USER MOD reduce.3.24.130724 H: found=0, std=0, add=887, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 887 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 83 TYR OH : rot 80:sc= 0.566 USER MOD Set 1.2: A 85 LYS NZ :NH3+ 157:sc= 0.619 (180deg=0) USER MOD Set 2.1: A 3 MET CE :methyl -172:sc= -0.218 (180deg=-0.374) USER MOD Set 2.2: A 70 GLN : amide:sc= 1.63 K(o=1.4,f=-6.1!) USER MOD Set 3.1: A 26 SER OG : rot 95:sc= 2.3 USER MOD Set 3.2: A 75 TYR OH : rot 179:sc= 1.28 USER MOD Set 4.1: A 13 ASN : amide:sc= 1.77 K(o=2.9,f=-5.5!) USER MOD Set 4.2: A 77 LYS NZ :NH3+ -160:sc= 1.09 (180deg=0) USER MOD Set 5.1: A 10 TYR OH : rot -8:sc= 1.23 USER MOD Set 5.2: A 12 ASN : amide:sc= 0.475 K(o=3.9,f=3.1) USER MOD Set 5.3: A 51 GLN : amide:sc= 2.16 K(o=3.9,f=-0.98) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 147:sc= 0.0167 (180deg=0) USER MOD Single : A 6 ASN : amide:sc= 0.0685 X(o=0.068,f=0.08) USER MOD Single : A 7 GLN : amide:sc= 0.943 K(o=0.94,f=-0.35) USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= -0.169 K(o=-0.17,f=-7.4!) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 162:sc= 1.09 (180deg=0.871) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0.00749 USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=-0.065) USER MOD Single : A 36 GLN : amide:sc= 0.83 K(o=0.83,f=-0.21) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot 70:sc= 0.0194 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl -178:sc= -0.143 (180deg=-0.151) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot 180:sc= 0.00545 USER MOD Single : A 63 SER OG : rot 80:sc= 1.11 USER MOD Single : A 64 ASN : amide:sc= 1.17 K(o=1.2,f=0) USER MOD Single : A 68 THR OG1 : rot 92:sc= 1.22 USER MOD Single : A 69 MET CE :methyl 178:sc= -1.23 (180deg=-1.25) USER MOD Single : A 79 MET CE :methyl -170:sc= -0.269 (180deg=-0.772) USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 84 SER OG : rot -150:sc= 0 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ -172:sc= 1.22 (180deg=1.14) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot -77:sc= 1.16 USER MOD Single : A 99 LYS NZ :NH3+ 171:sc= 1.19 (180deg=1.12) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.734 -12.339 4.485 1.00 0.00 N ATOM 2 CA MET A 1 3.907 -12.726 3.063 1.00 0.00 C ATOM 3 C MET A 1 4.779 -13.979 2.973 1.00 0.00 C ATOM 4 O MET A 1 5.744 -14.125 3.731 1.00 0.00 O ATOM 5 CB MET A 1 4.529 -11.600 2.209 1.00 0.00 C ATOM 6 CG MET A 1 3.590 -10.408 1.978 1.00 0.00 C ATOM 7 SD MET A 1 4.274 -9.150 0.861 1.00 0.00 S ATOM 8 CE MET A 1 2.891 -7.977 0.833 1.00 0.00 C ATOM 0 H1 MET A 1 3.666 -11.304 4.557 1.00 0.00 H new ATOM 0 H2 MET A 1 2.864 -12.770 4.859 1.00 0.00 H new ATOM 0 H3 MET A 1 4.550 -12.672 5.037 1.00 0.00 H new ATOM 0 HA MET A 1 2.913 -12.924 2.661 1.00 0.00 H new ATOM 0 HB2 MET A 1 5.437 -11.246 2.697 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.825 -12.010 1.243 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.648 -10.772 1.568 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.362 -9.944 2.938 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.142 -7.134 0.189 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.000 -8.474 0.450 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.699 -7.617 1.844 1.00 0.00 H new ATOM 20 N GLU A 2 4.471 -14.885 2.040 1.00 0.00 N ATOM 21 CA GLU A 2 5.288 -16.049 1.718 1.00 0.00 C ATOM 22 C GLU A 2 5.062 -16.376 0.238 1.00 0.00 C ATOM 23 O GLU A 2 3.932 -16.277 -0.249 1.00 0.00 O ATOM 24 CB GLU A 2 4.896 -17.225 2.629 1.00 0.00 C ATOM 25 CG GLU A 2 5.854 -18.418 2.477 1.00 0.00 C ATOM 26 CD GLU A 2 5.855 -19.306 3.733 1.00 0.00 C ATOM 27 OE1 GLU A 2 6.597 -18.979 4.690 1.00 0.00 O ATOM 28 OE2 GLU A 2 5.135 -20.330 3.770 1.00 0.00 O ATOM 0 H GLU A 2 3.624 -14.823 1.476 1.00 0.00 H new ATOM 0 HA GLU A 2 6.347 -15.852 1.886 1.00 0.00 H new ATOM 0 HB2 GLU A 2 4.893 -16.893 3.667 1.00 0.00 H new ATOM 0 HB3 GLU A 2 3.881 -17.543 2.393 1.00 0.00 H new ATOM 0 HG2 GLU A 2 5.562 -19.012 1.611 1.00 0.00 H new ATOM 0 HG3 GLU A 2 6.864 -18.053 2.288 1.00 0.00 H new ATOM 35 N MET A 3 6.132 -16.747 -0.470 1.00 0.00 N ATOM 36 CA MET A 3 6.146 -16.986 -1.909 1.00 0.00 C ATOM 37 C MET A 3 6.888 -18.308 -2.139 1.00 0.00 C ATOM 38 O MET A 3 7.896 -18.569 -1.475 1.00 0.00 O ATOM 39 CB MET A 3 6.849 -15.816 -2.626 1.00 0.00 C ATOM 40 CG MET A 3 6.068 -14.486 -2.651 1.00 0.00 C ATOM 41 SD MET A 3 5.870 -13.529 -1.108 1.00 0.00 S ATOM 42 CE MET A 3 7.579 -13.192 -0.601 1.00 0.00 C ATOM 0 H MET A 3 7.044 -16.894 -0.038 1.00 0.00 H new ATOM 0 HA MET A 3 5.136 -17.052 -2.312 1.00 0.00 H new ATOM 0 HB2 MET A 3 7.811 -15.643 -2.144 1.00 0.00 H new ATOM 0 HB3 MET A 3 7.056 -16.115 -3.654 1.00 0.00 H new ATOM 0 HG2 MET A 3 6.554 -13.836 -3.378 1.00 0.00 H new ATOM 0 HG3 MET A 3 5.070 -14.701 -3.032 1.00 0.00 H new ATOM 0 HE1 MET A 3 7.582 -12.743 0.392 1.00 0.00 H new ATOM 0 HE2 MET A 3 8.143 -14.125 -0.579 1.00 0.00 H new ATOM 0 HE3 MET A 3 8.041 -12.506 -1.311 1.00 0.00 H new ATOM 52 N LEU A 4 6.370 -19.164 -3.026 1.00 0.00 N ATOM 53 CA LEU A 4 6.867 -20.534 -3.182 1.00 0.00 C ATOM 54 C LEU A 4 8.179 -20.562 -3.981 1.00 0.00 C ATOM 55 O LEU A 4 8.371 -19.710 -4.853 1.00 0.00 O ATOM 56 CB LEU A 4 5.831 -21.425 -3.893 1.00 0.00 C ATOM 57 CG LEU A 4 4.469 -21.573 -3.186 1.00 0.00 C ATOM 58 CD1 LEU A 4 3.614 -22.600 -3.936 1.00 0.00 C ATOM 59 CD2 LEU A 4 4.599 -22.007 -1.719 1.00 0.00 C ATOM 0 H LEU A 4 5.600 -18.929 -3.652 1.00 0.00 H new ATOM 0 HA LEU A 4 7.048 -20.921 -2.179 1.00 0.00 H new ATOM 0 HB2 LEU A 4 5.658 -21.022 -4.891 1.00 0.00 H new ATOM 0 HB3 LEU A 4 6.262 -22.418 -4.021 1.00 0.00 H new ATOM 0 HG LEU A 4 3.998 -20.590 -3.195 1.00 0.00 H new ATOM 0 HD11 LEU A 4 2.651 -22.705 -3.437 1.00 0.00 H new ATOM 0 HD12 LEU A 4 3.457 -22.264 -4.961 1.00 0.00 H new ATOM 0 HD13 LEU A 4 4.125 -23.563 -3.944 1.00 0.00 H new ATOM 0 HD21 LEU A 4 3.607 -22.094 -1.276 1.00 0.00 H new ATOM 0 HD22 LEU A 4 5.105 -22.971 -1.668 1.00 0.00 H new ATOM 0 HD23 LEU A 4 5.178 -21.264 -1.170 1.00 0.00 H new ATOM 71 N PRO A 5 9.062 -21.553 -3.749 1.00 0.00 N ATOM 72 CA PRO A 5 10.227 -21.796 -4.589 1.00 0.00 C ATOM 73 C PRO A 5 9.867 -21.991 -6.062 1.00 0.00 C ATOM 74 O PRO A 5 8.959 -22.750 -6.408 1.00 0.00 O ATOM 75 CB PRO A 5 10.913 -23.044 -4.022 1.00 0.00 C ATOM 76 CG PRO A 5 10.451 -23.080 -2.570 1.00 0.00 C ATOM 77 CD PRO A 5 9.043 -22.494 -2.638 1.00 0.00 C ATOM 0 HA PRO A 5 10.886 -20.928 -4.570 1.00 0.00 H new ATOM 0 HB2 PRO A 5 10.615 -23.944 -4.560 1.00 0.00 H new ATOM 0 HB3 PRO A 5 11.998 -22.973 -4.096 1.00 0.00 H new ATOM 0 HG2 PRO A 5 10.446 -24.096 -2.174 1.00 0.00 H new ATOM 0 HG3 PRO A 5 11.102 -22.490 -1.925 1.00 0.00 H new ATOM 0 HD2 PRO A 5 8.301 -23.276 -2.800 1.00 0.00 H new ATOM 0 HD3 PRO A 5 8.781 -21.994 -1.706 1.00 0.00 H new ATOM 85 N ASN A 6 10.637 -21.331 -6.923 1.00 0.00 N ATOM 86 CA ASN A 6 10.673 -21.484 -8.372 1.00 0.00 C ATOM 87 C ASN A 6 12.000 -20.865 -8.808 1.00 0.00 C ATOM 88 O ASN A 6 12.468 -19.947 -8.138 1.00 0.00 O ATOM 89 CB ASN A 6 9.514 -20.726 -9.033 1.00 0.00 C ATOM 90 CG ASN A 6 9.537 -20.925 -10.543 1.00 0.00 C ATOM 91 OD1 ASN A 6 9.463 -22.046 -11.031 1.00 0.00 O ATOM 92 ND2 ASN A 6 9.696 -19.861 -11.310 1.00 0.00 N ATOM 0 H ASN A 6 11.299 -20.625 -6.602 1.00 0.00 H new ATOM 0 HA ASN A 6 10.581 -22.531 -8.662 1.00 0.00 H new ATOM 0 HB2 ASN A 6 8.565 -21.077 -8.629 1.00 0.00 H new ATOM 0 HB3 ASN A 6 9.586 -19.664 -8.799 1.00 0.00 H new ATOM 0 HD21 ASN A 6 9.759 -19.967 -12.323 1.00 0.00 H new ATOM 0 HD22 ASN A 6 9.756 -18.934 -10.890 1.00 0.00 H new ATOM 99 N GLN A 7 12.618 -21.319 -9.902 1.00 0.00 N ATOM 100 CA GLN A 7 13.938 -20.808 -10.291 1.00 0.00 C ATOM 101 C GLN A 7 13.878 -19.340 -10.753 1.00 0.00 C ATOM 102 O GLN A 7 14.912 -18.670 -10.788 1.00 0.00 O ATOM 103 CB GLN A 7 14.571 -21.731 -11.349 1.00 0.00 C ATOM 104 CG GLN A 7 16.096 -21.530 -11.434 1.00 0.00 C ATOM 105 CD GLN A 7 16.817 -22.465 -12.408 1.00 0.00 C ATOM 106 OE1 GLN A 7 16.237 -23.351 -13.033 1.00 0.00 O ATOM 107 NE2 GLN A 7 18.119 -22.279 -12.553 1.00 0.00 N ATOM 0 H GLN A 7 12.234 -22.028 -10.526 1.00 0.00 H new ATOM 0 HA GLN A 7 14.581 -20.815 -9.411 1.00 0.00 H new ATOM 0 HB2 GLN A 7 14.353 -22.770 -11.104 1.00 0.00 H new ATOM 0 HB3 GLN A 7 14.122 -21.532 -12.322 1.00 0.00 H new ATOM 0 HG2 GLN A 7 16.296 -20.499 -11.727 1.00 0.00 H new ATOM 0 HG3 GLN A 7 16.522 -21.667 -10.440 1.00 0.00 H new ATOM 0 HE21 GLN A 7 18.590 -21.541 -12.030 1.00 0.00 H new ATOM 0 HE22 GLN A 7 18.651 -22.874 -13.188 1.00 0.00 H new ATOM 116 N THR A 8 12.685 -18.828 -11.067 1.00 0.00 N ATOM 117 CA THR A 8 12.479 -17.517 -11.665 1.00 0.00 C ATOM 118 C THR A 8 11.461 -16.743 -10.829 1.00 0.00 C ATOM 119 O THR A 8 10.489 -17.323 -10.323 1.00 0.00 O ATOM 120 CB THR A 8 12.006 -17.696 -13.120 1.00 0.00 C ATOM 121 OG1 THR A 8 12.787 -18.687 -13.769 1.00 0.00 O ATOM 122 CG2 THR A 8 12.074 -16.395 -13.927 1.00 0.00 C ATOM 0 H THR A 8 11.814 -19.333 -10.905 1.00 0.00 H new ATOM 0 HA THR A 8 13.408 -16.947 -11.680 1.00 0.00 H new ATOM 0 HB THR A 8 10.962 -18.005 -13.074 1.00 0.00 H new ATOM 0 HG1 THR A 8 12.477 -18.795 -14.693 1.00 0.00 H new ATOM 0 HG21 THR A 8 11.729 -16.580 -14.944 1.00 0.00 H new ATOM 0 HG22 THR A 8 11.438 -15.643 -13.459 1.00 0.00 H new ATOM 0 HG23 THR A 8 13.103 -16.036 -13.952 1.00 0.00 H new ATOM 130 N ILE A 9 11.669 -15.432 -10.716 1.00 0.00 N ATOM 131 CA ILE A 9 10.791 -14.513 -10.007 1.00 0.00 C ATOM 132 C ILE A 9 10.359 -13.418 -10.992 1.00 0.00 C ATOM 133 O ILE A 9 11.020 -13.183 -12.010 1.00 0.00 O ATOM 134 CB ILE A 9 11.464 -13.973 -8.712 1.00 0.00 C ATOM 135 CG1 ILE A 9 12.427 -12.803 -9.008 1.00 0.00 C ATOM 136 CG2 ILE A 9 12.177 -15.101 -7.932 1.00 0.00 C ATOM 137 CD1 ILE A 9 13.186 -12.248 -7.794 1.00 0.00 C ATOM 0 H ILE A 9 12.479 -14.970 -11.129 1.00 0.00 H new ATOM 0 HA ILE A 9 9.894 -15.023 -9.654 1.00 0.00 H new ATOM 0 HB ILE A 9 10.667 -13.584 -8.078 1.00 0.00 H new ATOM 0 HG12 ILE A 9 13.155 -13.133 -9.750 1.00 0.00 H new ATOM 0 HG13 ILE A 9 11.857 -11.991 -9.460 1.00 0.00 H new ATOM 0 HG21 ILE A 9 12.636 -14.688 -7.034 1.00 0.00 H new ATOM 0 HG22 ILE A 9 11.451 -15.864 -7.651 1.00 0.00 H new ATOM 0 HG23 ILE A 9 12.948 -15.547 -8.561 1.00 0.00 H new ATOM 0 HD11 ILE A 9 13.834 -11.431 -8.112 1.00 0.00 H new ATOM 0 HD12 ILE A 9 12.473 -11.880 -7.056 1.00 0.00 H new ATOM 0 HD13 ILE A 9 13.791 -13.039 -7.350 1.00 0.00 H new ATOM 149 N TYR A 10 9.280 -12.725 -10.648 1.00 0.00 N ATOM 150 CA TYR A 10 8.638 -11.680 -11.426 1.00 0.00 C ATOM 151 C TYR A 10 8.547 -10.468 -10.506 1.00 0.00 C ATOM 152 O TYR A 10 8.189 -10.604 -9.334 1.00 0.00 O ATOM 153 CB TYR A 10 7.252 -12.185 -11.862 1.00 0.00 C ATOM 154 CG TYR A 10 6.318 -11.176 -12.516 1.00 0.00 C ATOM 155 CD1 TYR A 10 6.786 -10.250 -13.471 1.00 0.00 C ATOM 156 CD2 TYR A 10 4.944 -11.208 -12.202 1.00 0.00 C ATOM 157 CE1 TYR A 10 5.895 -9.370 -14.111 1.00 0.00 C ATOM 158 CE2 TYR A 10 4.045 -10.337 -12.842 1.00 0.00 C ATOM 159 CZ TYR A 10 4.515 -9.417 -13.805 1.00 0.00 C ATOM 160 OH TYR A 10 3.629 -8.590 -14.429 1.00 0.00 O ATOM 0 H TYR A 10 8.802 -12.891 -9.762 1.00 0.00 H new ATOM 0 HA TYR A 10 9.186 -11.413 -12.330 1.00 0.00 H new ATOM 0 HB2 TYR A 10 7.397 -13.011 -12.558 1.00 0.00 H new ATOM 0 HB3 TYR A 10 6.749 -12.592 -10.985 1.00 0.00 H new ATOM 0 HD1 TYR A 10 7.838 -10.216 -13.713 1.00 0.00 H new ATOM 0 HD2 TYR A 10 4.579 -11.907 -11.464 1.00 0.00 H new ATOM 0 HE1 TYR A 10 6.264 -8.659 -14.835 1.00 0.00 H new ATOM 0 HE2 TYR A 10 2.994 -10.371 -12.597 1.00 0.00 H new ATOM 0 HH TYR A 10 4.118 -7.934 -14.968 1.00 0.00 H new ATOM 170 N ILE A 11 8.902 -9.295 -11.022 1.00 0.00 N ATOM 171 CA ILE A 11 9.086 -8.064 -10.265 1.00 0.00 C ATOM 172 C ILE A 11 8.117 -7.042 -10.856 1.00 0.00 C ATOM 173 O ILE A 11 7.874 -7.030 -12.064 1.00 0.00 O ATOM 174 CB ILE A 11 10.574 -7.631 -10.351 1.00 0.00 C ATOM 175 CG1 ILE A 11 11.480 -8.661 -9.627 1.00 0.00 C ATOM 176 CG2 ILE A 11 10.803 -6.221 -9.774 1.00 0.00 C ATOM 177 CD1 ILE A 11 12.987 -8.452 -9.823 1.00 0.00 C ATOM 0 H ILE A 11 9.076 -9.173 -12.020 1.00 0.00 H new ATOM 0 HA ILE A 11 8.868 -8.178 -9.203 1.00 0.00 H new ATOM 0 HB ILE A 11 10.840 -7.598 -11.407 1.00 0.00 H new ATOM 0 HG12 ILE A 11 11.260 -8.628 -8.560 1.00 0.00 H new ATOM 0 HG13 ILE A 11 11.219 -9.660 -9.976 1.00 0.00 H new ATOM 0 HG21 ILE A 11 11.858 -5.961 -9.856 1.00 0.00 H new ATOM 0 HG22 ILE A 11 10.207 -5.498 -10.332 1.00 0.00 H new ATOM 0 HG23 ILE A 11 10.506 -6.204 -8.726 1.00 0.00 H new ATOM 0 HD11 ILE A 11 13.535 -9.221 -9.279 1.00 0.00 H new ATOM 0 HD12 ILE A 11 13.228 -8.517 -10.884 1.00 0.00 H new ATOM 0 HD13 ILE A 11 13.270 -7.469 -9.446 1.00 0.00 H new ATOM 189 N ASN A 12 7.567 -6.181 -10.006 1.00 0.00 N ATOM 190 CA ASN A 12 6.614 -5.128 -10.330 1.00 0.00 C ATOM 191 C ASN A 12 6.836 -3.963 -9.363 1.00 0.00 C ATOM 192 O ASN A 12 7.572 -4.092 -8.380 1.00 0.00 O ATOM 193 CB ASN A 12 5.171 -5.669 -10.222 1.00 0.00 C ATOM 194 CG ASN A 12 4.480 -5.693 -11.579 1.00 0.00 C ATOM 195 OD1 ASN A 12 3.483 -5.011 -11.799 1.00 0.00 O ATOM 196 ND2 ASN A 12 5.007 -6.457 -12.518 1.00 0.00 N ATOM 0 H ASN A 12 7.790 -6.202 -9.011 1.00 0.00 H new ATOM 0 HA ASN A 12 6.763 -4.783 -11.353 1.00 0.00 H new ATOM 0 HB2 ASN A 12 5.189 -6.676 -9.804 1.00 0.00 H new ATOM 0 HB3 ASN A 12 4.599 -5.048 -9.532 1.00 0.00 H new ATOM 0 HD21 ASN A 12 4.586 -6.488 -13.446 1.00 0.00 H new ATOM 0 HD22 ASN A 12 5.836 -7.016 -12.315 1.00 0.00 H new ATOM 203 N ASN A 13 6.185 -2.826 -9.634 1.00 0.00 N ATOM 204 CA ASN A 13 6.417 -1.545 -8.954 1.00 0.00 C ATOM 205 C ASN A 13 7.907 -1.166 -8.913 1.00 0.00 C ATOM 206 O ASN A 13 8.373 -0.495 -7.993 1.00 0.00 O ATOM 207 CB ASN A 13 5.745 -1.531 -7.570 1.00 0.00 C ATOM 208 CG ASN A 13 5.597 -0.115 -7.016 1.00 0.00 C ATOM 209 OD1 ASN A 13 5.081 0.779 -7.685 1.00 0.00 O ATOM 210 ND2 ASN A 13 6.004 0.129 -5.783 1.00 0.00 N ATOM 0 H ASN A 13 5.462 -2.769 -10.352 1.00 0.00 H new ATOM 0 HA ASN A 13 5.941 -0.761 -9.543 1.00 0.00 H new ATOM 0 HB2 ASN A 13 4.762 -1.997 -7.640 1.00 0.00 H new ATOM 0 HB3 ASN A 13 6.333 -2.131 -6.876 1.00 0.00 H new ATOM 0 HD21 ASN A 13 5.891 1.061 -5.383 1.00 0.00 H new ATOM 0 HD22 ASN A 13 6.432 -0.614 -5.231 1.00 0.00 H new ATOM 217 N LEU A 14 8.672 -1.623 -9.909 1.00 0.00 N ATOM 218 CA LEU A 14 10.045 -1.198 -10.157 1.00 0.00 C ATOM 219 C LEU A 14 9.939 0.257 -10.635 1.00 0.00 C ATOM 220 O LEU A 14 8.950 0.609 -11.287 1.00 0.00 O ATOM 221 CB LEU A 14 10.629 -2.139 -11.230 1.00 0.00 C ATOM 222 CG LEU A 14 12.132 -2.464 -11.168 1.00 0.00 C ATOM 223 CD1 LEU A 14 12.426 -3.562 -12.196 1.00 0.00 C ATOM 224 CD2 LEU A 14 13.045 -1.255 -11.398 1.00 0.00 C ATOM 0 H LEU A 14 8.341 -2.316 -10.580 1.00 0.00 H new ATOM 0 HA LEU A 14 10.701 -1.246 -9.288 1.00 0.00 H new ATOM 0 HB2 LEU A 14 10.082 -3.081 -11.181 1.00 0.00 H new ATOM 0 HB3 LEU A 14 10.423 -1.700 -12.206 1.00 0.00 H new ATOM 0 HG LEU A 14 12.354 -2.798 -10.155 1.00 0.00 H new ATOM 0 HD11 LEU A 14 13.487 -3.810 -12.170 1.00 0.00 H new ATOM 0 HD12 LEU A 14 11.840 -4.450 -11.958 1.00 0.00 H new ATOM 0 HD13 LEU A 14 12.160 -3.209 -13.192 1.00 0.00 H new ATOM 0 HD21 LEU A 14 14.087 -1.569 -11.338 1.00 0.00 H new ATOM 0 HD22 LEU A 14 12.849 -0.834 -12.384 1.00 0.00 H new ATOM 0 HD23 LEU A 14 12.849 -0.501 -10.636 1.00 0.00 H new ATOM 236 N ASN A 15 10.903 1.125 -10.315 1.00 0.00 N ATOM 237 CA ASN A 15 10.854 2.504 -10.802 1.00 0.00 C ATOM 238 C ASN A 15 11.025 2.494 -12.322 1.00 0.00 C ATOM 239 O ASN A 15 12.074 2.105 -12.833 1.00 0.00 O ATOM 240 CB ASN A 15 11.881 3.401 -10.097 1.00 0.00 C ATOM 241 CG ASN A 15 11.678 4.873 -10.470 1.00 0.00 C ATOM 242 OD1 ASN A 15 11.464 5.220 -11.627 1.00 0.00 O ATOM 243 ND2 ASN A 15 11.709 5.768 -9.498 1.00 0.00 N ATOM 0 H ASN A 15 11.711 0.903 -9.733 1.00 0.00 H new ATOM 0 HA ASN A 15 9.884 2.938 -10.562 1.00 0.00 H new ATOM 0 HB2 ASN A 15 11.792 3.281 -9.017 1.00 0.00 H new ATOM 0 HB3 ASN A 15 12.889 3.089 -10.371 1.00 0.00 H new ATOM 0 HD21 ASN A 15 11.554 6.754 -9.708 1.00 0.00 H new ATOM 0 HD22 ASN A 15 11.887 5.473 -8.538 1.00 0.00 H new ATOM 250 N GLU A 16 9.984 2.912 -13.043 1.00 0.00 N ATOM 251 CA GLU A 16 9.904 2.828 -14.496 1.00 0.00 C ATOM 252 C GLU A 16 10.975 3.643 -15.235 1.00 0.00 C ATOM 253 O GLU A 16 11.143 3.446 -16.437 1.00 0.00 O ATOM 254 CB GLU A 16 8.484 3.203 -14.961 1.00 0.00 C ATOM 255 CG GLU A 16 8.106 4.663 -14.662 1.00 0.00 C ATOM 256 CD GLU A 16 6.680 4.989 -15.141 1.00 0.00 C ATOM 257 OE1 GLU A 16 5.704 4.688 -14.416 1.00 0.00 O ATOM 258 OE2 GLU A 16 6.520 5.573 -16.235 1.00 0.00 O ATOM 0 H GLU A 16 9.155 3.328 -12.619 1.00 0.00 H new ATOM 0 HA GLU A 16 10.115 1.792 -14.762 1.00 0.00 H new ATOM 0 HB2 GLU A 16 8.403 3.028 -16.034 1.00 0.00 H new ATOM 0 HB3 GLU A 16 7.765 2.543 -14.475 1.00 0.00 H new ATOM 0 HG2 GLU A 16 8.181 4.847 -13.590 1.00 0.00 H new ATOM 0 HG3 GLU A 16 8.816 5.331 -15.150 1.00 0.00 H new ATOM 265 N LYS A 17 11.711 4.547 -14.574 1.00 0.00 N ATOM 266 CA LYS A 17 12.801 5.255 -15.240 1.00 0.00 C ATOM 267 C LYS A 17 13.970 4.324 -15.572 1.00 0.00 C ATOM 268 O LYS A 17 14.610 4.507 -16.608 1.00 0.00 O ATOM 269 CB LYS A 17 13.241 6.482 -14.432 1.00 0.00 C ATOM 270 CG LYS A 17 14.181 6.186 -13.254 1.00 0.00 C ATOM 271 CD LYS A 17 14.336 7.457 -12.422 1.00 0.00 C ATOM 272 CE LYS A 17 15.280 7.217 -11.236 1.00 0.00 C ATOM 273 NZ LYS A 17 15.500 8.450 -10.437 1.00 0.00 N ATOM 0 H LYS A 17 11.572 4.799 -13.596 1.00 0.00 H new ATOM 0 HA LYS A 17 12.422 5.620 -16.195 1.00 0.00 H new ATOM 0 HB2 LYS A 17 13.737 7.182 -15.105 1.00 0.00 H new ATOM 0 HB3 LYS A 17 12.352 6.983 -14.050 1.00 0.00 H new ATOM 0 HG2 LYS A 17 13.777 5.380 -12.641 1.00 0.00 H new ATOM 0 HG3 LYS A 17 15.152 5.853 -13.620 1.00 0.00 H new ATOM 0 HD2 LYS A 17 14.726 8.261 -13.046 1.00 0.00 H new ATOM 0 HD3 LYS A 17 13.361 7.780 -12.058 1.00 0.00 H new ATOM 0 HE2 LYS A 17 14.865 6.439 -10.595 1.00 0.00 H new ATOM 0 HE3 LYS A 17 16.238 6.849 -11.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 16.143 8.242 -9.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 15.920 9.185 -11.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 14.590 8.788 -10.063 1.00 0.00 H new ATOM 287 N ILE A 18 14.237 3.345 -14.703 1.00 0.00 N ATOM 288 CA ILE A 18 15.427 2.497 -14.721 1.00 0.00 C ATOM 289 C ILE A 18 15.535 1.791 -16.075 1.00 0.00 C ATOM 290 O ILE A 18 14.689 0.965 -16.416 1.00 0.00 O ATOM 291 CB ILE A 18 15.376 1.531 -13.509 1.00 0.00 C ATOM 292 CG1 ILE A 18 15.299 2.269 -12.149 1.00 0.00 C ATOM 293 CG2 ILE A 18 16.562 0.557 -13.478 1.00 0.00 C ATOM 294 CD1 ILE A 18 16.453 3.233 -11.834 1.00 0.00 C ATOM 0 H ILE A 18 13.603 3.114 -13.938 1.00 0.00 H new ATOM 0 HA ILE A 18 16.337 3.087 -14.615 1.00 0.00 H new ATOM 0 HB ILE A 18 14.455 0.965 -13.651 1.00 0.00 H new ATOM 0 HG12 ILE A 18 14.365 2.830 -12.116 1.00 0.00 H new ATOM 0 HG13 ILE A 18 15.250 1.522 -11.356 1.00 0.00 H new ATOM 0 HG21 ILE A 18 16.475 -0.095 -12.609 1.00 0.00 H new ATOM 0 HG22 ILE A 18 16.561 -0.046 -14.386 1.00 0.00 H new ATOM 0 HG23 ILE A 18 17.493 1.120 -13.417 1.00 0.00 H new ATOM 0 HD11 ILE A 18 16.290 3.690 -10.858 1.00 0.00 H new ATOM 0 HD12 ILE A 18 17.394 2.683 -11.824 1.00 0.00 H new ATOM 0 HD13 ILE A 18 16.495 4.011 -12.596 1.00 0.00 H new ATOM 306 N LYS A 19 16.555 2.143 -16.864 1.00 0.00 N ATOM 307 CA LYS A 19 16.821 1.545 -18.173 1.00 0.00 C ATOM 308 C LYS A 19 17.200 0.071 -17.994 1.00 0.00 C ATOM 309 O LYS A 19 17.605 -0.337 -16.908 1.00 0.00 O ATOM 310 CB LYS A 19 17.922 2.380 -18.858 1.00 0.00 C ATOM 311 CG LYS A 19 18.087 2.121 -20.364 1.00 0.00 C ATOM 312 CD LYS A 19 19.081 3.122 -20.972 1.00 0.00 C ATOM 313 CE LYS A 19 19.250 2.880 -22.479 1.00 0.00 C ATOM 314 NZ LYS A 19 20.186 3.853 -23.098 1.00 0.00 N ATOM 0 H LYS A 19 17.229 2.863 -16.605 1.00 0.00 H new ATOM 0 HA LYS A 19 15.940 1.558 -18.814 1.00 0.00 H new ATOM 0 HB2 LYS A 19 17.703 3.437 -18.708 1.00 0.00 H new ATOM 0 HB3 LYS A 19 18.872 2.178 -18.363 1.00 0.00 H new ATOM 0 HG2 LYS A 19 18.440 1.103 -20.528 1.00 0.00 H new ATOM 0 HG3 LYS A 19 17.122 2.208 -20.863 1.00 0.00 H new ATOM 0 HD2 LYS A 19 18.730 4.139 -20.800 1.00 0.00 H new ATOM 0 HD3 LYS A 19 20.046 3.030 -20.474 1.00 0.00 H new ATOM 0 HE2 LYS A 19 19.618 1.867 -22.644 1.00 0.00 H new ATOM 0 HE3 LYS A 19 18.279 2.950 -22.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 20.271 3.654 -24.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 19.823 4.818 -22.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 21.121 3.769 -22.649 1.00 0.00 H new ATOM 328 N LYS A 20 17.138 -0.724 -19.066 1.00 0.00 N ATOM 329 CA LYS A 20 17.442 -2.161 -19.036 1.00 0.00 C ATOM 330 C LYS A 20 18.828 -2.422 -18.455 1.00 0.00 C ATOM 331 O LYS A 20 18.986 -3.305 -17.617 1.00 0.00 O ATOM 332 CB LYS A 20 17.299 -2.736 -20.459 1.00 0.00 C ATOM 333 CG LYS A 20 17.282 -4.274 -20.516 1.00 0.00 C ATOM 334 CD LYS A 20 18.662 -4.926 -20.717 1.00 0.00 C ATOM 335 CE LYS A 20 18.600 -6.464 -20.708 1.00 0.00 C ATOM 336 NZ LYS A 20 17.778 -7.034 -21.809 1.00 0.00 N ATOM 0 H LYS A 20 16.872 -0.386 -19.991 1.00 0.00 H new ATOM 0 HA LYS A 20 16.733 -2.666 -18.381 1.00 0.00 H new ATOM 0 HB2 LYS A 20 16.378 -2.356 -20.902 1.00 0.00 H new ATOM 0 HB3 LYS A 20 18.122 -2.369 -21.072 1.00 0.00 H new ATOM 0 HG2 LYS A 20 16.847 -4.653 -19.591 1.00 0.00 H new ATOM 0 HG3 LYS A 20 16.626 -4.587 -21.328 1.00 0.00 H new ATOM 0 HD2 LYS A 20 19.084 -4.589 -21.664 1.00 0.00 H new ATOM 0 HD3 LYS A 20 19.336 -4.589 -19.930 1.00 0.00 H new ATOM 0 HE2 LYS A 20 19.613 -6.860 -20.780 1.00 0.00 H new ATOM 0 HE3 LYS A 20 18.194 -6.797 -19.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 18.016 -8.038 -21.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 16.769 -6.944 -21.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 17.973 -6.518 -22.691 1.00 0.00 H new ATOM 350 N GLU A 21 19.823 -1.650 -18.887 1.00 0.00 N ATOM 351 CA GLU A 21 21.194 -1.776 -18.407 1.00 0.00 C ATOM 352 C GLU A 21 21.267 -1.463 -16.910 1.00 0.00 C ATOM 353 O GLU A 21 21.929 -2.178 -16.161 1.00 0.00 O ATOM 354 CB GLU A 21 22.079 -0.840 -19.241 1.00 0.00 C ATOM 355 CG GLU A 21 23.526 -0.759 -18.732 1.00 0.00 C ATOM 356 CD GLU A 21 24.424 0.023 -19.707 1.00 0.00 C ATOM 357 OE1 GLU A 21 24.533 1.263 -19.583 1.00 0.00 O ATOM 358 OE2 GLU A 21 25.048 -0.598 -20.599 1.00 0.00 O ATOM 0 H GLU A 21 19.698 -0.916 -19.584 1.00 0.00 H new ATOM 0 HA GLU A 21 21.553 -2.798 -18.526 1.00 0.00 H new ATOM 0 HB2 GLU A 21 22.084 -1.182 -20.276 1.00 0.00 H new ATOM 0 HB3 GLU A 21 21.643 0.159 -19.238 1.00 0.00 H new ATOM 0 HG2 GLU A 21 23.542 -0.277 -17.754 1.00 0.00 H new ATOM 0 HG3 GLU A 21 23.923 -1.765 -18.598 1.00 0.00 H new ATOM 365 N GLU A 22 20.562 -0.425 -16.460 1.00 0.00 N ATOM 366 CA GLU A 22 20.577 -0.008 -15.063 1.00 0.00 C ATOM 367 C GLU A 22 19.899 -1.067 -14.191 1.00 0.00 C ATOM 368 O GLU A 22 20.404 -1.404 -13.122 1.00 0.00 O ATOM 369 CB GLU A 22 19.884 1.352 -14.907 1.00 0.00 C ATOM 370 CG GLU A 22 20.590 2.473 -15.682 1.00 0.00 C ATOM 371 CD GLU A 22 19.843 3.811 -15.530 1.00 0.00 C ATOM 372 OE1 GLU A 22 18.632 3.873 -15.847 1.00 0.00 O ATOM 373 OE2 GLU A 22 20.470 4.810 -15.106 1.00 0.00 O ATOM 0 H GLU A 22 19.965 0.149 -17.056 1.00 0.00 H new ATOM 0 HA GLU A 22 21.611 0.097 -14.735 1.00 0.00 H new ATOM 0 HB2 GLU A 22 18.853 1.271 -15.253 1.00 0.00 H new ATOM 0 HB3 GLU A 22 19.846 1.616 -13.850 1.00 0.00 H new ATOM 0 HG2 GLU A 22 21.612 2.581 -15.320 1.00 0.00 H new ATOM 0 HG3 GLU A 22 20.652 2.206 -16.737 1.00 0.00 H new ATOM 380 N LEU A 23 18.790 -1.638 -14.670 1.00 0.00 N ATOM 381 CA LEU A 23 18.105 -2.772 -14.058 1.00 0.00 C ATOM 382 C LEU A 23 19.088 -3.935 -13.935 1.00 0.00 C ATOM 383 O LEU A 23 19.237 -4.494 -12.848 1.00 0.00 O ATOM 384 CB LEU A 23 16.831 -3.084 -14.887 1.00 0.00 C ATOM 385 CG LEU A 23 16.111 -4.437 -14.712 1.00 0.00 C ATOM 386 CD1 LEU A 23 16.861 -5.650 -15.270 1.00 0.00 C ATOM 387 CD2 LEU A 23 15.753 -4.643 -13.243 1.00 0.00 C ATOM 0 H LEU A 23 18.333 -1.311 -15.521 1.00 0.00 H new ATOM 0 HA LEU A 23 17.766 -2.557 -13.045 1.00 0.00 H new ATOM 0 HB2 LEU A 23 16.105 -2.300 -14.673 1.00 0.00 H new ATOM 0 HB3 LEU A 23 17.098 -2.992 -15.940 1.00 0.00 H new ATOM 0 HG LEU A 23 15.208 -4.374 -15.319 1.00 0.00 H new ATOM 0 HD11 LEU A 23 16.273 -6.552 -15.098 1.00 0.00 H new ATOM 0 HD12 LEU A 23 17.020 -5.519 -16.340 1.00 0.00 H new ATOM 0 HD13 LEU A 23 17.825 -5.744 -14.769 1.00 0.00 H new ATOM 0 HD21 LEU A 23 15.245 -5.600 -13.123 1.00 0.00 H new ATOM 0 HD22 LEU A 23 16.663 -4.638 -12.643 1.00 0.00 H new ATOM 0 HD23 LEU A 23 15.096 -3.839 -12.912 1.00 0.00 H new ATOM 399 N LYS A 24 19.795 -4.276 -15.018 1.00 0.00 N ATOM 400 CA LYS A 24 20.735 -5.394 -15.031 1.00 0.00 C ATOM 401 C LYS A 24 21.828 -5.172 -13.989 1.00 0.00 C ATOM 402 O LYS A 24 22.090 -6.069 -13.184 1.00 0.00 O ATOM 403 CB LYS A 24 21.297 -5.573 -16.454 1.00 0.00 C ATOM 404 CG LYS A 24 22.077 -6.889 -16.604 1.00 0.00 C ATOM 405 CD LYS A 24 22.577 -7.126 -18.040 1.00 0.00 C ATOM 406 CE LYS A 24 23.637 -6.123 -18.527 1.00 0.00 C ATOM 407 NZ LYS A 24 24.953 -6.293 -17.854 1.00 0.00 N ATOM 0 H LYS A 24 19.729 -3.783 -15.908 1.00 0.00 H new ATOM 0 HA LYS A 24 20.226 -6.319 -14.761 1.00 0.00 H new ATOM 0 HB2 LYS A 24 20.478 -5.553 -17.172 1.00 0.00 H new ATOM 0 HB3 LYS A 24 21.951 -4.735 -16.694 1.00 0.00 H new ATOM 0 HG2 LYS A 24 22.929 -6.880 -15.924 1.00 0.00 H new ATOM 0 HG3 LYS A 24 21.439 -7.720 -16.305 1.00 0.00 H new ATOM 0 HD2 LYS A 24 22.992 -8.132 -18.104 1.00 0.00 H new ATOM 0 HD3 LYS A 24 21.724 -7.090 -18.718 1.00 0.00 H new ATOM 0 HE2 LYS A 24 23.769 -6.236 -19.603 1.00 0.00 H new ATOM 0 HE3 LYS A 24 23.276 -5.109 -18.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 25.625 -5.590 -18.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 24.839 -6.158 -16.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 25.316 -7.250 -18.039 1.00 0.00 H new ATOM 421 N LYS A 25 22.428 -3.976 -13.956 1.00 0.00 N ATOM 422 CA LYS A 25 23.443 -3.648 -12.961 1.00 0.00 C ATOM 423 C LYS A 25 22.868 -3.749 -11.555 1.00 0.00 C ATOM 424 O LYS A 25 23.513 -4.345 -10.702 1.00 0.00 O ATOM 425 CB LYS A 25 24.031 -2.246 -13.180 1.00 0.00 C ATOM 426 CG LYS A 25 24.970 -2.183 -14.397 1.00 0.00 C ATOM 427 CD LYS A 25 25.831 -0.911 -14.413 1.00 0.00 C ATOM 428 CE LYS A 25 26.876 -0.918 -13.282 1.00 0.00 C ATOM 429 NZ LYS A 25 27.759 0.276 -13.328 1.00 0.00 N ATOM 0 H LYS A 25 22.224 -3.221 -14.611 1.00 0.00 H new ATOM 0 HA LYS A 25 24.249 -4.373 -13.076 1.00 0.00 H new ATOM 0 HB2 LYS A 25 23.218 -1.532 -13.315 1.00 0.00 H new ATOM 0 HB3 LYS A 25 24.578 -1.942 -12.287 1.00 0.00 H new ATOM 0 HG2 LYS A 25 25.620 -3.058 -14.395 1.00 0.00 H new ATOM 0 HG3 LYS A 25 24.378 -2.228 -15.311 1.00 0.00 H new ATOM 0 HD2 LYS A 25 26.336 -0.825 -15.375 1.00 0.00 H new ATOM 0 HD3 LYS A 25 25.190 -0.036 -14.311 1.00 0.00 H new ATOM 0 HE2 LYS A 25 26.367 -0.955 -12.319 1.00 0.00 H new ATOM 0 HE3 LYS A 25 27.483 -1.820 -13.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 28.446 0.230 -12.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 28.266 0.298 -14.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 27.184 1.137 -13.231 1.00 0.00 H new ATOM 443 N SER A 26 21.684 -3.199 -11.299 1.00 0.00 N ATOM 444 CA SER A 26 21.108 -3.159 -9.957 1.00 0.00 C ATOM 445 C SER A 26 20.821 -4.574 -9.438 1.00 0.00 C ATOM 446 O SER A 26 21.121 -4.904 -8.287 1.00 0.00 O ATOM 447 CB SER A 26 19.844 -2.291 -9.972 1.00 0.00 C ATOM 448 OG SER A 26 20.110 -1.010 -10.515 1.00 0.00 O ATOM 0 H SER A 26 21.097 -2.769 -12.014 1.00 0.00 H new ATOM 0 HA SER A 26 21.827 -2.712 -9.270 1.00 0.00 H new ATOM 0 HB2 SER A 26 19.068 -2.784 -10.558 1.00 0.00 H new ATOM 0 HB3 SER A 26 19.459 -2.186 -8.958 1.00 0.00 H new ATOM 0 HG SER A 26 19.888 -1.007 -11.470 1.00 0.00 H new ATOM 454 N LEU A 27 20.290 -5.436 -10.307 1.00 0.00 N ATOM 455 CA LEU A 27 20.034 -6.835 -9.990 1.00 0.00 C ATOM 456 C LEU A 27 21.344 -7.543 -9.655 1.00 0.00 C ATOM 457 O LEU A 27 21.436 -8.173 -8.603 1.00 0.00 O ATOM 458 CB LEU A 27 19.346 -7.529 -11.176 1.00 0.00 C ATOM 459 CG LEU A 27 17.828 -7.314 -11.264 1.00 0.00 C ATOM 460 CD1 LEU A 27 17.300 -8.011 -12.515 1.00 0.00 C ATOM 461 CD2 LEU A 27 17.072 -7.897 -10.075 1.00 0.00 C ATOM 0 H LEU A 27 20.025 -5.177 -11.257 1.00 0.00 H new ATOM 0 HA LEU A 27 19.374 -6.885 -9.124 1.00 0.00 H new ATOM 0 HB2 LEU A 27 19.802 -7.173 -12.100 1.00 0.00 H new ATOM 0 HB3 LEU A 27 19.543 -8.599 -11.115 1.00 0.00 H new ATOM 0 HG LEU A 27 17.666 -6.236 -11.283 1.00 0.00 H new ATOM 0 HD11 LEU A 27 16.222 -7.864 -12.586 1.00 0.00 H new ATOM 0 HD12 LEU A 27 17.783 -7.590 -13.397 1.00 0.00 H new ATOM 0 HD13 LEU A 27 17.517 -9.077 -12.456 1.00 0.00 H new ATOM 0 HD21 LEU A 27 16.005 -7.712 -10.197 1.00 0.00 H new ATOM 0 HD22 LEU A 27 17.251 -8.971 -10.021 1.00 0.00 H new ATOM 0 HD23 LEU A 27 17.419 -7.425 -9.156 1.00 0.00 H new ATOM 473 N TYR A 28 22.364 -7.410 -10.504 1.00 0.00 N ATOM 474 CA TYR A 28 23.665 -8.018 -10.245 1.00 0.00 C ATOM 475 C TYR A 28 24.286 -7.463 -8.952 1.00 0.00 C ATOM 476 O TYR A 28 24.901 -8.208 -8.188 1.00 0.00 O ATOM 477 CB TYR A 28 24.580 -7.784 -11.455 1.00 0.00 C ATOM 478 CG TYR A 28 25.930 -8.465 -11.339 1.00 0.00 C ATOM 479 CD1 TYR A 28 26.052 -9.839 -11.622 1.00 0.00 C ATOM 480 CD2 TYR A 28 27.062 -7.730 -10.934 1.00 0.00 C ATOM 481 CE1 TYR A 28 27.297 -10.480 -11.500 1.00 0.00 C ATOM 482 CE2 TYR A 28 28.312 -8.364 -10.808 1.00 0.00 C ATOM 483 CZ TYR A 28 28.434 -9.745 -11.091 1.00 0.00 C ATOM 484 OH TYR A 28 29.637 -10.377 -10.977 1.00 0.00 O ATOM 0 H TYR A 28 22.312 -6.886 -11.377 1.00 0.00 H new ATOM 0 HA TYR A 28 23.540 -9.091 -10.101 1.00 0.00 H new ATOM 0 HB2 TYR A 28 24.078 -8.143 -12.354 1.00 0.00 H new ATOM 0 HB3 TYR A 28 24.733 -6.712 -11.582 1.00 0.00 H new ATOM 0 HD1 TYR A 28 25.185 -10.403 -11.934 1.00 0.00 H new ATOM 0 HD2 TYR A 28 26.970 -6.676 -10.719 1.00 0.00 H new ATOM 0 HE1 TYR A 28 27.385 -11.534 -11.719 1.00 0.00 H new ATOM 0 HE2 TYR A 28 29.177 -7.797 -10.496 1.00 0.00 H new ATOM 0 HH TYR A 28 30.318 -9.734 -10.688 1.00 0.00 H new ATOM 494 N ALA A 29 24.112 -6.164 -8.690 1.00 0.00 N ATOM 495 CA ALA A 29 24.674 -5.486 -7.536 1.00 0.00 C ATOM 496 C ALA A 29 24.032 -5.952 -6.225 1.00 0.00 C ATOM 497 O ALA A 29 24.737 -5.995 -5.217 1.00 0.00 O ATOM 498 CB ALA A 29 24.518 -3.968 -7.688 1.00 0.00 C ATOM 0 H ALA A 29 23.564 -5.549 -9.291 1.00 0.00 H new ATOM 0 HA ALA A 29 25.733 -5.741 -7.491 1.00 0.00 H new ATOM 0 HB1 ALA A 29 24.943 -3.470 -6.817 1.00 0.00 H new ATOM 0 HB2 ALA A 29 25.040 -3.637 -8.586 1.00 0.00 H new ATOM 0 HB3 ALA A 29 23.460 -3.717 -7.769 1.00 0.00 H new ATOM 504 N ILE A 30 22.730 -6.288 -6.213 1.00 0.00 N ATOM 505 CA ILE A 30 22.002 -6.531 -4.962 1.00 0.00 C ATOM 506 C ILE A 30 21.364 -7.922 -4.947 1.00 0.00 C ATOM 507 O ILE A 30 21.647 -8.695 -4.035 1.00 0.00 O ATOM 508 CB ILE A 30 20.962 -5.409 -4.688 1.00 0.00 C ATOM 509 CG1 ILE A 30 21.574 -3.994 -4.855 1.00 0.00 C ATOM 510 CG2 ILE A 30 20.374 -5.571 -3.274 1.00 0.00 C ATOM 511 CD1 ILE A 30 20.613 -2.826 -4.597 1.00 0.00 C ATOM 0 H ILE A 30 22.164 -6.396 -7.055 1.00 0.00 H new ATOM 0 HA ILE A 30 22.724 -6.505 -4.146 1.00 0.00 H new ATOM 0 HB ILE A 30 20.167 -5.509 -5.427 1.00 0.00 H new ATOM 0 HG12 ILE A 30 22.422 -3.901 -4.176 1.00 0.00 H new ATOM 0 HG13 ILE A 30 21.965 -3.903 -5.868 1.00 0.00 H new ATOM 0 HG21 ILE A 30 19.646 -4.781 -3.090 1.00 0.00 H new ATOM 0 HG22 ILE A 30 19.884 -6.541 -3.193 1.00 0.00 H new ATOM 0 HG23 ILE A 30 21.175 -5.506 -2.537 1.00 0.00 H new ATOM 0 HD11 ILE A 30 21.140 -1.883 -4.740 1.00 0.00 H new ATOM 0 HD12 ILE A 30 19.776 -2.883 -5.293 1.00 0.00 H new ATOM 0 HD13 ILE A 30 20.240 -2.881 -3.574 1.00 0.00 H new ATOM 523 N PHE A 31 20.530 -8.282 -5.926 1.00 0.00 N ATOM 524 CA PHE A 31 19.780 -9.539 -5.878 1.00 0.00 C ATOM 525 C PHE A 31 20.718 -10.749 -5.916 1.00 0.00 C ATOM 526 O PHE A 31 20.452 -11.730 -5.219 1.00 0.00 O ATOM 527 CB PHE A 31 18.738 -9.609 -7.003 1.00 0.00 C ATOM 528 CG PHE A 31 17.399 -8.961 -6.695 1.00 0.00 C ATOM 529 CD1 PHE A 31 17.282 -7.560 -6.618 1.00 0.00 C ATOM 530 CD2 PHE A 31 16.247 -9.759 -6.543 1.00 0.00 C ATOM 531 CE1 PHE A 31 16.019 -6.965 -6.441 1.00 0.00 C ATOM 532 CE2 PHE A 31 14.988 -9.164 -6.359 1.00 0.00 C ATOM 533 CZ PHE A 31 14.872 -7.765 -6.318 1.00 0.00 C ATOM 0 H PHE A 31 20.357 -7.721 -6.760 1.00 0.00 H new ATOM 0 HA PHE A 31 19.245 -9.566 -4.929 1.00 0.00 H new ATOM 0 HB2 PHE A 31 19.156 -9.135 -7.891 1.00 0.00 H new ATOM 0 HB3 PHE A 31 18.567 -10.656 -7.251 1.00 0.00 H new ATOM 0 HD1 PHE A 31 18.163 -6.941 -6.695 1.00 0.00 H new ATOM 0 HD2 PHE A 31 16.333 -10.835 -6.568 1.00 0.00 H new ATOM 0 HE1 PHE A 31 15.932 -5.889 -6.400 1.00 0.00 H new ATOM 0 HE2 PHE A 31 14.109 -9.782 -6.249 1.00 0.00 H new ATOM 0 HZ PHE A 31 13.903 -7.306 -6.192 1.00 0.00 H new ATOM 543 N SER A 32 21.840 -10.693 -6.643 1.00 0.00 N ATOM 544 CA SER A 32 22.828 -11.770 -6.595 1.00 0.00 C ATOM 545 C SER A 32 23.396 -11.979 -5.189 1.00 0.00 C ATOM 546 O SER A 32 23.624 -13.128 -4.811 1.00 0.00 O ATOM 547 CB SER A 32 23.959 -11.523 -7.591 1.00 0.00 C ATOM 548 OG SER A 32 23.445 -11.646 -8.900 1.00 0.00 O ATOM 0 H SER A 32 22.082 -9.921 -7.264 1.00 0.00 H new ATOM 0 HA SER A 32 22.305 -12.684 -6.875 1.00 0.00 H new ATOM 0 HB2 SER A 32 24.382 -10.529 -7.443 1.00 0.00 H new ATOM 0 HB3 SER A 32 24.765 -12.240 -7.433 1.00 0.00 H new ATOM 0 HG SER A 32 24.162 -11.488 -9.549 1.00 0.00 H new ATOM 554 N GLN A 33 23.543 -10.924 -4.378 1.00 0.00 N ATOM 555 CA GLN A 33 24.023 -11.045 -2.999 1.00 0.00 C ATOM 556 C GLN A 33 23.035 -11.832 -2.121 1.00 0.00 C ATOM 557 O GLN A 33 23.403 -12.256 -1.024 1.00 0.00 O ATOM 558 CB GLN A 33 24.292 -9.663 -2.375 1.00 0.00 C ATOM 559 CG GLN A 33 25.216 -8.770 -3.218 1.00 0.00 C ATOM 560 CD GLN A 33 25.581 -7.466 -2.497 1.00 0.00 C ATOM 561 OE1 GLN A 33 24.758 -6.832 -1.838 1.00 0.00 O ATOM 562 NE2 GLN A 33 26.834 -7.043 -2.577 1.00 0.00 N ATOM 0 H GLN A 33 23.333 -9.966 -4.660 1.00 0.00 H new ATOM 0 HA GLN A 33 24.962 -11.598 -3.040 1.00 0.00 H new ATOM 0 HB2 GLN A 33 23.342 -9.150 -2.228 1.00 0.00 H new ATOM 0 HB3 GLN A 33 24.736 -9.800 -1.389 1.00 0.00 H new ATOM 0 HG2 GLN A 33 26.127 -9.318 -3.458 1.00 0.00 H new ATOM 0 HG3 GLN A 33 24.727 -8.535 -4.164 1.00 0.00 H new ATOM 0 HE21 GLN A 33 27.516 -7.569 -3.123 1.00 0.00 H new ATOM 0 HE22 GLN A 33 27.117 -6.191 -2.092 1.00 0.00 H new ATOM 571 N PHE A 34 21.804 -12.049 -2.599 1.00 0.00 N ATOM 572 CA PHE A 34 20.737 -12.723 -1.877 1.00 0.00 C ATOM 573 C PHE A 34 20.281 -14.005 -2.585 1.00 0.00 C ATOM 574 O PHE A 34 19.341 -14.632 -2.097 1.00 0.00 O ATOM 575 CB PHE A 34 19.584 -11.728 -1.645 1.00 0.00 C ATOM 576 CG PHE A 34 19.960 -10.531 -0.787 1.00 0.00 C ATOM 577 CD1 PHE A 34 20.334 -10.734 0.558 1.00 0.00 C ATOM 578 CD2 PHE A 34 19.940 -9.221 -1.312 1.00 0.00 C ATOM 579 CE1 PHE A 34 20.689 -9.642 1.370 1.00 0.00 C ATOM 580 CE2 PHE A 34 20.288 -8.131 -0.493 1.00 0.00 C ATOM 581 CZ PHE A 34 20.663 -8.339 0.846 1.00 0.00 C ATOM 0 H PHE A 34 21.521 -11.747 -3.531 1.00 0.00 H new ATOM 0 HA PHE A 34 21.111 -13.052 -0.907 1.00 0.00 H new ATOM 0 HB2 PHE A 34 19.227 -11.371 -2.611 1.00 0.00 H new ATOM 0 HB3 PHE A 34 18.754 -12.254 -1.173 1.00 0.00 H new ATOM 0 HD1 PHE A 34 20.348 -11.734 0.966 1.00 0.00 H new ATOM 0 HD2 PHE A 34 19.658 -9.055 -2.341 1.00 0.00 H new ATOM 0 HE1 PHE A 34 20.982 -9.805 2.397 1.00 0.00 H new ATOM 0 HE2 PHE A 34 20.267 -7.129 -0.895 1.00 0.00 H new ATOM 0 HZ PHE A 34 20.930 -7.499 1.470 1.00 0.00 H new ATOM 591 N GLY A 35 20.925 -14.447 -3.677 1.00 0.00 N ATOM 592 CA GLY A 35 20.552 -15.718 -4.297 1.00 0.00 C ATOM 593 C GLY A 35 21.305 -16.140 -5.560 1.00 0.00 C ATOM 594 O GLY A 35 20.860 -17.091 -6.193 1.00 0.00 O ATOM 0 H GLY A 35 21.689 -13.952 -4.137 1.00 0.00 H new ATOM 0 HA2 GLY A 35 20.678 -16.504 -3.553 1.00 0.00 H new ATOM 0 HA3 GLY A 35 19.490 -15.675 -4.538 1.00 0.00 H new ATOM 598 N GLN A 36 22.403 -15.466 -5.923 1.00 0.00 N ATOM 599 CA GLN A 36 23.160 -15.574 -7.176 1.00 0.00 C ATOM 600 C GLN A 36 22.301 -15.792 -8.432 1.00 0.00 C ATOM 601 O GLN A 36 21.845 -16.893 -8.747 1.00 0.00 O ATOM 602 CB GLN A 36 24.311 -16.587 -7.060 1.00 0.00 C ATOM 603 CG GLN A 36 25.223 -16.595 -8.307 1.00 0.00 C ATOM 604 CD GLN A 36 25.745 -15.202 -8.684 1.00 0.00 C ATOM 605 OE1 GLN A 36 26.548 -14.611 -7.968 1.00 0.00 O ATOM 606 NE2 GLN A 36 25.271 -14.627 -9.780 1.00 0.00 N ATOM 0 H GLN A 36 22.818 -14.775 -5.298 1.00 0.00 H new ATOM 0 HA GLN A 36 23.602 -14.589 -7.328 1.00 0.00 H new ATOM 0 HB2 GLN A 36 24.909 -16.353 -6.179 1.00 0.00 H new ATOM 0 HB3 GLN A 36 23.898 -17.585 -6.910 1.00 0.00 H new ATOM 0 HG2 GLN A 36 26.070 -17.256 -8.125 1.00 0.00 H new ATOM 0 HG3 GLN A 36 24.671 -17.009 -9.150 1.00 0.00 H new ATOM 0 HE21 GLN A 36 24.604 -15.125 -10.370 1.00 0.00 H new ATOM 0 HE22 GLN A 36 25.573 -13.686 -10.034 1.00 0.00 H new ATOM 615 N ILE A 37 22.134 -14.714 -9.192 1.00 0.00 N ATOM 616 CA ILE A 37 21.443 -14.713 -10.472 1.00 0.00 C ATOM 617 C ILE A 37 22.109 -15.691 -11.450 1.00 0.00 C ATOM 618 O ILE A 37 23.318 -15.929 -11.396 1.00 0.00 O ATOM 619 CB ILE A 37 21.409 -13.257 -10.980 1.00 0.00 C ATOM 620 CG1 ILE A 37 20.469 -12.469 -10.039 1.00 0.00 C ATOM 621 CG2 ILE A 37 20.975 -13.125 -12.446 1.00 0.00 C ATOM 622 CD1 ILE A 37 20.399 -10.977 -10.323 1.00 0.00 C ATOM 0 H ILE A 37 22.486 -13.794 -8.926 1.00 0.00 H new ATOM 0 HA ILE A 37 20.417 -15.067 -10.372 1.00 0.00 H new ATOM 0 HB ILE A 37 22.421 -12.852 -10.960 1.00 0.00 H new ATOM 0 HG12 ILE A 37 19.466 -12.888 -10.114 1.00 0.00 H new ATOM 0 HG13 ILE A 37 20.799 -12.615 -9.011 1.00 0.00 H new ATOM 0 HG21 ILE A 37 20.975 -12.073 -12.732 1.00 0.00 H new ATOM 0 HG22 ILE A 37 21.669 -13.674 -13.082 1.00 0.00 H new ATOM 0 HG23 ILE A 37 19.972 -13.534 -12.567 1.00 0.00 H new ATOM 0 HD11 ILE A 37 19.717 -10.504 -9.616 1.00 0.00 H new ATOM 0 HD12 ILE A 37 21.392 -10.540 -10.218 1.00 0.00 H new ATOM 0 HD13 ILE A 37 20.038 -10.817 -11.339 1.00 0.00 H new ATOM 634 N LEU A 38 21.295 -16.196 -12.374 1.00 0.00 N ATOM 635 CA LEU A 38 21.651 -17.052 -13.493 1.00 0.00 C ATOM 636 C LEU A 38 21.301 -16.324 -14.796 1.00 0.00 C ATOM 637 O LEU A 38 22.127 -16.326 -15.709 1.00 0.00 O ATOM 638 CB LEU A 38 20.909 -18.394 -13.322 1.00 0.00 C ATOM 639 CG LEU A 38 21.164 -19.518 -14.348 1.00 0.00 C ATOM 640 CD1 LEU A 38 20.460 -19.309 -15.693 1.00 0.00 C ATOM 641 CD2 LEU A 38 22.658 -19.784 -14.559 1.00 0.00 C ATOM 0 H LEU A 38 20.294 -16.000 -12.354 1.00 0.00 H new ATOM 0 HA LEU A 38 22.719 -17.269 -13.528 1.00 0.00 H new ATOM 0 HB2 LEU A 38 21.157 -18.785 -12.335 1.00 0.00 H new ATOM 0 HB3 LEU A 38 19.840 -18.183 -13.322 1.00 0.00 H new ATOM 0 HG LEU A 38 20.715 -20.404 -13.899 1.00 0.00 H new ATOM 0 HD11 LEU A 38 20.690 -20.142 -16.357 1.00 0.00 H new ATOM 0 HD12 LEU A 38 19.383 -19.257 -15.536 1.00 0.00 H new ATOM 0 HD13 LEU A 38 20.806 -18.379 -16.144 1.00 0.00 H new ATOM 0 HD21 LEU A 38 22.786 -20.583 -15.289 1.00 0.00 H new ATOM 0 HD22 LEU A 38 23.141 -18.878 -14.924 1.00 0.00 H new ATOM 0 HD23 LEU A 38 23.112 -20.081 -13.613 1.00 0.00 H new ATOM 653 N ASP A 39 20.146 -15.640 -14.884 1.00 0.00 N ATOM 654 CA ASP A 39 19.778 -14.836 -16.063 1.00 0.00 C ATOM 655 C ASP A 39 18.777 -13.734 -15.688 1.00 0.00 C ATOM 656 O ASP A 39 18.159 -13.815 -14.631 1.00 0.00 O ATOM 657 CB ASP A 39 19.209 -15.742 -17.170 1.00 0.00 C ATOM 658 CG ASP A 39 18.918 -14.971 -18.468 1.00 0.00 C ATOM 659 OD1 ASP A 39 19.724 -14.090 -18.845 1.00 0.00 O ATOM 660 OD2 ASP A 39 17.893 -15.259 -19.122 1.00 0.00 O ATOM 0 H ASP A 39 19.445 -15.629 -14.144 1.00 0.00 H new ATOM 0 HA ASP A 39 20.678 -14.351 -16.442 1.00 0.00 H new ATOM 0 HB2 ASP A 39 19.917 -16.544 -17.378 1.00 0.00 H new ATOM 0 HB3 ASP A 39 18.291 -16.211 -16.816 1.00 0.00 H new ATOM 665 N ILE A 40 18.604 -12.706 -16.522 1.00 0.00 N ATOM 666 CA ILE A 40 17.794 -11.510 -16.264 1.00 0.00 C ATOM 667 C ILE A 40 17.005 -11.215 -17.547 1.00 0.00 C ATOM 668 O ILE A 40 17.545 -11.359 -18.647 1.00 0.00 O ATOM 669 CB ILE A 40 18.720 -10.321 -15.875 1.00 0.00 C ATOM 670 CG1 ILE A 40 19.430 -10.593 -14.527 1.00 0.00 C ATOM 671 CG2 ILE A 40 17.938 -8.995 -15.811 1.00 0.00 C ATOM 672 CD1 ILE A 40 20.511 -9.582 -14.117 1.00 0.00 C ATOM 0 H ILE A 40 19.046 -12.683 -17.441 1.00 0.00 H new ATOM 0 HA ILE A 40 17.104 -11.664 -15.434 1.00 0.00 H new ATOM 0 HB ILE A 40 19.477 -10.228 -16.654 1.00 0.00 H new ATOM 0 HG12 ILE A 40 18.675 -10.625 -13.742 1.00 0.00 H new ATOM 0 HG13 ILE A 40 19.885 -11.582 -14.572 1.00 0.00 H new ATOM 0 HG21 ILE A 40 18.615 -8.186 -15.537 1.00 0.00 H new ATOM 0 HG22 ILE A 40 17.498 -8.785 -16.786 1.00 0.00 H new ATOM 0 HG23 ILE A 40 17.147 -9.075 -15.065 1.00 0.00 H new ATOM 0 HD11 ILE A 40 20.938 -9.875 -13.158 1.00 0.00 H new ATOM 0 HD12 ILE A 40 21.296 -9.562 -14.873 1.00 0.00 H new ATOM 0 HD13 ILE A 40 20.067 -8.590 -14.029 1.00 0.00 H new ATOM 684 N VAL A 41 15.752 -10.760 -17.414 1.00 0.00 N ATOM 685 CA VAL A 41 14.890 -10.399 -18.533 1.00 0.00 C ATOM 686 C VAL A 41 14.160 -9.093 -18.188 1.00 0.00 C ATOM 687 O VAL A 41 13.250 -9.062 -17.358 1.00 0.00 O ATOM 688 CB VAL A 41 13.919 -11.553 -18.886 1.00 0.00 C ATOM 689 CG1 VAL A 41 13.123 -11.220 -20.159 1.00 0.00 C ATOM 690 CG2 VAL A 41 14.630 -12.900 -19.108 1.00 0.00 C ATOM 0 H VAL A 41 15.306 -10.632 -16.505 1.00 0.00 H new ATOM 0 HA VAL A 41 15.489 -10.233 -19.428 1.00 0.00 H new ATOM 0 HB VAL A 41 13.258 -11.653 -18.025 1.00 0.00 H new ATOM 0 HG11 VAL A 41 12.446 -12.043 -20.391 1.00 0.00 H new ATOM 0 HG12 VAL A 41 12.546 -10.309 -19.999 1.00 0.00 H new ATOM 0 HG13 VAL A 41 13.812 -11.072 -20.991 1.00 0.00 H new ATOM 0 HG21 VAL A 41 13.893 -13.665 -19.352 1.00 0.00 H new ATOM 0 HG22 VAL A 41 15.340 -12.806 -19.930 1.00 0.00 H new ATOM 0 HG23 VAL A 41 15.162 -13.185 -18.200 1.00 0.00 H new ATOM 700 N ALA A 42 14.581 -8.007 -18.837 1.00 0.00 N ATOM 701 CA ALA A 42 13.946 -6.699 -18.870 1.00 0.00 C ATOM 702 C ALA A 42 14.242 -6.107 -20.253 1.00 0.00 C ATOM 703 O ALA A 42 15.064 -6.656 -20.999 1.00 0.00 O ATOM 704 CB ALA A 42 14.508 -5.818 -17.752 1.00 0.00 C ATOM 0 H ALA A 42 15.437 -8.025 -19.392 1.00 0.00 H new ATOM 0 HA ALA A 42 12.870 -6.766 -18.709 1.00 0.00 H new ATOM 0 HB1 ALA A 42 14.028 -4.840 -17.783 1.00 0.00 H new ATOM 0 HB2 ALA A 42 14.314 -6.287 -16.787 1.00 0.00 H new ATOM 0 HB3 ALA A 42 15.583 -5.699 -17.888 1.00 0.00 H new ATOM 710 N LEU A 43 13.612 -4.985 -20.601 1.00 0.00 N ATOM 711 CA LEU A 43 13.652 -4.410 -21.946 1.00 0.00 C ATOM 712 C LEU A 43 13.648 -2.886 -21.839 1.00 0.00 C ATOM 713 O LEU A 43 13.271 -2.332 -20.806 1.00 0.00 O ATOM 714 CB LEU A 43 12.442 -4.909 -22.772 1.00 0.00 C ATOM 715 CG LEU A 43 12.785 -5.367 -24.199 1.00 0.00 C ATOM 716 CD1 LEU A 43 13.598 -6.667 -24.191 1.00 0.00 C ATOM 717 CD2 LEU A 43 11.485 -5.599 -24.978 1.00 0.00 C ATOM 0 H LEU A 43 13.050 -4.441 -19.946 1.00 0.00 H new ATOM 0 HA LEU A 43 14.562 -4.726 -22.456 1.00 0.00 H new ATOM 0 HB2 LEU A 43 11.974 -5.738 -22.241 1.00 0.00 H new ATOM 0 HB3 LEU A 43 11.703 -4.109 -22.829 1.00 0.00 H new ATOM 0 HG LEU A 43 13.385 -4.589 -24.671 1.00 0.00 H new ATOM 0 HD11 LEU A 43 13.823 -6.962 -25.216 1.00 0.00 H new ATOM 0 HD12 LEU A 43 14.529 -6.511 -23.646 1.00 0.00 H new ATOM 0 HD13 LEU A 43 13.021 -7.454 -23.705 1.00 0.00 H new ATOM 0 HD21 LEU A 43 11.721 -5.924 -25.991 1.00 0.00 H new ATOM 0 HD22 LEU A 43 10.894 -6.367 -24.479 1.00 0.00 H new ATOM 0 HD23 LEU A 43 10.914 -4.671 -25.018 1.00 0.00 H new ATOM 729 N LYS A 44 14.078 -2.203 -22.904 1.00 0.00 N ATOM 730 CA LYS A 44 14.242 -0.747 -22.887 1.00 0.00 C ATOM 731 C LYS A 44 12.906 -0.009 -22.958 1.00 0.00 C ATOM 732 O LYS A 44 12.857 1.158 -22.567 1.00 0.00 O ATOM 733 CB LYS A 44 15.161 -0.300 -24.039 1.00 0.00 C ATOM 734 CG LYS A 44 16.584 -0.875 -23.926 1.00 0.00 C ATOM 735 CD LYS A 44 17.445 -0.452 -25.125 1.00 0.00 C ATOM 736 CE LYS A 44 18.837 -1.095 -25.036 1.00 0.00 C ATOM 737 NZ LYS A 44 19.684 -0.764 -26.210 1.00 0.00 N ATOM 0 H LYS A 44 14.320 -2.639 -23.794 1.00 0.00 H new ATOM 0 HA LYS A 44 14.702 -0.486 -21.934 1.00 0.00 H new ATOM 0 HB2 LYS A 44 14.723 -0.610 -24.988 1.00 0.00 H new ATOM 0 HB3 LYS A 44 15.214 0.789 -24.053 1.00 0.00 H new ATOM 0 HG2 LYS A 44 17.047 -0.530 -23.001 1.00 0.00 H new ATOM 0 HG3 LYS A 44 16.537 -1.963 -23.873 1.00 0.00 H new ATOM 0 HD2 LYS A 44 16.958 -0.750 -26.054 1.00 0.00 H new ATOM 0 HD3 LYS A 44 17.539 0.634 -25.148 1.00 0.00 H new ATOM 0 HE2 LYS A 44 19.333 -0.758 -24.126 1.00 0.00 H new ATOM 0 HE3 LYS A 44 18.731 -2.177 -24.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 20.613 -1.219 -26.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 19.225 -1.108 -27.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 19.808 0.267 -26.269 1.00 0.00 H new ATOM 751 N THR A 45 11.839 -0.640 -23.441 1.00 0.00 N ATOM 752 CA THR A 45 10.501 -0.068 -23.440 1.00 0.00 C ATOM 753 C THR A 45 9.997 0.023 -21.993 1.00 0.00 C ATOM 754 O THR A 45 10.207 -0.909 -21.214 1.00 0.00 O ATOM 755 CB THR A 45 9.602 -0.959 -24.318 1.00 0.00 C ATOM 756 OG1 THR A 45 9.825 -2.334 -24.041 1.00 0.00 O ATOM 757 CG2 THR A 45 9.896 -0.760 -25.808 1.00 0.00 C ATOM 0 H THR A 45 11.883 -1.574 -23.848 1.00 0.00 H new ATOM 0 HA THR A 45 10.493 0.941 -23.852 1.00 0.00 H new ATOM 0 HB THR A 45 8.575 -0.673 -24.089 1.00 0.00 H new ATOM 0 HG1 THR A 45 9.477 -2.549 -23.151 1.00 0.00 H new ATOM 0 HG21 THR A 45 9.243 -1.404 -26.397 1.00 0.00 H new ATOM 0 HG22 THR A 45 9.718 0.281 -26.078 1.00 0.00 H new ATOM 0 HG23 THR A 45 10.936 -1.015 -26.011 1.00 0.00 H new ATOM 765 N LEU A 46 9.297 1.106 -21.623 1.00 0.00 N ATOM 766 CA LEU A 46 8.837 1.338 -20.245 1.00 0.00 C ATOM 767 C LEU A 46 8.008 0.183 -19.664 1.00 0.00 C ATOM 768 O LEU A 46 8.102 -0.093 -18.467 1.00 0.00 O ATOM 769 CB LEU A 46 8.116 2.695 -20.097 1.00 0.00 C ATOM 770 CG LEU A 46 6.643 2.777 -20.562 1.00 0.00 C ATOM 771 CD1 LEU A 46 6.072 4.149 -20.193 1.00 0.00 C ATOM 772 CD2 LEU A 46 6.470 2.571 -22.074 1.00 0.00 C ATOM 0 H LEU A 46 9.033 1.847 -22.272 1.00 0.00 H new ATOM 0 HA LEU A 46 9.743 1.378 -19.641 1.00 0.00 H new ATOM 0 HB2 LEU A 46 8.153 2.983 -19.046 1.00 0.00 H new ATOM 0 HB3 LEU A 46 8.686 3.441 -20.652 1.00 0.00 H new ATOM 0 HG LEU A 46 6.112 1.970 -20.058 1.00 0.00 H new ATOM 0 HD11 LEU A 46 5.034 4.211 -20.519 1.00 0.00 H new ATOM 0 HD12 LEU A 46 6.122 4.285 -19.113 1.00 0.00 H new ATOM 0 HD13 LEU A 46 6.654 4.929 -20.684 1.00 0.00 H new ATOM 0 HD21 LEU A 46 5.413 2.641 -22.332 1.00 0.00 H new ATOM 0 HD22 LEU A 46 7.027 3.339 -22.612 1.00 0.00 H new ATOM 0 HD23 LEU A 46 6.847 1.587 -22.353 1.00 0.00 H new ATOM 784 N LYS A 47 7.274 -0.550 -20.513 1.00 0.00 N ATOM 785 CA LYS A 47 6.513 -1.751 -20.144 1.00 0.00 C ATOM 786 C LYS A 47 7.369 -2.850 -19.506 1.00 0.00 C ATOM 787 O LYS A 47 6.812 -3.760 -18.895 1.00 0.00 O ATOM 788 CB LYS A 47 5.749 -2.293 -21.369 1.00 0.00 C ATOM 789 CG LYS A 47 6.681 -2.847 -22.463 1.00 0.00 C ATOM 790 CD LYS A 47 5.912 -3.302 -23.709 1.00 0.00 C ATOM 791 CE LYS A 47 6.897 -3.860 -24.748 1.00 0.00 C ATOM 792 NZ LYS A 47 6.212 -4.306 -25.988 1.00 0.00 N ATOM 0 H LYS A 47 7.191 -0.317 -21.503 1.00 0.00 H new ATOM 0 HA LYS A 47 5.803 -1.444 -19.376 1.00 0.00 H new ATOM 0 HB2 LYS A 47 5.068 -3.081 -21.046 1.00 0.00 H new ATOM 0 HB3 LYS A 47 5.137 -1.496 -21.790 1.00 0.00 H new ATOM 0 HG2 LYS A 47 7.403 -2.080 -22.744 1.00 0.00 H new ATOM 0 HG3 LYS A 47 7.248 -3.687 -22.062 1.00 0.00 H new ATOM 0 HD2 LYS A 47 5.181 -4.065 -23.439 1.00 0.00 H new ATOM 0 HD3 LYS A 47 5.357 -2.465 -24.132 1.00 0.00 H new ATOM 0 HE2 LYS A 47 7.632 -3.095 -24.996 1.00 0.00 H new ATOM 0 HE3 LYS A 47 7.443 -4.698 -24.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 6.915 -4.675 -26.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 5.528 -5.055 -25.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 5.712 -3.501 -26.417 1.00 0.00 H new ATOM 806 N MET A 48 8.696 -2.786 -19.639 1.00 0.00 N ATOM 807 CA MET A 48 9.656 -3.727 -19.072 1.00 0.00 C ATOM 808 C MET A 48 10.749 -2.974 -18.291 1.00 0.00 C ATOM 809 O MET A 48 11.844 -3.499 -18.087 1.00 0.00 O ATOM 810 CB MET A 48 10.206 -4.617 -20.194 1.00 0.00 C ATOM 811 CG MET A 48 9.240 -5.726 -20.633 1.00 0.00 C ATOM 812 SD MET A 48 9.704 -7.406 -20.104 1.00 0.00 S ATOM 813 CE MET A 48 9.715 -7.229 -18.298 1.00 0.00 C ATOM 0 H MET A 48 9.148 -2.041 -20.170 1.00 0.00 H new ATOM 0 HA MET A 48 9.171 -4.382 -18.348 1.00 0.00 H new ATOM 0 HB2 MET A 48 10.445 -3.994 -21.056 1.00 0.00 H new ATOM 0 HB3 MET A 48 11.139 -5.071 -19.861 1.00 0.00 H new ATOM 0 HG2 MET A 48 8.248 -5.499 -20.242 1.00 0.00 H new ATOM 0 HG3 MET A 48 9.164 -5.712 -21.720 1.00 0.00 H new ATOM 0 HE1 MET A 48 10.018 -8.172 -17.842 1.00 0.00 H new ATOM 0 HE2 MET A 48 10.418 -6.446 -18.013 1.00 0.00 H new ATOM 0 HE3 MET A 48 8.716 -6.963 -17.952 1.00 0.00 H new ATOM 823 N ARG A 49 10.459 -1.736 -17.863 1.00 0.00 N ATOM 824 CA ARG A 49 11.280 -0.983 -16.912 1.00 0.00 C ATOM 825 C ARG A 49 10.563 -0.967 -15.566 1.00 0.00 C ATOM 826 O ARG A 49 11.210 -1.114 -14.538 1.00 0.00 O ATOM 827 CB ARG A 49 11.515 0.467 -17.355 1.00 0.00 C ATOM 828 CG ARG A 49 12.365 0.639 -18.620 1.00 0.00 C ATOM 829 CD ARG A 49 12.680 2.132 -18.806 1.00 0.00 C ATOM 830 NE ARG A 49 13.318 2.396 -20.099 1.00 0.00 N ATOM 831 CZ ARG A 49 14.158 3.389 -20.408 1.00 0.00 C ATOM 832 NH1 ARG A 49 14.655 4.208 -19.480 1.00 0.00 N ATOM 833 NH2 ARG A 49 14.495 3.537 -21.684 1.00 0.00 N ATOM 0 H ARG A 49 9.633 -1.225 -18.175 1.00 0.00 H new ATOM 0 HA ARG A 49 12.252 -1.472 -16.851 1.00 0.00 H new ATOM 0 HB2 ARG A 49 10.547 0.940 -17.521 1.00 0.00 H new ATOM 0 HB3 ARG A 49 11.996 1.005 -16.538 1.00 0.00 H new ATOM 0 HG2 ARG A 49 13.288 0.066 -18.535 1.00 0.00 H new ATOM 0 HG3 ARG A 49 11.831 0.255 -19.489 1.00 0.00 H new ATOM 0 HD2 ARG A 49 11.759 2.710 -18.730 1.00 0.00 H new ATOM 0 HD3 ARG A 49 13.335 2.468 -18.002 1.00 0.00 H new ATOM 0 HE ARG A 49 13.095 1.745 -20.852 1.00 0.00 H new ATOM 0 HH11 ARG A 49 14.396 4.086 -18.501 1.00 0.00 H new ATOM 0 HH12 ARG A 49 15.294 4.956 -19.749 1.00 0.00 H new ATOM 0 HH21 ARG A 49 14.115 2.905 -22.388 1.00 0.00 H new ATOM 0 HH22 ARG A 49 15.134 4.283 -21.960 1.00 0.00 H new ATOM 847 N GLY A 50 9.228 -0.830 -15.564 1.00 0.00 N ATOM 848 CA GLY A 50 8.415 -0.875 -14.347 1.00 0.00 C ATOM 849 C GLY A 50 8.235 -2.295 -13.794 1.00 0.00 C ATOM 850 O GLY A 50 7.717 -2.469 -12.689 1.00 0.00 O ATOM 0 H GLY A 50 8.683 -0.684 -16.414 1.00 0.00 H new ATOM 0 HA2 GLY A 50 8.880 -0.251 -13.584 1.00 0.00 H new ATOM 0 HA3 GLY A 50 7.435 -0.446 -14.556 1.00 0.00 H new ATOM 854 N GLN A 51 8.662 -3.311 -14.546 1.00 0.00 N ATOM 855 CA GLN A 51 8.584 -4.722 -14.202 1.00 0.00 C ATOM 856 C GLN A 51 9.709 -5.458 -14.933 1.00 0.00 C ATOM 857 O GLN A 51 10.243 -4.935 -15.912 1.00 0.00 O ATOM 858 CB GLN A 51 7.198 -5.275 -14.576 1.00 0.00 C ATOM 859 CG GLN A 51 6.766 -5.046 -16.031 1.00 0.00 C ATOM 860 CD GLN A 51 5.424 -5.704 -16.368 1.00 0.00 C ATOM 861 OE1 GLN A 51 4.810 -6.401 -15.561 1.00 0.00 O ATOM 862 NE2 GLN A 51 4.948 -5.491 -17.581 1.00 0.00 N ATOM 0 H GLN A 51 9.093 -3.158 -15.458 1.00 0.00 H new ATOM 0 HA GLN A 51 8.710 -4.867 -13.129 1.00 0.00 H new ATOM 0 HB2 GLN A 51 7.188 -6.347 -14.377 1.00 0.00 H new ATOM 0 HB3 GLN A 51 6.456 -4.821 -13.919 1.00 0.00 H new ATOM 0 HG2 GLN A 51 6.696 -3.975 -16.219 1.00 0.00 H new ATOM 0 HG3 GLN A 51 7.534 -5.438 -16.698 1.00 0.00 H new ATOM 0 HE21 GLN A 51 5.469 -4.911 -18.239 1.00 0.00 H new ATOM 0 HE22 GLN A 51 4.059 -5.907 -17.860 1.00 0.00 H new ATOM 871 N ALA A 52 10.066 -6.654 -14.464 1.00 0.00 N ATOM 872 CA ALA A 52 11.200 -7.449 -14.928 1.00 0.00 C ATOM 873 C ALA A 52 11.013 -8.896 -14.459 1.00 0.00 C ATOM 874 O ALA A 52 10.142 -9.170 -13.627 1.00 0.00 O ATOM 875 CB ALA A 52 12.504 -6.874 -14.345 1.00 0.00 C ATOM 0 H ALA A 52 9.548 -7.115 -13.716 1.00 0.00 H new ATOM 0 HA ALA A 52 11.256 -7.420 -16.016 1.00 0.00 H new ATOM 0 HB1 ALA A 52 13.350 -7.467 -14.691 1.00 0.00 H new ATOM 0 HB2 ALA A 52 12.626 -5.842 -14.674 1.00 0.00 H new ATOM 0 HB3 ALA A 52 12.461 -6.905 -13.256 1.00 0.00 H new ATOM 881 N PHE A 53 11.874 -9.799 -14.924 1.00 0.00 N ATOM 882 CA PHE A 53 11.988 -11.167 -14.437 1.00 0.00 C ATOM 883 C PHE A 53 13.474 -11.474 -14.256 1.00 0.00 C ATOM 884 O PHE A 53 14.323 -10.866 -14.916 1.00 0.00 O ATOM 885 CB PHE A 53 11.385 -12.175 -15.426 1.00 0.00 C ATOM 886 CG PHE A 53 9.959 -11.921 -15.875 1.00 0.00 C ATOM 887 CD1 PHE A 53 9.706 -11.075 -16.974 1.00 0.00 C ATOM 888 CD2 PHE A 53 8.890 -12.582 -15.242 1.00 0.00 C ATOM 889 CE1 PHE A 53 8.389 -10.882 -17.429 1.00 0.00 C ATOM 890 CE2 PHE A 53 7.575 -12.402 -15.710 1.00 0.00 C ATOM 891 CZ PHE A 53 7.324 -11.548 -16.796 1.00 0.00 C ATOM 0 H PHE A 53 12.532 -9.589 -15.675 1.00 0.00 H new ATOM 0 HA PHE A 53 11.441 -11.256 -13.499 1.00 0.00 H new ATOM 0 HB2 PHE A 53 12.020 -12.204 -16.311 1.00 0.00 H new ATOM 0 HB3 PHE A 53 11.427 -13.165 -14.971 1.00 0.00 H new ATOM 0 HD1 PHE A 53 10.525 -10.574 -17.468 1.00 0.00 H new ATOM 0 HD2 PHE A 53 9.079 -13.227 -14.397 1.00 0.00 H new ATOM 0 HE1 PHE A 53 8.196 -10.224 -18.263 1.00 0.00 H new ATOM 0 HE2 PHE A 53 6.757 -12.922 -15.233 1.00 0.00 H new ATOM 0 HZ PHE A 53 6.313 -11.402 -17.145 1.00 0.00 H new ATOM 901 N VAL A 54 13.799 -12.434 -13.396 1.00 0.00 N ATOM 902 CA VAL A 54 15.177 -12.839 -13.151 1.00 0.00 C ATOM 903 C VAL A 54 15.169 -14.286 -12.651 1.00 0.00 C ATOM 904 O VAL A 54 14.266 -14.699 -11.919 1.00 0.00 O ATOM 905 CB VAL A 54 15.891 -11.796 -12.251 1.00 0.00 C ATOM 906 CG1 VAL A 54 15.080 -11.285 -11.051 1.00 0.00 C ATOM 907 CG2 VAL A 54 17.246 -12.267 -11.721 1.00 0.00 C ATOM 0 H VAL A 54 13.112 -12.953 -12.849 1.00 0.00 H new ATOM 0 HA VAL A 54 15.780 -12.845 -14.059 1.00 0.00 H new ATOM 0 HB VAL A 54 16.021 -10.970 -12.950 1.00 0.00 H new ATOM 0 HG11 VAL A 54 15.674 -10.562 -10.492 1.00 0.00 H new ATOM 0 HG12 VAL A 54 14.167 -10.807 -11.406 1.00 0.00 H new ATOM 0 HG13 VAL A 54 14.823 -12.122 -10.402 1.00 0.00 H new ATOM 0 HG21 VAL A 54 17.685 -11.486 -11.100 1.00 0.00 H new ATOM 0 HG22 VAL A 54 17.110 -13.170 -11.126 1.00 0.00 H new ATOM 0 HG23 VAL A 54 17.910 -12.481 -12.559 1.00 0.00 H new ATOM 917 N ILE A 55 16.153 -15.052 -13.119 1.00 0.00 N ATOM 918 CA ILE A 55 16.317 -16.487 -12.970 1.00 0.00 C ATOM 919 C ILE A 55 17.576 -16.643 -12.114 1.00 0.00 C ATOM 920 O ILE A 55 18.547 -15.912 -12.332 1.00 0.00 O ATOM 921 CB ILE A 55 16.505 -17.170 -14.358 1.00 0.00 C ATOM 922 CG1 ILE A 55 15.429 -16.927 -15.450 1.00 0.00 C ATOM 923 CG2 ILE A 55 16.586 -18.699 -14.172 1.00 0.00 C ATOM 924 CD1 ILE A 55 15.277 -15.506 -16.014 1.00 0.00 C ATOM 0 H ILE A 55 16.918 -14.645 -13.657 1.00 0.00 H new ATOM 0 HA ILE A 55 15.446 -16.957 -12.515 1.00 0.00 H new ATOM 0 HB ILE A 55 17.415 -16.696 -14.726 1.00 0.00 H new ATOM 0 HG12 ILE A 55 15.644 -17.595 -16.284 1.00 0.00 H new ATOM 0 HG13 ILE A 55 14.465 -17.228 -15.040 1.00 0.00 H new ATOM 0 HG21 ILE A 55 16.717 -19.177 -15.143 1.00 0.00 H new ATOM 0 HG22 ILE A 55 17.432 -18.943 -13.530 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.666 -19.059 -13.712 1.00 0.00 H new ATOM 0 HD11 ILE A 55 14.488 -15.495 -16.766 1.00 0.00 H new ATOM 0 HD12 ILE A 55 15.019 -14.820 -15.207 1.00 0.00 H new ATOM 0 HD13 ILE A 55 16.216 -15.193 -16.470 1.00 0.00 H new ATOM 936 N PHE A 56 17.597 -17.599 -11.182 1.00 0.00 N ATOM 937 CA PHE A 56 18.663 -17.757 -10.192 1.00 0.00 C ATOM 938 C PHE A 56 19.309 -19.135 -10.263 1.00 0.00 C ATOM 939 O PHE A 56 18.859 -20.027 -10.983 1.00 0.00 O ATOM 940 CB PHE A 56 18.108 -17.509 -8.783 1.00 0.00 C ATOM 941 CG PHE A 56 17.692 -16.078 -8.547 1.00 0.00 C ATOM 942 CD1 PHE A 56 16.408 -15.648 -8.917 1.00 0.00 C ATOM 943 CD2 PHE A 56 18.611 -15.168 -7.995 1.00 0.00 C ATOM 944 CE1 PHE A 56 16.052 -14.302 -8.753 1.00 0.00 C ATOM 945 CE2 PHE A 56 18.241 -13.826 -7.801 1.00 0.00 C ATOM 946 CZ PHE A 56 16.966 -13.390 -8.198 1.00 0.00 C ATOM 0 H PHE A 56 16.859 -18.298 -11.093 1.00 0.00 H new ATOM 0 HA PHE A 56 19.435 -17.021 -10.418 1.00 0.00 H new ATOM 0 HB2 PHE A 56 17.250 -18.161 -8.618 1.00 0.00 H new ATOM 0 HB3 PHE A 56 18.864 -17.786 -8.049 1.00 0.00 H new ATOM 0 HD1 PHE A 56 15.698 -16.351 -9.326 1.00 0.00 H new ATOM 0 HD2 PHE A 56 19.601 -15.500 -7.720 1.00 0.00 H new ATOM 0 HE1 PHE A 56 15.071 -13.965 -9.054 1.00 0.00 H new ATOM 0 HE2 PHE A 56 18.934 -13.133 -7.348 1.00 0.00 H new ATOM 0 HZ PHE A 56 16.688 -12.353 -8.077 1.00 0.00 H new ATOM 956 N LYS A 57 20.380 -19.292 -9.486 1.00 0.00 N ATOM 957 CA LYS A 57 21.141 -20.520 -9.329 1.00 0.00 C ATOM 958 C LYS A 57 20.251 -21.723 -8.998 1.00 0.00 C ATOM 959 O LYS A 57 20.424 -22.781 -9.603 1.00 0.00 O ATOM 960 CB LYS A 57 22.193 -20.240 -8.238 1.00 0.00 C ATOM 961 CG LYS A 57 22.953 -21.495 -7.803 1.00 0.00 C ATOM 962 CD LYS A 57 24.106 -21.215 -6.827 1.00 0.00 C ATOM 963 CE LYS A 57 25.249 -20.439 -7.497 1.00 0.00 C ATOM 964 NZ LYS A 57 26.418 -20.275 -6.592 1.00 0.00 N ATOM 0 H LYS A 57 20.754 -18.527 -8.924 1.00 0.00 H new ATOM 0 HA LYS A 57 21.625 -20.797 -10.265 1.00 0.00 H new ATOM 0 HB2 LYS A 57 22.904 -19.501 -8.608 1.00 0.00 H new ATOM 0 HB3 LYS A 57 21.700 -19.801 -7.370 1.00 0.00 H new ATOM 0 HG2 LYS A 57 22.254 -22.188 -7.335 1.00 0.00 H new ATOM 0 HG3 LYS A 57 23.351 -21.992 -8.688 1.00 0.00 H new ATOM 0 HD2 LYS A 57 23.731 -20.646 -5.976 1.00 0.00 H new ATOM 0 HD3 LYS A 57 24.488 -22.158 -6.436 1.00 0.00 H new ATOM 0 HE2 LYS A 57 25.561 -20.962 -8.401 1.00 0.00 H new ATOM 0 HE3 LYS A 57 24.889 -19.457 -7.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 27.166 -19.746 -7.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 26.127 -19.753 -5.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 26.779 -21.211 -6.318 1.00 0.00 H new ATOM 978 N GLU A 58 19.328 -21.587 -8.044 1.00 0.00 N ATOM 979 CA GLU A 58 18.539 -22.696 -7.513 1.00 0.00 C ATOM 980 C GLU A 58 17.259 -22.123 -6.900 1.00 0.00 C ATOM 981 O GLU A 58 17.231 -20.950 -6.523 1.00 0.00 O ATOM 982 CB GLU A 58 19.397 -23.444 -6.468 1.00 0.00 C ATOM 983 CG GLU A 58 18.738 -24.661 -5.803 1.00 0.00 C ATOM 984 CD GLU A 58 18.294 -25.725 -6.822 1.00 0.00 C ATOM 985 OE1 GLU A 58 17.218 -25.545 -7.433 1.00 0.00 O ATOM 986 OE2 GLU A 58 19.006 -26.738 -7.006 1.00 0.00 O ATOM 0 H GLU A 58 19.106 -20.689 -7.613 1.00 0.00 H new ATOM 0 HA GLU A 58 18.256 -23.405 -8.291 1.00 0.00 H new ATOM 0 HB2 GLU A 58 20.317 -23.773 -6.951 1.00 0.00 H new ATOM 0 HB3 GLU A 58 19.681 -22.738 -5.688 1.00 0.00 H new ATOM 0 HG2 GLU A 58 19.439 -25.109 -5.098 1.00 0.00 H new ATOM 0 HG3 GLU A 58 17.873 -24.332 -5.227 1.00 0.00 H new ATOM 993 N ILE A 59 16.204 -22.937 -6.781 1.00 0.00 N ATOM 994 CA ILE A 59 14.894 -22.503 -6.293 1.00 0.00 C ATOM 995 C ILE A 59 14.947 -21.965 -4.855 1.00 0.00 C ATOM 996 O ILE A 59 14.202 -21.042 -4.523 1.00 0.00 O ATOM 997 CB ILE A 59 13.843 -23.632 -6.454 1.00 0.00 C ATOM 998 CG1 ILE A 59 14.056 -24.819 -5.483 1.00 0.00 C ATOM 999 CG2 ILE A 59 13.788 -24.113 -7.914 1.00 0.00 C ATOM 1000 CD1 ILE A 59 13.038 -25.955 -5.642 1.00 0.00 C ATOM 0 H ILE A 59 16.238 -23.927 -7.024 1.00 0.00 H new ATOM 0 HA ILE A 59 14.581 -21.664 -6.914 1.00 0.00 H new ATOM 0 HB ILE A 59 12.880 -23.198 -6.184 1.00 0.00 H new ATOM 0 HG12 ILE A 59 15.058 -25.221 -5.634 1.00 0.00 H new ATOM 0 HG13 ILE A 59 14.012 -24.448 -4.459 1.00 0.00 H new ATOM 0 HG21 ILE A 59 13.045 -24.905 -8.008 1.00 0.00 H new ATOM 0 HG22 ILE A 59 13.514 -23.280 -8.561 1.00 0.00 H new ATOM 0 HG23 ILE A 59 14.765 -24.495 -8.208 1.00 0.00 H new ATOM 0 HD11 ILE A 59 13.260 -26.745 -4.925 1.00 0.00 H new ATOM 0 HD12 ILE A 59 12.034 -25.572 -5.461 1.00 0.00 H new ATOM 0 HD13 ILE A 59 13.096 -26.357 -6.654 1.00 0.00 H new ATOM 1012 N GLY A 60 15.827 -22.494 -3.999 1.00 0.00 N ATOM 1013 CA GLY A 60 15.965 -22.010 -2.628 1.00 0.00 C ATOM 1014 C GLY A 60 16.631 -20.637 -2.614 1.00 0.00 C ATOM 1015 O GLY A 60 16.199 -19.734 -1.896 1.00 0.00 O ATOM 0 H GLY A 60 16.456 -23.261 -4.236 1.00 0.00 H new ATOM 0 HA2 GLY A 60 14.984 -21.951 -2.156 1.00 0.00 H new ATOM 0 HA3 GLY A 60 16.557 -22.715 -2.044 1.00 0.00 H new ATOM 1019 N SER A 61 17.642 -20.448 -3.461 1.00 0.00 N ATOM 1020 CA SER A 61 18.352 -19.187 -3.600 1.00 0.00 C ATOM 1021 C SER A 61 17.420 -18.128 -4.201 1.00 0.00 C ATOM 1022 O SER A 61 17.383 -16.995 -3.718 1.00 0.00 O ATOM 1023 CB SER A 61 19.600 -19.412 -4.462 1.00 0.00 C ATOM 1024 OG SER A 61 20.258 -20.618 -4.101 1.00 0.00 O ATOM 0 H SER A 61 17.993 -21.181 -4.077 1.00 0.00 H new ATOM 0 HA SER A 61 18.673 -18.820 -2.625 1.00 0.00 H new ATOM 0 HB2 SER A 61 19.318 -19.449 -5.514 1.00 0.00 H new ATOM 0 HB3 SER A 61 20.284 -18.571 -4.344 1.00 0.00 H new ATOM 0 HG SER A 61 21.050 -20.740 -4.666 1.00 0.00 H new ATOM 1030 N ALA A 62 16.605 -18.518 -5.189 1.00 0.00 N ATOM 1031 CA ALA A 62 15.552 -17.682 -5.740 1.00 0.00 C ATOM 1032 C ALA A 62 14.589 -17.255 -4.636 1.00 0.00 C ATOM 1033 O ALA A 62 14.292 -16.070 -4.524 1.00 0.00 O ATOM 1034 CB ALA A 62 14.788 -18.443 -6.827 1.00 0.00 C ATOM 0 H ALA A 62 16.666 -19.437 -5.628 1.00 0.00 H new ATOM 0 HA ALA A 62 16.006 -16.794 -6.180 1.00 0.00 H new ATOM 0 HB1 ALA A 62 14.002 -17.806 -7.232 1.00 0.00 H new ATOM 0 HB2 ALA A 62 15.475 -18.724 -7.625 1.00 0.00 H new ATOM 0 HB3 ALA A 62 14.343 -19.341 -6.398 1.00 0.00 H new ATOM 1040 N SER A 63 14.135 -18.195 -3.798 1.00 0.00 N ATOM 1041 CA SER A 63 13.217 -17.904 -2.701 1.00 0.00 C ATOM 1042 C SER A 63 13.813 -16.877 -1.744 1.00 0.00 C ATOM 1043 O SER A 63 13.123 -15.946 -1.329 1.00 0.00 O ATOM 1044 CB SER A 63 12.865 -19.179 -1.925 1.00 0.00 C ATOM 1045 OG SER A 63 12.355 -20.175 -2.780 1.00 0.00 O ATOM 0 H SER A 63 14.397 -19.179 -3.865 1.00 0.00 H new ATOM 0 HA SER A 63 12.308 -17.493 -3.140 1.00 0.00 H new ATOM 0 HB2 SER A 63 13.753 -19.554 -1.416 1.00 0.00 H new ATOM 0 HB3 SER A 63 12.130 -18.947 -1.155 1.00 0.00 H new ATOM 0 HG SER A 63 13.096 -20.619 -3.243 1.00 0.00 H new ATOM 1051 N ASN A 64 15.098 -17.028 -1.412 1.00 0.00 N ATOM 1052 CA ASN A 64 15.768 -16.118 -0.496 1.00 0.00 C ATOM 1053 C ASN A 64 15.837 -14.711 -1.083 1.00 0.00 C ATOM 1054 O ASN A 64 15.486 -13.755 -0.393 1.00 0.00 O ATOM 1055 CB ASN A 64 17.163 -16.628 -0.122 1.00 0.00 C ATOM 1056 CG ASN A 64 17.750 -15.741 0.972 1.00 0.00 C ATOM 1057 OD1 ASN A 64 17.407 -15.877 2.144 1.00 0.00 O ATOM 1058 ND2 ASN A 64 18.626 -14.817 0.624 1.00 0.00 N ATOM 0 H ASN A 64 15.692 -17.777 -1.769 1.00 0.00 H new ATOM 0 HA ASN A 64 15.179 -16.074 0.420 1.00 0.00 H new ATOM 0 HB2 ASN A 64 17.104 -17.660 0.224 1.00 0.00 H new ATOM 0 HB3 ASN A 64 17.812 -16.622 -0.998 1.00 0.00 H new ATOM 0 HD21 ASN A 64 19.028 -14.203 1.332 1.00 0.00 H new ATOM 0 HD22 ASN A 64 18.901 -14.717 -0.353 1.00 0.00 H new ATOM 1065 N ALA A 65 16.221 -14.585 -2.357 1.00 0.00 N ATOM 1066 CA ALA A 65 16.245 -13.315 -3.068 1.00 0.00 C ATOM 1067 C ALA A 65 14.853 -12.685 -3.052 1.00 0.00 C ATOM 1068 O ALA A 65 14.693 -11.545 -2.623 1.00 0.00 O ATOM 1069 CB ALA A 65 16.732 -13.528 -4.510 1.00 0.00 C ATOM 0 H ALA A 65 16.527 -15.375 -2.925 1.00 0.00 H new ATOM 0 HA ALA A 65 16.937 -12.636 -2.570 1.00 0.00 H new ATOM 0 HB1 ALA A 65 16.747 -12.572 -5.034 1.00 0.00 H new ATOM 0 HB2 ALA A 65 17.737 -13.950 -4.496 1.00 0.00 H new ATOM 0 HB3 ALA A 65 16.058 -14.213 -5.024 1.00 0.00 H new ATOM 1075 N LEU A 66 13.846 -13.454 -3.472 1.00 0.00 N ATOM 1076 CA LEU A 66 12.456 -13.033 -3.579 1.00 0.00 C ATOM 1077 C LEU A 66 11.990 -12.465 -2.239 1.00 0.00 C ATOM 1078 O LEU A 66 11.575 -11.311 -2.161 1.00 0.00 O ATOM 1079 CB LEU A 66 11.615 -14.252 -4.022 1.00 0.00 C ATOM 1080 CG LEU A 66 10.278 -13.955 -4.714 1.00 0.00 C ATOM 1081 CD1 LEU A 66 9.610 -15.286 -5.076 1.00 0.00 C ATOM 1082 CD2 LEU A 66 9.306 -13.140 -3.861 1.00 0.00 C ATOM 0 H LEU A 66 13.987 -14.423 -3.757 1.00 0.00 H new ATOM 0 HA LEU A 66 12.338 -12.244 -4.321 1.00 0.00 H new ATOM 0 HB2 LEU A 66 12.221 -14.855 -4.698 1.00 0.00 H new ATOM 0 HB3 LEU A 66 11.414 -14.864 -3.143 1.00 0.00 H new ATOM 0 HG LEU A 66 10.506 -13.353 -5.594 1.00 0.00 H new ATOM 0 HD11 LEU A 66 8.657 -15.093 -5.569 1.00 0.00 H new ATOM 0 HD12 LEU A 66 10.259 -15.848 -5.748 1.00 0.00 H new ATOM 0 HD13 LEU A 66 9.438 -15.865 -4.169 1.00 0.00 H new ATOM 0 HD21 LEU A 66 8.385 -12.971 -4.419 1.00 0.00 H new ATOM 0 HD22 LEU A 66 9.080 -13.686 -2.945 1.00 0.00 H new ATOM 0 HD23 LEU A 66 9.759 -12.181 -3.610 1.00 0.00 H new ATOM 1094 N ARG A 67 12.085 -13.256 -1.169 1.00 0.00 N ATOM 1095 CA ARG A 67 11.505 -12.886 0.115 1.00 0.00 C ATOM 1096 C ARG A 67 12.284 -11.744 0.766 1.00 0.00 C ATOM 1097 O ARG A 67 11.662 -10.872 1.368 1.00 0.00 O ATOM 1098 CB ARG A 67 11.436 -14.131 1.015 1.00 0.00 C ATOM 1099 CG ARG A 67 10.429 -13.959 2.161 1.00 0.00 C ATOM 1100 CD ARG A 67 10.281 -15.266 2.950 1.00 0.00 C ATOM 1101 NE ARG A 67 9.061 -15.258 3.776 1.00 0.00 N ATOM 1102 CZ ARG A 67 8.453 -16.346 4.263 1.00 0.00 C ATOM 1103 NH1 ARG A 67 8.991 -17.556 4.170 1.00 0.00 N ATOM 1104 NH2 ARG A 67 7.262 -16.244 4.831 1.00 0.00 N ATOM 0 H ARG A 67 12.560 -14.159 -1.170 1.00 0.00 H new ATOM 0 HA ARG A 67 10.492 -12.515 -0.037 1.00 0.00 H new ATOM 0 HB2 ARG A 67 11.157 -14.997 0.415 1.00 0.00 H new ATOM 0 HB3 ARG A 67 12.424 -14.334 1.428 1.00 0.00 H new ATOM 0 HG2 ARG A 67 10.760 -13.162 2.826 1.00 0.00 H new ATOM 0 HG3 ARG A 67 9.461 -13.658 1.760 1.00 0.00 H new ATOM 0 HD2 ARG A 67 10.249 -16.109 2.259 1.00 0.00 H new ATOM 0 HD3 ARG A 67 11.153 -15.409 3.588 1.00 0.00 H new ATOM 0 HE ARG A 67 8.647 -14.352 3.994 1.00 0.00 H new ATOM 0 HH11 ARG A 67 9.896 -17.678 3.716 1.00 0.00 H new ATOM 0 HH12 ARG A 67 8.499 -18.364 4.553 1.00 0.00 H new ATOM 0 HH21 ARG A 67 6.805 -15.334 4.898 1.00 0.00 H new ATOM 0 HH22 ARG A 67 6.801 -17.075 5.201 1.00 0.00 H new ATOM 1118 N THR A 68 13.613 -11.711 0.632 1.00 0.00 N ATOM 1119 CA THR A 68 14.418 -10.630 1.198 1.00 0.00 C ATOM 1120 C THR A 68 14.091 -9.306 0.495 1.00 0.00 C ATOM 1121 O THR A 68 13.971 -8.272 1.154 1.00 0.00 O ATOM 1122 CB THR A 68 15.919 -10.971 1.105 1.00 0.00 C ATOM 1123 OG1 THR A 68 16.167 -12.235 1.687 1.00 0.00 O ATOM 1124 CG2 THR A 68 16.797 -9.950 1.834 1.00 0.00 C ATOM 0 H THR A 68 14.152 -12.421 0.136 1.00 0.00 H new ATOM 0 HA THR A 68 14.174 -10.516 2.254 1.00 0.00 H new ATOM 0 HB THR A 68 16.170 -10.964 0.044 1.00 0.00 H new ATOM 0 HG1 THR A 68 16.116 -12.929 0.997 1.00 0.00 H new ATOM 0 HG21 THR A 68 17.844 -10.236 1.738 1.00 0.00 H new ATOM 0 HG22 THR A 68 16.649 -8.963 1.395 1.00 0.00 H new ATOM 0 HG23 THR A 68 16.524 -9.922 2.889 1.00 0.00 H new ATOM 1132 N MET A 69 13.919 -9.331 -0.830 1.00 0.00 N ATOM 1133 CA MET A 69 13.747 -8.121 -1.624 1.00 0.00 C ATOM 1134 C MET A 69 12.278 -7.689 -1.718 1.00 0.00 C ATOM 1135 O MET A 69 12.000 -6.578 -2.167 1.00 0.00 O ATOM 1136 CB MET A 69 14.384 -8.315 -3.008 1.00 0.00 C ATOM 1137 CG MET A 69 15.900 -8.582 -2.928 1.00 0.00 C ATOM 1138 SD MET A 69 16.887 -7.318 -2.070 1.00 0.00 S ATOM 1139 CE MET A 69 16.692 -5.915 -3.202 1.00 0.00 C ATOM 0 H MET A 69 13.896 -10.191 -1.377 1.00 0.00 H new ATOM 0 HA MET A 69 14.261 -7.304 -1.118 1.00 0.00 H new ATOM 0 HB2 MET A 69 13.898 -9.149 -3.515 1.00 0.00 H new ATOM 0 HB3 MET A 69 14.206 -7.427 -3.614 1.00 0.00 H new ATOM 0 HG2 MET A 69 16.055 -9.538 -2.427 1.00 0.00 H new ATOM 0 HG3 MET A 69 16.284 -8.688 -3.942 1.00 0.00 H new ATOM 0 HE1 MET A 69 17.212 -5.046 -2.798 1.00 0.00 H new ATOM 0 HE2 MET A 69 17.114 -6.170 -4.174 1.00 0.00 H new ATOM 0 HE3 MET A 69 15.633 -5.684 -3.316 1.00 0.00 H new ATOM 1149 N GLN A 70 11.327 -8.522 -1.284 1.00 0.00 N ATOM 1150 CA GLN A 70 9.915 -8.169 -1.199 1.00 0.00 C ATOM 1151 C GLN A 70 9.764 -6.904 -0.346 1.00 0.00 C ATOM 1152 O GLN A 70 10.226 -6.861 0.796 1.00 0.00 O ATOM 1153 CB GLN A 70 9.131 -9.362 -0.613 1.00 0.00 C ATOM 1154 CG GLN A 70 7.605 -9.182 -0.581 1.00 0.00 C ATOM 1155 CD GLN A 70 6.984 -9.249 -1.975 1.00 0.00 C ATOM 1156 OE1 GLN A 70 7.106 -8.319 -2.765 1.00 0.00 O ATOM 1157 NE2 GLN A 70 6.336 -10.348 -2.323 1.00 0.00 N ATOM 0 H GLN A 70 11.525 -9.475 -0.978 1.00 0.00 H new ATOM 0 HA GLN A 70 9.508 -7.955 -2.187 1.00 0.00 H new ATOM 0 HB2 GLN A 70 9.365 -10.253 -1.196 1.00 0.00 H new ATOM 0 HB3 GLN A 70 9.482 -9.545 0.403 1.00 0.00 H new ATOM 0 HG2 GLN A 70 7.163 -9.955 0.049 1.00 0.00 H new ATOM 0 HG3 GLN A 70 7.364 -8.222 -0.124 1.00 0.00 H new ATOM 0 HE21 GLN A 70 6.240 -11.116 -1.658 1.00 0.00 H new ATOM 0 HE22 GLN A 70 5.932 -10.428 -3.256 1.00 0.00 H new ATOM 1166 N GLY A 71 9.127 -5.869 -0.901 1.00 0.00 N ATOM 1167 CA GLY A 71 8.908 -4.591 -0.234 1.00 0.00 C ATOM 1168 C GLY A 71 10.174 -3.740 -0.083 1.00 0.00 C ATOM 1169 O GLY A 71 10.092 -2.656 0.495 1.00 0.00 O ATOM 0 H GLY A 71 8.743 -5.901 -1.845 1.00 0.00 H new ATOM 0 HA2 GLY A 71 8.166 -4.023 -0.795 1.00 0.00 H new ATOM 0 HA3 GLY A 71 8.487 -4.776 0.754 1.00 0.00 H new ATOM 1173 N PHE A 72 11.338 -4.194 -0.561 1.00 0.00 N ATOM 1174 CA PHE A 72 12.597 -3.478 -0.363 1.00 0.00 C ATOM 1175 C PHE A 72 12.618 -2.214 -1.237 1.00 0.00 C ATOM 1176 O PHE A 72 12.218 -2.294 -2.401 1.00 0.00 O ATOM 1177 CB PHE A 72 13.776 -4.402 -0.700 1.00 0.00 C ATOM 1178 CG PHE A 72 15.135 -3.806 -0.391 1.00 0.00 C ATOM 1179 CD1 PHE A 72 15.673 -3.906 0.907 1.00 0.00 C ATOM 1180 CD2 PHE A 72 15.857 -3.134 -1.396 1.00 0.00 C ATOM 1181 CE1 PHE A 72 16.924 -3.331 1.197 1.00 0.00 C ATOM 1182 CE2 PHE A 72 17.107 -2.558 -1.105 1.00 0.00 C ATOM 1183 CZ PHE A 72 17.640 -2.655 0.192 1.00 0.00 C ATOM 0 H PHE A 72 11.431 -5.061 -1.091 1.00 0.00 H new ATOM 0 HA PHE A 72 12.687 -3.174 0.680 1.00 0.00 H new ATOM 0 HB2 PHE A 72 13.664 -5.333 -0.145 1.00 0.00 H new ATOM 0 HB3 PHE A 72 13.734 -4.655 -1.759 1.00 0.00 H new ATOM 0 HD1 PHE A 72 15.125 -4.424 1.680 1.00 0.00 H new ATOM 0 HD2 PHE A 72 15.450 -3.061 -2.394 1.00 0.00 H new ATOM 0 HE1 PHE A 72 17.335 -3.409 2.193 1.00 0.00 H new ATOM 0 HE2 PHE A 72 17.657 -2.041 -1.878 1.00 0.00 H new ATOM 0 HZ PHE A 72 18.598 -2.211 0.417 1.00 0.00 H new ATOM 1193 N PRO A 73 13.095 -1.058 -0.739 1.00 0.00 N ATOM 1194 CA PRO A 73 13.279 0.152 -1.534 1.00 0.00 C ATOM 1195 C PRO A 73 14.526 0.020 -2.427 1.00 0.00 C ATOM 1196 O PRO A 73 15.591 0.573 -2.143 1.00 0.00 O ATOM 1197 CB PRO A 73 13.354 1.291 -0.515 1.00 0.00 C ATOM 1198 CG PRO A 73 14.000 0.627 0.701 1.00 0.00 C ATOM 1199 CD PRO A 73 13.450 -0.798 0.651 1.00 0.00 C ATOM 0 HA PRO A 73 12.465 0.341 -2.234 1.00 0.00 H new ATOM 0 HB2 PRO A 73 13.952 2.124 -0.885 1.00 0.00 H new ATOM 0 HB3 PRO A 73 12.366 1.688 -0.280 1.00 0.00 H new ATOM 0 HG2 PRO A 73 15.088 0.642 0.638 1.00 0.00 H new ATOM 0 HG3 PRO A 73 13.728 1.132 1.628 1.00 0.00 H new ATOM 0 HD2 PRO A 73 14.194 -1.513 1.001 1.00 0.00 H new ATOM 0 HD3 PRO A 73 12.580 -0.901 1.299 1.00 0.00 H new ATOM 1207 N PHE A 74 14.400 -0.763 -3.501 1.00 0.00 N ATOM 1208 CA PHE A 74 15.450 -0.979 -4.502 1.00 0.00 C ATOM 1209 C PHE A 74 15.824 0.351 -5.169 1.00 0.00 C ATOM 1210 O PHE A 74 16.995 0.604 -5.456 1.00 0.00 O ATOM 1211 CB PHE A 74 14.910 -2.002 -5.506 1.00 0.00 C ATOM 1212 CG PHE A 74 15.833 -2.517 -6.596 1.00 0.00 C ATOM 1213 CD1 PHE A 74 16.989 -3.248 -6.260 1.00 0.00 C ATOM 1214 CD2 PHE A 74 15.445 -2.416 -7.946 1.00 0.00 C ATOM 1215 CE1 PHE A 74 17.731 -3.896 -7.265 1.00 0.00 C ATOM 1216 CE2 PHE A 74 16.177 -3.074 -8.948 1.00 0.00 C ATOM 1217 CZ PHE A 74 17.306 -3.835 -8.603 1.00 0.00 C ATOM 0 H PHE A 74 13.543 -1.278 -3.705 1.00 0.00 H new ATOM 0 HA PHE A 74 16.364 -1.363 -4.050 1.00 0.00 H new ATOM 0 HB2 PHE A 74 14.555 -2.863 -4.940 1.00 0.00 H new ATOM 0 HB3 PHE A 74 14.040 -1.560 -5.992 1.00 0.00 H new ATOM 0 HD1 PHE A 74 17.306 -3.311 -5.230 1.00 0.00 H new ATOM 0 HD2 PHE A 74 14.579 -1.829 -8.213 1.00 0.00 H new ATOM 0 HE1 PHE A 74 18.628 -4.440 -7.008 1.00 0.00 H new ATOM 0 HE2 PHE A 74 15.872 -2.995 -9.981 1.00 0.00 H new ATOM 0 HZ PHE A 74 17.848 -4.374 -9.366 1.00 0.00 H new ATOM 1227 N TYR A 75 14.818 1.211 -5.340 1.00 0.00 N ATOM 1228 CA TYR A 75 14.891 2.607 -5.742 1.00 0.00 C ATOM 1229 C TYR A 75 13.812 3.330 -4.926 1.00 0.00 C ATOM 1230 O TYR A 75 13.376 2.813 -3.893 1.00 0.00 O ATOM 1231 CB TYR A 75 14.746 2.722 -7.276 1.00 0.00 C ATOM 1232 CG TYR A 75 16.042 2.419 -8.007 1.00 0.00 C ATOM 1233 CD1 TYR A 75 17.057 3.395 -8.039 1.00 0.00 C ATOM 1234 CD2 TYR A 75 16.261 1.160 -8.600 1.00 0.00 C ATOM 1235 CE1 TYR A 75 18.294 3.113 -8.641 1.00 0.00 C ATOM 1236 CE2 TYR A 75 17.501 0.866 -9.198 1.00 0.00 C ATOM 1237 CZ TYR A 75 18.527 1.841 -9.213 1.00 0.00 C ATOM 1238 OH TYR A 75 19.744 1.573 -9.758 1.00 0.00 O ATOM 0 H TYR A 75 13.853 0.919 -5.187 1.00 0.00 H new ATOM 0 HA TYR A 75 15.852 3.077 -5.533 1.00 0.00 H new ATOM 0 HB2 TYR A 75 13.971 2.035 -7.617 1.00 0.00 H new ATOM 0 HB3 TYR A 75 14.415 3.728 -7.532 1.00 0.00 H new ATOM 0 HD1 TYR A 75 16.883 4.365 -7.598 1.00 0.00 H new ATOM 0 HD2 TYR A 75 15.476 0.419 -8.596 1.00 0.00 H new ATOM 0 HE1 TYR A 75 19.067 3.867 -8.667 1.00 0.00 H new ATOM 0 HE2 TYR A 75 17.669 -0.103 -9.645 1.00 0.00 H new ATOM 0 HH TYR A 75 19.756 0.653 -10.095 1.00 0.00 H new ATOM 1248 N ASP A 76 13.360 4.508 -5.360 1.00 0.00 N ATOM 1249 CA ASP A 76 12.341 5.330 -4.693 1.00 0.00 C ATOM 1250 C ASP A 76 10.931 4.692 -4.687 1.00 0.00 C ATOM 1251 O ASP A 76 9.924 5.385 -4.543 1.00 0.00 O ATOM 1252 CB ASP A 76 12.342 6.728 -5.337 1.00 0.00 C ATOM 1253 CG ASP A 76 11.521 7.763 -4.542 1.00 0.00 C ATOM 1254 OD1 ASP A 76 11.722 7.896 -3.313 1.00 0.00 O ATOM 1255 OD2 ASP A 76 10.720 8.506 -5.155 1.00 0.00 O ATOM 0 H ASP A 76 13.706 4.935 -6.219 1.00 0.00 H new ATOM 0 HA ASP A 76 12.604 5.407 -3.638 1.00 0.00 H new ATOM 0 HB2 ASP A 76 13.370 7.080 -5.425 1.00 0.00 H new ATOM 0 HB3 ASP A 76 11.942 6.655 -6.348 1.00 0.00 H new ATOM 1260 N LYS A 77 10.833 3.368 -4.860 1.00 0.00 N ATOM 1261 CA LYS A 77 9.607 2.587 -4.783 1.00 0.00 C ATOM 1262 C LYS A 77 9.930 1.267 -4.076 1.00 0.00 C ATOM 1263 O LYS A 77 10.975 0.680 -4.371 1.00 0.00 O ATOM 1264 CB LYS A 77 9.068 2.284 -6.192 1.00 0.00 C ATOM 1265 CG LYS A 77 8.155 3.386 -6.749 1.00 0.00 C ATOM 1266 CD LYS A 77 7.719 3.027 -8.179 1.00 0.00 C ATOM 1267 CE LYS A 77 6.579 3.904 -8.715 1.00 0.00 C ATOM 1268 NZ LYS A 77 5.277 3.613 -8.060 1.00 0.00 N ATOM 0 H LYS A 77 11.649 2.792 -5.067 1.00 0.00 H new ATOM 0 HA LYS A 77 8.850 3.149 -4.237 1.00 0.00 H new ATOM 0 HB2 LYS A 77 9.909 2.142 -6.871 1.00 0.00 H new ATOM 0 HB3 LYS A 77 8.516 1.344 -6.167 1.00 0.00 H new ATOM 0 HG2 LYS A 77 7.279 3.503 -6.110 1.00 0.00 H new ATOM 0 HG3 LYS A 77 8.680 4.341 -6.748 1.00 0.00 H new ATOM 0 HD2 LYS A 77 8.578 3.116 -8.844 1.00 0.00 H new ATOM 0 HD3 LYS A 77 7.405 1.984 -8.202 1.00 0.00 H new ATOM 0 HE2 LYS A 77 6.831 4.954 -8.563 1.00 0.00 H new ATOM 0 HE3 LYS A 77 6.483 3.751 -9.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 4.501 3.960 -8.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 5.178 2.586 -7.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 5.240 4.088 -7.136 1.00 0.00 H new ATOM 1282 N PRO A 78 9.059 0.776 -3.177 1.00 0.00 N ATOM 1283 CA PRO A 78 9.186 -0.563 -2.623 1.00 0.00 C ATOM 1284 C PRO A 78 8.873 -1.581 -3.722 1.00 0.00 C ATOM 1285 O PRO A 78 7.840 -1.485 -4.393 1.00 0.00 O ATOM 1286 CB PRO A 78 8.184 -0.625 -1.466 1.00 0.00 C ATOM 1287 CG PRO A 78 7.097 0.371 -1.869 1.00 0.00 C ATOM 1288 CD PRO A 78 7.860 1.430 -2.666 1.00 0.00 C ATOM 0 HA PRO A 78 10.188 -0.791 -2.259 1.00 0.00 H new ATOM 0 HB2 PRO A 78 7.779 -1.629 -1.341 1.00 0.00 H new ATOM 0 HB3 PRO A 78 8.649 -0.348 -0.520 1.00 0.00 H new ATOM 0 HG2 PRO A 78 6.322 -0.103 -2.471 1.00 0.00 H new ATOM 0 HG3 PRO A 78 6.605 0.802 -0.997 1.00 0.00 H new ATOM 0 HD2 PRO A 78 7.250 1.816 -3.483 1.00 0.00 H new ATOM 0 HD3 PRO A 78 8.120 2.279 -2.034 1.00 0.00 H new ATOM 1296 N MET A 79 9.756 -2.557 -3.908 1.00 0.00 N ATOM 1297 CA MET A 79 9.569 -3.629 -4.878 1.00 0.00 C ATOM 1298 C MET A 79 8.337 -4.452 -4.513 1.00 0.00 C ATOM 1299 O MET A 79 8.066 -4.677 -3.332 1.00 0.00 O ATOM 1300 CB MET A 79 10.804 -4.540 -4.881 1.00 0.00 C ATOM 1301 CG MET A 79 12.048 -3.812 -5.388 1.00 0.00 C ATOM 1302 SD MET A 79 12.070 -3.496 -7.172 1.00 0.00 S ATOM 1303 CE MET A 79 13.176 -4.839 -7.676 1.00 0.00 C ATOM 0 H MET A 79 10.629 -2.626 -3.385 1.00 0.00 H new ATOM 0 HA MET A 79 9.431 -3.193 -5.868 1.00 0.00 H new ATOM 0 HB2 MET A 79 10.985 -4.909 -3.871 1.00 0.00 H new ATOM 0 HB3 MET A 79 10.612 -5.410 -5.509 1.00 0.00 H new ATOM 0 HG2 MET A 79 12.134 -2.860 -4.864 1.00 0.00 H new ATOM 0 HG3 MET A 79 12.928 -4.400 -5.127 1.00 0.00 H new ATOM 0 HE1 MET A 79 13.456 -4.707 -8.721 1.00 0.00 H new ATOM 0 HE2 MET A 79 14.072 -4.825 -7.055 1.00 0.00 H new ATOM 0 HE3 MET A 79 12.666 -5.795 -7.555 1.00 0.00 H new ATOM 1313 N GLN A 80 7.646 -4.972 -5.521 1.00 0.00 N ATOM 1314 CA GLN A 80 6.581 -5.951 -5.364 1.00 0.00 C ATOM 1315 C GLN A 80 7.033 -7.143 -6.194 1.00 0.00 C ATOM 1316 O GLN A 80 7.460 -6.966 -7.336 1.00 0.00 O ATOM 1317 CB GLN A 80 5.241 -5.368 -5.840 1.00 0.00 C ATOM 1318 CG GLN A 80 4.757 -4.221 -4.934 1.00 0.00 C ATOM 1319 CD GLN A 80 3.458 -3.572 -5.422 1.00 0.00 C ATOM 1320 OE1 GLN A 80 2.630 -4.185 -6.093 1.00 0.00 O ATOM 1321 NE2 GLN A 80 3.246 -2.304 -5.102 1.00 0.00 N ATOM 0 H GLN A 80 7.817 -4.717 -6.494 1.00 0.00 H new ATOM 0 HA GLN A 80 6.412 -6.240 -4.327 1.00 0.00 H new ATOM 0 HB2 GLN A 80 5.347 -5.003 -6.862 1.00 0.00 H new ATOM 0 HB3 GLN A 80 4.489 -6.157 -5.860 1.00 0.00 H new ATOM 0 HG2 GLN A 80 4.607 -4.603 -3.924 1.00 0.00 H new ATOM 0 HG3 GLN A 80 5.535 -3.460 -4.875 1.00 0.00 H new ATOM 0 HE21 GLN A 80 3.934 -1.797 -4.545 1.00 0.00 H new ATOM 0 HE22 GLN A 80 2.395 -1.835 -5.412 1.00 0.00 H new ATOM 1330 N ILE A 81 7.010 -8.344 -5.625 1.00 0.00 N ATOM 1331 CA ILE A 81 7.623 -9.519 -6.231 1.00 0.00 C ATOM 1332 C ILE A 81 6.668 -10.705 -6.063 1.00 0.00 C ATOM 1333 O ILE A 81 5.933 -10.786 -5.075 1.00 0.00 O ATOM 1334 CB ILE A 81 9.020 -9.782 -5.597 1.00 0.00 C ATOM 1335 CG1 ILE A 81 9.847 -8.487 -5.381 1.00 0.00 C ATOM 1336 CG2 ILE A 81 9.822 -10.777 -6.454 1.00 0.00 C ATOM 1337 CD1 ILE A 81 11.303 -8.686 -4.945 1.00 0.00 C ATOM 0 H ILE A 81 6.564 -8.530 -4.727 1.00 0.00 H new ATOM 0 HA ILE A 81 7.790 -9.363 -7.297 1.00 0.00 H new ATOM 0 HB ILE A 81 8.833 -10.208 -4.611 1.00 0.00 H new ATOM 0 HG12 ILE A 81 9.841 -7.916 -6.310 1.00 0.00 H new ATOM 0 HG13 ILE A 81 9.343 -7.879 -4.630 1.00 0.00 H new ATOM 0 HG21 ILE A 81 10.796 -10.949 -5.996 1.00 0.00 H new ATOM 0 HG22 ILE A 81 9.280 -11.720 -6.519 1.00 0.00 H new ATOM 0 HG23 ILE A 81 9.959 -10.367 -7.455 1.00 0.00 H new ATOM 0 HD11 ILE A 81 11.783 -7.715 -4.825 1.00 0.00 H new ATOM 0 HD12 ILE A 81 11.329 -9.223 -3.997 1.00 0.00 H new ATOM 0 HD13 ILE A 81 11.834 -9.262 -5.703 1.00 0.00 H new ATOM 1349 N ALA A 82 6.706 -11.639 -7.011 1.00 0.00 N ATOM 1350 CA ALA A 82 6.044 -12.934 -6.957 1.00 0.00 C ATOM 1351 C ALA A 82 6.964 -13.964 -7.616 1.00 0.00 C ATOM 1352 O ALA A 82 7.931 -13.601 -8.290 1.00 0.00 O ATOM 1353 CB ALA A 82 4.694 -12.853 -7.683 1.00 0.00 C ATOM 0 H ALA A 82 7.225 -11.503 -7.878 1.00 0.00 H new ATOM 0 HA ALA A 82 5.850 -13.229 -5.926 1.00 0.00 H new ATOM 0 HB1 ALA A 82 4.200 -13.824 -7.642 1.00 0.00 H new ATOM 0 HB2 ALA A 82 4.065 -12.105 -7.200 1.00 0.00 H new ATOM 0 HB3 ALA A 82 4.857 -12.573 -8.724 1.00 0.00 H new ATOM 1359 N TYR A 83 6.674 -15.250 -7.432 1.00 0.00 N ATOM 1360 CA TYR A 83 7.364 -16.313 -8.152 1.00 0.00 C ATOM 1361 C TYR A 83 6.675 -16.486 -9.508 1.00 0.00 C ATOM 1362 O TYR A 83 5.458 -16.310 -9.613 1.00 0.00 O ATOM 1363 CB TYR A 83 7.383 -17.602 -7.315 1.00 0.00 C ATOM 1364 CG TYR A 83 6.039 -18.222 -6.965 1.00 0.00 C ATOM 1365 CD1 TYR A 83 5.250 -17.685 -5.928 1.00 0.00 C ATOM 1366 CD2 TYR A 83 5.602 -19.374 -7.647 1.00 0.00 C ATOM 1367 CE1 TYR A 83 4.020 -18.277 -5.588 1.00 0.00 C ATOM 1368 CE2 TYR A 83 4.384 -19.982 -7.301 1.00 0.00 C ATOM 1369 CZ TYR A 83 3.580 -19.429 -6.278 1.00 0.00 C ATOM 1370 OH TYR A 83 2.391 -20.018 -5.963 1.00 0.00 O ATOM 0 H TYR A 83 5.959 -15.581 -6.784 1.00 0.00 H new ATOM 0 HA TYR A 83 8.409 -16.058 -8.327 1.00 0.00 H new ATOM 0 HB2 TYR A 83 7.969 -18.347 -7.854 1.00 0.00 H new ATOM 0 HB3 TYR A 83 7.912 -17.393 -6.385 1.00 0.00 H new ATOM 0 HD1 TYR A 83 5.592 -16.813 -5.391 1.00 0.00 H new ATOM 0 HD2 TYR A 83 6.206 -19.792 -8.439 1.00 0.00 H new ATOM 0 HE1 TYR A 83 3.414 -17.852 -4.802 1.00 0.00 H new ATOM 0 HE2 TYR A 83 4.061 -20.874 -7.818 1.00 0.00 H new ATOM 0 HH TYR A 83 1.658 -19.521 -6.383 1.00 0.00 H new ATOM 1380 N SER A 84 7.442 -16.803 -10.552 1.00 0.00 N ATOM 1381 CA SER A 84 6.925 -16.953 -11.909 1.00 0.00 C ATOM 1382 C SER A 84 6.114 -18.252 -12.038 1.00 0.00 C ATOM 1383 O SER A 84 6.649 -19.293 -12.422 1.00 0.00 O ATOM 1384 CB SER A 84 8.074 -16.854 -12.920 1.00 0.00 C ATOM 1385 OG SER A 84 8.827 -15.683 -12.660 1.00 0.00 O ATOM 0 H SER A 84 8.446 -16.964 -10.477 1.00 0.00 H new ATOM 0 HA SER A 84 6.235 -16.140 -12.133 1.00 0.00 H new ATOM 0 HB2 SER A 84 8.713 -17.734 -12.849 1.00 0.00 H new ATOM 0 HB3 SER A 84 7.679 -16.828 -13.936 1.00 0.00 H new ATOM 0 HG SER A 84 9.216 -15.352 -13.496 1.00 0.00 H new ATOM 1391 N LYS A 85 4.825 -18.193 -11.674 1.00 0.00 N ATOM 1392 CA LYS A 85 3.877 -19.311 -11.703 1.00 0.00 C ATOM 1393 C LYS A 85 3.923 -20.046 -13.047 1.00 0.00 C ATOM 1394 O LYS A 85 4.099 -21.266 -13.063 1.00 0.00 O ATOM 1395 CB LYS A 85 2.470 -18.754 -11.397 1.00 0.00 C ATOM 1396 CG LYS A 85 1.312 -19.765 -11.497 1.00 0.00 C ATOM 1397 CD LYS A 85 1.376 -20.953 -10.524 1.00 0.00 C ATOM 1398 CE LYS A 85 1.341 -20.483 -9.063 1.00 0.00 C ATOM 1399 NZ LYS A 85 1.196 -21.609 -8.108 1.00 0.00 N ATOM 0 H LYS A 85 4.399 -17.329 -11.338 1.00 0.00 H new ATOM 0 HA LYS A 85 4.146 -20.049 -10.947 1.00 0.00 H new ATOM 0 HB2 LYS A 85 2.476 -18.336 -10.390 1.00 0.00 H new ATOM 0 HB3 LYS A 85 2.269 -17.931 -12.083 1.00 0.00 H new ATOM 0 HG2 LYS A 85 0.375 -19.233 -11.331 1.00 0.00 H new ATOM 0 HG3 LYS A 85 1.281 -20.154 -12.515 1.00 0.00 H new ATOM 0 HD2 LYS A 85 0.538 -21.625 -10.712 1.00 0.00 H new ATOM 0 HD3 LYS A 85 2.288 -21.523 -10.703 1.00 0.00 H new ATOM 0 HE2 LYS A 85 2.257 -19.936 -8.839 1.00 0.00 H new ATOM 0 HE3 LYS A 85 0.513 -19.787 -8.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 1.557 -21.322 -7.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 0.192 -21.867 -8.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 1.737 -22.428 -8.452 1.00 0.00 H new ATOM 1413 N SER A 86 3.811 -19.299 -14.147 1.00 0.00 N ATOM 1414 CA SER A 86 3.841 -19.800 -15.514 1.00 0.00 C ATOM 1415 C SER A 86 4.387 -18.690 -16.416 1.00 0.00 C ATOM 1416 O SER A 86 4.293 -17.505 -16.075 1.00 0.00 O ATOM 1417 CB SER A 86 2.419 -20.175 -15.971 1.00 0.00 C ATOM 1418 OG SER A 86 1.807 -21.129 -15.114 1.00 0.00 O ATOM 0 H SER A 86 3.692 -18.287 -14.103 1.00 0.00 H new ATOM 0 HA SER A 86 4.472 -20.687 -15.571 1.00 0.00 H new ATOM 0 HB2 SER A 86 1.803 -19.276 -16.007 1.00 0.00 H new ATOM 0 HB3 SER A 86 2.460 -20.575 -16.984 1.00 0.00 H new ATOM 0 HG SER A 86 0.907 -21.334 -15.443 1.00 0.00 H new ATOM 1424 N ASP A 87 4.924 -19.061 -17.577 1.00 0.00 N ATOM 1425 CA ASP A 87 5.315 -18.153 -18.654 1.00 0.00 C ATOM 1426 C ASP A 87 5.354 -18.949 -19.965 1.00 0.00 C ATOM 1427 O ASP A 87 5.546 -20.170 -19.934 1.00 0.00 O ATOM 1428 CB ASP A 87 6.689 -17.532 -18.367 1.00 0.00 C ATOM 1429 CG ASP A 87 7.141 -16.689 -19.562 1.00 0.00 C ATOM 1430 OD1 ASP A 87 6.674 -15.540 -19.707 1.00 0.00 O ATOM 1431 OD2 ASP A 87 7.896 -17.217 -20.406 1.00 0.00 O ATOM 0 H ASP A 87 5.106 -20.039 -17.802 1.00 0.00 H new ATOM 0 HA ASP A 87 4.593 -17.340 -18.730 1.00 0.00 H new ATOM 0 HB2 ASP A 87 6.637 -16.912 -17.472 1.00 0.00 H new ATOM 0 HB3 ASP A 87 7.418 -18.317 -18.169 1.00 0.00 H new ATOM 1436 N SER A 88 5.184 -18.264 -21.100 1.00 0.00 N ATOM 1437 CA SER A 88 5.126 -18.859 -22.432 1.00 0.00 C ATOM 1438 C SER A 88 5.918 -18.027 -23.460 1.00 0.00 C ATOM 1439 O SER A 88 5.676 -18.160 -24.661 1.00 0.00 O ATOM 1440 CB SER A 88 3.650 -18.993 -22.849 1.00 0.00 C ATOM 1441 OG SER A 88 2.869 -19.670 -21.871 1.00 0.00 O ATOM 0 H SER A 88 5.080 -17.249 -21.114 1.00 0.00 H new ATOM 0 HA SER A 88 5.590 -19.845 -22.403 1.00 0.00 H new ATOM 0 HB2 SER A 88 3.232 -18.001 -23.020 1.00 0.00 H new ATOM 0 HB3 SER A 88 3.590 -19.532 -23.795 1.00 0.00 H new ATOM 0 HG SER A 88 1.940 -19.730 -22.178 1.00 0.00 H new ATOM 1447 N ASP A 89 6.836 -17.149 -23.027 1.00 0.00 N ATOM 1448 CA ASP A 89 7.529 -16.219 -23.924 1.00 0.00 C ATOM 1449 C ASP A 89 8.980 -15.973 -23.535 1.00 0.00 C ATOM 1450 O ASP A 89 9.856 -16.110 -24.388 1.00 0.00 O ATOM 1451 CB ASP A 89 6.783 -14.883 -24.006 1.00 0.00 C ATOM 1452 CG ASP A 89 7.449 -13.971 -25.049 1.00 0.00 C ATOM 1453 OD1 ASP A 89 7.081 -14.050 -26.242 1.00 0.00 O ATOM 1454 OD2 ASP A 89 8.339 -13.171 -24.686 1.00 0.00 O ATOM 0 H ASP A 89 7.116 -17.066 -22.050 1.00 0.00 H new ATOM 0 HA ASP A 89 7.537 -16.699 -24.903 1.00 0.00 H new ATOM 0 HB2 ASP A 89 5.741 -15.055 -24.274 1.00 0.00 H new ATOM 0 HB3 ASP A 89 6.785 -14.396 -23.031 1.00 0.00 H new ATOM 1459 N ILE A 90 9.275 -15.687 -22.267 1.00 0.00 N ATOM 1460 CA ILE A 90 10.667 -15.583 -21.813 1.00 0.00 C ATOM 1461 C ILE A 90 11.275 -16.988 -21.775 1.00 0.00 C ATOM 1462 O ILE A 90 12.422 -17.176 -22.181 1.00 0.00 O ATOM 1463 CB ILE A 90 10.839 -14.787 -20.491 1.00 0.00 C ATOM 1464 CG1 ILE A 90 10.711 -15.614 -19.189 1.00 0.00 C ATOM 1465 CG2 ILE A 90 9.919 -13.551 -20.485 1.00 0.00 C ATOM 1466 CD1 ILE A 90 10.959 -14.815 -17.904 1.00 0.00 C ATOM 0 H ILE A 90 8.578 -15.524 -21.540 1.00 0.00 H new ATOM 0 HA ILE A 90 11.225 -14.981 -22.531 1.00 0.00 H new ATOM 0 HB ILE A 90 11.880 -14.465 -20.483 1.00 0.00 H new ATOM 0 HG12 ILE A 90 9.712 -16.048 -19.145 1.00 0.00 H new ATOM 0 HG13 ILE A 90 11.417 -16.443 -19.229 1.00 0.00 H new ATOM 0 HG21 ILE A 90 10.051 -13.004 -19.552 1.00 0.00 H new ATOM 0 HG22 ILE A 90 10.173 -12.904 -21.324 1.00 0.00 H new ATOM 0 HG23 ILE A 90 8.881 -13.870 -20.575 1.00 0.00 H new ATOM 0 HD11 ILE A 90 10.849 -15.471 -17.041 1.00 0.00 H new ATOM 0 HD12 ILE A 90 11.968 -14.403 -17.921 1.00 0.00 H new ATOM 0 HD13 ILE A 90 10.236 -14.002 -17.836 1.00 0.00 H new ATOM 1478 N VAL A 91 10.478 -17.984 -21.372 1.00 0.00 N ATOM 1479 CA VAL A 91 10.847 -19.389 -21.426 1.00 0.00 C ATOM 1480 C VAL A 91 11.131 -19.774 -22.883 1.00 0.00 C ATOM 1481 O VAL A 91 12.151 -20.402 -23.167 1.00 0.00 O ATOM 1482 CB VAL A 91 9.740 -20.234 -20.754 1.00 0.00 C ATOM 1483 CG1 VAL A 91 9.952 -21.743 -20.939 1.00 0.00 C ATOM 1484 CG2 VAL A 91 9.695 -19.944 -19.244 1.00 0.00 C ATOM 0 H VAL A 91 9.544 -17.826 -20.994 1.00 0.00 H new ATOM 0 HA VAL A 91 11.762 -19.586 -20.868 1.00 0.00 H new ATOM 0 HB VAL A 91 8.805 -19.953 -21.238 1.00 0.00 H new ATOM 0 HG11 VAL A 91 9.146 -22.287 -20.447 1.00 0.00 H new ATOM 0 HG12 VAL A 91 9.955 -21.982 -22.002 1.00 0.00 H new ATOM 0 HG13 VAL A 91 10.906 -22.033 -20.499 1.00 0.00 H new ATOM 0 HG21 VAL A 91 8.912 -20.545 -18.781 1.00 0.00 H new ATOM 0 HG22 VAL A 91 10.657 -20.195 -18.797 1.00 0.00 H new ATOM 0 HG23 VAL A 91 9.484 -18.887 -19.083 1.00 0.00 H new ATOM 1494 N ALA A 92 10.284 -19.345 -23.827 1.00 0.00 N ATOM 1495 CA ALA A 92 10.514 -19.606 -25.243 1.00 0.00 C ATOM 1496 C ALA A 92 11.812 -18.941 -25.719 1.00 0.00 C ATOM 1497 O ALA A 92 12.578 -19.559 -26.459 1.00 0.00 O ATOM 1498 CB ALA A 92 9.312 -19.139 -26.067 1.00 0.00 C ATOM 0 H ALA A 92 9.434 -18.816 -23.630 1.00 0.00 H new ATOM 0 HA ALA A 92 10.628 -20.681 -25.386 1.00 0.00 H new ATOM 0 HB1 ALA A 92 9.495 -19.339 -27.123 1.00 0.00 H new ATOM 0 HB2 ALA A 92 8.420 -19.676 -25.745 1.00 0.00 H new ATOM 0 HB3 ALA A 92 9.164 -18.069 -25.921 1.00 0.00 H new ATOM 1504 N LYS A 93 12.098 -17.718 -25.257 1.00 0.00 N ATOM 1505 CA LYS A 93 13.317 -16.997 -25.615 1.00 0.00 C ATOM 1506 C LYS A 93 14.555 -17.774 -25.175 1.00 0.00 C ATOM 1507 O LYS A 93 15.463 -17.953 -25.985 1.00 0.00 O ATOM 1508 CB LYS A 93 13.308 -15.577 -25.011 1.00 0.00 C ATOM 1509 CG LYS A 93 13.621 -14.465 -26.028 1.00 0.00 C ATOM 1510 CD LYS A 93 12.604 -14.312 -27.177 1.00 0.00 C ATOM 1511 CE LYS A 93 11.132 -14.241 -26.733 1.00 0.00 C ATOM 1512 NZ LYS A 93 10.831 -13.051 -25.896 1.00 0.00 N ATOM 0 H LYS A 93 11.487 -17.203 -24.623 1.00 0.00 H new ATOM 0 HA LYS A 93 13.351 -16.900 -26.700 1.00 0.00 H new ATOM 0 HB2 LYS A 93 12.330 -15.387 -24.569 1.00 0.00 H new ATOM 0 HB3 LYS A 93 14.037 -15.532 -24.202 1.00 0.00 H new ATOM 0 HG2 LYS A 93 13.686 -13.517 -25.495 1.00 0.00 H new ATOM 0 HG3 LYS A 93 14.604 -14.657 -26.459 1.00 0.00 H new ATOM 0 HD2 LYS A 93 12.844 -13.408 -27.737 1.00 0.00 H new ATOM 0 HD3 LYS A 93 12.722 -15.152 -27.862 1.00 0.00 H new ATOM 0 HE2 LYS A 93 10.493 -14.227 -27.616 1.00 0.00 H new ATOM 0 HE3 LYS A 93 10.884 -15.143 -26.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 9.865 -13.128 -25.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 11.509 -13.000 -25.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 10.908 -12.191 -26.475 1.00 0.00 H new ATOM 1526 N ILE A 94 14.604 -18.254 -23.927 1.00 0.00 N ATOM 1527 CA ILE A 94 15.777 -18.990 -23.451 1.00 0.00 C ATOM 1528 C ILE A 94 15.871 -20.378 -24.100 1.00 0.00 C ATOM 1529 O ILE A 94 16.980 -20.870 -24.310 1.00 0.00 O ATOM 1530 CB ILE A 94 15.870 -19.027 -21.908 1.00 0.00 C ATOM 1531 CG1 ILE A 94 14.717 -19.810 -21.249 1.00 0.00 C ATOM 1532 CG2 ILE A 94 15.964 -17.588 -21.365 1.00 0.00 C ATOM 1533 CD1 ILE A 94 14.839 -19.959 -19.727 1.00 0.00 C ATOM 0 H ILE A 94 13.858 -18.148 -23.240 1.00 0.00 H new ATOM 0 HA ILE A 94 16.659 -18.438 -23.776 1.00 0.00 H new ATOM 0 HB ILE A 94 16.776 -19.573 -21.644 1.00 0.00 H new ATOM 0 HG12 ILE A 94 13.776 -19.309 -21.478 1.00 0.00 H new ATOM 0 HG13 ILE A 94 14.667 -20.803 -21.696 1.00 0.00 H new ATOM 0 HG21 ILE A 94 16.030 -17.613 -20.277 1.00 0.00 H new ATOM 0 HG22 ILE A 94 16.852 -17.103 -21.771 1.00 0.00 H new ATOM 0 HG23 ILE A 94 15.077 -17.028 -21.662 1.00 0.00 H new ATOM 0 HD11 ILE A 94 13.987 -20.522 -19.347 1.00 0.00 H new ATOM 0 HD12 ILE A 94 15.761 -20.489 -19.486 1.00 0.00 H new ATOM 0 HD13 ILE A 94 14.857 -18.972 -19.265 1.00 0.00 H new ATOM 1545 N LYS A 95 14.739 -20.997 -24.468 1.00 0.00 N ATOM 1546 CA LYS A 95 14.745 -22.241 -25.240 1.00 0.00 C ATOM 1547 C LYS A 95 15.333 -22.005 -26.632 1.00 0.00 C ATOM 1548 O LYS A 95 16.128 -22.828 -27.087 1.00 0.00 O ATOM 1549 CB LYS A 95 13.334 -22.845 -25.324 1.00 0.00 C ATOM 1550 CG LYS A 95 12.937 -23.535 -24.009 1.00 0.00 C ATOM 1551 CD LYS A 95 11.489 -24.043 -24.069 1.00 0.00 C ATOM 1552 CE LYS A 95 11.063 -24.754 -22.774 1.00 0.00 C ATOM 1553 NZ LYS A 95 11.746 -26.059 -22.572 1.00 0.00 N ATOM 0 H LYS A 95 13.807 -20.652 -24.241 1.00 0.00 H new ATOM 0 HA LYS A 95 15.379 -22.962 -24.724 1.00 0.00 H new ATOM 0 HB2 LYS A 95 12.614 -22.060 -25.556 1.00 0.00 H new ATOM 0 HB3 LYS A 95 13.294 -23.566 -26.141 1.00 0.00 H new ATOM 0 HG2 LYS A 95 13.611 -24.369 -23.814 1.00 0.00 H new ATOM 0 HG3 LYS A 95 13.047 -22.836 -23.180 1.00 0.00 H new ATOM 0 HD2 LYS A 95 10.820 -23.203 -24.256 1.00 0.00 H new ATOM 0 HD3 LYS A 95 11.382 -24.729 -24.909 1.00 0.00 H new ATOM 0 HE2 LYS A 95 11.274 -24.105 -21.924 1.00 0.00 H new ATOM 0 HE3 LYS A 95 9.985 -24.914 -22.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 11.418 -26.489 -21.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 11.525 -26.693 -23.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 12.774 -25.909 -22.525 1.00 0.00 H new ATOM 1567 N GLY A 96 14.987 -20.904 -27.301 1.00 0.00 N ATOM 1568 CA GLY A 96 15.565 -20.543 -28.586 1.00 0.00 C ATOM 1569 C GLY A 96 15.038 -19.199 -29.073 1.00 0.00 C ATOM 1570 O GLY A 96 15.796 -18.228 -29.114 1.00 0.00 O ATOM 0 H GLY A 96 14.294 -20.238 -26.961 1.00 0.00 H new ATOM 0 HA2 GLY A 96 16.651 -20.500 -28.500 1.00 0.00 H new ATOM 0 HA3 GLY A 96 15.334 -21.314 -29.321 1.00 0.00 H new ATOM 1574 N THR A 97 13.747 -19.126 -29.407 1.00 0.00 N ATOM 1575 CA THR A 97 13.100 -17.922 -29.932 1.00 0.00 C ATOM 1576 C THR A 97 11.622 -17.913 -29.510 1.00 0.00 C ATOM 1577 O THR A 97 11.276 -17.350 -28.472 1.00 0.00 O ATOM 1578 CB THR A 97 13.273 -17.854 -31.469 1.00 0.00 C ATOM 1579 OG1 THR A 97 12.986 -19.107 -32.074 1.00 0.00 O ATOM 1580 CG2 THR A 97 14.662 -17.407 -31.919 1.00 0.00 C ATOM 0 H THR A 97 13.110 -19.918 -29.318 1.00 0.00 H new ATOM 0 HA THR A 97 13.571 -17.031 -29.517 1.00 0.00 H new ATOM 0 HB THR A 97 12.560 -17.097 -31.795 1.00 0.00 H new ATOM 0 HG1 THR A 97 13.743 -19.715 -31.941 1.00 0.00 H new ATOM 0 HG21 THR A 97 14.702 -17.385 -33.008 1.00 0.00 H new ATOM 0 HG22 THR A 97 14.868 -16.411 -31.528 1.00 0.00 H new ATOM 0 HG23 THR A 97 15.409 -18.106 -31.542 1.00 0.00 H new ATOM 1588 N PHE A 98 10.766 -18.590 -30.281 1.00 0.00 N ATOM 1589 CA PHE A 98 9.366 -18.887 -29.959 1.00 0.00 C ATOM 1590 C PHE A 98 9.196 -20.399 -29.734 1.00 0.00 C ATOM 1591 O PHE A 98 8.187 -20.863 -29.201 1.00 0.00 O ATOM 1592 CB PHE A 98 8.468 -18.370 -31.092 1.00 0.00 C ATOM 1593 CG PHE A 98 6.979 -18.549 -30.854 1.00 0.00 C ATOM 1594 CD1 PHE A 98 6.319 -17.761 -29.891 1.00 0.00 C ATOM 1595 CD2 PHE A 98 6.252 -19.509 -31.587 1.00 0.00 C ATOM 1596 CE1 PHE A 98 4.943 -17.933 -29.659 1.00 0.00 C ATOM 1597 CE2 PHE A 98 4.875 -19.679 -31.354 1.00 0.00 C ATOM 1598 CZ PHE A 98 4.220 -18.892 -30.391 1.00 0.00 C ATOM 0 H PHE A 98 11.043 -18.964 -31.189 1.00 0.00 H new ATOM 0 HA PHE A 98 9.072 -18.383 -29.038 1.00 0.00 H new ATOM 0 HB2 PHE A 98 8.673 -17.310 -31.245 1.00 0.00 H new ATOM 0 HB3 PHE A 98 8.739 -18.883 -32.015 1.00 0.00 H new ATOM 0 HD1 PHE A 98 6.872 -17.022 -29.329 1.00 0.00 H new ATOM 0 HD2 PHE A 98 6.753 -20.114 -32.328 1.00 0.00 H new ATOM 0 HE1 PHE A 98 4.441 -17.328 -28.918 1.00 0.00 H new ATOM 0 HE2 PHE A 98 4.320 -20.416 -31.916 1.00 0.00 H new ATOM 0 HZ PHE A 98 3.163 -19.024 -30.213 1.00 0.00 H new ATOM 1608 N LYS A 99 10.218 -21.176 -30.095 1.00 0.00 N ATOM 1609 CA LYS A 99 10.389 -22.600 -29.854 1.00 0.00 C ATOM 1610 C LYS A 99 11.862 -22.774 -29.488 1.00 0.00 C ATOM 1611 O LYS A 99 12.613 -21.798 -29.437 1.00 0.00 O ATOM 1612 CB LYS A 99 10.014 -23.382 -31.136 1.00 0.00 C ATOM 1613 CG LYS A 99 8.515 -23.428 -31.494 1.00 0.00 C ATOM 1614 CD LYS A 99 7.722 -24.557 -30.809 1.00 0.00 C ATOM 1615 CE LYS A 99 7.636 -24.503 -29.275 1.00 0.00 C ATOM 1616 NZ LYS A 99 6.865 -23.333 -28.777 1.00 0.00 N ATOM 0 H LYS A 99 11.011 -20.788 -30.606 1.00 0.00 H new ATOM 0 HA LYS A 99 9.750 -22.980 -29.057 1.00 0.00 H new ATOM 0 HB2 LYS A 99 10.553 -22.942 -31.975 1.00 0.00 H new ATOM 0 HB3 LYS A 99 10.372 -24.406 -31.029 1.00 0.00 H new ATOM 0 HG2 LYS A 99 8.063 -22.472 -31.228 1.00 0.00 H new ATOM 0 HG3 LYS A 99 8.417 -23.538 -32.574 1.00 0.00 H new ATOM 0 HD2 LYS A 99 6.708 -24.552 -31.208 1.00 0.00 H new ATOM 0 HD3 LYS A 99 8.171 -25.509 -31.092 1.00 0.00 H new ATOM 0 HE2 LYS A 99 7.172 -25.419 -28.910 1.00 0.00 H new ATOM 0 HE3 LYS A 99 8.644 -24.470 -28.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 6.710 -23.429 -27.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 7.398 -22.460 -28.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 5.947 -23.290 -29.263 1.00 0.00 H new ATOM 1630 N GLU A 100 12.311 -24.010 -29.301 1.00 0.00 N ATOM 1631 CA GLU A 100 13.725 -24.342 -29.135 1.00 0.00 C ATOM 1632 C GLU A 100 14.579 -24.016 -30.379 1.00 0.00 C ATOM 1633 O GLU A 100 15.804 -24.135 -30.345 1.00 0.00 O ATOM 1634 CB GLU A 100 13.850 -25.810 -28.686 1.00 0.00 C ATOM 1635 CG GLU A 100 13.606 -26.881 -29.770 1.00 0.00 C ATOM 1636 CD GLU A 100 12.181 -26.908 -30.358 1.00 0.00 C ATOM 1637 OE1 GLU A 100 11.206 -26.587 -29.643 1.00 0.00 O ATOM 1638 OE2 GLU A 100 12.034 -27.261 -31.550 1.00 0.00 O ATOM 0 H GLU A 100 11.696 -24.823 -29.260 1.00 0.00 H new ATOM 0 HA GLU A 100 14.138 -23.703 -28.355 1.00 0.00 H new ATOM 0 HB2 GLU A 100 14.850 -25.959 -28.277 1.00 0.00 H new ATOM 0 HB3 GLU A 100 13.145 -25.980 -27.873 1.00 0.00 H new ATOM 0 HG2 GLU A 100 14.314 -26.720 -30.583 1.00 0.00 H new ATOM 0 HG3 GLU A 100 13.825 -27.861 -29.346 1.00 0.00 H new ATOM 1645 N ARG A 101 13.944 -23.621 -31.490 1.00 0.00 N ATOM 1646 CA ARG A 101 14.608 -23.254 -32.737 1.00 0.00 C ATOM 1647 C ARG A 101 15.459 -21.992 -32.534 1.00 0.00 C ATOM 1648 O ARG A 101 15.012 -21.073 -31.840 1.00 0.00 O ATOM 1649 CB ARG A 101 13.558 -22.972 -33.825 1.00 0.00 C ATOM 1650 CG ARG A 101 12.583 -24.124 -34.116 1.00 0.00 C ATOM 1651 CD ARG A 101 11.489 -23.641 -35.076 1.00 0.00 C ATOM 1652 NE ARG A 101 10.494 -24.695 -35.338 1.00 0.00 N ATOM 1653 CZ ARG A 101 9.306 -24.513 -35.931 1.00 0.00 C ATOM 1654 NH1 ARG A 101 8.926 -23.312 -36.358 1.00 0.00 N ATOM 1655 NH2 ARG A 101 8.493 -25.553 -36.095 1.00 0.00 N ATOM 0 H ARG A 101 12.928 -23.548 -31.543 1.00 0.00 H new ATOM 0 HA ARG A 101 15.248 -24.081 -33.043 1.00 0.00 H new ATOM 0 HB2 ARG A 101 12.981 -22.096 -33.530 1.00 0.00 H new ATOM 0 HB3 ARG A 101 14.077 -22.716 -34.749 1.00 0.00 H new ATOM 0 HG2 ARG A 101 13.119 -24.966 -34.554 1.00 0.00 H new ATOM 0 HG3 ARG A 101 12.136 -24.479 -33.187 1.00 0.00 H new ATOM 0 HD2 ARG A 101 10.992 -22.768 -34.653 1.00 0.00 H new ATOM 0 HD3 ARG A 101 11.942 -23.326 -36.016 1.00 0.00 H new ATOM 0 HE ARG A 101 10.729 -25.643 -35.043 1.00 0.00 H new ATOM 0 HH11 ARG A 101 9.543 -22.509 -36.237 1.00 0.00 H new ATOM 0 HH12 ARG A 101 8.018 -23.194 -36.807 1.00 0.00 H new ATOM 0 HH21 ARG A 101 8.776 -26.478 -35.771 1.00 0.00 H new ATOM 0 HH22 ARG A 101 7.587 -25.426 -36.545 1.00 0.00 H new ATOM 1669 N PRO A 102 16.620 -21.872 -33.205 1.00 0.00 N ATOM 1670 CA PRO A 102 17.431 -20.657 -33.175 1.00 0.00 C ATOM 1671 C PRO A 102 16.814 -19.509 -33.995 1.00 0.00 C ATOM 1672 O PRO A 102 17.268 -18.368 -33.886 1.00 0.00 O ATOM 1673 CB PRO A 102 18.794 -21.079 -33.735 1.00 0.00 C ATOM 1674 CG PRO A 102 18.437 -22.194 -34.717 1.00 0.00 C ATOM 1675 CD PRO A 102 17.256 -22.886 -34.037 1.00 0.00 C ATOM 0 HA PRO A 102 17.504 -20.259 -32.163 1.00 0.00 H new ATOM 0 HB2 PRO A 102 19.299 -20.251 -34.232 1.00 0.00 H new ATOM 0 HB3 PRO A 102 19.461 -21.433 -32.949 1.00 0.00 H new ATOM 0 HG2 PRO A 102 18.164 -21.798 -35.695 1.00 0.00 H new ATOM 0 HG3 PRO A 102 19.271 -22.878 -34.871 1.00 0.00 H new ATOM 0 HD2 PRO A 102 16.557 -23.280 -34.775 1.00 0.00 H new ATOM 0 HD3 PRO A 102 17.592 -23.730 -33.435 1.00 0.00 H new ATOM 1683 N LYS A 103 15.790 -19.787 -34.812 1.00 0.00 N ATOM 1684 CA LYS A 103 15.008 -18.818 -35.572 1.00 0.00 C ATOM 1685 C LYS A 103 13.588 -19.378 -35.631 1.00 0.00 C ATOM 1686 O LYS A 103 13.436 -20.587 -35.817 1.00 0.00 O ATOM 1687 CB LYS A 103 15.623 -18.647 -36.973 1.00 0.00 C ATOM 1688 CG LYS A 103 14.926 -17.547 -37.788 1.00 0.00 C ATOM 1689 CD LYS A 103 15.607 -17.356 -39.150 1.00 0.00 C ATOM 1690 CE LYS A 103 14.894 -16.254 -39.946 1.00 0.00 C ATOM 1691 NZ LYS A 103 15.516 -16.030 -41.275 1.00 0.00 N ATOM 0 H LYS A 103 15.473 -20.744 -34.965 1.00 0.00 H new ATOM 0 HA LYS A 103 15.002 -17.830 -35.112 1.00 0.00 H new ATOM 0 HB2 LYS A 103 16.682 -18.407 -36.875 1.00 0.00 H new ATOM 0 HB3 LYS A 103 15.558 -19.592 -37.513 1.00 0.00 H new ATOM 0 HG2 LYS A 103 13.878 -17.807 -37.935 1.00 0.00 H new ATOM 0 HG3 LYS A 103 14.947 -16.609 -37.232 1.00 0.00 H new ATOM 0 HD2 LYS A 103 16.655 -17.092 -39.008 1.00 0.00 H new ATOM 0 HD3 LYS A 103 15.587 -18.291 -39.710 1.00 0.00 H new ATOM 0 HE2 LYS A 103 13.846 -16.524 -40.078 1.00 0.00 H new ATOM 0 HE3 LYS A 103 14.915 -15.325 -39.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 15.002 -15.278 -41.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 16.509 -15.747 -41.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 15.474 -16.908 -41.831 1.00 0.00 H new ATOM 1705 N LYS A 104 12.580 -18.525 -35.438 1.00 0.00 N ATOM 1706 CA LYS A 104 11.178 -18.929 -35.346 1.00 0.00 C ATOM 1707 C LYS A 104 10.793 -19.789 -36.547 1.00 0.00 C ATOM 1708 O LYS A 104 10.196 -20.864 -36.331 1.00 0.00 O ATOM 1709 CB LYS A 104 10.248 -17.709 -35.230 1.00 0.00 C ATOM 1710 CG LYS A 104 10.534 -16.835 -33.998 1.00 0.00 C ATOM 1711 CD LYS A 104 9.512 -15.694 -33.891 1.00 0.00 C ATOM 1712 CE LYS A 104 9.841 -14.782 -32.700 1.00 0.00 C ATOM 1713 NZ LYS A 104 8.887 -13.651 -32.581 1.00 0.00 N ATOM 1714 OXT LYS A 104 11.054 -19.374 -37.698 1.00 0.00 O ATOM 0 H LYS A 104 12.718 -17.519 -35.340 1.00 0.00 H new ATOM 0 HA LYS A 104 11.058 -19.522 -34.439 1.00 0.00 H new ATOM 0 HB2 LYS A 104 10.347 -17.100 -36.129 1.00 0.00 H new ATOM 0 HB3 LYS A 104 9.214 -18.053 -35.190 1.00 0.00 H new ATOM 0 HG2 LYS A 104 10.499 -17.447 -33.096 1.00 0.00 H new ATOM 0 HG3 LYS A 104 11.541 -16.423 -34.065 1.00 0.00 H new ATOM 0 HD2 LYS A 104 9.512 -15.112 -34.812 1.00 0.00 H new ATOM 0 HD3 LYS A 104 8.510 -16.106 -33.774 1.00 0.00 H new ATOM 0 HE2 LYS A 104 9.825 -15.367 -31.781 1.00 0.00 H new ATOM 0 HE3 LYS A 104 10.853 -14.392 -32.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 9.147 -13.062 -31.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 8.920 -13.076 -33.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 7.924 -14.021 -32.448 1.00 0.00 H new TER 1728 LYS A 104