 -9.262 -13.808 1.00 0.00 C ATOM 0 H PHE A 71 1.940 -5.436 -10.063 1.00 0.00 H new ATOM 0 HA PHE A 71 1.318 -5.791 -12.901 1.00 0.00 H new ATOM 0 HB2 PHE A 71 1.722 -7.357 -10.380 1.00 0.00 H new ATOM 0 HB3 PHE A 71 0.492 -8.012 -11.443 1.00 0.00 H new ATOM 0 HD1 PHE A 71 3.860 -6.480 -11.978 1.00 0.00 H new ATOM 0 HD2 PHE A 71 1.287 -9.752 -12.711 1.00 0.00 H new ATOM 0 HE1 PHE A 71 5.635 -7.565 -13.363 1.00 0.00 H new ATOM 0 HE2 PHE A 71 3.064 -10.838 -14.095 1.00 0.00 H new ATOM 0 HZ PHE A 71 5.214 -9.730 -14.408 1.00 0.00 H new ATOM 1055 N ASN A 72 -1.048 -5.153 -12.784 1.00 0.00 N ATOM 1056 CA ASN A 72 -2.480 -4.910 -12.822 1.00 0.00 C ATOM 1057 C ASN A 72 -3.221 -6.249 -12.808 1.00 0.00 C ATOM 1058 O ASN A 72 -4.424 -6.294 -12.554 1.00 0.00 O ATOM 1059 CB ASN A 72 -2.878 -4.163 -14.097 1.00 0.00 C ATOM 1060 CG ASN A 72 -3.567 -2.839 -13.763 1.00 0.00 C ATOM 1061 OD1 ASN A 72 -3.837 -2.521 -12.617 1.00 0.00 O ATOM 1062 ND2 ASN A 72 -3.837 -2.087 -14.826 1.00 0.00 N ATOM 0 H ASN A 72 -0.533 -4.792 -13.587 1.00 0.00 H new ATOM 0 HA ASN A 72 -2.743 -4.307 -11.953 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -1.992 -3.973 -14.703 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -3.546 -4.784 -14.694 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -4.297 -1.184 -14.709 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -3.584 -2.413 -15.759 1.00 0.00 H new ATOM 1069 N GLN A 73 -2.472 -7.306 -13.084 1.00 0.00 N ATOM 1070 CA GLN A 73 -3.043 -8.643 -13.106 1.00 0.00 C ATOM 1071 C GLN A 73 -2.202 -9.593 -12.251 1.00 0.00 C ATOM 1072 O GLN A 73 -0.975 -9.502 -12.239 1.00 0.00 O ATOM 1073 CB GLN A 73 -3.169 -9.161 -14.539 1.00 0.00 C ATOM 1074 CG GLN A 73 -4.037 -8.228 -15.386 1.00 0.00 C ATOM 1075 CD GLN A 73 -3.185 -7.443 -16.385 1.00 0.00 C ATOM 1076 OE1 GLN A 73 -2.028 -7.138 -16.149 1.00 0.00 O ATOM 1077 NE2 GLN A 73 -3.821 -7.134 -17.512 1.00 0.00 N ATOM 0 H GLN A 73 -1.475 -7.264 -13.294 1.00 0.00 H new ATOM 0 HA GLN A 73 -4.046 -8.596 -12.682 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -2.179 -9.248 -14.986 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -3.604 -10.160 -14.531 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -4.788 -8.810 -15.921 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -4.573 -7.536 -14.737 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -4.791 -7.421 -17.645 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -3.339 -6.611 -18.243 1.00 0.00 H new ATOM 1086 N LEU A 74 -2.895 -10.483 -11.556 1.00 0.00 N ATOM 1087 CA LEU A 74 -2.228 -11.449 -10.701 1.00 0.00 C ATOM 1088 C LEU A 74 -1.523 -12.493 -11.570 1.00 0.00 C ATOM 1089 O LEU A 74 -2.144 -13.105 -12.438 1.00 0.00 O ATOM 1090 CB LEU A 74 -3.215 -12.050 -9.699 1.00 0.00 C ATOM 1091 CG LEU A 74 -2.623 -12.506 -8.364 1.00 0.00 C ATOM 1092 CD1 LEU A 74 -1.159 -12.919 -8.527 1.00 0.00 C ATOM 1093 CD2 LEU A 74 -2.799 -11.431 -7.290 1.00 0.00 C ATOM 0 H LEU A 74 -3.912 -10.555 -11.568 1.00 0.00 H new ATOM 0 HA LEU A 74 -1.460 -10.960 -10.103 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -3.991 -11.312 -9.496 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -3.703 -12.904 -10.168 1.00 0.00 H new ATOM 0 HG LEU A 74 -3.171 -13.387 -8.030 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -0.762 -13.239 -7.564 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -1.090 -13.741 -9.239 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -0.581 -12.071 -8.895 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -2.370 -11.781 -6.351 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -2.293 -10.518 -7.603 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -3.861 -11.227 -7.150 1.00 0.00 H new ATOM 1105 N ASN A 75 -0.235 -12.663 -11.307 1.00 0.00 N ATOM 1106 CA ASN A 75 0.561 -13.622 -12.055 1.00 0.00 C ATOM 1107 C ASN A 75 1.644 -14.200 -11.142 1.00 0.00 C ATOM 1108 O ASN A 75 1.685 -13.896 -9.951 1.00 0.00 O ATOM 1109 CB ASN A 75 1.252 -12.954 -13.245 1.00 0.00 C ATOM 1110 CG ASN A 75 0.263 -12.709 -14.387 1.00 0.00 C ATOM 1111 OD1 ASN A 75 -0.473 -13.588 -14.805 1.00 0.00 O ATOM 1112 ND2 ASN A 75 0.286 -11.468 -14.865 1.00 0.00 N ATOM 0 H ASN A 75 0.277 -12.153 -10.587 1.00 0.00 H new ATOM 0 HA ASN A 75 -0.105 -14.404 -12.418 1.00 0.00 H new ATOM 0 HB2 ASN A 75 1.691 -12.007 -12.930 1.00 0.00 H new ATOM 0 HB3 ASN A 75 2.069 -13.584 -13.596 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -0.338 -11.204 -15.628 1.00 0.00 H new ATOM 0 HD22 ASN A 75 0.927 -10.781 -14.469 1.00 0.00 H new ATOM 1119 N GLU A 76 2.495 -15.023 -11.736 1.00 0.00 N ATOM 1120 CA GLU A 76 3.576 -15.647 -10.992 1.00 0.00 C ATOM 1121 C GLU A 76 4.805 -14.735 -10.976 1.00 0.00 C ATOM 1122 O GLU A 76 5.911 -15.183 -10.678 1.00 0.00 O ATOM 1123 CB GLU A 76 3.920 -17.020 -11.572 1.00 0.00 C ATOM 1124 CG GLU A 76 2.653 -17.787 -11.954 1.00 0.00 C ATOM 1125 CD GLU A 76 2.962 -18.880 -12.979 1.00 0.00 C ATOM 1126 OE1 GLU A 76 3.437 -19.951 -12.542 1.00 0.00 O ATOM 1127 OE2 GLU A 76 2.715 -18.621 -14.177 1.00 0.00 O ATOM 0 H GLU A 76 2.458 -15.272 -12.724 1.00 0.00 H new ATOM 0 HA GLU A 76 3.245 -15.796 -9.964 1.00 0.00 H new ATOM 0 HB2 GLU A 76 4.555 -16.899 -12.450 1.00 0.00 H new ATOM 0 HB3 GLU A 76 4.491 -17.594 -10.842 1.00 0.00 H new ATOM 0 HG2 GLU A 76 2.211 -18.233 -11.063 1.00 0.00 H new ATOM 0 HG3 GLU A 76 1.916 -17.097 -12.364 1.00 0.00 H new ATOM 1134 N ASP A 77 4.569 -13.472 -11.301 1.00 0.00 N ATOM 1135 CA ASP A 77 5.643 -12.494 -11.328 1.00 0.00 C ATOM 1136 C ASP A 77 5.595 -11.656 -10.049 1.00 0.00 C ATOM 1137 O ASP A 77 6.616 -11.465 -9.389 1.00 0.00 O ATOM 1138 CB ASP A 77 5.495 -11.546 -12.520 1.00 0.00 C ATOM 1139 CG ASP A 77 6.578 -11.681 -13.592 1.00 0.00 C ATOM 1140 OD1 ASP A 77 7.742 -11.362 -13.266 1.00 0.00 O ATOM 1141 OD2 ASP A 77 6.218 -12.100 -14.713 1.00 0.00 O ATOM 0 H ASP A 77 3.650 -13.104 -11.548 1.00 0.00 H new ATOM 0 HA ASP A 77 6.587 -13.032 -11.410 1.00 0.00 H new ATOM 0 HB2 ASP A 77 4.523 -11.718 -12.983 1.00 0.00 H new ATOM 0 HB3 ASP A 77 5.496 -10.520 -12.151 1.00 0.00 H new ATOM 1146 N VAL A 78 4.400 -11.177 -9.737 1.00 0.00 N ATOM 1147 CA VAL A 78 4.205 -10.364 -8.549 1.00 0.00 C ATOM 1148 C VAL A 78 4.731 -11.120 -7.327 1.00 0.00 C ATOM 1149 O VAL A 78 4.530 -12.328 -7.206 1.00 0.00 O ATOM 1150 CB VAL A 78 2.733 -9.970 -8.419 1.00 0.00 C ATOM 1151 CG1 VAL A 78 1.819 -11.092 -8.915 1.00 0.00 C ATOM 1152 CG2 VAL A 78 2.394 -9.582 -6.979 1.00 0.00 C ATOM 0 H VAL A 78 3.556 -11.337 -10.287 1.00 0.00 H new ATOM 0 HA VAL A 78 4.770 -9.435 -8.626 1.00 0.00 H new ATOM 0 HB VAL A 78 2.563 -9.097 -9.049 1.00 0.00 H new ATOM 0 HG11 VAL A 78 0.778 -10.786 -8.811 1.00 0.00 H new ATOM 0 HG12 VAL A 78 2.034 -11.300 -9.963 1.00 0.00 H new ATOM 0 HG13 VAL A 78 1.993 -11.991 -8.324 1.00 0.00 H new ATOM 0 HG21 VAL A 78 1.341 -9.306 -6.915 1.00 0.00 H new ATOM 0 HG22 VAL A 78 2.589 -10.427 -6.319 1.00 0.00 H new ATOM 0 HG23 VAL A 78 3.010 -8.735 -6.676 1.00 0.00 H new ATOM 1162 N THR A 79 5.395 -10.378 -6.452 1.00 0.00 N ATOM 1163 CA THR A 79 5.951 -10.964 -5.244 1.00 0.00 C ATOM 1164 C THR A 79 5.324 -10.324 -4.004 1.00 0.00 C ATOM 1165 O THR A 79 5.730 -10.613 -2.880 1.00 0.00 O ATOM 1166 CB THR A 79 7.473 -10.811 -5.302 1.00 0.00 C ATOM 1167 OG1 THR A 79 7.692 -9.423 -5.068 1.00 0.00 O ATOM 1168 CG2 THR A 79 8.031 -11.045 -6.708 1.00 0.00 C ATOM 0 H THR A 79 5.560 -9.377 -6.556 1.00 0.00 H new ATOM 0 HA THR A 79 5.718 -12.027 -5.176 1.00 0.00 H new ATOM 0 HB THR A 79 7.935 -11.512 -4.606 1.00 0.00 H new ATOM 0 HG1 THR A 79 7.110 -8.896 -5.655 1.00 0.00 H new ATOM 0 HG21 THR A 79 9.114 -10.925 -6.694 1.00 0.00 H new ATOM 0 HG22 THR A 79 7.782 -12.055 -7.035 1.00 0.00 H new ATOM 0 HG23 THR A 79 7.594 -10.323 -7.398 1.00 0.00 H new ATOM 1176 N HIS A 80 4.343 -9.468 -4.251 1.00 0.00 N ATOM 1177 CA HIS A 80 3.656 -8.785 -3.168 1.00 0.00 C ATOM 1178 C HIS A 80 2.254 -8.377 -3.627 1.00 0.00 C ATOM 1179 O HIS A 80 2.075 -7.920 -4.755 1.00 0.00 O ATOM 1180 CB HIS A 80 4.482 -7.602 -2.661 1.00 0.00 C ATOM 1181 CG HIS A 80 5.844 -7.984 -2.135 1.00 0.00 C ATOM 1182 ND1 HIS A 80 6.867 -8.428 -2.955 1.00 0.00 N ATOM 1183 CD2 HIS A 80 6.342 -7.983 -0.865 1.00 0.00 C ATOM 1184 CE1 HIS A 80 7.927 -8.681 -2.202 1.00 0.00 C ATOM 1185 NE2 HIS A 80 7.600 -8.405 -0.907 1.00 0.00 N ATOM 0 H HIS A 80 4.008 -9.232 -5.185 1.00 0.00 H new ATOM 0 HA HIS A 80 3.541 -9.461 -2.321 1.00 0.00 H new ATOM 0 HB2 HIS A 80 4.605 -6.884 -3.472 1.00 0.00 H new ATOM 0 HB3 HIS A 80 3.927 -7.097 -1.870 1.00 0.00 H new ATOM 0 HD1 HIS A 80 6.814 -8.541 -3.967 1.00 0.00 H new ATOM 0 HD2 HIS A 80 5.804 -7.689 0.024 1.00 0.00 H new ATOM 0 HE1 HIS A 80 8.883 -9.042 -2.552 1.00 0.00 H new ATOM 1193 N VAL A 81 1.297 -8.557 -2.729 1.00 0.00 N ATOM 1194 CA VAL A 81 -0.083 -8.214 -3.027 1.00 0.00 C ATOM 1195 C VAL A 81 -0.615 -7.273 -1.944 1.00 0.00 C ATOM 1196 O VAL A 81 -0.833 -7.689 -0.808 1.00 0.00 O ATOM 1197 CB VAL A 81 -0.919 -9.487 -3.177 1.00 0.00 C ATOM 1198 CG1 VAL A 81 -2.349 -9.156 -3.609 1.00 0.00 C ATOM 1199 CG2 VAL A 81 -0.262 -10.462 -4.155 1.00 0.00 C ATOM 0 H VAL A 81 1.450 -8.936 -1.794 1.00 0.00 H new ATOM 0 HA VAL A 81 -0.148 -7.685 -3.978 1.00 0.00 H new ATOM 0 HB VAL A 81 -0.968 -9.973 -2.202 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -2.922 -10.078 -3.708 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -2.817 -8.517 -2.860 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -2.329 -8.637 -4.567 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -0.876 -11.358 -4.243 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -0.168 -9.989 -5.132 1.00 0.00 H new ATOM 0 HG23 VAL A 81 0.727 -10.735 -3.787 1.00 0.00 H new ATOM 1209 N ILE A 82 -0.809 -6.022 -2.336 1.00 0.00 N ATOM 1210 CA ILE A 82 -1.312 -5.019 -1.413 1.00 0.00 C ATOM 1211 C ILE A 82 -2.838 -4.962 -1.509 1.00 0.00 C ATOM 1212 O ILE A 82 -3.383 -4.420 -2.469 1.00 0.00 O ATOM 1213 CB ILE A 82 -0.630 -3.672 -1.661 1.00 0.00 C ATOM 1214 CG1 ILE A 82 0.888 -3.837 -1.765 1.00 0.00 C ATOM 1215 CG2 ILE A 82 -1.024 -2.652 -0.592 1.00 0.00 C ATOM 1216 CD1 ILE A 82 1.580 -3.357 -0.487 1.00 0.00 C ATOM 0 H ILE A 82 -0.627 -5.681 -3.280 1.00 0.00 H new ATOM 0 HA ILE A 82 -1.067 -5.290 -0.386 1.00 0.00 H new ATOM 0 HB ILE A 82 -0.978 -3.284 -2.618 1.00 0.00 H new ATOM 0 HG12 ILE A 82 1.132 -4.884 -1.944 1.00 0.00 H new ATOM 0 HG13 ILE A 82 1.261 -3.272 -2.619 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -0.525 -1.704 -0.792 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -2.104 -2.505 -0.610 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -0.724 -3.019 0.389 1.00 0.00 H new ATOM 0 HD11 ILE A 82 2.658 -3.485 -0.587 1.00 0.00 H new ATOM 0 HD12 ILE A 82 1.353 -2.303 -0.324 1.00 0.00 H new ATOM 0 HD13 ILE A 82 1.222 -3.940 0.361 1.00 0.00 H new ATOM 1228 N VAL A 83 -3.484 -5.529 -0.500 1.00 0.00 N ATOM 1229 CA VAL A 83 -4.936 -5.550 -0.459 1.00 0.00 C ATOM 1230 C VAL A 83 -5.443 -4.255 0.179 1.00 0.00 C ATOM 1231 O VAL A 83 -5.190 -3.998 1.355 1.00 0.00 O ATOM 1232 CB VAL A 83 -5.421 -6.805 0.269 1.00 0.00 C ATOM 1233 CG1 VAL A 83 -6.945 -6.926 0.199 1.00 0.00 C ATOM 1234 CG2 VAL A 83 -4.745 -8.059 -0.289 1.00 0.00 C ATOM 0 H VAL A 83 -3.028 -5.977 0.295 1.00 0.00 H new ATOM 0 HA VAL A 83 -5.346 -5.597 -1.468 1.00 0.00 H new ATOM 0 HB VAL A 83 -5.141 -6.712 1.318 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -7.263 -7.827 0.724 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -7.401 -6.053 0.666 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -7.258 -6.984 -0.844 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -5.108 -8.937 0.246 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -4.980 -8.158 -1.349 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -3.665 -7.977 -0.162 1.00 0.00 H new ATOM 1244 N GLY A 84 -6.149 -3.473 -0.625 1.00 0.00 N ATOM 1245 CA GLY A 84 -6.693 -2.211 -0.154 1.00 0.00 C ATOM 1246 C GLY A 84 -8.135 -2.383 0.330 1.00 0.00 C ATOM 1247 O GLY A 84 -8.520 -1.821 1.354 1.00 0.00 O ATOM 0 H GLY A 84 -6.357 -3.689 -1.600 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -6.076 -1.825 0.658 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -6.660 -1.474 -0.957 1.00 0.00 H new ATOM 1251 N ASP A 85 -8.892 -3.160 -0.430 1.00 0.00 N ATOM 1252 CA ASP A 85 -10.282 -3.412 -0.092 1.00 0.00 C ATOM 1253 C ASP A 85 -10.514 -4.921 0.001 1.00 0.00 C ATOM 1254 O ASP A 85 -11.158 -5.398 0.934 1.00 0.00 O ATOM 1255 CB ASP A 85 -11.219 -2.855 -1.165 1.00 0.00 C ATOM 1256 CG ASP A 85 -12.578 -2.375 -0.651 1.00 0.00 C ATOM 1257 OD1 ASP A 85 -13.268 -3.201 -0.014 1.00 0.00 O ATOM 1258 OD2 ASP A 85 -12.897 -1.194 -0.906 1.00 0.00 O ATOM 0 H ASP A 85 -8.569 -3.624 -1.279 1.00 0.00 H new ATOM 0 HA ASP A 85 -10.492 -2.923 0.859 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -10.722 -2.023 -1.664 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -11.384 -3.626 -1.918 1.00 0.00 H new ATOM 1263 N TYR A 86 -9.978 -5.632 -0.980 1.00 0.00 N ATOM 1264 CA TYR A 86 -10.118 -7.078 -1.021 1.00 0.00 C ATOM 1265 C TYR A 86 -9.285 -7.678 -2.155 1.00 0.00 C ATOM 1266 O TYR A 86 -8.711 -6.948 -2.962 1.00 0.00 O ATOM 1267 CB TYR A 86 -11.599 -7.350 -1.293 1.00 0.00 C ATOM 1268 CG TYR A 86 -12.173 -6.554 -2.467 1.00 0.00 C ATOM 1269 CD1 TYR A 86 -11.715 -6.787 -3.748 1.00 0.00 C ATOM 1270 CD2 TYR A 86 -13.148 -5.603 -2.245 1.00 0.00 C ATOM 1271 CE1 TYR A 86 -12.255 -6.038 -4.853 1.00 0.00 C ATOM 1272 CE2 TYR A 86 -13.688 -4.855 -3.350 1.00 0.00 C ATOM 1273 CZ TYR A 86 -13.215 -5.109 -4.600 1.00 0.00 C ATOM 1274 OH TYR A 86 -13.725 -4.402 -5.643 1.00 0.00 O ATOM 0 H TYR A 86 -9.446 -5.233 -1.753 1.00 0.00 H new ATOM 0 HA TYR A 86 -9.775 -7.523 -0.087 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -11.732 -8.414 -1.489 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -12.171 -7.117 -0.395 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -10.952 -7.531 -3.922 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -13.506 -5.420 -1.243 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -11.905 -6.210 -5.860 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -14.452 -4.108 -3.190 1.00 0.00 H new ATOM 0 HH TYR A 86 -14.403 -3.775 -5.313 1.00 0.00 H new ATOM 1284 N ASP A 87 -9.246 -9.002 -2.181 1.00 0.00 N ATOM 1285 CA ASP A 87 -8.493 -9.709 -3.203 1.00 0.00 C ATOM 1286 C ASP A 87 -9.305 -10.912 -3.688 1.00 0.00 C ATOM 1287 O ASP A 87 -9.221 -11.995 -3.112 1.00 0.00 O ATOM 1288 CB ASP A 87 -7.165 -10.228 -2.649 1.00 0.00 C ATOM 1289 CG ASP A 87 -7.292 -11.277 -1.543 1.00 0.00 C ATOM 1290 OD1 ASP A 87 -8.355 -11.284 -0.886 1.00 0.00 O ATOM 1291 OD2 ASP A 87 -6.322 -12.049 -1.379 1.00 0.00 O ATOM 0 H ASP A 87 -9.724 -9.604 -1.510 1.00 0.00 H new ATOM 0 HA ASP A 87 -8.296 -9.013 -4.018 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -6.588 -10.655 -3.470 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -6.594 -9.383 -2.264 1.00 0.00 H new ATOM 1296 N ASP A 88 -10.072 -10.681 -4.744 1.00 0.00 N ATOM 1297 CA ASP A 88 -10.898 -11.732 -5.313 1.00 0.00 C ATOM 1298 C ASP A 88 -10.139 -12.407 -6.457 1.00 0.00 C ATOM 1299 O ASP A 88 -10.306 -13.602 -6.698 1.00 0.00 O ATOM 1300 CB ASP A 88 -12.200 -11.163 -5.880 1.00 0.00 C ATOM 1301 CG ASP A 88 -13.101 -10.467 -4.858 1.00 0.00 C ATOM 1302 OD1 ASP A 88 -13.043 -10.877 -3.678 1.00 0.00 O ATOM 1303 OD2 ASP A 88 -13.828 -9.542 -5.279 1.00 0.00 O ATOM 0 H ASP A 88 -10.138 -9.781 -5.220 1.00 0.00 H new ATOM 0 HA ASP A 88 -11.131 -12.444 -4.522 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -11.955 -10.452 -6.669 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -12.761 -11.974 -6.344 1.00 0.00 H new ATOM 1308 N GLU A 89 -9.322 -11.613 -7.133 1.00 0.00 N ATOM 1309 CA GLU A 89 -8.537 -12.119 -8.246 1.00 0.00 C ATOM 1310 C GLU A 89 -7.479 -13.104 -7.745 1.00 0.00 C ATOM 1311 O GLU A 89 -7.319 -14.187 -8.305 1.00 0.00 O ATOM 1312 CB GLU A 89 -7.893 -10.973 -9.029 1.00 0.00 C ATOM 1313 CG GLU A 89 -6.528 -11.386 -9.583 1.00 0.00 C ATOM 1314 CD GLU A 89 -6.646 -12.642 -10.450 1.00 0.00 C ATOM 1315 OE1 GLU A 89 -7.586 -12.677 -11.273 1.00 0.00 O ATOM 1316 OE2 GLU A 89 -5.794 -13.538 -10.269 1.00 0.00 O ATOM 0 H GLU A 89 -9.187 -10.622 -6.931 1.00 0.00 H new ATOM 0 HA GLU A 89 -9.205 -12.648 -8.925 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -8.547 -10.675 -9.849 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -7.779 -10.104 -8.381 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -6.109 -10.571 -10.173 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -5.838 -11.571 -8.760 1.00 0.00 H new ATOM 1323 N LEU A 90 -6.782 -12.691 -6.696 1.00 0.00 N ATOM 1324 CA LEU A 90 -5.744 -13.523 -6.113 1.00 0.00 C ATOM 1325 C LEU A 90 -6.258 -14.959 -5.984 1.00 0.00 C ATOM 1326 O LEU A 90 -5.589 -15.902 -6.404 1.00 0.00 O ATOM 1327 CB LEU A 90 -5.255 -12.925 -4.792 1.00 0.00 C ATOM 1328 CG LEU A 90 -3.769 -13.111 -4.481 1.00 0.00 C ATOM 1329 CD1 LEU A 90 -3.262 -12.008 -3.549 1.00 0.00 C ATOM 1330 CD2 LEU A 90 -3.498 -14.507 -3.916 1.00 0.00 C ATOM 0 H LEU A 90 -6.916 -11.791 -6.235 1.00 0.00 H new ATOM 0 HA LEU A 90 -4.871 -13.553 -6.765 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -5.474 -11.857 -4.796 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -5.834 -13.366 -3.980 1.00 0.00 H new ATOM 0 HG LEU A 90 -3.211 -13.027 -5.414 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -2.203 -12.164 -3.344 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -3.401 -11.037 -4.025 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -3.821 -12.037 -2.614 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -2.434 -14.613 -3.703 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -4.067 -14.644 -2.997 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -3.799 -15.259 -4.645 1.00 0.00 H new ATOM 1342 N LYS A 91 -7.442 -15.079 -5.402 1.00 0.00 N ATOM 1343 CA LYS A 91 -8.054 -16.383 -5.213 1.00 0.00 C ATOM 1344 C LYS A 91 -8.058 -17.138 -6.544 1.00 0.00 C ATOM 1345 O LYS A 91 -7.851 -18.350 -6.575 1.00 0.00 O ATOM 1346 CB LYS A 91 -9.441 -16.238 -4.585 1.00 0.00 C ATOM 1347 CG LYS A 91 -9.337 -15.946 -3.087 1.00 0.00 C ATOM 1348 CD LYS A 91 -10.713 -15.642 -2.490 1.00 0.00 C ATOM 1349 CE LYS A 91 -10.585 -15.106 -1.063 1.00 0.00 C ATOM 1350 NZ LYS A 91 -11.614 -15.712 -0.188 1.00 0.00 N ATOM 0 H LYS A 91 -7.994 -14.294 -5.055 1.00 0.00 H new ATOM 0 HA LYS A 91 -7.471 -16.978 -4.510 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -9.985 -15.433 -5.079 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -10.013 -17.153 -4.742 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -8.896 -16.802 -2.576 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -8.671 -15.099 -2.923 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -11.230 -14.911 -3.112 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -11.321 -16.547 -2.489 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -9.591 -15.327 -0.673 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -10.693 -14.021 -1.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -11.513 -15.338 0.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -12.560 -15.480 -0.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -11.493 -16.745 -0.173 1.00 0.00 H new ATOM 1364 N GLN A 92 -8.295 -16.390 -7.612 1.00 0.00 N ATOM 1365 CA GLN A 92 -8.328 -16.973 -8.942 1.00 0.00 C ATOM 1366 C GLN A 92 -6.938 -17.478 -9.335 1.00 0.00 C ATOM 1367 O GLN A 92 -6.802 -18.576 -9.873 1.00 0.00 O ATOM 1368 CB GLN A 92 -8.856 -15.968 -9.968 1.00 0.00 C ATOM 1369 CG GLN A 92 -10.209 -15.400 -9.533 1.00 0.00 C ATOM 1370 CD GLN A 92 -11.303 -15.759 -10.540 1.00 0.00 C ATOM 1371 OE1 GLN A 92 -11.887 -14.908 -11.191 1.00 0.00 O ATOM 1372 NE2 GLN A 92 -11.548 -17.063 -10.632 1.00 0.00 N ATOM 0 H GLN A 92 -8.466 -15.385 -7.583 1.00 0.00 H new ATOM 0 HA GLN A 92 -9.011 -17.822 -8.928 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -8.139 -15.156 -10.090 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -8.956 -16.453 -10.939 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -10.472 -15.790 -8.550 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -10.139 -14.316 -9.437 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -11.023 -17.722 -10.058 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -12.261 -17.404 -11.277 1.00 0.00 H new ATOM 1381 N PHE A 93 -5.941 -16.653 -9.051 1.00 0.00 N ATOM 1382 CA PHE A 93 -4.567 -17.003 -9.368 1.00 0.00 C ATOM 1383 C PHE A 93 -4.105 -18.208 -8.546 1.00 0.00 C ATOM 1384 O PHE A 93 -3.098 -18.836 -8.871 1.00 0.00 O ATOM 1385 CB PHE A 93 -3.703 -15.793 -9.007 1.00 0.00 C ATOM 1386 CG PHE A 93 -2.198 -16.054 -9.096 1.00 0.00 C ATOM 1387 CD1 PHE A 93 -1.625 -16.329 -10.298 1.00 0.00 C ATOM 1388 CD2 PHE A 93 -1.433 -16.011 -7.972 1.00 0.00 C ATOM 1389 CE1 PHE A 93 -0.229 -16.571 -10.380 1.00 0.00 C ATOM 1390 CE2 PHE A 93 -0.037 -16.254 -8.054 1.00 0.00 C ATOM 1391 CZ PHE A 93 0.536 -16.529 -9.257 1.00 0.00 C ATOM 0 H PHE A 93 -6.057 -15.743 -8.605 1.00 0.00 H new ATOM 0 HA PHE A 93 -4.483 -17.263 -10.423 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -3.958 -14.967 -9.671 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -3.947 -15.475 -7.993 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -2.232 -16.363 -11.190 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -1.888 -15.792 -7.017 1.00 0.00 H new ATOM 0 HE1 PHE A 93 0.226 -16.789 -11.335 1.00 0.00 H new ATOM 0 HE2 PHE A 93 0.570 -16.221 -7.162 1.00 0.00 H new ATOM 0 HZ PHE A 93 1.598 -16.714 -9.320 1.00 0.00 H new ATOM 1401 N TRP A 94 -4.862 -18.495 -7.498 1.00 0.00 N ATOM 1402 CA TRP A 94 -4.543 -19.613 -6.627 1.00 0.00 C ATOM 1403 C TRP A 94 -5.030 -20.895 -7.306 1.00 0.00 C ATOM 1404 O TRP A 94 -4.686 -21.997 -6.881 1.00 0.00 O ATOM 1405 CB TRP A 94 -5.140 -19.412 -5.233 1.00 0.00 C ATOM 1406 CG TRP A 94 -4.316 -18.492 -4.330 1.00 0.00 C ATOM 1407 CD1 TRP A 94 -3.008 -18.211 -4.413 1.00 0.00 C ATOM 1408 CD2 TRP A 94 -4.800 -17.740 -3.198 1.00 0.00 C ATOM 1409 NE1 TRP A 94 -2.615 -17.336 -3.420 1.00 0.00 N ATOM 1410 CE2 TRP A 94 -3.740 -17.040 -2.658 1.00 0.00 C ATOM 1411 CE3 TRP A 94 -6.091 -17.653 -2.647 1.00 0.00 C ATOM 1412 CZ2 TRP A 94 -3.861 -16.205 -1.541 1.00 0.00 C ATOM 1413 CZ3 TRP A 94 -6.196 -16.814 -1.532 1.00 0.00 C ATOM 1414 CH2 TRP A 94 -5.138 -16.103 -0.976 1.00 0.00 C ATOM 0 H TRP A 94 -5.696 -17.972 -7.232 1.00 0.00 H new ATOM 0 HA TRP A 94 -3.466 -19.686 -6.474 1.00 0.00 H new ATOM 0 HB2 TRP A 94 -6.144 -19.000 -5.335 1.00 0.00 H new ATOM 0 HB3 TRP A 94 -5.242 -20.383 -4.749 1.00 0.00 H new ATOM 0 HD1 TRP A 94 -2.345 -18.618 -5.162 1.00 0.00 H new ATOM 0 HE1 TRP A 94 -1.673 -16.973 -3.272 1.00 0.00 H new ATOM 0 HE3 TRP A 94 -6.935 -18.191 -3.052 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 -3.015 -15.669 -1.137 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 -7.167 -16.711 -1.071 1.00 0.00 H new ATOM 0 HH2 TRP A 94 -5.301 -15.475 -0.112 1.00 0.00 H new ATOM 1425 N ASN A 95 -5.823 -20.709 -8.351 1.00 0.00 N ATOM 1426 CA ASN A 95 -6.360 -21.836 -9.093 1.00 0.00 C ATOM 1427 C ASN A 95 -5.832 -21.795 -10.529 1.00 0.00 C ATOM 1428 O ASN A 95 -6.311 -22.530 -11.391 1.00 0.00 O ATOM 1429 CB ASN A 95 -7.888 -21.780 -9.150 1.00 0.00 C ATOM 1430 CG ASN A 95 -8.485 -23.185 -9.255 1.00 0.00 C ATOM 1431 OD1 ASN A 95 -8.125 -23.978 -10.109 1.00 0.00 O ATOM 1432 ND2 ASN A 95 -9.415 -23.447 -8.341 1.00 0.00 N ATOM 0 H ASN A 95 -6.106 -19.794 -8.701 1.00 0.00 H new ATOM 0 HA ASN A 95 -6.051 -22.750 -8.587 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -8.271 -21.284 -8.258 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -8.202 -21.183 -10.006 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -9.874 -24.358 -8.327 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -9.669 -22.737 -7.654 1.00 0.00 H new ATOM 1439 N LYS A 96 -4.853 -20.928 -10.740 1.00 0.00 N ATOM 1440 CA LYS A 96 -4.254 -20.782 -12.056 1.00 0.00 C ATOM 1441 C LYS A 96 -2.822 -21.318 -12.023 1.00 0.00 C ATOM 1442 O LYS A 96 -2.557 -22.420 -12.501 1.00 0.00 O ATOM 1443 CB LYS A 96 -4.357 -19.332 -12.533 1.00 0.00 C ATOM 1444 CG LYS A 96 -5.814 -18.942 -12.793 1.00 0.00 C ATOM 1445 CD LYS A 96 -6.025 -18.557 -14.258 1.00 0.00 C ATOM 1446 CE LYS A 96 -7.466 -18.104 -14.504 1.00 0.00 C ATOM 1447 NZ LYS A 96 -7.659 -16.713 -14.035 1.00 0.00 N ATOM 0 H LYS A 96 -4.460 -20.320 -10.022 1.00 0.00 H new ATOM 0 HA LYS A 96 -4.799 -21.375 -12.790 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -3.927 -18.668 -11.783 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -3.774 -19.203 -13.445 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -6.469 -19.774 -12.534 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -6.091 -18.106 -12.150 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -5.337 -17.757 -14.530 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -5.793 -19.408 -14.898 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -7.698 -18.171 -15.567 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -8.156 -18.768 -13.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -8.642 -16.421 -14.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -7.457 -16.659 -13.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -7.014 -16.080 -14.550 1.00 0.00 H new ATOM 1461 N SER A 97 -1.936 -20.514 -11.454 1.00 0.00 N ATOM 1462 CA SER A 97 -0.537 -20.894 -11.352 1.00 0.00 C ATOM 1463 C SER A 97 -0.198 -21.259 -9.906 1.00 0.00 C ATOM 1464 O SER A 97 -0.900 -20.856 -8.979 1.00 0.00 O ATOM 1465 CB SER A 97 0.377 -19.770 -11.844 1.00 0.00 C ATOM 1466 OG SER A 97 0.304 -19.603 -13.258 1.00 0.00 O ATOM 0 H SER A 97 -2.160 -19.601 -11.059 1.00 0.00 H new ATOM 0 HA SER A 97 -0.372 -21.764 -11.988 1.00 0.00 H new ATOM 0 HB2 SER A 97 0.100 -18.837 -11.354 1.00 0.00 H new ATOM 0 HB3 SER A 97 1.406 -19.988 -11.557 1.00 0.00 H new ATOM 0 HG SER A 97 0.346 -18.649 -13.477 1.00 0.00 H new ATOM 1472 N ALA A 98 0.878 -22.018 -9.757 1.00 0.00 N ATOM 1473 CA ALA A 98 1.319 -22.441 -8.439 1.00 0.00 C ATOM 1474 C ALA A 98 2.218 -21.360 -7.835 1.00 0.00 C ATOM 1475 O ALA A 98 3.413 -21.312 -8.119 1.00 0.00 O ATOM 1476 CB ALA A 98 2.026 -23.794 -8.547 1.00 0.00 C ATOM 0 H ALA A 98 1.457 -22.351 -10.528 1.00 0.00 H new ATOM 0 HA ALA A 98 0.466 -22.571 -7.772 1.00 0.00 H new ATOM 0 HB1 ALA A 98 2.357 -24.112 -7.558 1.00 0.00 H new ATOM 0 HB2 ALA A 98 1.336 -24.534 -8.954 1.00 0.00 H new ATOM 0 HB3 ALA A 98 2.889 -23.702 -9.206 1.00 0.00 H new ATOM 1482 N HIS A 99 1.607 -20.520 -7.012 1.00 0.00 N ATOM 1483 CA HIS A 99 2.337 -19.443 -6.365 1.00 0.00 C ATOM 1484 C HIS A 99 1.413 -18.709 -5.392 1.00 0.00 C ATOM 1485 O HIS A 99 0.298 -18.334 -5.752 1.00 0.00 O ATOM 1486 CB HIS A 99 2.965 -18.512 -7.404 1.00 0.00 C ATOM 1487 CG HIS A 99 3.669 -17.315 -6.810 1.00 0.00 C ATOM 1488 ND1 HIS A 99 4.833 -17.422 -6.069 1.00 0.00 N ATOM 1489 CD2 HIS A 99 3.363 -15.987 -6.857 1.00 0.00 C ATOM 1490 CE1 HIS A 99 5.201 -16.207 -5.691 1.00 0.00 C ATOM 1491 NE2 HIS A 99 4.289 -15.319 -6.179 1.00 0.00 N ATOM 0 H HIS A 99 0.615 -20.564 -6.779 1.00 0.00 H new ATOM 0 HA HIS A 99 3.163 -19.855 -5.786 1.00 0.00 H new ATOM 0 HB2 HIS A 99 3.678 -19.080 -8.002 1.00 0.00 H new ATOM 0 HB3 HIS A 99 2.186 -18.163 -8.082 1.00 0.00 H new ATOM 0 HD2 HIS A 99 2.512 -15.552 -7.360 1.00 0.00 H new ATOM 0 HE1 HIS A 99 6.071 -15.963 -5.100 1.00 0.00 H new ATOM 0 HE2 HIS A 99 4.314 -14.308 -6.045 1.00 0.00 H new ATOM 1499 N ARG A 100 1.910 -18.524 -4.178 1.00 0.00 N ATOM 1500 CA ARG A 100 1.143 -17.841 -3.151 1.00 0.00 C ATOM 1501 C ARG A 100 1.873 -16.576 -2.696 1.00 0.00 C ATOM 1502 O ARG A 100 2.730 -16.633 -1.815 1.00 0.00 O ATOM 1503 CB ARG A 100 0.909 -18.750 -1.942 1.00 0.00 C ATOM 1504 CG ARG A 100 0.092 -18.032 -0.866 1.00 0.00 C ATOM 1505 CD ARG A 100 -1.065 -18.909 -0.381 1.00 0.00 C ATOM 1506 NE ARG A 100 -1.608 -18.373 0.887 1.00 0.00 N ATOM 1507 CZ ARG A 100 -2.785 -18.736 1.413 1.00 0.00 C ATOM 1508 NH1 ARG A 100 -3.550 -19.639 0.784 1.00 0.00 N ATOM 1509 NH2 ARG A 100 -3.198 -18.197 2.569 1.00 0.00 N ATOM 0 H ARG A 100 2.835 -18.836 -3.883 1.00 0.00 H new ATOM 0 HA ARG A 100 0.178 -17.573 -3.581 1.00 0.00 H new ATOM 0 HB2 ARG A 100 0.387 -19.653 -2.257 1.00 0.00 H new ATOM 0 HB3 ARG A 100 1.867 -19.064 -1.527 1.00 0.00 H new ATOM 0 HG2 ARG A 100 0.736 -17.776 -0.025 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -0.299 -17.096 -1.265 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -1.849 -18.942 -1.137 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -0.720 -19.933 -0.235 1.00 0.00 H new ATOM 0 HE ARG A 100 -1.051 -17.684 1.392 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -3.236 -20.050 -0.095 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -4.446 -19.916 1.185 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -2.616 -17.510 3.048 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -4.094 -18.474 2.969 1.00 0.00 H new ATOM 1523 N PRO A 101 1.498 -15.435 -3.333 1.00 0.00 N ATOM 1524 CA PRO A 101 2.108 -14.158 -3.003 1.00 0.00 C ATOM 1525 C PRO A 101 1.580 -13.627 -1.668 1.00 0.00 C ATOM 1526 O PRO A 101 0.486 -13.993 -1.239 1.00 0.00 O ATOM 1527 CB PRO A 101 1.777 -13.249 -4.175 1.00 0.00 C ATOM 1528 CG PRO A 101 0.610 -13.905 -4.895 1.00 0.00 C ATOM 1529 CD PRO A 101 0.487 -15.330 -4.381 1.00 0.00 C ATOM 0 HA PRO A 101 3.187 -14.231 -2.865 1.00 0.00 H new ATOM 0 HB2 PRO A 101 1.511 -12.249 -3.831 1.00 0.00 H new ATOM 0 HB3 PRO A 101 2.634 -13.140 -4.839 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -0.311 -13.352 -4.711 1.00 0.00 H new ATOM 0 HG3 PRO A 101 0.775 -13.901 -5.972 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -0.511 -15.525 -3.989 1.00 0.00 H new ATOM 0 HD3 PRO A 101 0.664 -16.054 -5.176 1.00 0.00 H new ATOM 1537 N HIS A 102 2.382 -12.774 -1.048 1.00 0.00 N ATOM 1538 CA HIS A 102 2.010 -12.190 0.229 1.00 0.00 C ATOM 1539 C HIS A 102 0.734 -11.361 0.062 1.00 0.00 C ATOM 1540 O HIS A 102 0.427 -10.903 -1.038 1.00 0.00 O ATOM 1541 CB HIS A 102 3.169 -11.381 0.815 1.00 0.00 C ATOM 1542 CG HIS A 102 3.115 -9.907 0.492 1.00 0.00 C ATOM 1543 ND1 HIS A 102 2.016 -9.117 0.780 1.00 0.00 N ATOM 1544 CD2 HIS A 102 4.035 -9.089 -0.095 1.00 0.00 C ATOM 1545 CE1 HIS A 102 2.274 -7.880 0.379 1.00 0.00 C ATOM 1546 NE2 HIS A 102 3.525 -7.865 -0.163 1.00 0.00 N ATOM 0 H HIS A 102 3.288 -12.473 -1.407 1.00 0.00 H new ATOM 0 HA HIS A 102 1.797 -12.982 0.947 1.00 0.00 H new ATOM 0 HB2 HIS A 102 3.174 -11.505 1.898 1.00 0.00 H new ATOM 0 HB3 HIS A 102 4.108 -11.790 0.443 1.00 0.00 H new ATOM 0 HD2 HIS A 102 5.012 -9.386 -0.445 1.00 0.00 H new ATOM 0 HE1 HIS A 102 1.610 -7.033 0.466 1.00 0.00 H new ATOM 0 HE2 HIS A 102 3.992 -7.048 -0.556 1.00 0.00 H new ATOM 1554 N VAL A 103 0.026 -11.194 1.169 1.00 0.00 N ATOM 1555 CA VAL A 103 -1.209 -10.429 1.159 1.00 0.00 C ATOM 1556 C VAL A 103 -1.232 -9.490 2.366 1.00 0.00 C ATOM 1557 O VAL A 103 -1.619 -9.891 3.463 1.00 0.00 O ATOM 1558 CB VAL A 103 -2.410 -11.375 1.115 1.00 0.00 C ATOM 1559 CG1 VAL A 103 -3.708 -10.603 0.872 1.00 0.00 C ATOM 1560 CG2 VAL A 103 -2.213 -12.463 0.058 1.00 0.00 C ATOM 0 H VAL A 103 0.284 -11.575 2.079 1.00 0.00 H new ATOM 0 HA VAL A 103 -1.267 -9.810 0.264 1.00 0.00 H new ATOM 0 HB VAL A 103 -2.487 -11.863 2.087 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -4.546 -11.299 0.845 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -3.860 -9.884 1.677 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -3.645 -10.075 -0.079 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -3.081 -13.122 0.048 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -2.096 -12.001 -0.922 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -1.321 -13.043 0.294 1.00 0.00 H new ATOM 1570 N VAL A 104 -0.811 -8.257 2.124 1.00 0.00 N ATOM 1571 CA VAL A 104 -0.778 -7.257 3.178 1.00 0.00 C ATOM 1572 C VAL A 104 -1.547 -6.015 2.722 1.00 0.00 C ATOM 1573 O VAL A 104 -2.045 -5.968 1.598 1.00 0.00 O ATOM 1574 CB VAL A 104 0.670 -6.954 3.567 1.00 0.00 C ATOM 1575 CG1 VAL A 104 1.479 -8.244 3.716 1.00 0.00 C ATOM 1576 CG2 VAL A 104 1.323 -6.010 2.555 1.00 0.00 C ATOM 0 H VAL A 104 -0.490 -7.928 1.214 1.00 0.00 H new ATOM 0 HA VAL A 104 -1.270 -7.632 4.075 1.00 0.00 H new ATOM 0 HB VAL A 104 0.660 -6.452 4.535 1.00 0.00 H new ATOM 0 HG11 VAL A 104 2.505 -8.000 3.993 1.00 0.00 H new ATOM 0 HG12 VAL A 104 1.032 -8.866 4.491 1.00 0.00 H new ATOM 0 HG13 VAL A 104 1.478 -8.786 2.770 1.00 0.00 H new ATOM 0 HG21 VAL A 104 2.352 -5.811 2.855 1.00 0.00 H new ATOM 0 HG22 VAL A 104 1.316 -6.473 1.568 1.00 0.00 H new ATOM 0 HG23 VAL A 104 0.767 -5.073 2.520 1.00 0.00 H new ATOM 1586 N GLY A 105 -1.619 -5.041 3.617 1.00 0.00 N ATOM 1587 CA GLY A 105 -2.319 -3.802 3.320 1.00 0.00 C ATOM 1588 C GLY A 105 -1.345 -2.723 2.843 1.00 0.00 C ATOM 1589 O GLY A 105 -0.133 -2.864 2.998 1.00 0.00 O ATOM 0 H GLY A 105 -1.204 -5.084 4.548 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -3.073 -3.981 2.553 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -2.845 -3.455 4.209 1.00 0.00 H new ATOM 1593 N ALA A 106 -1.912 -1.670 2.273 1.00 0.00 N ATOM 1594 CA ALA A 106 -1.108 -0.567 1.773 1.00 0.00 C ATOM 1595 C ALA A 106 -0.269 0.006 2.916 1.00 0.00 C ATOM 1596 O ALA A 106 0.871 0.420 2.708 1.00 0.00 O ATOM 1597 CB ALA A 106 -2.022 0.483 1.137 1.00 0.00 C ATOM 0 H ALA A 106 -2.918 -1.557 2.146 1.00 0.00 H new ATOM 0 HA ALA A 106 -0.420 -0.912 1.001 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -1.420 1.310 0.762 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -2.574 0.033 0.312 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -2.724 0.855 1.884 1.00 0.00 H new ATOM 1603 N LYS A 107 -0.864 0.013 4.100 1.00 0.00 N ATOM 1604 CA LYS A 107 -0.186 0.528 5.276 1.00 0.00 C ATOM 1605 C LYS A 107 1.287 0.116 5.232 1.00 0.00 C ATOM 1606 O LYS A 107 2.174 0.945 5.432 1.00 0.00 O ATOM 1607 CB LYS A 107 -0.910 0.086 6.550 1.00 0.00 C ATOM 1608 CG LYS A 107 -0.694 1.094 7.681 1.00 0.00 C ATOM 1609 CD LYS A 107 -1.674 0.846 8.830 1.00 0.00 C ATOM 1610 CE LYS A 107 -0.988 1.031 10.185 1.00 0.00 C ATOM 1611 NZ LYS A 107 -1.876 0.582 11.280 1.00 0.00 N ATOM 0 H LYS A 107 -1.809 -0.330 4.269 1.00 0.00 H new ATOM 0 HA LYS A 107 -0.213 1.618 5.284 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -1.976 -0.018 6.349 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -0.547 -0.895 6.858 1.00 0.00 H new ATOM 0 HG2 LYS A 107 0.329 1.020 8.049 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -0.823 2.107 7.300 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -2.517 1.532 8.748 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -2.077 -0.164 8.757 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -0.057 0.465 10.208 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -0.727 2.080 10.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -1.396 0.714 12.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -2.753 1.140 11.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -2.104 -0.425 11.151 1.00 0.00 H new ATOM 1625 N TRP A 108 1.502 -1.165 4.969 1.00 0.00 N ATOM 1626 CA TRP A 108 2.852 -1.697 4.896 1.00 0.00 C ATOM 1627 C TRP A 108 3.640 -0.851 3.893 1.00 0.00 C ATOM 1628 O TRP A 108 4.610 -0.189 4.261 1.00 0.00 O ATOM 1629 CB TRP A 108 2.837 -3.185 4.541 1.00 0.00 C ATOM 1630 CG TRP A 108 4.212 -3.755 4.187 1.00 0.00 C ATOM 1631 CD1 TRP A 108 5.131 -4.266 5.017 1.00 0.00 C ATOM 1632 CD2 TRP A 108 4.788 -3.852 2.867 1.00 0.00 C ATOM 1633 NE1 TRP A 108 6.254 -4.684 4.332 1.00 0.00 N ATOM 1634 CE2 TRP A 108 6.039 -4.424 2.983 1.00 0.00 C ATOM 1635 CE3 TRP A 108 4.271 -3.469 1.618 1.00 0.00 C ATOM 1636 CZ2 TRP A 108 6.877 -4.664 1.887 1.00 0.00 C ATOM 1637 CZ3 TRP A 108 5.120 -3.716 0.532 1.00 0.00 C ATOM 1638 CH2 TRP A 108 6.382 -4.291 0.632 1.00 0.00 C ATOM 0 H TRP A 108 0.764 -1.850 4.804 1.00 0.00 H new ATOM 0 HA TRP A 108 3.344 -1.635 5.867 1.00 0.00 H new ATOM 0 HB2 TRP A 108 2.429 -3.745 5.383 1.00 0.00 H new ATOM 0 HB3 TRP A 108 2.163 -3.340 3.698 1.00 0.00 H new ATOM 0 HD1 TRP A 108 5.009 -4.341 6.087 1.00 0.00 H new ATOM 0 HE1 TRP A 108 7.088 -5.106 4.740 1.00 0.00 H new ATOM 0 HE3 TRP A 108 3.296 -3.019 1.504 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 7.852 -5.113 2.004 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 4.770 -3.441 -0.452 1.00 0.00 H new ATOM 0 HH2 TRP A 108 6.978 -4.449 -0.255 1.00 0.00 H new ATOM 1649 N LEU A 109 3.195 -0.901 2.646 1.00 0.00 N ATOM 1650 CA LEU A 109 3.846 -0.148 1.588 1.00 0.00 C ATOM 1651 C LEU A 109 4.240 1.232 2.118 1.00 0.00 C ATOM 1652 O LEU A 109 5.363 1.686 1.905 1.00 0.00 O ATOM 1653 CB LEU A 109 2.960 -0.099 0.342 1.00 0.00 C ATOM 1654 CG LEU A 109 3.566 -0.684 -0.935 1.00 0.00 C ATOM 1655 CD1 LEU A 109 2.827 -0.176 -2.175 1.00 0.00 C ATOM 1656 CD2 LEU A 109 5.068 -0.403 -1.008 1.00 0.00 C ATOM 0 H LEU A 109 2.391 -1.452 2.345 1.00 0.00 H new ATOM 0 HA LEU A 109 4.765 -0.644 1.277 1.00 0.00 H new ATOM 0 HB2 LEU A 109 2.034 -0.631 0.558 1.00 0.00 H new ATOM 0 HB3 LEU A 109 2.693 0.940 0.151 1.00 0.00 H new ATOM 0 HG LEU A 109 3.442 -1.767 -0.907 1.00 0.00 H new ATOM 0 HD11 LEU A 109 3.278 -0.607 -3.069 1.00 0.00 H new ATOM 0 HD12 LEU A 109 1.779 -0.469 -2.119 1.00 0.00 H new ATOM 0 HD13 LEU A 109 2.898 0.911 -2.221 1.00 0.00 H new ATOM 0 HD21 LEU A 109 5.474 -0.830 -1.925 1.00 0.00 H new ATOM 0 HD22 LEU A 109 5.237 0.674 -1.003 1.00 0.00 H new ATOM 0 HD23 LEU A 109 5.565 -0.853 -0.148 1.00 0.00 H new ATOM 1668 N LEU A 110 3.293 1.861 2.799 1.00 0.00 N ATOM 1669 CA LEU A 110 3.526 3.181 3.361 1.00 0.00 C ATOM 1670 C LEU A 110 4.725 3.121 4.309 1.00 0.00 C ATOM 1671 O LEU A 110 5.716 3.822 4.108 1.00 0.00 O ATOM 1672 CB LEU A 110 2.251 3.718 4.014 1.00 0.00 C ATOM 1673 CG LEU A 110 0.998 3.722 3.136 1.00 0.00 C ATOM 1674 CD1 LEU A 110 -0.258 3.972 3.974 1.00 0.00 C ATOM 1675 CD2 LEU A 110 1.134 4.730 1.993 1.00 0.00 C ATOM 0 H LEU A 110 2.363 1.481 2.974 1.00 0.00 H new ATOM 0 HA LEU A 110 3.776 3.892 2.574 1.00 0.00 H new ATOM 0 HB2 LEU A 110 2.045 3.124 4.904 1.00 0.00 H new ATOM 0 HB3 LEU A 110 2.440 4.738 4.348 1.00 0.00 H new ATOM 0 HG LEU A 110 0.893 2.735 2.685 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -1.134 3.970 3.326 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -0.358 3.186 4.722 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -0.177 4.938 4.471 1.00 0.00 H new ATOM 0 HD21 LEU A 110 0.230 4.713 1.384 1.00 0.00 H new ATOM 0 HD22 LEU A 110 1.276 5.729 2.404 1.00 0.00 H new ATOM 0 HD23 LEU A 110 1.993 4.466 1.376 1.00 0.00 H new ATOM 1687 N GLU A 111 4.596 2.278 5.323 1.00 0.00 N ATOM 1688 CA GLU A 111 5.656 2.118 6.304 1.00 0.00 C ATOM 1689 C GLU A 111 6.991 1.859 5.603 1.00 0.00 C ATOM 1690 O GLU A 111 8.041 2.283 6.084 1.00 0.00 O ATOM 1691 CB GLU A 111 5.327 0.996 7.290 1.00 0.00 C ATOM 1692 CG GLU A 111 3.968 1.230 7.953 1.00 0.00 C ATOM 1693 CD GLU A 111 4.122 1.435 9.462 1.00 0.00 C ATOM 1694 OE1 GLU A 111 5.185 1.961 9.857 1.00 0.00 O ATOM 1695 OE2 GLU A 111 3.174 1.060 10.185 1.00 0.00 O ATOM 0 H GLU A 111 3.773 1.698 5.487 1.00 0.00 H new ATOM 0 HA GLU A 111 5.740 3.043 6.874 1.00 0.00 H new ATOM 0 HB2 GLU A 111 5.321 0.039 6.769 1.00 0.00 H new ATOM 0 HB3 GLU A 111 6.103 0.939 8.053 1.00 0.00 H new ATOM 0 HG2 GLU A 111 3.489 2.104 7.511 1.00 0.00 H new ATOM 0 HG3 GLU A 111 3.315 0.378 7.763 1.00 0.00 H new ATOM 1702 N CYS A 112 6.908 1.163 4.479 1.00 0.00 N ATOM 1703 CA CYS A 112 8.097 0.841 3.707 1.00 0.00 C ATOM 1704 C CYS A 112 8.709 2.149 3.202 1.00 0.00 C ATOM 1705 O CYS A 112 9.870 2.444 3.482 1.00 0.00 O ATOM 1706 CB CYS A 112 7.784 -0.123 2.562 1.00 0.00 C ATOM 1707 SG CYS A 112 6.859 -1.569 3.196 1.00 0.00 S ATOM 0 H CYS A 112 6.035 0.813 4.084 1.00 0.00 H new ATOM 0 HA CYS A 112 8.818 0.325 4.341 1.00 0.00 H new ATOM 0 HB2 CYS A 112 7.199 0.386 1.797 1.00 0.00 H new ATOM 0 HB3 CYS A 112 8.709 -0.452 2.089 1.00 0.00 H new ATOM 0 HG CYS A 112 7.015 -2.573 2.385 1.00 0.00 H new ATOM 1713 N PHE A 113 7.902 2.897 2.465 1.00 0.00 N ATOM 1714 CA PHE A 113 8.350 4.167 1.918 1.00 0.00 C ATOM 1715 C PHE A 113 8.541 5.205 3.025 1.00 0.00 C ATOM 1716 O PHE A 113 9.129 6.261 2.797 1.00 0.00 O ATOM 1717 CB PHE A 113 7.258 4.652 0.963 1.00 0.00 C ATOM 1718 CG PHE A 113 7.247 3.934 -0.388 1.00 0.00 C ATOM 1719 CD1 PHE A 113 8.227 4.182 -1.298 1.00 0.00 C ATOM 1720 CD2 PHE A 113 6.259 3.046 -0.679 1.00 0.00 C ATOM 1721 CE1 PHE A 113 8.217 3.515 -2.552 1.00 0.00 C ATOM 1722 CE2 PHE A 113 6.249 2.379 -1.932 1.00 0.00 C ATOM 1723 CZ PHE A 113 7.228 2.628 -2.842 1.00 0.00 C ATOM 0 H PHE A 113 6.940 2.648 2.233 1.00 0.00 H new ATOM 0 HA PHE A 113 9.306 4.037 1.411 1.00 0.00 H new ATOM 0 HB2 PHE A 113 6.287 4.520 1.441 1.00 0.00 H new ATOM 0 HB3 PHE A 113 7.387 5.721 0.793 1.00 0.00 H new ATOM 0 HD1 PHE A 113 9.013 4.886 -1.067 1.00 0.00 H new ATOM 0 HD2 PHE A 113 5.481 2.848 0.044 1.00 0.00 H new ATOM 0 HE1 PHE A 113 8.995 3.712 -3.275 1.00 0.00 H new ATOM 0 HE2 PHE A 113 5.464 1.674 -2.162 1.00 0.00 H new ATOM 0 HZ PHE A 113 7.220 2.121 -3.796 1.00 0.00 H new ATOM 1733 N SER A 114 8.033 4.868 4.202 1.00 0.00 N ATOM 1734 CA SER A 114 8.140 5.758 5.345 1.00 0.00 C ATOM 1735 C SER A 114 9.417 5.450 6.130 1.00 0.00 C ATOM 1736 O SER A 114 10.132 6.363 6.543 1.00 0.00 O ATOM 1737 CB SER A 114 6.916 5.636 6.255 1.00 0.00 C ATOM 1738 OG SER A 114 6.896 6.644 7.262 1.00 0.00 O ATOM 0 H SER A 114 7.546 3.991 4.388 1.00 0.00 H new ATOM 0 HA SER A 114 8.185 6.783 4.977 1.00 0.00 H new ATOM 0 HB2 SER A 114 6.009 5.706 5.654 1.00 0.00 H new ATOM 0 HB3 SER A 114 6.911 4.653 6.726 1.00 0.00 H new ATOM 0 HG SER A 114 6.099 6.532 7.821 1.00 0.00 H new ATOM 1744 N LYS A 115 9.666 4.162 6.312 1.00 0.00 N ATOM 1745 CA LYS A 115 10.845 3.722 7.039 1.00 0.00 C ATOM 1746 C LYS A 115 12.063 3.789 6.116 1.00 0.00 C ATOM 1747 O LYS A 115 13.201 3.791 6.583 1.00 0.00 O ATOM 1748 CB LYS A 115 10.612 2.339 7.651 1.00 0.00 C ATOM 1749 CG LYS A 115 9.264 2.278 8.372 1.00 0.00 C ATOM 1750 CD LYS A 115 9.454 2.257 9.889 1.00 0.00 C ATOM 1751 CE LYS A 115 8.785 1.029 10.509 1.00 0.00 C ATOM 1752 NZ LYS A 115 8.841 1.097 11.986 1.00 0.00 N ATOM 0 H LYS A 115 9.071 3.408 5.968 1.00 0.00 H new ATOM 0 HA LYS A 115 11.045 4.387 7.879 1.00 0.00 H new ATOM 0 HB2 LYS A 115 10.644 1.581 6.868 1.00 0.00 H new ATOM 0 HB3 LYS A 115 11.414 2.108 8.352 1.00 0.00 H new ATOM 0 HG2 LYS A 115 8.657 3.139 8.090 1.00 0.00 H new ATOM 0 HG3 LYS A 115 8.720 1.388 8.058 1.00 0.00 H new ATOM 0 HD2 LYS A 115 10.518 2.254 10.126 1.00 0.00 H new ATOM 0 HD3 LYS A 115 9.033 3.163 10.324 1.00 0.00 H new ATOM 0 HE2 LYS A 115 7.747 0.969 10.181 1.00 0.00 H new ATOM 0 HE3 LYS A 115 9.282 0.123 10.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 8.382 0.256 12.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 9.834 1.132 12.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 8.347 1.951 12.313 1.00 0.00 H new ATOM 1766 N GLY A 116 11.783 3.844 4.822 1.00 0.00 N ATOM 1767 CA GLY A 116 12.842 3.911 3.829 1.00 0.00 C ATOM 1768 C GLY A 116 13.243 2.511 3.360 1.00 0.00 C ATOM 1769 O GLY A 116 13.899 2.362 2.330 1.00 0.00 O ATOM 0 H GLY A 116 10.838 3.844 4.438 1.00 0.00 H new ATOM 0 HA2 GLY A 116 12.509 4.503 2.976 1.00 0.00 H new ATOM 0 HA3 GLY A 116 13.709 4.419 4.251 1.00 0.00 H new ATOM 1773 N TYR A 117 12.832 1.521 4.137 1.00 0.00 N ATOM 1774 CA TYR A 117 13.140 0.138 3.814 1.00 0.00 C ATOM 1775 C TYR A 117 11.920 -0.760 4.029 1.00 0.00 C ATOM 1776 O TYR A 117 11.034 -0.432 4.816 1.00 0.00 O ATOM 1777 CB TYR A 117 14.247 -0.285 4.782 1.00 0.00 C ATOM 1778 CG TYR A 117 13.732 -0.856 6.105 1.00 0.00 C ATOM 1779 CD1 TYR A 117 13.269 -0.006 7.089 1.00 0.00 C ATOM 1780 CD2 TYR A 117 13.730 -2.220 6.313 1.00 0.00 C ATOM 1781 CE1 TYR A 117 12.785 -0.544 8.334 1.00 0.00 C ATOM 1782 CE2 TYR A 117 13.246 -2.757 7.559 1.00 0.00 C ATOM 1783 CZ TYR A 117 12.797 -1.892 8.508 1.00 0.00 C ATOM 1784 OH TYR A 117 12.339 -2.400 9.683 1.00 0.00 O ATOM 0 H TYR A 117 12.288 1.649 4.990 1.00 0.00 H new ATOM 0 HA TYR A 117 13.440 0.045 2.770 1.00 0.00 H new ATOM 0 HB2 TYR A 117 14.875 -1.032 4.296 1.00 0.00 H new ATOM 0 HB3 TYR A 117 14.881 0.577 4.992 1.00 0.00 H new ATOM 0 HD1 TYR A 117 13.270 1.062 6.925 1.00 0.00 H new ATOM 0 HD2 TYR A 117 14.091 -2.885 5.542 1.00 0.00 H new ATOM 0 HE1 TYR A 117 12.420 0.110 9.113 1.00 0.00 H new ATOM 0 HE2 TYR A 117 13.240 -3.822 7.736 1.00 0.00 H new ATOM 0 HH TYR A 117 12.406 -3.378 9.665 1.00 0.00 H new ATOM 1794 N MET A 118 11.914 -1.877 3.315 1.00 0.00 N ATOM 1795 CA MET A 118 10.818 -2.825 3.418 1.00 0.00 C ATOM 1796 C MET A 118 10.755 -3.440 4.817 1.00 0.00 C ATOM 1797 O MET A 118 11.787 -3.754 5.408 1.00 0.00 O ATOM 1798 CB MET A 118 11.002 -3.933 2.379 1.00 0.00 C ATOM 1799 CG MET A 118 10.841 -3.387 0.959 1.00 0.00 C ATOM 1800 SD MET A 118 11.367 -4.611 -0.229 1.00 0.00 S ATOM 1801 CE MET A 118 9.828 -5.479 -0.481 1.00 0.00 C ATOM 0 H MET A 118 12.651 -2.146 2.663 1.00 0.00 H new ATOM 0 HA MET A 118 9.884 -2.294 3.233 1.00 0.00 H new ATOM 0 HB2 MET A 118 11.990 -4.380 2.490 1.00 0.00 H new ATOM 0 HB3 MET A 118 10.273 -4.724 2.553 1.00 0.00 H new ATOM 0 HG2 MET A 118 9.800 -3.118 0.780 1.00 0.00 H new ATOM 0 HG3 MET A 118 11.430 -2.477 0.841 1.00 0.00 H new ATOM 0 HE1 MET A 118 9.978 -6.283 -1.201 1.00 0.00 H new ATOM 0 HE2 MET A 118 9.487 -5.898 0.466 1.00 0.00 H new ATOM 0 HE3 MET A 118 9.078 -4.786 -0.862 1.00 0.00 H new ATOM 1811 N LEU A 119 9.533 -3.595 5.306 1.00 0.00 N ATOM 1812 CA LEU A 119 9.322 -4.168 6.624 1.00 0.00 C ATOM 1813 C LEU A 119 8.613 -5.516 6.482 1.00 0.00 C ATOM 1814 O LEU A 119 8.270 -5.928 5.375 1.00 0.00 O ATOM 1815 CB LEU A 119 8.583 -3.177 7.527 1.00 0.00 C ATOM 1816 CG LEU A 119 8.837 -1.695 7.245 1.00 0.00 C ATOM 1817 CD1 LEU A 119 7.665 -0.837 7.725 1.00 0.00 C ATOM 1818 CD2 LEU A 119 10.167 -1.242 7.852 1.00 0.00 C ATOM 0 H LEU A 119 8.679 -3.334 4.813 1.00 0.00 H new ATOM 0 HA LEU A 119 10.277 -4.359 7.113 1.00 0.00 H new ATOM 0 HB2 LEU A 119 7.513 -3.365 7.440 1.00 0.00 H new ATOM 0 HB3 LEU A 119 8.860 -3.382 8.561 1.00 0.00 H new ATOM 0 HG LEU A 119 8.913 -1.560 6.166 1.00 0.00 H new ATOM 0 HD11 LEU A 119 7.871 0.212 7.513 1.00 0.00 H new ATOM 0 HD12 LEU A 119 6.756 -1.140 7.206 1.00 0.00 H new ATOM 0 HD13 LEU A 119 7.532 -0.970 8.799 1.00 0.00 H new ATOM 0 HD21 LEU A 119 10.324 -0.185 7.637 1.00 0.00 H new ATOM 0 HD22 LEU A 119 10.145 -1.394 8.931 1.00 0.00 H new ATOM 0 HD23 LEU A 119 10.981 -1.824 7.420 1.00 0.00 H new ATOM 1830 N SER A 120 8.416 -6.168 7.619 1.00 0.00 N ATOM 1831 CA SER A 120 7.755 -7.461 7.636 1.00 0.00 C ATOM 1832 C SER A 120 6.320 -7.323 7.122 1.00 0.00 C ATOM 1833 O SER A 120 5.646 -6.336 7.412 1.00 0.00 O ATOM 1834 CB SER A 120 7.759 -8.064 9.042 1.00 0.00 C ATOM 1835 OG SER A 120 9.081 -8.240 9.544 1.00 0.00 O ATOM 0 H SER A 120 8.703 -5.824 8.535 1.00 0.00 H new ATOM 0 HA SER A 120 8.306 -8.134 6.980 1.00 0.00 H new ATOM 0 HB2 SER A 120 7.199 -7.416 9.716 1.00 0.00 H new ATOM 0 HB3 SER A 120 7.247 -9.026 9.025 1.00 0.00 H new ATOM 0 HG SER A 120 9.041 -8.625 10.444 1.00 0.00 H new ATOM 1841 N GLU A 121 5.896 -8.326 6.367 1.00 0.00 N ATOM 1842 CA GLU A 121 4.554 -8.328 5.810 1.00 0.00 C ATOM 1843 C GLU A 121 3.611 -9.140 6.701 1.00 0.00 C ATOM 1844 O GLU A 121 2.400 -8.929 6.683 1.00 0.00 O ATOM 1845 CB GLU A 121 4.556 -8.867 4.379 1.00 0.00 C ATOM 1846 CG GLU A 121 4.882 -7.758 3.376 1.00 0.00 C ATOM 1847 CD GLU A 121 6.244 -7.995 2.721 1.00 0.00 C ATOM 1848 OE1 GLU A 121 6.436 -9.114 2.199 1.00 0.00 O ATOM 1849 OE2 GLU A 121 7.062 -7.051 2.757 1.00 0.00 O ATOM 0 H GLU A 121 6.458 -9.143 6.128 1.00 0.00 H new ATOM 0 HA GLU A 121 4.194 -7.300 5.775 1.00 0.00 H new ATOM 0 HB2 GLU A 121 5.288 -9.670 4.290 1.00 0.00 H new ATOM 0 HB3 GLU A 121 3.582 -9.297 4.147 1.00 0.00 H new ATOM 0 HG2 GLU A 121 4.108 -7.717 2.610 1.00 0.00 H new ATOM 0 HG3 GLU A 121 4.881 -6.793 3.882 1.00 0.00 H new ATOM 1856 N GLU A 122 4.203 -10.051 7.459 1.00 0.00 N ATOM 1857 CA GLU A 122 3.431 -10.896 8.354 1.00 0.00 C ATOM 1858 C GLU A 122 2.587 -10.037 9.298 1.00 0.00 C ATOM 1859 O GLU A 122 1.401 -10.301 9.490 1.00 0.00 O ATOM 1860 CB GLU A 122 4.343 -11.839 9.141 1.00 0.00 C ATOM 1861 CG GLU A 122 4.629 -13.115 8.345 1.00 0.00 C ATOM 1862 CD GLU A 122 5.178 -14.216 9.254 1.00 0.00 C ATOM 1863 OE1 GLU A 122 4.506 -14.502 10.269 1.00 0.00 O ATOM 1864 OE2 GLU A 122 6.257 -14.748 8.914 1.00 0.00 O ATOM 0 H GLU A 122 5.208 -10.222 7.472 1.00 0.00 H new ATOM 0 HA GLU A 122 2.760 -11.510 7.753 1.00 0.00 H new ATOM 0 HB2 GLU A 122 5.280 -11.334 9.374 1.00 0.00 H new ATOM 0 HB3 GLU A 122 3.874 -12.096 10.091 1.00 0.00 H new ATOM 0 HG2 GLU A 122 3.715 -13.459 7.862 1.00 0.00 H new ATOM 0 HG3 GLU A 122 5.347 -12.901 7.553 1.00 0.00 H new ATOM 1871 N PRO A 123 3.248 -8.999 9.877 1.00 0.00 N ATOM 1872 CA PRO A 123 2.572 -8.099 10.795 1.00 0.00 C ATOM 1873 C PRO A 123 1.651 -7.137 10.042 1.00 0.00 C ATOM 1874 O PRO A 123 1.090 -6.217 10.635 1.00 0.00 O ATOM 1875 CB PRO A 123 3.688 -7.389 11.544 1.00 0.00 C ATOM 1876 CG PRO A 123 4.939 -7.573 10.700 1.00 0.00 C ATOM 1877 CD PRO A 123 4.653 -8.656 9.673 1.00 0.00 C ATOM 0 HA PRO A 123 1.915 -8.623 11.489 1.00 0.00 H new ATOM 0 HB2 PRO A 123 3.458 -6.332 11.677 1.00 0.00 H new ATOM 0 HB3 PRO A 123 3.822 -7.813 12.539 1.00 0.00 H new ATOM 0 HG2 PRO A 123 5.207 -6.639 10.206 1.00 0.00 H new ATOM 0 HG3 PRO A 123 5.785 -7.855 11.327 1.00 0.00 H new ATOM 0 HD2 PRO A 123 4.830 -8.297 8.659 1.00 0.00 H new ATOM 0 HD3 PRO A 123 5.298 -9.522 9.821 1.00 0.00 H new ATOM 1885 N TYR A 124 1.524 -7.383 8.747 1.00 0.00 N ATOM 1886 CA TYR A 124 0.680 -6.550 7.906 1.00 0.00 C ATOM 1887 C TYR A 124 -0.219 -7.406 7.012 1.00 0.00 C ATOM 1888 O TYR A 124 -0.782 -6.911 6.036 1.00 0.00 O ATOM 1889 CB TYR A 124 1.633 -5.740 7.025 1.00 0.00 C ATOM 1890 CG TYR A 124 2.248 -4.526 7.725 1.00 0.00 C ATOM 1891 CD1 TYR A 124 1.609 -3.304 7.677 1.00 0.00 C ATOM 1892 CD2 TYR A 124 3.443 -4.654 8.403 1.00 0.00 C ATOM 1893 CE1 TYR A 124 2.188 -2.162 8.336 1.00 0.00 C ATOM 1894 CE2 TYR A 124 4.022 -3.512 9.062 1.00 0.00 C ATOM 1895 CZ TYR A 124 3.366 -2.322 8.996 1.00 0.00 C ATOM 1896 OH TYR A 124 3.913 -1.244 9.618 1.00 0.00 O ATOM 0 H TYR A 124 1.991 -8.147 8.259 1.00 0.00 H new ATOM 0 HA TYR A 124 0.035 -5.918 8.516 1.00 0.00 H new ATOM 0 HB2 TYR A 124 2.435 -6.392 6.680 1.00 0.00 H new ATOM 0 HB3 TYR A 124 1.094 -5.402 6.140 1.00 0.00 H new ATOM 0 HD1 TYR A 124 0.674 -3.204 7.145 1.00 0.00 H new ATOM 0 HD2 TYR A 124 3.944 -5.610 8.439 1.00 0.00 H new ATOM 0 HE1 TYR A 124 1.698 -1.200 8.307 1.00 0.00 H new ATOM 0 HE2 TYR A 124 4.956 -3.598 9.597 1.00 0.00 H new ATOM 0 HH TYR A 124 3.201 -0.630 9.896 1.00 0.00 H new ATOM 1906 N ILE A 125 -0.326 -8.675 7.377 1.00 0.00 N ATOM 1907 CA ILE A 125 -1.148 -9.604 6.620 1.00 0.00 C ATOM 1908 C ILE A 125 -2.607 -9.147 6.672 1.00 0.00 C ATOM 1909 O ILE A 125 -3.060 -8.618 7.686 1.00 0.00 O ATOM 1910 CB ILE A 125 -0.934 -11.035 7.117 1.00 0.00 C ATOM 1911 CG1 ILE A 125 0.539 -11.436 7.017 1.00 0.00 C ATOM 1912 CG2 ILE A 125 -1.846 -12.015 6.376 1.00 0.00 C ATOM 1913 CD1 ILE A 125 0.900 -11.846 5.588 1.00 0.00 C ATOM 0 H ILE A 125 0.143 -9.082 8.187 1.00 0.00 H new ATOM 0 HA ILE A 125 -0.852 -9.607 5.571 1.00 0.00 H new ATOM 0 HB ILE A 125 -1.208 -11.075 8.171 1.00 0.00 H new ATOM 0 HG12 ILE A 125 1.168 -10.603 7.330 1.00 0.00 H new ATOM 0 HG13 ILE A 125 0.742 -12.262 7.698 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -1.674 -13.025 6.748 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -2.887 -11.740 6.542 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -1.627 -11.980 5.309 1.00 0.00 H new ATOM 0 HD11 ILE A 125 1.952 -12.126 5.545 1.00 0.00 H new ATOM 0 HD12 ILE A 125 0.286 -12.695 5.287 1.00 0.00 H new ATOM 0 HD13 ILE A 125 0.719 -11.010 4.913 1.00 0.00 H new ATOM 1925 N HIS A 126 -3.302 -9.368 5.566 1.00 0.00 N ATOM 1926 CA HIS A 126 -4.701 -8.985 5.472 1.00 0.00 C ATOM 1927 C HIS A 126 -5.576 -10.240 5.457 1.00 0.00 C ATOM 1928 O HIS A 126 -5.593 -10.977 4.473 1.00 0.00 O ATOM 1929 CB HIS A 126 -4.937 -8.082 4.260 1.00 0.00 C ATOM 1930 CG HIS A 126 -6.295 -7.421 4.241 1.00 0.00 C ATOM 1931 ND1 HIS A 126 -6.524 -6.166 4.777 1.00 0.00 N ATOM 1932 CD2 HIS A 126 -7.490 -7.853 3.747 1.00 0.00 C ATOM 1933 CE1 HIS A 126 -7.804 -5.866 4.607 1.00 0.00 C ATOM 1934 NE2 HIS A 126 -8.401 -6.914 3.969 1.00 0.00 N ATOM 0 H HIS A 126 -2.923 -9.807 4.727 1.00 0.00 H new ATOM 0 HA HIS A 126 -4.982 -8.399 6.347 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -4.168 -7.310 4.240 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -4.819 -8.673 3.351 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -7.666 -8.800 3.258 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -8.289 -4.953 4.919 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -9.385 -6.967 3.706 1.00 0.00 H new ATOM 1942 N SER A 127 -6.283 -10.443 6.559 1.00 0.00 N ATOM 1943 CA SER A 127 -7.158 -11.596 6.685 1.00 0.00 C ATOM 1944 C SER A 127 -8.616 -11.138 6.772 1.00 0.00 C ATOM 1945 O SER A 127 -8.908 -10.092 7.349 1.00 0.00 O ATOM 1946 CB SER A 127 -6.791 -12.435 7.910 1.00 0.00 C ATOM 1947 OG SER A 127 -7.508 -13.666 7.948 1.00 0.00 O ATOM 0 H SER A 127 -6.268 -9.828 7.373 1.00 0.00 H new ATOM 0 HA SER A 127 -7.031 -12.220 5.801 1.00 0.00 H new ATOM 0 HB2 SER A 127 -5.720 -12.639 7.902 1.00 0.00 H new ATOM 0 HB3 SER A 127 -7.000 -11.865 8.815 1.00 0.00 H new ATOM 0 HG SER A 127 -7.245 -14.174 8.744 1.00 0.00 H new ATOM 1953 N GLY A 128 -9.492 -11.945 6.191 1.00 0.00 N ATOM 1954 CA GLY A 128 -10.911 -11.637 6.196 1.00 0.00 C ATOM 1955 C GLY A 128 -11.595 -12.218 7.436 1.00 0.00 C ATOM 1956 O GLY A 128 -10.981 -12.968 8.193 1.00 0.00 O ATOM 0 H GLY A 128 -9.246 -12.812 5.714 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -11.052 -10.556 6.171 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -11.377 -12.040 5.297 1.00 0.00 H new ATOM 1960 N PRO A 129 -12.890 -11.841 7.608 1.00 0.00 N ATOM 1961 CA PRO A 129 -13.663 -12.316 8.743 1.00 0.00 C ATOM 1962 C PRO A 129 -14.078 -13.776 8.550 1.00 0.00 C ATOM 1963 O PRO A 129 -14.461 -14.177 7.451 1.00 0.00 O ATOM 1964 CB PRO A 129 -14.848 -11.369 8.836 1.00 0.00 C ATOM 1965 CG PRO A 129 -14.945 -10.688 7.481 1.00 0.00 C ATOM 1966 CD PRO A 129 -13.649 -10.954 6.732 1.00 0.00 C ATOM 0 HA PRO A 129 -13.093 -12.311 9.672 1.00 0.00 H new ATOM 0 HB2 PRO A 129 -15.765 -11.912 9.067 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -14.702 -10.638 9.631 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -15.796 -11.074 6.920 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -15.103 -9.616 7.603 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -13.839 -11.420 5.765 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -13.106 -10.029 6.539 1.00 0.00 H new ATOM 1974 N SER A 130 -13.988 -14.532 9.634 1.00 0.00 N ATOM 1975 CA SER A 130 -14.350 -15.939 9.598 1.00 0.00 C ATOM 1976 C SER A 130 -14.512 -16.474 11.022 1.00 0.00 C ATOM 1977 O SER A 130 -13.943 -15.925 11.964 1.00 0.00 O ATOM 1978 CB SER A 130 -13.303 -16.757 8.839 1.00 0.00 C ATOM 1979 OG SER A 130 -13.733 -18.097 8.615 1.00 0.00 O ATOM 0 H SER A 130 -13.670 -14.197 10.543 1.00 0.00 H new ATOM 0 HA SER A 130 -15.299 -16.035 9.071 1.00 0.00 H new ATOM 0 HB2 SER A 130 -13.093 -16.279 7.882 1.00 0.00 H new ATOM 0 HB3 SER A 130 -12.370 -16.765 9.403 1.00 0.00 H new ATOM 0 HG SER A 130 -13.038 -18.586 8.127 1.00 0.00 H new ATOM 1985 N SER A 131 -15.290 -17.541 11.134 1.00 0.00 N ATOM 1986 CA SER A 131 -15.534 -18.157 12.428 1.00 0.00 C ATOM 1987 C SER A 131 -16.448 -17.264 13.268 1.00 0.00 C ATOM 1988 O SER A 131 -17.533 -17.683 13.669 1.00 0.00 O ATOM 1989 CB SER A 131 -14.221 -18.419 13.169 1.00 0.00 C ATOM 1990 OG SER A 131 -14.385 -19.358 14.228 1.00 0.00 O ATOM 0 H SER A 131 -15.759 -17.995 10.350 1.00 0.00 H new ATOM 0 HA SER A 131 -16.025 -19.116 12.264 1.00 0.00 H new ATOM 0 HB2 SER A 131 -13.476 -18.792 12.466 1.00 0.00 H new ATOM 0 HB3 SER A 131 -13.838 -17.481 13.572 1.00 0.00 H new ATOM 0 HG SER A 131 -13.525 -19.500 14.675 1.00 0.00 H new ATOM 1996 N GLY A 132 -15.977 -16.050 13.511 1.00 0.00 N ATOM 1997 CA GLY A 132 -16.739 -15.094 14.297 1.00 0.00 C ATOM 1998 C GLY A 132 -16.427 -13.659 13.867 1.00 0.00 C ATOM 1999 O GLY A 132 -16.762 -13.254 12.755 1.00 0.00 O ATOM 0 H GLY A 132 -15.077 -15.706 13.177 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -17.805 -15.289 14.180 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -16.506 -15.219 15.354 1.00 0.00 H new TER 2003 GLY A 132