USER MOD reduce.3.24.130724 H: found=0, std=0, add=1174, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1171 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 91 TYR OH : rot 120:sc= 1.12 USER MOD Set 1.2: A 139 LYS NZ :NH3+ 178:sc= 2.18 (180deg=0.997) USER MOD Set 2.1: A 57 HIS : no HD1:sc= 0 X(o=1.2,f=1.2) USER MOD Set 2.2: A 61 THR OG1 : rot 95:sc= 1.23 USER MOD Set 3.1: A 20 GLN : amide:sc= 0.532 K(o=2.5,f=-7.1!) USER MOD Set 3.2: A 24 LYS NZ :NH3+ 149:sc= 2 (180deg=0.173) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 ASN : amide:sc= -0.0592 K(o=-0.059,f=-1.3) USER MOD Single : A 6 TYR OH : rot 130:sc=-0.000356 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 CYS SG : rot 180:sc= 0.011 USER MOD Single : A 12 GLN : amide:sc= -0.0283 X(o=-0.028,f=0) USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 GLN :FLIP amide:sc= 0 F(o=-0.61,f=0) USER MOD Single : A 17 ASN : amide:sc= 0 X(o=0,f=-0.023) USER MOD Single : A 18 ASN : amide:sc= 0.278 X(o=0.28,f=-0.01) USER MOD Single : A 22 LYS NZ :NH3+ 154:sc= 2.75 (180deg=-1.19!) USER MOD Single : A 26 ASN : amide:sc= -1.02 K(o=-1,f=-3.7!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ -152:sc= -0.127 (180deg=-0.538) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 TYR OH : rot 69:sc= 0.568 USER MOD Single : A 43 LYS NZ :NH3+ 146:sc= 1.02 (180deg=-0.562) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0.114 USER MOD Single : A 46 HIS : no HD1:sc= -0.184 X(o=-0.18,f=-0.027) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ -131:sc= 2 (180deg=0.802) USER MOD Single : A 52 ASN : amide:sc= 0.0312 K(o=0.031,f=-6.9!) USER MOD Single : A 55 TYR OH : rot -179:sc= 1.72 USER MOD Single : A 58 GLN : amide:sc= 0.101 K(o=0.1,f=-2.4) USER MOD Single : A 64 TYR OH : rot 180:sc= -0.381 USER MOD Single : A 68 TYR OH : rot -130:sc= -0.507 USER MOD Single : A 70 SER OG : rot -139:sc= 0.622 USER MOD Single : A 71 THR OG1 : rot -115:sc= -1.12 USER MOD Single : A 72 THR OG1 : rot 180:sc= -0.384 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0.0203 USER MOD Single : A 75 LYS NZ :NH3+ -127:sc= 1.31 (180deg=-0.397) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 139:sc= 0 (180deg=-0.135) USER MOD Single : A 83 THR OG1 : rot 83:sc= 1.21 USER MOD Single : A 84 SER OG : rot 98:sc= 1.27 USER MOD Single : A 85 SER OG : rot 82:sc= 1.03 USER MOD Single : A 89 ASN : amide:sc= -0.149 X(o=-0.15,f=-0.016) USER MOD Single : A 93 TYR OH : rot -46:sc= 0.335 USER MOD Single : A 96 ASN : amide:sc= 0.624 K(o=0.62,f=-13!) USER MOD Single : A 102 GLN : amide:sc=-0.00127 X(o=-0.0013,f=-0.28) USER MOD Single : A 103 TYR OH : rot 30:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 HIS : no HE2:sc= 0.484 K(o=0.48,f=-2.7!) USER MOD Single : A 115 ASN :FLIP amide:sc= -0.338 F(o=-2.9!,f=-0.34) USER MOD Single : A 117 ASN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 THR OG1 : rot -139:sc= 0.309 USER MOD Single : A 130 CYS SG : rot 159:sc= -2.33! USER MOD Single : A 145 ASN : amide:sc=-0.00572 X(o=-0.0057,f=-0.0057) USER MOD Single : A 148 HIS : no HD1:sc= -0.016 X(o=-0.016,f=0) USER MOD Single : A 149 HIS : no HD1:sc= 0 X(o=0,f=-0.04) USER MOD Single : A 150 HIS : no HE2:sc= 0.787 K(o=0.79,f=-4.2!) USER MOD Single : A 151 HIS : +bothHN:sc= 0.759 K(o=0.76,f=-3.4!) USER MOD Single : A 152 HIS : no HD1:sc=-0.000327 X(o=-0.00033,f=-0.00033) USER MOD Single : A 153 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.823 8.728 -12.265 1.00 0.00 N ATOM 2 CA MET A 1 2.060 8.040 -13.556 1.00 0.00 C ATOM 3 C MET A 1 2.854 6.750 -13.342 1.00 0.00 C ATOM 4 O MET A 1 4.072 6.717 -13.536 1.00 0.00 O ATOM 5 CB MET A 1 2.810 8.966 -14.529 1.00 0.00 C ATOM 6 CG MET A 1 2.906 8.424 -15.952 1.00 0.00 C ATOM 7 SD MET A 1 3.970 9.431 -17.007 1.00 0.00 S ATOM 8 CE MET A 1 3.580 8.766 -18.626 1.00 0.00 C ATOM 0 H1 MET A 1 1.283 9.601 -12.431 1.00 0.00 H new ATOM 0 H2 MET A 1 1.284 8.103 -11.632 1.00 0.00 H new ATOM 0 H3 MET A 1 2.735 8.964 -11.825 1.00 0.00 H new ATOM 0 HA MET A 1 1.093 7.785 -13.989 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.309 9.934 -14.553 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.817 9.138 -14.148 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.289 7.404 -15.923 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.908 8.377 -16.387 1.00 0.00 H new ATOM 0 HE1 MET A 1 4.162 9.290 -19.384 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.824 7.704 -18.651 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.517 8.899 -18.828 1.00 0.00 H new ATOM 20 N GLY A 2 2.155 5.695 -12.924 1.00 0.00 N ATOM 21 CA GLY A 2 2.782 4.397 -12.753 1.00 0.00 C ATOM 22 C GLY A 2 3.565 4.294 -11.460 1.00 0.00 C ATOM 23 O GLY A 2 4.713 4.733 -11.383 1.00 0.00 O ATOM 0 H GLY A 2 1.160 5.719 -12.700 1.00 0.00 H new ATOM 0 HA2 GLY A 2 2.016 3.622 -12.772 1.00 0.00 H new ATOM 0 HA3 GLY A 2 3.449 4.206 -13.594 1.00 0.00 H new ATOM 27 N ASN A 3 2.940 3.719 -10.437 1.00 0.00 N ATOM 28 CA ASN A 3 3.594 3.502 -9.152 1.00 0.00 C ATOM 29 C ASN A 3 2.848 2.422 -8.381 1.00 0.00 C ATOM 30 O ASN A 3 1.679 2.148 -8.662 1.00 0.00 O ATOM 31 CB ASN A 3 3.675 4.809 -8.337 1.00 0.00 C ATOM 32 CG ASN A 3 2.336 5.258 -7.766 1.00 0.00 C ATOM 33 OD1 ASN A 3 1.328 5.308 -8.475 1.00 0.00 O ATOM 34 ND2 ASN A 3 2.323 5.612 -6.486 1.00 0.00 N ATOM 0 H ASN A 3 1.974 3.393 -10.475 1.00 0.00 H new ATOM 0 HA ASN A 3 4.617 3.171 -9.329 1.00 0.00 H new ATOM 0 HB2 ASN A 3 4.382 4.673 -7.519 1.00 0.00 H new ATOM 0 HB3 ASN A 3 4.072 5.600 -8.973 1.00 0.00 H new ATOM 0 HD21 ASN A 3 1.458 5.939 -6.056 1.00 0.00 H new ATOM 0 HD22 ASN A 3 3.178 5.556 -5.933 1.00 0.00 H new ATOM 41 N PHE A 4 3.525 1.803 -7.428 1.00 0.00 N ATOM 42 CA PHE A 4 2.949 0.690 -6.686 1.00 0.00 C ATOM 43 C PHE A 4 2.762 1.046 -5.217 1.00 0.00 C ATOM 44 O PHE A 4 3.361 1.999 -4.713 1.00 0.00 O ATOM 45 CB PHE A 4 3.836 -0.564 -6.818 1.00 0.00 C ATOM 46 CG PHE A 4 5.311 -0.318 -6.586 1.00 0.00 C ATOM 47 CD1 PHE A 4 5.793 -0.001 -5.320 1.00 0.00 C ATOM 48 CD2 PHE A 4 6.218 -0.411 -7.634 1.00 0.00 C ATOM 49 CE1 PHE A 4 7.141 0.216 -5.110 1.00 0.00 C ATOM 50 CE2 PHE A 4 7.567 -0.195 -7.426 1.00 0.00 C ATOM 51 CZ PHE A 4 8.030 0.118 -6.163 1.00 0.00 C ATOM 0 H PHE A 4 4.474 2.051 -7.149 1.00 0.00 H new ATOM 0 HA PHE A 4 1.969 0.477 -7.113 1.00 0.00 H new ATOM 0 HB2 PHE A 4 3.490 -1.315 -6.107 1.00 0.00 H new ATOM 0 HB3 PHE A 4 3.703 -0.984 -7.815 1.00 0.00 H new ATOM 0 HD1 PHE A 4 5.105 0.076 -4.491 1.00 0.00 H new ATOM 0 HD2 PHE A 4 5.864 -0.655 -8.625 1.00 0.00 H new ATOM 0 HE1 PHE A 4 7.500 0.462 -4.122 1.00 0.00 H new ATOM 0 HE2 PHE A 4 8.259 -0.271 -8.251 1.00 0.00 H new ATOM 0 HZ PHE A 4 9.084 0.286 -5.999 1.00 0.00 H new ATOM 61 N LEU A 5 1.912 0.278 -4.552 1.00 0.00 N ATOM 62 CA LEU A 5 1.753 0.348 -3.110 1.00 0.00 C ATOM 63 C LEU A 5 2.530 -0.801 -2.488 1.00 0.00 C ATOM 64 O LEU A 5 2.750 -1.835 -3.140 1.00 0.00 O ATOM 65 CB LEU A 5 0.268 0.263 -2.708 1.00 0.00 C ATOM 66 CG LEU A 5 -0.749 0.481 -3.849 1.00 0.00 C ATOM 67 CD1 LEU A 5 -1.752 -0.668 -3.901 1.00 0.00 C ATOM 68 CD2 LEU A 5 -1.466 1.821 -3.693 1.00 0.00 C ATOM 0 H LEU A 5 1.311 -0.414 -5.001 1.00 0.00 H new ATOM 0 HA LEU A 5 2.135 1.304 -2.751 1.00 0.00 H new ATOM 0 HB2 LEU A 5 0.086 -0.717 -2.266 1.00 0.00 H new ATOM 0 HB3 LEU A 5 0.078 1.003 -1.931 1.00 0.00 H new ATOM 0 HG LEU A 5 -0.202 0.501 -4.792 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -2.460 -0.496 -4.711 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -1.223 -1.605 -4.074 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -2.290 -0.724 -2.955 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -2.177 1.950 -4.509 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -1.998 1.840 -2.742 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -0.735 2.630 -3.717 1.00 0.00 H new ATOM 80 N TYR A 6 2.934 -0.633 -1.239 1.00 0.00 N ATOM 81 CA TYR A 6 3.773 -1.617 -0.574 1.00 0.00 C ATOM 82 C TYR A 6 2.983 -2.405 0.467 1.00 0.00 C ATOM 83 O TYR A 6 2.135 -1.860 1.177 1.00 0.00 O ATOM 84 CB TYR A 6 4.990 -0.932 0.077 1.00 0.00 C ATOM 85 CG TYR A 6 6.324 -1.565 -0.289 1.00 0.00 C ATOM 86 CD1 TYR A 6 6.924 -1.309 -1.518 1.00 0.00 C ATOM 87 CD2 TYR A 6 6.984 -2.415 0.594 1.00 0.00 C ATOM 88 CE1 TYR A 6 8.138 -1.878 -1.856 1.00 0.00 C ATOM 89 CE2 TYR A 6 8.198 -2.987 0.263 1.00 0.00 C ATOM 90 CZ TYR A 6 8.770 -2.716 -0.965 1.00 0.00 C ATOM 91 OH TYR A 6 9.980 -3.285 -1.304 1.00 0.00 O ATOM 0 H TYR A 6 2.694 0.176 -0.665 1.00 0.00 H new ATOM 0 HA TYR A 6 4.128 -2.321 -1.327 1.00 0.00 H new ATOM 0 HB2 TYR A 6 5.004 0.117 -0.218 1.00 0.00 H new ATOM 0 HB3 TYR A 6 4.872 -0.957 1.160 1.00 0.00 H new ATOM 0 HD1 TYR A 6 6.432 -0.653 -2.221 1.00 0.00 H new ATOM 0 HD2 TYR A 6 6.540 -2.631 1.554 1.00 0.00 H new ATOM 0 HE1 TYR A 6 8.588 -1.666 -2.814 1.00 0.00 H new ATOM 0 HE2 TYR A 6 8.697 -3.643 0.961 1.00 0.00 H new ATOM 0 HH TYR A 6 10.624 -3.141 -0.579 1.00 0.00 H new ATOM 101 N ARG A 7 3.276 -3.694 0.541 1.00 0.00 N ATOM 102 CA ARG A 7 2.670 -4.583 1.519 1.00 0.00 C ATOM 103 C ARG A 7 3.712 -5.602 1.965 1.00 0.00 C ATOM 104 O ARG A 7 4.678 -5.847 1.252 1.00 0.00 O ATOM 105 CB ARG A 7 1.439 -5.291 0.921 1.00 0.00 C ATOM 106 CG ARG A 7 0.379 -5.694 1.956 1.00 0.00 C ATOM 107 CD ARG A 7 -0.850 -4.780 1.911 1.00 0.00 C ATOM 108 NE ARG A 7 -0.958 -3.927 3.103 1.00 0.00 N ATOM 109 CZ ARG A 7 -2.027 -3.887 3.910 1.00 0.00 C ATOM 110 NH1 ARG A 7 -3.081 -4.661 3.666 1.00 0.00 N ATOM 111 NH2 ARG A 7 -2.039 -3.072 4.961 1.00 0.00 N ATOM 0 H ARG A 7 3.943 -4.154 -0.078 1.00 0.00 H new ATOM 0 HA ARG A 7 2.332 -4.005 2.379 1.00 0.00 H new ATOM 0 HB2 ARG A 7 0.979 -4.634 0.183 1.00 0.00 H new ATOM 0 HB3 ARG A 7 1.770 -6.184 0.390 1.00 0.00 H new ATOM 0 HG2 ARG A 7 0.071 -6.724 1.776 1.00 0.00 H new ATOM 0 HG3 ARG A 7 0.817 -5.662 2.954 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -0.800 -4.152 1.022 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -1.749 -5.389 1.821 1.00 0.00 H new ATOM 0 HE ARG A 7 -0.167 -3.325 3.331 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -3.078 -5.288 2.862 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -3.892 -4.627 4.283 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -1.234 -2.476 5.154 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -2.853 -3.043 5.574 1.00 0.00 H new ATOM 125 N GLY A 8 3.540 -6.164 3.150 1.00 0.00 N ATOM 126 CA GLY A 8 4.466 -7.173 3.634 1.00 0.00 C ATOM 127 C GLY A 8 3.737 -8.319 4.300 1.00 0.00 C ATOM 128 O GLY A 8 2.597 -8.156 4.739 1.00 0.00 O ATOM 0 H GLY A 8 2.776 -5.942 3.788 1.00 0.00 H new ATOM 0 HA2 GLY A 8 5.060 -7.552 2.803 1.00 0.00 H new ATOM 0 HA3 GLY A 8 5.161 -6.721 4.342 1.00 0.00 H new ATOM 132 N ILE A 9 4.384 -9.478 4.369 1.00 0.00 N ATOM 133 CA ILE A 9 3.780 -10.672 4.948 1.00 0.00 C ATOM 134 C ILE A 9 4.846 -11.534 5.629 1.00 0.00 C ATOM 135 O ILE A 9 5.970 -11.657 5.137 1.00 0.00 O ATOM 136 CB ILE A 9 3.017 -11.503 3.858 1.00 0.00 C ATOM 137 CG1 ILE A 9 1.500 -11.485 4.121 1.00 0.00 C ATOM 138 CG2 ILE A 9 3.521 -12.950 3.770 1.00 0.00 C ATOM 139 CD1 ILE A 9 0.683 -12.153 3.032 1.00 0.00 C ATOM 0 H ILE A 9 5.335 -9.615 4.028 1.00 0.00 H new ATOM 0 HA ILE A 9 3.056 -10.354 5.698 1.00 0.00 H new ATOM 0 HB ILE A 9 3.219 -11.027 2.899 1.00 0.00 H new ATOM 0 HG12 ILE A 9 1.299 -11.982 5.070 1.00 0.00 H new ATOM 0 HG13 ILE A 9 1.171 -10.451 4.227 1.00 0.00 H new ATOM 0 HG21 ILE A 9 2.962 -13.484 3.002 1.00 0.00 H new ATOM 0 HG22 ILE A 9 4.581 -12.951 3.515 1.00 0.00 H new ATOM 0 HG23 ILE A 9 3.379 -13.444 4.731 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -0.375 -12.101 3.287 1.00 0.00 H new ATOM 0 HD12 ILE A 9 0.853 -11.642 2.084 1.00 0.00 H new ATOM 0 HD13 ILE A 9 0.983 -13.197 2.940 1.00 0.00 H new ATOM 151 N SER A 10 4.497 -12.099 6.779 1.00 0.00 N ATOM 152 CA SER A 10 5.340 -13.076 7.459 1.00 0.00 C ATOM 153 C SER A 10 4.621 -14.425 7.496 1.00 0.00 C ATOM 154 O SER A 10 5.091 -15.388 8.103 1.00 0.00 O ATOM 155 CB SER A 10 5.667 -12.595 8.881 1.00 0.00 C ATOM 156 OG SER A 10 5.756 -11.177 8.933 1.00 0.00 O ATOM 0 H SER A 10 3.624 -11.894 7.265 1.00 0.00 H new ATOM 0 HA SER A 10 6.278 -13.189 6.916 1.00 0.00 H new ATOM 0 HB2 SER A 10 4.897 -12.940 9.571 1.00 0.00 H new ATOM 0 HB3 SER A 10 6.609 -13.034 9.209 1.00 0.00 H new ATOM 0 HG SER A 10 5.963 -10.896 9.849 1.00 0.00 H new ATOM 162 N CYS A 11 3.479 -14.479 6.814 1.00 0.00 N ATOM 163 CA CYS A 11 2.619 -15.651 6.803 1.00 0.00 C ATOM 164 C CYS A 11 2.811 -16.448 5.510 1.00 0.00 C ATOM 165 O CYS A 11 1.844 -16.816 4.834 1.00 0.00 O ATOM 166 CB CYS A 11 1.159 -15.207 6.968 1.00 0.00 C ATOM 167 SG CYS A 11 0.980 -13.584 7.749 1.00 0.00 S ATOM 0 H CYS A 11 3.126 -13.705 6.252 1.00 0.00 H new ATOM 0 HA CYS A 11 2.886 -16.305 7.633 1.00 0.00 H new ATOM 0 HB2 CYS A 11 0.682 -15.184 5.988 1.00 0.00 H new ATOM 0 HB3 CYS A 11 0.627 -15.949 7.564 1.00 0.00 H new ATOM 0 HG CYS A 11 -0.282 -13.286 7.847 1.00 0.00 H new ATOM 173 N GLN A 12 4.072 -16.713 5.171 1.00 0.00 N ATOM 174 CA GLN A 12 4.393 -17.536 4.008 1.00 0.00 C ATOM 175 C GLN A 12 3.779 -18.920 4.183 1.00 0.00 C ATOM 176 O GLN A 12 3.469 -19.608 3.211 1.00 0.00 O ATOM 177 CB GLN A 12 5.913 -17.645 3.824 1.00 0.00 C ATOM 178 CG GLN A 12 6.590 -16.316 3.493 1.00 0.00 C ATOM 179 CD GLN A 12 7.873 -16.490 2.696 1.00 0.00 C ATOM 180 OE1 GLN A 12 8.962 -16.171 3.170 1.00 0.00 O ATOM 181 NE2 GLN A 12 7.751 -16.998 1.480 1.00 0.00 N ATOM 0 H GLN A 12 4.885 -16.371 5.684 1.00 0.00 H new ATOM 0 HA GLN A 12 3.978 -17.067 3.116 1.00 0.00 H new ATOM 0 HB2 GLN A 12 6.352 -18.049 4.736 1.00 0.00 H new ATOM 0 HB3 GLN A 12 6.123 -18.358 3.027 1.00 0.00 H new ATOM 0 HG2 GLN A 12 5.898 -15.692 2.927 1.00 0.00 H new ATOM 0 HG3 GLN A 12 6.812 -15.786 4.419 1.00 0.00 H new ATOM 0 HE21 GLN A 12 6.829 -17.250 1.123 1.00 0.00 H new ATOM 0 HE22 GLN A 12 8.578 -17.137 0.900 1.00 0.00 H new ATOM 190 N GLN A 13 3.601 -19.303 5.446 1.00 0.00 N ATOM 191 CA GLN A 13 2.930 -20.549 5.798 1.00 0.00 C ATOM 192 C GLN A 13 1.494 -20.528 5.275 1.00 0.00 C ATOM 193 O GLN A 13 1.032 -21.485 4.656 1.00 0.00 O ATOM 194 CB GLN A 13 2.943 -20.734 7.323 1.00 0.00 C ATOM 195 CG GLN A 13 2.306 -22.035 7.802 1.00 0.00 C ATOM 196 CD GLN A 13 1.991 -22.015 9.288 1.00 0.00 C ATOM 197 OE1 GLN A 13 0.828 -22.027 9.689 1.00 0.00 O ATOM 198 NE2 GLN A 13 3.023 -21.975 10.116 1.00 0.00 N ATOM 0 H GLN A 13 3.917 -18.760 6.250 1.00 0.00 H new ATOM 0 HA GLN A 13 3.457 -21.386 5.340 1.00 0.00 H new ATOM 0 HB2 GLN A 13 3.975 -20.698 7.673 1.00 0.00 H new ATOM 0 HB3 GLN A 13 2.420 -19.896 7.784 1.00 0.00 H new ATOM 0 HG2 GLN A 13 1.388 -22.215 7.242 1.00 0.00 H new ATOM 0 HG3 GLN A 13 2.978 -22.866 7.587 1.00 0.00 H new ATOM 0 HE21 GLN A 13 3.974 -21.966 9.746 1.00 0.00 H new ATOM 0 HE22 GLN A 13 2.868 -21.953 11.124 1.00 0.00 H new ATOM 207 N ASP A 14 0.807 -19.409 5.514 1.00 0.00 N ATOM 208 CA ASP A 14 -0.572 -19.224 5.056 1.00 0.00 C ATOM 209 C ASP A 14 -0.630 -19.283 3.535 1.00 0.00 C ATOM 210 O ASP A 14 -1.464 -19.987 2.958 1.00 0.00 O ATOM 211 CB ASP A 14 -1.126 -17.878 5.550 1.00 0.00 C ATOM 212 CG ASP A 14 -2.480 -17.529 4.937 1.00 0.00 C ATOM 213 OD1 ASP A 14 -3.506 -18.071 5.406 1.00 0.00 O ATOM 214 OD2 ASP A 14 -2.524 -16.708 3.994 1.00 0.00 O ATOM 0 H ASP A 14 1.186 -18.612 6.026 1.00 0.00 H new ATOM 0 HA ASP A 14 -1.185 -20.026 5.467 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -1.221 -17.907 6.635 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -0.412 -17.089 5.314 1.00 0.00 H new ATOM 219 N GLU A 15 0.284 -18.557 2.895 1.00 0.00 N ATOM 220 CA GLU A 15 0.367 -18.531 1.435 1.00 0.00 C ATOM 221 C GLU A 15 0.502 -19.956 0.880 1.00 0.00 C ATOM 222 O GLU A 15 -0.248 -20.365 -0.009 1.00 0.00 O ATOM 223 CB GLU A 15 1.557 -17.660 0.981 1.00 0.00 C ATOM 224 CG GLU A 15 1.353 -16.975 -0.380 1.00 0.00 C ATOM 225 CD GLU A 15 2.334 -17.430 -1.459 1.00 0.00 C ATOM 226 OE1 GLU A 15 3.223 -18.259 -1.167 1.00 0.00 O ATOM 227 OE2 GLU A 15 2.215 -16.961 -2.611 1.00 0.00 O ATOM 0 H GLU A 15 0.979 -17.977 3.365 1.00 0.00 H new ATOM 0 HA GLU A 15 -0.552 -18.094 1.043 1.00 0.00 H new ATOM 0 HB2 GLU A 15 1.742 -16.896 1.736 1.00 0.00 H new ATOM 0 HB3 GLU A 15 2.450 -18.282 0.932 1.00 0.00 H new ATOM 0 HG2 GLU A 15 0.337 -17.168 -0.723 1.00 0.00 H new ATOM 0 HG3 GLU A 15 1.447 -15.897 -0.250 1.00 0.00 H new ATOM 234 N GLN A 16 1.445 -20.713 1.437 1.00 0.00 N ATOM 235 CA GLN A 16 1.716 -22.082 0.993 1.00 0.00 C ATOM 236 C GLN A 16 0.596 -23.039 1.415 1.00 0.00 C ATOM 237 O GLN A 16 0.398 -24.087 0.795 1.00 0.00 O ATOM 238 CB GLN A 16 3.063 -22.565 1.559 1.00 0.00 C ATOM 239 CG GLN A 16 4.282 -21.896 0.921 1.00 0.00 C ATOM 240 CD GLN A 16 4.891 -22.715 -0.208 1.00 0.00 C ATOM 241 OE1 GLN A 16 4.108 -22.976 -1.244 1.00 0.00 O flip ATOM 242 NE2 GLN A 16 6.064 -23.096 -0.157 1.00 0.00 N flip ATOM 0 H GLN A 16 2.040 -20.399 2.204 1.00 0.00 H new ATOM 0 HA GLN A 16 1.763 -22.078 -0.096 1.00 0.00 H new ATOM 0 HB2 GLN A 16 3.081 -22.381 2.633 1.00 0.00 H new ATOM 0 HB3 GLN A 16 3.138 -23.643 1.419 1.00 0.00 H new ATOM 0 HG2 GLN A 16 3.992 -20.918 0.537 1.00 0.00 H new ATOM 0 HG3 GLN A 16 5.038 -21.726 1.687 1.00 0.00 H new ATOM 0 HE21 GLN A 16 6.637 -22.876 0.658 1.00 0.00 H new ATOM 0 HE22 GLN A 16 6.460 -23.631 -0.930 1.00 0.00 H new ATOM 251 N ASN A 17 -0.129 -22.673 2.469 1.00 0.00 N ATOM 252 CA ASN A 17 -1.223 -23.500 2.987 1.00 0.00 C ATOM 253 C ASN A 17 -2.443 -23.417 2.072 1.00 0.00 C ATOM 254 O ASN A 17 -3.096 -24.426 1.786 1.00 0.00 O ATOM 255 CB ASN A 17 -1.601 -23.056 4.410 1.00 0.00 C ATOM 256 CG ASN A 17 -2.704 -23.906 5.026 1.00 0.00 C ATOM 257 OD1 ASN A 17 -2.651 -25.137 4.996 1.00 0.00 O ATOM 258 ND2 ASN A 17 -3.712 -23.257 5.589 1.00 0.00 N ATOM 0 H ASN A 17 0.020 -21.806 2.985 1.00 0.00 H new ATOM 0 HA ASN A 17 -0.883 -24.535 3.018 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -0.717 -23.102 5.046 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -1.923 -22.015 4.386 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -4.478 -23.777 6.017 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -3.722 -22.237 5.595 1.00 0.00 H new ATOM 265 N ASN A 18 -2.748 -22.210 1.612 1.00 0.00 N ATOM 266 CA ASN A 18 -3.905 -21.982 0.744 1.00 0.00 C ATOM 267 C ASN A 18 -3.502 -22.028 -0.726 1.00 0.00 C ATOM 268 O ASN A 18 -4.356 -22.138 -1.609 1.00 0.00 O ATOM 269 CB ASN A 18 -4.549 -20.620 1.045 1.00 0.00 C ATOM 270 CG ASN A 18 -4.909 -20.440 2.508 1.00 0.00 C ATOM 271 OD1 ASN A 18 -5.700 -21.202 3.064 1.00 0.00 O ATOM 272 ND2 ASN A 18 -4.333 -19.432 3.138 1.00 0.00 N ATOM 0 H ASN A 18 -2.211 -21.369 1.824 1.00 0.00 H new ATOM 0 HA ASN A 18 -4.625 -22.776 0.943 1.00 0.00 H new ATOM 0 HB2 ASN A 18 -3.864 -19.827 0.746 1.00 0.00 H new ATOM 0 HB3 ASN A 18 -5.449 -20.509 0.440 1.00 0.00 H new ATOM 0 HD21 ASN A 18 -4.538 -19.262 4.123 1.00 0.00 H new ATOM 0 HD22 ASN A 18 -3.683 -18.824 2.640 1.00 0.00 H new ATOM 279 N GLY A 19 -2.201 -21.925 -0.987 1.00 0.00 N ATOM 280 CA GLY A 19 -1.718 -21.792 -2.352 1.00 0.00 C ATOM 281 C GLY A 19 -1.856 -20.359 -2.826 1.00 0.00 C ATOM 282 O GLY A 19 -1.526 -20.022 -3.966 1.00 0.00 O ATOM 0 H GLY A 19 -1.470 -21.931 -0.275 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -0.674 -22.100 -2.406 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -2.281 -22.455 -3.009 1.00 0.00 H new ATOM 286 N GLN A 20 -2.326 -19.517 -1.915 1.00 0.00 N ATOM 287 CA GLN A 20 -2.581 -18.110 -2.175 1.00 0.00 C ATOM 288 C GLN A 20 -2.572 -17.370 -0.842 1.00 0.00 C ATOM 289 O GLN A 20 -2.748 -17.988 0.212 1.00 0.00 O ATOM 290 CB GLN A 20 -3.936 -17.924 -2.894 1.00 0.00 C ATOM 291 CG GLN A 20 -5.142 -17.796 -1.953 1.00 0.00 C ATOM 292 CD GLN A 20 -6.342 -18.620 -2.394 1.00 0.00 C ATOM 293 OE1 GLN A 20 -7.237 -18.122 -3.082 1.00 0.00 O ATOM 294 NE2 GLN A 20 -6.368 -19.887 -2.008 1.00 0.00 N ATOM 0 H GLN A 20 -2.544 -19.799 -0.959 1.00 0.00 H new ATOM 0 HA GLN A 20 -1.807 -17.707 -2.829 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -3.882 -17.033 -3.519 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -4.099 -18.771 -3.560 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -4.846 -18.106 -0.951 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -5.434 -16.748 -1.889 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -5.609 -20.263 -1.439 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -7.147 -20.487 -2.279 1.00 0.00 H new ATOM 303 N LEU A 21 -2.363 -16.065 -0.882 1.00 0.00 N ATOM 304 CA LEU A 21 -2.344 -15.261 0.333 1.00 0.00 C ATOM 305 C LEU A 21 -3.772 -14.932 0.767 1.00 0.00 C ATOM 306 O LEU A 21 -4.578 -14.487 -0.050 1.00 0.00 O ATOM 307 CB LEU A 21 -1.531 -13.968 0.125 1.00 0.00 C ATOM 308 CG LEU A 21 -1.928 -13.109 -1.095 1.00 0.00 C ATOM 309 CD1 LEU A 21 -1.729 -11.622 -0.804 1.00 0.00 C ATOM 310 CD2 LEU A 21 -1.139 -13.526 -2.338 1.00 0.00 C ATOM 0 H LEU A 21 -2.204 -15.538 -1.741 1.00 0.00 H new ATOM 0 HA LEU A 21 -1.861 -15.839 1.121 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -1.624 -13.355 1.022 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -0.479 -14.235 0.029 1.00 0.00 H new ATOM 0 HG LEU A 21 -2.987 -13.278 -1.292 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -2.016 -11.038 -1.679 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -2.348 -11.331 0.045 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -0.681 -11.434 -0.570 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -1.437 -12.906 -3.183 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -0.073 -13.398 -2.152 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -1.344 -14.572 -2.565 1.00 0.00 H new ATOM 322 N LYS A 22 -4.054 -15.166 2.057 1.00 0.00 N ATOM 323 CA LYS A 22 -5.350 -14.865 2.715 1.00 0.00 C ATOM 324 C LYS A 22 -6.578 -15.424 1.961 1.00 0.00 C ATOM 325 O LYS A 22 -6.570 -15.584 0.742 1.00 0.00 O ATOM 326 CB LYS A 22 -5.552 -13.343 2.999 1.00 0.00 C ATOM 327 CG LYS A 22 -4.562 -12.373 2.328 1.00 0.00 C ATOM 328 CD LYS A 22 -5.038 -11.829 0.961 1.00 0.00 C ATOM 329 CE LYS A 22 -6.557 -11.896 0.756 1.00 0.00 C ATOM 330 NZ LYS A 22 -6.963 -13.075 -0.061 1.00 0.00 N ATOM 0 H LYS A 22 -3.374 -15.580 2.695 1.00 0.00 H new ATOM 0 HA LYS A 22 -5.285 -15.388 3.669 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -6.560 -13.070 2.686 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -5.500 -13.189 4.077 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -4.383 -11.533 2.999 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -3.608 -12.882 2.192 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -4.714 -10.793 0.861 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -4.550 -12.394 0.167 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -7.051 -11.941 1.726 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -6.897 -10.983 0.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -7.940 -13.342 0.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -6.906 -12.834 -1.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -6.327 -13.873 0.141 1.00 0.00 H new ATOM 344 N PRO A 23 -7.670 -15.724 2.698 1.00 0.00 N ATOM 345 CA PRO A 23 -8.950 -16.120 2.096 1.00 0.00 C ATOM 346 C PRO A 23 -9.726 -14.906 1.564 1.00 0.00 C ATOM 347 O PRO A 23 -9.157 -13.824 1.398 1.00 0.00 O ATOM 348 CB PRO A 23 -9.686 -16.784 3.266 1.00 0.00 C ATOM 349 CG PRO A 23 -9.173 -16.076 4.475 1.00 0.00 C ATOM 350 CD PRO A 23 -7.737 -15.723 4.177 1.00 0.00 C ATOM 0 HA PRO A 23 -8.831 -16.775 1.233 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -10.766 -16.675 3.170 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -9.477 -17.853 3.312 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -9.760 -15.181 4.680 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -9.243 -16.712 5.358 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -7.471 -14.749 4.588 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -7.049 -16.450 4.609 1.00 0.00 H new ATOM 358 N LYS A 24 -11.020 -15.091 1.292 1.00 0.00 N ATOM 359 CA LYS A 24 -11.869 -14.016 0.770 1.00 0.00 C ATOM 360 C LYS A 24 -13.347 -14.352 0.990 1.00 0.00 C ATOM 361 O LYS A 24 -13.797 -15.453 0.652 1.00 0.00 O ATOM 362 CB LYS A 24 -11.586 -13.777 -0.728 1.00 0.00 C ATOM 363 CG LYS A 24 -11.281 -15.053 -1.518 1.00 0.00 C ATOM 364 CD LYS A 24 -10.849 -14.746 -2.953 1.00 0.00 C ATOM 365 CE LYS A 24 -10.239 -15.967 -3.646 1.00 0.00 C ATOM 366 NZ LYS A 24 -8.753 -15.893 -3.701 1.00 0.00 N ATOM 0 H LYS A 24 -11.505 -15.979 1.425 1.00 0.00 H new ATOM 0 HA LYS A 24 -11.636 -13.099 1.311 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -12.448 -13.283 -1.175 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -10.742 -13.093 -0.823 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -10.493 -15.613 -1.014 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -12.165 -15.690 -1.534 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -11.710 -14.399 -3.524 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -10.123 -13.933 -2.946 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -10.538 -16.871 -3.116 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -10.636 -16.045 -4.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -8.356 -16.854 -3.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -8.461 -15.429 -4.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -8.402 -15.345 -2.890 1.00 0.00 H new ATOM 380 N GLY A 25 -14.094 -13.408 1.563 1.00 0.00 N ATOM 381 CA GLY A 25 -15.504 -13.632 1.857 1.00 0.00 C ATOM 382 C GLY A 25 -16.412 -12.595 1.220 1.00 0.00 C ATOM 383 O GLY A 25 -17.597 -12.509 1.554 1.00 0.00 O ATOM 0 H GLY A 25 -13.746 -12.487 1.830 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -15.790 -14.623 1.506 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -15.651 -13.622 2.937 1.00 0.00 H new ATOM 387 N ASN A 26 -15.862 -11.802 0.304 1.00 0.00 N ATOM 388 CA ASN A 26 -16.639 -10.779 -0.396 1.00 0.00 C ATOM 389 C ASN A 26 -17.172 -11.324 -1.717 1.00 0.00 C ATOM 390 O ASN A 26 -16.424 -11.924 -2.493 1.00 0.00 O ATOM 391 CB ASN A 26 -15.785 -9.528 -0.657 1.00 0.00 C ATOM 392 CG ASN A 26 -16.583 -8.375 -1.263 1.00 0.00 C ATOM 393 OD1 ASN A 26 -17.222 -8.518 -2.308 1.00 0.00 O ATOM 394 ND2 ASN A 26 -16.551 -7.223 -0.613 1.00 0.00 N ATOM 0 H ASN A 26 -14.881 -11.847 0.028 1.00 0.00 H new ATOM 0 HA ASN A 26 -17.480 -10.502 0.240 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -15.337 -9.199 0.281 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -14.966 -9.788 -1.328 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -17.065 -6.419 -0.974 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -16.012 -7.139 0.249 1.00 0.00 H new ATOM 401 N LYS A 27 -18.466 -11.126 -1.954 1.00 0.00 N ATOM 402 CA LYS A 27 -19.087 -11.469 -3.229 1.00 0.00 C ATOM 403 C LYS A 27 -20.344 -10.625 -3.445 1.00 0.00 C ATOM 404 O LYS A 27 -21.471 -11.117 -3.362 1.00 0.00 O ATOM 405 CB LYS A 27 -19.424 -12.969 -3.300 1.00 0.00 C ATOM 406 CG LYS A 27 -19.990 -13.398 -4.654 1.00 0.00 C ATOM 407 CD LYS A 27 -20.283 -14.896 -4.715 1.00 0.00 C ATOM 408 CE LYS A 27 -19.141 -15.676 -5.359 1.00 0.00 C ATOM 409 NZ LYS A 27 -19.589 -17.003 -5.852 1.00 0.00 N ATOM 0 H LYS A 27 -19.110 -10.726 -1.272 1.00 0.00 H new ATOM 0 HA LYS A 27 -18.374 -11.252 -4.024 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -18.524 -13.547 -3.091 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -20.146 -13.210 -2.520 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -20.907 -12.843 -4.854 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -19.281 -13.137 -5.440 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -20.456 -15.273 -3.707 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -21.200 -15.063 -5.280 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -18.730 -15.100 -6.188 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -18.338 -15.810 -4.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -18.785 -17.503 -6.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -19.958 -17.562 -5.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -20.338 -16.875 -6.562 1.00 0.00 H new ATOM 423 N ALA A 28 -20.136 -9.338 -3.693 1.00 0.00 N ATOM 424 CA ALA A 28 -21.228 -8.421 -4.000 1.00 0.00 C ATOM 425 C ALA A 28 -20.813 -7.481 -5.124 1.00 0.00 C ATOM 426 O ALA A 28 -21.266 -6.337 -5.188 1.00 0.00 O ATOM 427 CB ALA A 28 -21.626 -7.638 -2.752 1.00 0.00 C ATOM 0 H ALA A 28 -19.214 -8.902 -3.687 1.00 0.00 H new ATOM 0 HA ALA A 28 -22.095 -8.993 -4.331 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -22.442 -6.957 -2.994 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -21.950 -8.331 -1.976 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -20.770 -7.066 -2.393 1.00 0.00 H new ATOM 433 N GLU A 29 -19.953 -7.992 -6.014 1.00 0.00 N ATOM 434 CA GLU A 29 -19.370 -7.207 -7.106 1.00 0.00 C ATOM 435 C GLU A 29 -18.628 -5.990 -6.547 1.00 0.00 C ATOM 436 O GLU A 29 -17.401 -6.000 -6.424 1.00 0.00 O ATOM 437 CB GLU A 29 -20.451 -6.771 -8.115 1.00 0.00 C ATOM 438 CG GLU A 29 -21.143 -7.933 -8.824 1.00 0.00 C ATOM 439 CD GLU A 29 -22.235 -8.583 -7.984 1.00 0.00 C ATOM 440 OE1 GLU A 29 -23.303 -7.962 -7.807 1.00 0.00 O ATOM 441 OE2 GLU A 29 -22.031 -9.719 -7.497 1.00 0.00 O ATOM 0 H GLU A 29 -19.642 -8.963 -5.996 1.00 0.00 H new ATOM 0 HA GLU A 29 -18.656 -7.837 -7.636 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -21.202 -6.178 -7.594 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -19.995 -6.122 -8.863 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -21.577 -7.574 -9.758 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -20.399 -8.685 -9.086 1.00 0.00 H new ATOM 448 N VAL A 30 -19.394 -4.960 -6.206 1.00 0.00 N ATOM 449 CA VAL A 30 -18.887 -3.763 -5.549 1.00 0.00 C ATOM 450 C VAL A 30 -19.949 -3.261 -4.574 1.00 0.00 C ATOM 451 O VAL A 30 -20.940 -2.646 -4.977 1.00 0.00 O ATOM 452 CB VAL A 30 -18.521 -2.637 -6.562 1.00 0.00 C ATOM 453 CG1 VAL A 30 -17.064 -2.762 -7.009 1.00 0.00 C ATOM 454 CG2 VAL A 30 -19.462 -2.654 -7.768 1.00 0.00 C ATOM 0 H VAL A 30 -20.399 -4.933 -6.381 1.00 0.00 H new ATOM 0 HA VAL A 30 -17.968 -4.024 -5.024 1.00 0.00 H new ATOM 0 HB VAL A 30 -18.642 -1.679 -6.056 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -16.831 -1.966 -7.716 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -16.409 -2.681 -6.142 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -16.912 -3.729 -7.489 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -19.183 -1.858 -8.458 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -19.387 -3.616 -8.275 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -20.487 -2.500 -7.432 1.00 0.00 H new ATOM 464 N ALA A 31 -19.759 -3.556 -3.293 1.00 0.00 N ATOM 465 CA ALA A 31 -20.744 -3.224 -2.271 1.00 0.00 C ATOM 466 C ALA A 31 -20.726 -1.732 -1.970 1.00 0.00 C ATOM 467 O ALA A 31 -21.756 -1.136 -1.644 1.00 0.00 O ATOM 468 CB ALA A 31 -20.492 -4.034 -1.003 1.00 0.00 C ATOM 0 H ALA A 31 -18.927 -4.027 -2.937 1.00 0.00 H new ATOM 0 HA ALA A 31 -21.733 -3.481 -2.651 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -21.237 -3.773 -0.251 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -20.563 -5.098 -1.231 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -19.496 -3.811 -0.620 1.00 0.00 H new ATOM 474 N ILE A 32 -19.549 -1.133 -2.081 1.00 0.00 N ATOM 475 CA ILE A 32 -19.390 0.291 -1.841 1.00 0.00 C ATOM 476 C ILE A 32 -19.474 1.081 -3.147 1.00 0.00 C ATOM 477 O ILE A 32 -18.511 1.158 -3.912 1.00 0.00 O ATOM 478 CB ILE A 32 -18.054 0.592 -1.116 1.00 0.00 C ATOM 479 CG1 ILE A 32 -18.119 0.071 0.332 1.00 0.00 C ATOM 480 CG2 ILE A 32 -17.738 2.088 -1.144 1.00 0.00 C ATOM 481 CD1 ILE A 32 -17.018 0.590 1.235 1.00 0.00 C ATOM 0 H ILE A 32 -18.687 -1.615 -2.337 1.00 0.00 H new ATOM 0 HA ILE A 32 -20.208 0.607 -1.194 1.00 0.00 H new ATOM 0 HB ILE A 32 -17.249 0.077 -1.640 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -19.083 0.345 0.761 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -18.075 -1.018 0.316 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -16.795 2.270 -0.628 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -17.657 2.423 -2.178 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -18.536 2.638 -0.646 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -17.140 0.173 2.235 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -16.049 0.293 0.834 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -17.072 1.677 1.286 1.00 0.00 H new ATOM 493 N ARG A 33 -20.651 1.644 -3.401 1.00 0.00 N ATOM 494 CA ARG A 33 -20.859 2.554 -4.530 1.00 0.00 C ATOM 495 C ARG A 33 -20.779 4.006 -4.043 1.00 0.00 C ATOM 496 O ARG A 33 -20.987 4.947 -4.811 1.00 0.00 O ATOM 497 CB ARG A 33 -22.227 2.279 -5.183 1.00 0.00 C ATOM 498 CG ARG A 33 -22.342 2.769 -6.628 1.00 0.00 C ATOM 499 CD ARG A 33 -23.704 2.437 -7.236 1.00 0.00 C ATOM 500 NE ARG A 33 -24.790 3.185 -6.595 1.00 0.00 N ATOM 501 CZ ARG A 33 -26.020 2.706 -6.390 1.00 0.00 C ATOM 502 NH1 ARG A 33 -26.342 1.479 -6.798 1.00 0.00 N ATOM 503 NH2 ARG A 33 -26.930 3.457 -5.778 1.00 0.00 N ATOM 0 H ARG A 33 -21.485 1.486 -2.836 1.00 0.00 H new ATOM 0 HA ARG A 33 -20.081 2.389 -5.275 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -22.420 1.206 -5.158 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -23.004 2.756 -4.586 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -22.184 3.847 -6.659 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -21.555 2.314 -7.229 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -23.689 2.662 -8.302 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -23.893 1.368 -7.138 1.00 0.00 H new ATOM 0 HE ARG A 33 -24.593 4.136 -6.284 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -25.648 0.900 -7.270 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -27.283 1.119 -6.638 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -26.689 4.398 -5.466 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -27.870 3.093 -5.621 1.00 0.00 H new ATOM 517 N TYR A 34 -20.465 4.155 -2.750 1.00 0.00 N ATOM 518 CA TYR A 34 -20.432 5.452 -2.062 1.00 0.00 C ATOM 519 C TYR A 34 -21.836 6.053 -1.962 1.00 0.00 C ATOM 520 O TYR A 34 -22.372 6.217 -0.861 1.00 0.00 O ATOM 521 CB TYR A 34 -19.458 6.438 -2.730 1.00 0.00 C ATOM 522 CG TYR A 34 -19.035 7.577 -1.816 1.00 0.00 C ATOM 523 CD1 TYR A 34 -18.618 7.331 -0.507 1.00 0.00 C ATOM 524 CD2 TYR A 34 -19.053 8.897 -2.258 1.00 0.00 C ATOM 525 CE1 TYR A 34 -18.235 8.365 0.325 1.00 0.00 C ATOM 526 CE2 TYR A 34 -18.670 9.933 -1.428 1.00 0.00 C ATOM 527 CZ TYR A 34 -18.262 9.662 -0.140 1.00 0.00 C ATOM 528 OH TYR A 34 -17.879 10.691 0.690 1.00 0.00 O ATOM 0 H TYR A 34 -20.224 3.370 -2.145 1.00 0.00 H new ATOM 0 HA TYR A 34 -20.062 5.271 -1.053 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -18.571 5.896 -3.058 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -19.927 6.852 -3.623 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -18.594 6.316 -0.139 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -19.372 9.115 -3.267 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -17.916 8.158 1.336 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -18.690 10.951 -1.787 1.00 0.00 H new ATOM 0 HH TYR A 34 -17.954 11.543 0.211 1.00 0.00 H new ATOM 538 N ASP A 35 -22.415 6.387 -3.115 1.00 0.00 N ATOM 539 CA ASP A 35 -23.799 6.864 -3.204 1.00 0.00 C ATOM 540 C ASP A 35 -23.959 8.228 -2.533 1.00 0.00 C ATOM 541 O ASP A 35 -25.075 8.669 -2.244 1.00 0.00 O ATOM 542 CB ASP A 35 -24.768 5.833 -2.589 1.00 0.00 C ATOM 543 CG ASP A 35 -26.159 5.883 -3.203 1.00 0.00 C ATOM 544 OD1 ASP A 35 -26.265 5.834 -4.450 1.00 0.00 O ATOM 545 OD2 ASP A 35 -27.149 5.970 -2.445 1.00 0.00 O ATOM 0 H ASP A 35 -21.939 6.335 -4.016 1.00 0.00 H new ATOM 0 HA ASP A 35 -24.047 6.983 -4.259 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -24.355 4.833 -2.719 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -24.844 6.009 -1.516 1.00 0.00 H new ATOM 550 N GLY A 36 -22.832 8.898 -2.298 1.00 0.00 N ATOM 551 CA GLY A 36 -22.841 10.213 -1.677 1.00 0.00 C ATOM 552 C GLY A 36 -23.060 10.160 -0.173 1.00 0.00 C ATOM 553 O GLY A 36 -22.207 10.591 0.603 1.00 0.00 O ATOM 0 H GLY A 36 -21.902 8.548 -2.530 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -21.894 10.712 -1.883 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -23.626 10.818 -2.132 1.00 0.00 H new ATOM 557 N LYS A 37 -24.194 9.600 0.240 1.00 0.00 N ATOM 558 CA LYS A 37 -24.600 9.601 1.648 1.00 0.00 C ATOM 559 C LYS A 37 -23.769 8.628 2.491 1.00 0.00 C ATOM 560 O LYS A 37 -23.997 8.504 3.695 1.00 0.00 O ATOM 561 CB LYS A 37 -26.096 9.258 1.768 1.00 0.00 C ATOM 562 CG LYS A 37 -27.019 10.471 1.681 1.00 0.00 C ATOM 563 CD LYS A 37 -26.953 11.148 0.309 1.00 0.00 C ATOM 564 CE LYS A 37 -28.329 11.592 -0.175 1.00 0.00 C ATOM 565 NZ LYS A 37 -29.262 10.444 -0.343 1.00 0.00 N ATOM 0 H LYS A 37 -24.854 9.136 -0.384 1.00 0.00 H new ATOM 0 HA LYS A 37 -24.422 10.604 2.037 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -26.362 8.555 0.979 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -26.267 8.751 2.718 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -28.044 10.161 1.883 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -26.746 11.190 2.453 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -26.291 12.012 0.363 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -26.519 10.459 -0.415 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -28.752 12.301 0.537 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -28.227 12.117 -1.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -29.964 10.672 -1.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -28.726 9.600 -0.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -29.749 10.258 0.557 1.00 0.00 H new ATOM 579 N PHE A 38 -22.841 7.914 1.848 1.00 0.00 N ATOM 580 CA PHE A 38 -21.913 7.011 2.546 1.00 0.00 C ATOM 581 C PHE A 38 -22.626 5.750 3.061 1.00 0.00 C ATOM 582 O PHE A 38 -21.985 4.830 3.567 1.00 0.00 O ATOM 583 CB PHE A 38 -21.212 7.750 3.707 1.00 0.00 C ATOM 584 CG PHE A 38 -19.990 7.046 4.254 1.00 0.00 C ATOM 585 CD1 PHE A 38 -18.784 7.082 3.568 1.00 0.00 C ATOM 586 CD2 PHE A 38 -20.048 6.354 5.459 1.00 0.00 C ATOM 587 CE1 PHE A 38 -17.665 6.446 4.070 1.00 0.00 C ATOM 588 CE2 PHE A 38 -18.931 5.715 5.962 1.00 0.00 C ATOM 589 CZ PHE A 38 -17.739 5.760 5.268 1.00 0.00 C ATOM 0 H PHE A 38 -22.710 7.943 0.837 1.00 0.00 H new ATOM 0 HA PHE A 38 -21.160 6.691 1.826 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -20.921 8.743 3.365 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -21.928 7.889 4.517 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -18.720 7.614 2.630 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -20.977 6.316 6.008 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -16.732 6.485 3.527 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -18.991 5.180 6.898 1.00 0.00 H new ATOM 0 HZ PHE A 38 -16.866 5.260 5.660 1.00 0.00 H new ATOM 599 N LYS A 39 -23.950 5.707 2.920 1.00 0.00 N ATOM 600 CA LYS A 39 -24.737 4.554 3.355 1.00 0.00 C ATOM 601 C LYS A 39 -24.733 3.468 2.279 1.00 0.00 C ATOM 602 O LYS A 39 -25.021 2.302 2.557 1.00 0.00 O ATOM 603 CB LYS A 39 -26.179 4.982 3.671 1.00 0.00 C ATOM 604 CG LYS A 39 -26.981 3.938 4.451 1.00 0.00 C ATOM 605 CD LYS A 39 -28.445 3.907 4.019 1.00 0.00 C ATOM 606 CE LYS A 39 -29.225 2.798 4.721 1.00 0.00 C ATOM 607 NZ LYS A 39 -29.792 3.250 6.019 1.00 0.00 N ATOM 0 H LYS A 39 -24.501 6.459 2.507 1.00 0.00 H new ATOM 0 HA LYS A 39 -24.285 4.148 4.260 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -26.155 5.909 4.244 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -26.696 5.198 2.736 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -26.537 2.954 4.302 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -26.921 4.156 5.517 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -28.908 4.870 4.237 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -28.502 3.763 2.940 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -30.032 2.456 4.073 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -28.569 1.944 4.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -30.313 2.467 6.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -29.021 3.552 6.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -30.439 4.048 5.856 1.00 0.00 H new ATOM 621 N TYR A 40 -24.390 3.871 1.051 1.00 0.00 N ATOM 622 CA TYR A 40 -24.305 2.956 -0.093 1.00 0.00 C ATOM 623 C TYR A 40 -25.676 2.374 -0.448 1.00 0.00 C ATOM 624 O TYR A 40 -26.675 2.630 0.232 1.00 0.00 O ATOM 625 CB TYR A 40 -23.293 1.824 0.178 1.00 0.00 C ATOM 626 CG TYR A 40 -22.035 2.292 0.887 1.00 0.00 C ATOM 627 CD1 TYR A 40 -21.199 3.230 0.303 1.00 0.00 C ATOM 628 CD2 TYR A 40 -21.696 1.809 2.145 1.00 0.00 C ATOM 629 CE1 TYR A 40 -20.061 3.676 0.947 1.00 0.00 C ATOM 630 CE2 TYR A 40 -20.558 2.248 2.793 1.00 0.00 C ATOM 631 CZ TYR A 40 -19.747 3.181 2.190 1.00 0.00 C ATOM 632 OH TYR A 40 -18.618 3.622 2.837 1.00 0.00 O ATOM 0 H TYR A 40 -24.164 4.839 0.822 1.00 0.00 H new ATOM 0 HA TYR A 40 -23.954 3.535 -0.947 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -23.775 1.054 0.780 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -23.016 1.361 -0.769 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -21.442 3.620 -0.674 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -22.332 1.079 2.623 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -19.422 4.409 0.477 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -20.306 1.860 3.769 1.00 0.00 H new ATOM 0 HH TYR A 40 -18.736 4.559 3.099 1.00 0.00 H new ATOM 642 N ASP A 41 -25.714 1.596 -1.523 1.00 0.00 N ATOM 643 CA ASP A 41 -26.944 0.959 -1.981 1.00 0.00 C ATOM 644 C ASP A 41 -27.127 -0.392 -1.293 1.00 0.00 C ATOM 645 O ASP A 41 -26.334 -0.764 -0.424 1.00 0.00 O ATOM 646 CB ASP A 41 -26.908 0.775 -3.506 1.00 0.00 C ATOM 647 CG ASP A 41 -25.953 -0.329 -3.943 1.00 0.00 C ATOM 648 OD1 ASP A 41 -24.723 -0.158 -3.787 1.00 0.00 O ATOM 649 OD2 ASP A 41 -26.427 -1.370 -4.441 1.00 0.00 O ATOM 0 H ASP A 41 -24.898 1.389 -2.099 1.00 0.00 H new ATOM 0 HA ASP A 41 -27.787 1.600 -1.723 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -27.911 0.544 -3.864 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -26.611 1.713 -3.974 1.00 0.00 H new ATOM 654 N GLY A 42 -28.174 -1.119 -1.680 1.00 0.00 N ATOM 655 CA GLY A 42 -28.425 -2.435 -1.111 1.00 0.00 C ATOM 656 C GLY A 42 -27.271 -3.390 -1.362 1.00 0.00 C ATOM 657 O GLY A 42 -26.460 -3.640 -0.463 1.00 0.00 O ATOM 0 H GLY A 42 -28.854 -0.820 -2.379 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -28.591 -2.341 -0.038 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -29.338 -2.848 -1.540 1.00 0.00 H new ATOM 661 N LYS A 43 -27.197 -3.903 -2.590 1.00 0.00 N ATOM 662 CA LYS A 43 -26.120 -4.798 -3.015 1.00 0.00 C ATOM 663 C LYS A 43 -26.061 -6.047 -2.128 1.00 0.00 C ATOM 664 O LYS A 43 -26.739 -7.041 -2.400 1.00 0.00 O ATOM 665 CB LYS A 43 -24.770 -4.048 -3.019 1.00 0.00 C ATOM 666 CG LYS A 43 -23.696 -4.676 -3.906 1.00 0.00 C ATOM 667 CD LYS A 43 -24.056 -4.627 -5.394 1.00 0.00 C ATOM 668 CE LYS A 43 -24.354 -3.210 -5.893 1.00 0.00 C ATOM 669 NZ LYS A 43 -23.492 -2.174 -5.258 1.00 0.00 N ATOM 0 H LYS A 43 -27.883 -3.710 -3.320 1.00 0.00 H new ATOM 0 HA LYS A 43 -26.327 -5.130 -4.032 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -24.940 -3.023 -3.347 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -24.395 -3.997 -1.997 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -22.751 -4.157 -3.748 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -23.544 -5.713 -3.607 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -23.234 -5.045 -5.975 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -24.926 -5.259 -5.572 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -24.217 -3.175 -6.974 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -25.400 -2.974 -5.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -23.293 -1.419 -5.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -23.982 -1.772 -4.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -22.598 -2.607 -4.951 1.00 0.00 H new ATOM 683 N ALA A 44 -25.277 -5.981 -1.056 1.00 0.00 N ATOM 684 CA ALA A 44 -25.104 -7.112 -0.150 1.00 0.00 C ATOM 685 C ALA A 44 -26.219 -7.140 0.893 1.00 0.00 C ATOM 686 O ALA A 44 -25.977 -6.941 2.086 1.00 0.00 O ATOM 687 CB ALA A 44 -23.731 -7.045 0.516 1.00 0.00 C ATOM 0 H ALA A 44 -24.748 -5.150 -0.792 1.00 0.00 H new ATOM 0 HA ALA A 44 -25.162 -8.036 -0.725 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -23.612 -7.893 1.190 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -22.954 -7.077 -0.248 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -23.646 -6.117 1.082 1.00 0.00 H new ATOM 693 N THR A 45 -27.443 -7.378 0.431 1.00 0.00 N ATOM 694 CA THR A 45 -28.606 -7.437 1.311 1.00 0.00 C ATOM 695 C THR A 45 -28.424 -8.520 2.380 1.00 0.00 C ATOM 696 O THR A 45 -28.573 -8.261 3.574 1.00 0.00 O ATOM 697 CB THR A 45 -29.896 -7.710 0.495 1.00 0.00 C ATOM 698 OG1 THR A 45 -29.605 -7.632 -0.909 1.00 0.00 O ATOM 699 CG2 THR A 45 -30.999 -6.712 0.844 1.00 0.00 C ATOM 0 H THR A 45 -27.656 -7.534 -0.554 1.00 0.00 H new ATOM 0 HA THR A 45 -28.702 -6.471 1.806 1.00 0.00 H new ATOM 0 HB THR A 45 -30.250 -8.710 0.747 1.00 0.00 H new ATOM 0 HG1 THR A 45 -30.421 -7.806 -1.422 1.00 0.00 H new ATOM 0 HG21 THR A 45 -31.889 -6.932 0.254 1.00 0.00 H new ATOM 0 HG22 THR A 45 -31.238 -6.790 1.905 1.00 0.00 H new ATOM 0 HG23 THR A 45 -30.658 -5.701 0.623 1.00 0.00 H new ATOM 707 N HIS A 46 -28.085 -9.728 1.936 1.00 0.00 N ATOM 708 CA HIS A 46 -27.845 -10.853 2.840 1.00 0.00 C ATOM 709 C HIS A 46 -26.348 -11.148 2.917 1.00 0.00 C ATOM 710 O HIS A 46 -25.924 -12.307 2.859 1.00 0.00 O ATOM 711 CB HIS A 46 -28.614 -12.099 2.361 1.00 0.00 C ATOM 712 CG HIS A 46 -30.036 -12.162 2.837 1.00 0.00 C ATOM 713 ND1 HIS A 46 -30.913 -13.168 2.498 1.00 0.00 N ATOM 714 CD2 HIS A 46 -30.729 -11.322 3.648 1.00 0.00 C ATOM 715 CE1 HIS A 46 -32.082 -12.918 3.100 1.00 0.00 C ATOM 716 NE2 HIS A 46 -32.023 -11.808 3.811 1.00 0.00 N ATOM 0 H HIS A 46 -27.969 -9.955 0.948 1.00 0.00 H new ATOM 0 HA HIS A 46 -28.204 -10.589 3.835 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -28.606 -12.121 1.271 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -28.088 -12.991 2.702 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -30.338 -10.420 4.095 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -32.959 -13.543 3.015 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -32.771 -11.392 4.366 1.00 0.00 H new ATOM 724 N GLY A 47 -25.549 -10.090 3.039 1.00 0.00 N ATOM 725 CA GLY A 47 -24.105 -10.236 3.092 1.00 0.00 C ATOM 726 C GLY A 47 -23.479 -9.351 4.156 1.00 0.00 C ATOM 727 O GLY A 47 -23.883 -8.194 4.314 1.00 0.00 O ATOM 0 H GLY A 47 -25.880 -9.127 3.102 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -23.854 -11.277 3.294 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -23.680 -9.988 2.119 1.00 0.00 H new ATOM 731 N PRO A 48 -22.495 -9.870 4.913 1.00 0.00 N ATOM 732 CA PRO A 48 -21.804 -9.111 5.954 1.00 0.00 C ATOM 733 C PRO A 48 -20.569 -8.389 5.416 1.00 0.00 C ATOM 734 O PRO A 48 -20.273 -8.456 4.216 1.00 0.00 O ATOM 735 CB PRO A 48 -21.395 -10.220 6.923 1.00 0.00 C ATOM 736 CG PRO A 48 -21.053 -11.364 6.026 1.00 0.00 C ATOM 737 CD PRO A 48 -21.968 -11.249 4.823 1.00 0.00 C ATOM 0 HA PRO A 48 -22.418 -8.324 6.392 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -20.544 -9.923 7.536 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -22.206 -10.475 7.606 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -20.006 -11.322 5.724 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -21.200 -12.316 6.537 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -21.426 -11.410 3.891 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -22.769 -11.987 4.858 1.00 0.00 H new ATOM 745 N SER A 49 -19.858 -7.709 6.314 1.00 0.00 N ATOM 746 CA SER A 49 -18.603 -7.041 5.984 1.00 0.00 C ATOM 747 C SER A 49 -18.840 -5.831 5.074 1.00 0.00 C ATOM 748 O SER A 49 -19.986 -5.487 4.765 1.00 0.00 O ATOM 749 CB SER A 49 -17.624 -8.033 5.331 1.00 0.00 C ATOM 750 OG SER A 49 -17.110 -8.950 6.288 1.00 0.00 O ATOM 0 H SER A 49 -20.137 -7.606 7.290 1.00 0.00 H new ATOM 0 HA SER A 49 -18.160 -6.675 6.910 1.00 0.00 H new ATOM 0 HB2 SER A 49 -18.131 -8.579 4.536 1.00 0.00 H new ATOM 0 HB3 SER A 49 -16.802 -7.486 4.869 1.00 0.00 H new ATOM 0 HG SER A 49 -16.492 -9.570 5.848 1.00 0.00 H new ATOM 756 N VAL A 50 -17.742 -5.193 4.652 1.00 0.00 N ATOM 757 CA VAL A 50 -17.791 -4.011 3.787 1.00 0.00 C ATOM 758 C VAL A 50 -18.666 -2.902 4.404 1.00 0.00 C ATOM 759 O VAL A 50 -18.999 -2.946 5.596 1.00 0.00 O ATOM 760 CB VAL A 50 -18.295 -4.352 2.346 1.00 0.00 C ATOM 761 CG1 VAL A 50 -17.694 -3.396 1.313 1.00 0.00 C ATOM 762 CG2 VAL A 50 -17.977 -5.801 1.971 1.00 0.00 C ATOM 0 H VAL A 50 -16.796 -5.482 4.901 1.00 0.00 H new ATOM 0 HA VAL A 50 -16.767 -3.646 3.704 1.00 0.00 H new ATOM 0 HB VAL A 50 -19.378 -4.230 2.345 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -18.061 -3.656 0.320 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -17.985 -2.373 1.551 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -16.607 -3.478 1.331 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -18.341 -6.004 0.964 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -16.899 -5.958 2.006 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -18.464 -6.475 2.676 1.00 0.00 H new ATOM 772 N LYS A 51 -18.976 -1.886 3.595 1.00 0.00 N ATOM 773 CA LYS A 51 -19.906 -0.826 3.964 1.00 0.00 C ATOM 774 C LYS A 51 -19.458 -0.059 5.213 1.00 0.00 C ATOM 775 O LYS A 51 -18.333 -0.223 5.702 1.00 0.00 O ATOM 776 CB LYS A 51 -21.323 -1.398 4.156 1.00 0.00 C ATOM 777 CG LYS A 51 -21.975 -1.870 2.855 1.00 0.00 C ATOM 778 CD LYS A 51 -23.502 -1.847 2.938 1.00 0.00 C ATOM 779 CE LYS A 51 -24.148 -2.080 1.577 1.00 0.00 C ATOM 780 NZ LYS A 51 -25.633 -2.132 1.665 1.00 0.00 N ATOM 0 H LYS A 51 -18.584 -1.779 2.660 1.00 0.00 H new ATOM 0 HA LYS A 51 -19.918 -0.110 3.142 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -21.277 -2.234 4.853 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -21.954 -0.636 4.613 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -21.647 -1.233 2.033 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -21.640 -2.882 2.628 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -23.839 -2.613 3.636 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -23.830 -0.887 3.336 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -23.853 -1.283 0.895 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -23.777 -3.014 1.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -25.981 -2.972 1.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -25.920 -2.184 2.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -26.037 -1.277 1.233 1.00 0.00 H new ATOM 794 N ASN A 52 -20.355 0.792 5.707 1.00 0.00 N ATOM 795 CA ASN A 52 -20.102 1.608 6.891 1.00 0.00 C ATOM 796 C ASN A 52 -19.834 0.725 8.106 1.00 0.00 C ATOM 797 O ASN A 52 -19.206 1.158 9.070 1.00 0.00 O ATOM 798 CB ASN A 52 -21.297 2.539 7.164 1.00 0.00 C ATOM 799 CG ASN A 52 -22.615 1.784 7.278 1.00 0.00 C ATOM 800 OD1 ASN A 52 -22.885 0.863 6.504 1.00 0.00 O ATOM 801 ND2 ASN A 52 -23.443 2.168 8.234 1.00 0.00 N ATOM 0 H ASN A 52 -21.278 0.935 5.297 1.00 0.00 H new ATOM 0 HA ASN A 52 -19.217 2.217 6.705 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -21.119 3.092 8.086 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -21.371 3.273 6.362 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -24.341 1.698 8.350 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -23.184 2.934 8.855 1.00 0.00 H new ATOM 808 N ALA A 53 -20.311 -0.517 8.039 1.00 0.00 N ATOM 809 CA ALA A 53 -20.083 -1.493 9.095 1.00 0.00 C ATOM 810 C ALA A 53 -18.584 -1.693 9.323 1.00 0.00 C ATOM 811 O ALA A 53 -18.050 -1.325 10.378 1.00 0.00 O ATOM 812 CB ALA A 53 -20.759 -2.813 8.744 1.00 0.00 C ATOM 0 H ALA A 53 -20.862 -0.870 7.256 1.00 0.00 H new ATOM 0 HA ALA A 53 -20.519 -1.118 10.021 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -20.582 -3.536 9.541 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -21.831 -2.654 8.630 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -20.348 -3.195 7.810 1.00 0.00 H new ATOM 818 N VAL A 54 -17.902 -2.245 8.317 1.00 0.00 N ATOM 819 CA VAL A 54 -16.467 -2.497 8.417 1.00 0.00 C ATOM 820 C VAL A 54 -15.690 -1.184 8.438 1.00 0.00 C ATOM 821 O VAL A 54 -14.594 -1.114 8.990 1.00 0.00 O ATOM 822 CB VAL A 54 -15.944 -3.393 7.257 1.00 0.00 C ATOM 823 CG1 VAL A 54 -15.641 -2.565 6.008 1.00 0.00 C ATOM 824 CG2 VAL A 54 -14.708 -4.184 7.696 1.00 0.00 C ATOM 0 H VAL A 54 -18.320 -2.524 7.429 1.00 0.00 H new ATOM 0 HA VAL A 54 -16.306 -3.032 9.353 1.00 0.00 H new ATOM 0 HB VAL A 54 -16.733 -4.101 7.004 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -15.278 -3.220 5.216 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -16.549 -2.063 5.675 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -14.880 -1.821 6.241 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -14.360 -4.803 6.869 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -13.918 -3.492 7.989 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -14.965 -4.820 8.543 1.00 0.00 H new ATOM 834 N TYR A 55 -16.267 -0.148 7.825 1.00 0.00 N ATOM 835 CA TYR A 55 -15.642 1.171 7.799 1.00 0.00 C ATOM 836 C TYR A 55 -15.483 1.712 9.215 1.00 0.00 C ATOM 837 O TYR A 55 -14.365 1.913 9.693 1.00 0.00 O ATOM 838 CB TYR A 55 -16.466 2.151 6.941 1.00 0.00 C ATOM 839 CG TYR A 55 -15.686 2.738 5.783 1.00 0.00 C ATOM 840 CD1 TYR A 55 -14.481 3.400 5.998 1.00 0.00 C ATOM 841 CD2 TYR A 55 -16.143 2.617 4.476 1.00 0.00 C ATOM 842 CE1 TYR A 55 -13.760 3.927 4.947 1.00 0.00 C ATOM 843 CE2 TYR A 55 -15.426 3.136 3.422 1.00 0.00 C ATOM 844 CZ TYR A 55 -14.234 3.792 3.662 1.00 0.00 C ATOM 845 OH TYR A 55 -13.510 4.308 2.614 1.00 0.00 O ATOM 0 H TYR A 55 -17.164 -0.199 7.342 1.00 0.00 H new ATOM 0 HA TYR A 55 -14.654 1.071 7.350 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -17.344 1.634 6.553 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -16.827 2.961 7.574 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -14.104 3.503 7.005 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -17.076 2.108 4.284 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -12.829 4.443 5.131 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -15.794 3.031 2.412 1.00 0.00 H new ATOM 0 HH TYR A 55 -13.987 4.143 1.774 1.00 0.00 H new ATOM 855 N ALA A 56 -16.612 1.923 9.883 1.00 0.00 N ATOM 856 CA ALA A 56 -16.618 2.437 11.245 1.00 0.00 C ATOM 857 C ALA A 56 -15.830 1.513 12.166 1.00 0.00 C ATOM 858 O ALA A 56 -14.997 1.967 12.948 1.00 0.00 O ATOM 859 CB ALA A 56 -18.050 2.600 11.745 1.00 0.00 C ATOM 0 H ALA A 56 -17.540 1.744 9.499 1.00 0.00 H new ATOM 0 HA ALA A 56 -16.139 3.416 11.249 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -18.038 2.985 12.765 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -18.583 3.298 11.100 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -18.553 1.633 11.728 1.00 0.00 H new ATOM 865 N HIS A 57 -16.080 0.211 12.042 1.00 0.00 N ATOM 866 CA HIS A 57 -15.412 -0.784 12.878 1.00 0.00 C ATOM 867 C HIS A 57 -13.889 -0.668 12.766 1.00 0.00 C ATOM 868 O HIS A 57 -13.190 -0.549 13.773 1.00 0.00 O ATOM 869 CB HIS A 57 -15.858 -2.200 12.486 1.00 0.00 C ATOM 870 CG HIS A 57 -15.140 -3.283 13.233 1.00 0.00 C ATOM 871 ND1 HIS A 57 -14.227 -4.142 12.659 1.00 0.00 N ATOM 872 CD2 HIS A 57 -15.210 -3.632 14.542 1.00 0.00 C ATOM 873 CE1 HIS A 57 -13.780 -4.966 13.615 1.00 0.00 C ATOM 874 NE2 HIS A 57 -14.345 -4.697 14.779 1.00 0.00 N ATOM 0 H HIS A 57 -16.741 -0.180 11.370 1.00 0.00 H new ATOM 0 HA HIS A 57 -15.696 -0.594 13.913 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -16.929 -2.297 12.663 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -15.698 -2.340 11.417 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -15.837 -3.159 15.283 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -13.053 -5.748 13.456 1.00 0.00 H new ATOM 0 HE2 HIS A 57 -14.181 -5.171 15.667 1.00 0.00 H new ATOM 882 N GLN A 58 -13.390 -0.683 11.536 1.00 0.00 N ATOM 883 CA GLN A 58 -11.951 -0.682 11.283 1.00 0.00 C ATOM 884 C GLN A 58 -11.310 0.633 11.732 1.00 0.00 C ATOM 885 O GLN A 58 -10.370 0.631 12.531 1.00 0.00 O ATOM 886 CB GLN A 58 -11.678 -0.930 9.790 1.00 0.00 C ATOM 887 CG GLN A 58 -10.207 -0.824 9.391 1.00 0.00 C ATOM 888 CD GLN A 58 -9.299 -1.715 10.220 1.00 0.00 C ATOM 889 OE1 GLN A 58 -9.156 -2.904 9.946 1.00 0.00 O ATOM 890 NE2 GLN A 58 -8.682 -1.142 11.240 1.00 0.00 N ATOM 0 H GLN A 58 -13.963 -0.696 10.692 1.00 0.00 H new ATOM 0 HA GLN A 58 -11.503 -1.487 11.865 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -12.043 -1.923 9.527 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -12.253 -0.213 9.204 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -10.102 -1.088 8.339 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -9.883 0.211 9.494 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -8.828 -0.151 11.433 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -8.060 -1.691 11.833 1.00 0.00 H new ATOM 899 N ILE A 59 -11.828 1.747 11.229 1.00 0.00 N ATOM 900 CA ILE A 59 -11.235 3.058 11.492 1.00 0.00 C ATOM 901 C ILE A 59 -11.294 3.411 12.980 1.00 0.00 C ATOM 902 O ILE A 59 -10.365 4.012 13.522 1.00 0.00 O ATOM 903 CB ILE A 59 -11.934 4.172 10.666 1.00 0.00 C ATOM 904 CG1 ILE A 59 -11.905 3.828 9.164 1.00 0.00 C ATOM 905 CG2 ILE A 59 -11.286 5.536 10.921 1.00 0.00 C ATOM 906 CD1 ILE A 59 -10.511 3.747 8.572 1.00 0.00 C ATOM 0 H ILE A 59 -12.658 1.772 10.636 1.00 0.00 H new ATOM 0 HA ILE A 59 -10.190 2.998 11.187 1.00 0.00 H new ATOM 0 HB ILE A 59 -12.974 4.230 10.988 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -12.408 2.873 9.012 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -12.476 4.580 8.619 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -11.795 6.297 10.330 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -11.366 5.785 11.979 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -10.235 5.498 10.636 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -10.579 3.501 7.512 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -10.009 4.708 8.690 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -9.941 2.974 9.088 1.00 0.00 H new ATOM 918 N GLU A 60 -12.387 3.029 13.637 1.00 0.00 N ATOM 919 CA GLU A 60 -12.598 3.370 15.042 1.00 0.00 C ATOM 920 C GLU A 60 -11.823 2.431 15.970 1.00 0.00 C ATOM 921 O GLU A 60 -10.985 2.877 16.756 1.00 0.00 O ATOM 922 CB GLU A 60 -14.091 3.323 15.375 1.00 0.00 C ATOM 923 CG GLU A 60 -14.451 3.959 16.710 1.00 0.00 C ATOM 924 CD GLU A 60 -15.949 3.964 16.959 1.00 0.00 C ATOM 925 OE1 GLU A 60 -16.558 2.871 16.966 1.00 0.00 O ATOM 926 OE2 GLU A 60 -16.526 5.057 17.146 1.00 0.00 O ATOM 0 H GLU A 60 -13.140 2.483 13.219 1.00 0.00 H new ATOM 0 HA GLU A 60 -12.224 4.381 15.201 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -14.645 3.828 14.583 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -14.418 2.283 15.380 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -13.953 3.418 17.514 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -14.077 4.983 16.735 1.00 0.00 H new ATOM 933 N THR A 61 -12.096 1.132 15.871 1.00 0.00 N ATOM 934 CA THR A 61 -11.499 0.148 16.774 1.00 0.00 C ATOM 935 C THR A 61 -9.996 -0.013 16.518 1.00 0.00 C ATOM 936 O THR A 61 -9.261 -0.500 17.379 1.00 0.00 O ATOM 937 CB THR A 61 -12.207 -1.224 16.650 1.00 0.00 C ATOM 938 OG1 THR A 61 -13.600 -1.025 16.355 1.00 0.00 O ATOM 939 CG2 THR A 61 -12.070 -2.041 17.935 1.00 0.00 C ATOM 0 H THR A 61 -12.727 0.735 15.175 1.00 0.00 H new ATOM 0 HA THR A 61 -11.634 0.522 17.789 1.00 0.00 H new ATOM 0 HB THR A 61 -11.730 -1.778 15.841 1.00 0.00 H new ATOM 0 HG1 THR A 61 -13.740 -1.076 15.386 1.00 0.00 H new ATOM 0 HG21 THR A 61 -12.578 -2.998 17.814 1.00 0.00 H new ATOM 0 HG22 THR A 61 -11.015 -2.215 18.145 1.00 0.00 H new ATOM 0 HG23 THR A 61 -12.520 -1.494 18.764 1.00 0.00 H new ATOM 947 N GLY A 62 -9.551 0.396 15.334 1.00 0.00 N ATOM 948 CA GLY A 62 -8.137 0.362 15.001 1.00 0.00 C ATOM 949 C GLY A 62 -7.757 1.539 14.130 1.00 0.00 C ATOM 950 O GLY A 62 -7.769 2.683 14.590 1.00 0.00 O ATOM 0 H GLY A 62 -10.151 0.754 14.591 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -7.544 0.375 15.915 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -7.904 -0.568 14.483 1.00 0.00 H new ATOM 954 N LEU A 63 -7.419 1.262 12.875 1.00 0.00 N ATOM 955 CA LEU A 63 -7.190 2.311 11.886 1.00 0.00 C ATOM 956 C LEU A 63 -7.260 1.723 10.479 1.00 0.00 C ATOM 957 O LEU A 63 -8.341 1.625 9.900 1.00 0.00 O ATOM 958 CB LEU A 63 -5.847 3.027 12.128 1.00 0.00 C ATOM 959 CG LEU A 63 -5.694 4.391 11.428 1.00 0.00 C ATOM 960 CD1 LEU A 63 -6.889 5.297 11.727 1.00 0.00 C ATOM 961 CD2 LEU A 63 -4.389 5.067 11.840 1.00 0.00 C ATOM 0 H LEU A 63 -7.297 0.315 12.517 1.00 0.00 H new ATOM 0 HA LEU A 63 -7.974 3.061 11.988 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -5.719 3.171 13.201 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -5.040 2.374 11.795 1.00 0.00 H new ATOM 0 HG LEU A 63 -5.664 4.216 10.353 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -6.756 6.253 11.221 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -7.803 4.822 11.371 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -6.960 5.462 12.802 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -4.302 6.028 11.334 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -4.385 5.223 12.919 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -3.547 4.433 11.562 1.00 0.00 H new ATOM 973 N TYR A 64 -6.116 1.319 9.939 1.00 0.00 N ATOM 974 CA TYR A 64 -6.074 0.662 8.636 1.00 0.00 C ATOM 975 C TYR A 64 -5.827 -0.818 8.824 1.00 0.00 C ATOM 976 O TYR A 64 -6.393 -1.659 8.114 1.00 0.00 O ATOM 977 CB TYR A 64 -4.977 1.273 7.753 1.00 0.00 C ATOM 978 CG TYR A 64 -4.939 2.789 7.776 1.00 0.00 C ATOM 979 CD1 TYR A 64 -6.053 3.539 7.417 1.00 0.00 C ATOM 980 CD2 TYR A 64 -3.785 3.470 8.149 1.00 0.00 C ATOM 981 CE1 TYR A 64 -6.017 4.921 7.425 1.00 0.00 C ATOM 982 CE2 TYR A 64 -3.742 4.850 8.163 1.00 0.00 C ATOM 983 CZ TYR A 64 -4.860 5.572 7.800 1.00 0.00 C ATOM 984 OH TYR A 64 -4.815 6.950 7.803 1.00 0.00 O ATOM 0 H TYR A 64 -5.205 1.434 10.382 1.00 0.00 H new ATOM 0 HA TYR A 64 -7.032 0.809 8.138 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -4.009 0.891 8.077 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -5.124 0.939 6.726 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -6.962 3.033 7.127 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -2.907 2.909 8.433 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -6.890 5.488 7.139 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -2.837 5.362 8.457 1.00 0.00 H new ATOM 0 HH TYR A 64 -3.928 7.248 8.093 1.00 0.00 H new ATOM 994 N ASP A 65 -4.979 -1.111 9.797 1.00 0.00 N ATOM 995 CA ASP A 65 -4.603 -2.467 10.135 1.00 0.00 C ATOM 996 C ASP A 65 -4.097 -3.192 8.898 1.00 0.00 C ATOM 997 O ASP A 65 -3.609 -2.561 7.954 1.00 0.00 O ATOM 998 CB ASP A 65 -5.783 -3.217 10.783 1.00 0.00 C ATOM 999 CG ASP A 65 -5.874 -2.971 12.281 1.00 0.00 C ATOM 1000 OD1 ASP A 65 -6.334 -1.877 12.686 1.00 0.00 O ATOM 1001 OD2 ASP A 65 -5.476 -3.859 13.062 1.00 0.00 O ATOM 0 H ASP A 65 -4.530 -0.403 10.378 1.00 0.00 H new ATOM 0 HA ASP A 65 -3.795 -2.436 10.866 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -6.713 -2.904 10.309 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -5.676 -4.286 10.599 1.00 0.00 H new ATOM 1006 N GLY A 66 -4.192 -4.508 8.899 1.00 0.00 N ATOM 1007 CA GLY A 66 -3.853 -5.256 7.715 1.00 0.00 C ATOM 1008 C GLY A 66 -5.004 -5.282 6.725 1.00 0.00 C ATOM 1009 O GLY A 66 -4.822 -5.615 5.550 1.00 0.00 O ATOM 0 H GLY A 66 -4.496 -5.069 9.695 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -2.976 -4.814 7.243 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -3.586 -6.276 7.992 1.00 0.00 H new ATOM 1013 N CYS A 67 -6.187 -4.904 7.207 1.00 0.00 N ATOM 1014 CA CYS A 67 -7.398 -4.903 6.395 1.00 0.00 C ATOM 1015 C CYS A 67 -7.266 -3.951 5.206 1.00 0.00 C ATOM 1016 O CYS A 67 -7.517 -4.338 4.060 1.00 0.00 O ATOM 1017 CB CYS A 67 -8.614 -4.522 7.251 1.00 0.00 C ATOM 1018 SG CYS A 67 -9.091 -5.792 8.472 1.00 0.00 S ATOM 0 H CYS A 67 -6.331 -4.592 8.167 1.00 0.00 H new ATOM 0 HA CYS A 67 -7.542 -5.911 6.005 1.00 0.00 H new ATOM 0 HB2 CYS A 67 -8.398 -3.591 7.776 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -9.462 -4.328 6.594 1.00 0.00 H new ATOM 1023 N TYR A 68 -6.856 -2.713 5.480 1.00 0.00 N ATOM 1024 CA TYR A 68 -6.730 -1.684 4.445 1.00 0.00 C ATOM 1025 C TYR A 68 -5.260 -1.466 4.092 1.00 0.00 C ATOM 1026 O TYR A 68 -4.371 -1.830 4.866 1.00 0.00 O ATOM 1027 CB TYR A 68 -7.368 -0.367 4.917 1.00 0.00 C ATOM 1028 CG TYR A 68 -8.860 -0.460 5.203 1.00 0.00 C ATOM 1029 CD1 TYR A 68 -9.616 -1.541 4.753 1.00 0.00 C ATOM 1030 CD2 TYR A 68 -9.513 0.541 5.918 1.00 0.00 C ATOM 1031 CE1 TYR A 68 -10.971 -1.623 5.008 1.00 0.00 C ATOM 1032 CE2 TYR A 68 -10.869 0.464 6.178 1.00 0.00 C ATOM 1033 CZ TYR A 68 -11.593 -0.619 5.721 1.00 0.00 C ATOM 1034 OH TYR A 68 -12.948 -0.696 5.969 1.00 0.00 O ATOM 0 H TYR A 68 -6.604 -2.396 6.416 1.00 0.00 H new ATOM 0 HA TYR A 68 -7.256 -2.023 3.553 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -6.857 -0.033 5.820 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -7.203 0.396 4.156 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -9.133 -2.329 4.194 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -8.951 1.391 6.275 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -11.540 -2.468 4.651 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -11.360 1.248 6.736 1.00 0.00 H new ATOM 0 HH TYR A 68 -13.375 0.150 5.718 1.00 0.00 H new ATOM 1044 N ILE A 69 -5.008 -0.884 2.919 1.00 0.00 N ATOM 1045 CA ILE A 69 -3.643 -0.634 2.457 1.00 0.00 C ATOM 1046 C ILE A 69 -3.341 0.865 2.458 1.00 0.00 C ATOM 1047 O ILE A 69 -3.735 1.588 1.544 1.00 0.00 O ATOM 1048 CB ILE A 69 -3.412 -1.201 1.027 1.00 0.00 C ATOM 1049 CG1 ILE A 69 -3.872 -2.674 0.932 1.00 0.00 C ATOM 1050 CG2 ILE A 69 -1.939 -1.070 0.631 1.00 0.00 C ATOM 1051 CD1 ILE A 69 -5.309 -2.849 0.476 1.00 0.00 C ATOM 0 H ILE A 69 -5.733 -0.577 2.271 1.00 0.00 H new ATOM 0 HA ILE A 69 -2.971 -1.143 3.147 1.00 0.00 H new ATOM 0 HB ILE A 69 -4.012 -0.616 0.330 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -3.216 -3.204 0.241 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -3.753 -3.144 1.908 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -1.795 -1.471 -0.372 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -1.650 -0.019 0.646 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -1.322 -1.626 1.337 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -5.551 -3.911 0.436 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -5.977 -2.350 1.178 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -5.432 -2.411 -0.515 1.00 0.00 H new ATOM 1063 N SER A 70 -2.652 1.325 3.493 1.00 0.00 N ATOM 1064 CA SER A 70 -2.251 2.723 3.603 1.00 0.00 C ATOM 1065 C SER A 70 -0.967 2.969 2.806 1.00 0.00 C ATOM 1066 O SER A 70 0.078 2.390 3.112 1.00 0.00 O ATOM 1067 CB SER A 70 -2.045 3.082 5.084 1.00 0.00 C ATOM 1068 OG SER A 70 -1.993 1.912 5.892 1.00 0.00 O ATOM 0 H SER A 70 -2.356 0.744 4.277 1.00 0.00 H new ATOM 0 HA SER A 70 -3.035 3.358 3.190 1.00 0.00 H new ATOM 0 HB2 SER A 70 -1.121 3.649 5.199 1.00 0.00 H new ATOM 0 HB3 SER A 70 -2.857 3.725 5.422 1.00 0.00 H new ATOM 0 HG SER A 70 -2.485 2.068 6.725 1.00 0.00 H new ATOM 1074 N THR A 71 -1.051 3.791 1.763 1.00 0.00 N ATOM 1075 CA THR A 71 0.119 4.110 0.951 1.00 0.00 C ATOM 1076 C THR A 71 0.127 5.582 0.536 1.00 0.00 C ATOM 1077 O THR A 71 -0.866 6.107 0.033 1.00 0.00 O ATOM 1078 CB THR A 71 0.181 3.210 -0.305 1.00 0.00 C ATOM 1079 OG1 THR A 71 0.271 1.833 0.096 1.00 0.00 O ATOM 1080 CG2 THR A 71 1.378 3.561 -1.186 1.00 0.00 C ATOM 0 H THR A 71 -1.913 4.246 1.462 1.00 0.00 H new ATOM 0 HA THR A 71 1.000 3.921 1.565 1.00 0.00 H new ATOM 0 HB THR A 71 -0.727 3.375 -0.884 1.00 0.00 H new ATOM 0 HG1 THR A 71 1.134 1.466 -0.187 1.00 0.00 H new ATOM 0 HG21 THR A 71 1.391 2.909 -2.059 1.00 0.00 H new ATOM 0 HG22 THR A 71 1.300 4.599 -1.509 1.00 0.00 H new ATOM 0 HG23 THR A 71 2.299 3.426 -0.619 1.00 0.00 H new ATOM 1088 N THR A 72 1.251 6.248 0.768 1.00 0.00 N ATOM 1089 CA THR A 72 1.432 7.627 0.342 1.00 0.00 C ATOM 1090 C THR A 72 1.843 7.670 -1.130 1.00 0.00 C ATOM 1091 O THR A 72 2.475 6.738 -1.628 1.00 0.00 O ATOM 1092 CB THR A 72 2.506 8.330 1.207 1.00 0.00 C ATOM 1093 OG1 THR A 72 2.456 7.821 2.548 1.00 0.00 O ATOM 1094 CG2 THR A 72 2.310 9.844 1.227 1.00 0.00 C ATOM 0 H THR A 72 2.056 5.850 1.253 1.00 0.00 H new ATOM 0 HA THR A 72 0.486 8.153 0.467 1.00 0.00 H new ATOM 0 HB THR A 72 3.480 8.122 0.765 1.00 0.00 H new ATOM 0 HG1 THR A 72 3.138 8.267 3.093 1.00 0.00 H new ATOM 0 HG21 THR A 72 3.083 10.303 1.844 1.00 0.00 H new ATOM 0 HG22 THR A 72 2.378 10.233 0.211 1.00 0.00 H new ATOM 0 HG23 THR A 72 1.329 10.078 1.640 1.00 0.00 H new ATOM 1102 N THR A 73 1.490 8.748 -1.821 1.00 0.00 N ATOM 1103 CA THR A 73 1.821 8.908 -3.235 1.00 0.00 C ATOM 1104 C THR A 73 3.314 9.231 -3.441 1.00 0.00 C ATOM 1105 O THR A 73 3.738 9.598 -4.543 1.00 0.00 O ATOM 1106 CB THR A 73 0.939 10.010 -3.874 1.00 0.00 C ATOM 1107 OG1 THR A 73 -0.297 10.113 -3.150 1.00 0.00 O ATOM 1108 CG2 THR A 73 0.648 9.709 -5.344 1.00 0.00 C ATOM 0 H THR A 73 0.971 9.530 -1.423 1.00 0.00 H new ATOM 0 HA THR A 73 1.619 7.958 -3.729 1.00 0.00 H new ATOM 0 HB THR A 73 1.482 10.953 -3.823 1.00 0.00 H new ATOM 0 HG1 THR A 73 -0.855 10.811 -3.553 1.00 0.00 H new ATOM 0 HG21 THR A 73 0.027 10.502 -5.762 1.00 0.00 H new ATOM 0 HG22 THR A 73 1.586 9.653 -5.897 1.00 0.00 H new ATOM 0 HG23 THR A 73 0.123 8.757 -5.423 1.00 0.00 H new ATOM 1116 N ASP A 74 4.104 9.099 -2.376 1.00 0.00 N ATOM 1117 CA ASP A 74 5.543 9.337 -2.437 1.00 0.00 C ATOM 1118 C ASP A 74 6.284 8.005 -2.380 1.00 0.00 C ATOM 1119 O ASP A 74 6.094 7.230 -1.445 1.00 0.00 O ATOM 1120 CB ASP A 74 5.987 10.239 -1.277 1.00 0.00 C ATOM 1121 CG ASP A 74 7.359 10.853 -1.511 1.00 0.00 C ATOM 1122 OD1 ASP A 74 8.370 10.131 -1.396 1.00 0.00 O ATOM 1123 OD2 ASP A 74 7.433 12.063 -1.814 1.00 0.00 O ATOM 0 H ASP A 74 3.766 8.826 -1.453 1.00 0.00 H new ATOM 0 HA ASP A 74 5.780 9.841 -3.374 1.00 0.00 H new ATOM 0 HB2 ASP A 74 5.255 11.035 -1.138 1.00 0.00 H new ATOM 0 HB3 ASP A 74 6.005 9.658 -0.355 1.00 0.00 H new ATOM 1128 N LYS A 75 7.114 7.745 -3.388 1.00 0.00 N ATOM 1129 CA LYS A 75 7.852 6.480 -3.504 1.00 0.00 C ATOM 1130 C LYS A 75 8.575 6.091 -2.208 1.00 0.00 C ATOM 1131 O LYS A 75 8.761 4.903 -1.933 1.00 0.00 O ATOM 1132 CB LYS A 75 8.862 6.556 -4.661 1.00 0.00 C ATOM 1133 CG LYS A 75 9.982 7.583 -4.461 1.00 0.00 C ATOM 1134 CD LYS A 75 11.269 7.171 -5.183 1.00 0.00 C ATOM 1135 CE LYS A 75 12.133 8.374 -5.552 1.00 0.00 C ATOM 1136 NZ LYS A 75 12.844 8.940 -4.373 1.00 0.00 N ATOM 0 H LYS A 75 7.297 8.401 -4.148 1.00 0.00 H new ATOM 0 HA LYS A 75 7.113 5.704 -3.706 1.00 0.00 H new ATOM 0 HB2 LYS A 75 9.309 5.572 -4.801 1.00 0.00 H new ATOM 0 HB3 LYS A 75 8.326 6.796 -5.579 1.00 0.00 H new ATOM 0 HG2 LYS A 75 9.654 8.555 -4.830 1.00 0.00 H new ATOM 0 HG3 LYS A 75 10.184 7.698 -3.396 1.00 0.00 H new ATOM 0 HD2 LYS A 75 11.841 6.497 -4.546 1.00 0.00 H new ATOM 0 HD3 LYS A 75 11.015 6.617 -6.087 1.00 0.00 H new ATOM 0 HE2 LYS A 75 12.862 8.077 -6.306 1.00 0.00 H new ATOM 0 HE3 LYS A 75 11.506 9.145 -6.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 12.650 9.960 -4.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 12.512 8.467 -3.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 13.867 8.789 -4.479 1.00 0.00 H new ATOM 1150 N GLU A 76 8.961 7.081 -1.401 1.00 0.00 N ATOM 1151 CA GLU A 76 9.737 6.817 -0.184 1.00 0.00 C ATOM 1152 C GLU A 76 8.922 6.002 0.822 1.00 0.00 C ATOM 1153 O GLU A 76 9.484 5.359 1.716 1.00 0.00 O ATOM 1154 CB GLU A 76 10.216 8.127 0.455 1.00 0.00 C ATOM 1155 CG GLU A 76 11.245 8.881 -0.384 1.00 0.00 C ATOM 1156 CD GLU A 76 12.433 8.019 -0.787 1.00 0.00 C ATOM 1157 OE1 GLU A 76 13.283 7.720 0.081 1.00 0.00 O ATOM 1158 OE2 GLU A 76 12.538 7.654 -1.977 1.00 0.00 O ATOM 0 H GLU A 76 8.752 8.066 -1.564 1.00 0.00 H new ATOM 0 HA GLU A 76 10.611 6.232 -0.469 1.00 0.00 H new ATOM 0 HB2 GLU A 76 9.355 8.774 0.625 1.00 0.00 H new ATOM 0 HB3 GLU A 76 10.648 7.908 1.432 1.00 0.00 H new ATOM 0 HG2 GLU A 76 10.761 9.266 -1.282 1.00 0.00 H new ATOM 0 HG3 GLU A 76 11.603 9.743 0.179 1.00 0.00 H new ATOM 1165 N ILE A 77 7.598 6.020 0.660 1.00 0.00 N ATOM 1166 CA ILE A 77 6.700 5.259 1.526 1.00 0.00 C ATOM 1167 C ILE A 77 7.054 3.771 1.492 1.00 0.00 C ATOM 1168 O ILE A 77 6.848 3.056 2.466 1.00 0.00 O ATOM 1169 CB ILE A 77 5.208 5.452 1.126 1.00 0.00 C ATOM 1170 CG1 ILE A 77 4.264 4.978 2.260 1.00 0.00 C ATOM 1171 CG2 ILE A 77 4.891 4.741 -0.193 1.00 0.00 C ATOM 1172 CD1 ILE A 77 3.704 3.578 2.078 1.00 0.00 C ATOM 0 H ILE A 77 7.124 6.556 -0.067 1.00 0.00 H new ATOM 0 HA ILE A 77 6.831 5.640 2.539 1.00 0.00 H new ATOM 0 HB ILE A 77 5.038 6.518 0.974 1.00 0.00 H new ATOM 0 HG12 ILE A 77 4.806 5.018 3.205 1.00 0.00 H new ATOM 0 HG13 ILE A 77 3.433 5.679 2.339 1.00 0.00 H new ATOM 0 HG21 ILE A 77 3.842 4.894 -0.446 1.00 0.00 H new ATOM 0 HG22 ILE A 77 5.518 5.148 -0.986 1.00 0.00 H new ATOM 0 HG23 ILE A 77 5.087 3.674 -0.087 1.00 0.00 H new ATOM 0 HD11 ILE A 77 3.055 3.333 2.919 1.00 0.00 H new ATOM 0 HD12 ILE A 77 3.130 3.533 1.152 1.00 0.00 H new ATOM 0 HD13 ILE A 77 4.524 2.861 2.032 1.00 0.00 H new ATOM 1184 N ALA A 78 7.607 3.327 0.368 1.00 0.00 N ATOM 1185 CA ALA A 78 7.977 1.927 0.185 1.00 0.00 C ATOM 1186 C ALA A 78 9.023 1.507 1.216 1.00 0.00 C ATOM 1187 O ALA A 78 8.855 0.513 1.933 1.00 0.00 O ATOM 1188 CB ALA A 78 8.503 1.710 -1.230 1.00 0.00 C ATOM 0 H ALA A 78 7.810 3.921 -0.436 1.00 0.00 H new ATOM 0 HA ALA A 78 7.091 1.309 0.330 1.00 0.00 H new ATOM 0 HB1 ALA A 78 8.777 0.663 -1.360 1.00 0.00 H new ATOM 0 HB2 ALA A 78 7.729 1.974 -1.950 1.00 0.00 H new ATOM 0 HB3 ALA A 78 9.379 2.337 -1.393 1.00 0.00 H new ATOM 1194 N LYS A 79 10.090 2.295 1.300 1.00 0.00 N ATOM 1195 CA LYS A 79 11.196 2.009 2.209 1.00 0.00 C ATOM 1196 C LYS A 79 10.751 2.247 3.647 1.00 0.00 C ATOM 1197 O LYS A 79 11.024 1.437 4.540 1.00 0.00 O ATOM 1198 CB LYS A 79 12.418 2.887 1.864 1.00 0.00 C ATOM 1199 CG LYS A 79 13.740 2.120 1.803 1.00 0.00 C ATOM 1200 CD LYS A 79 13.794 1.163 0.610 1.00 0.00 C ATOM 1201 CE LYS A 79 13.887 1.911 -0.720 1.00 0.00 C ATOM 1202 NZ LYS A 79 14.131 0.988 -1.862 1.00 0.00 N ATOM 0 H LYS A 79 10.213 3.142 0.746 1.00 0.00 H new ATOM 0 HA LYS A 79 11.489 0.965 2.098 1.00 0.00 H new ATOM 0 HB2 LYS A 79 12.245 3.369 0.902 1.00 0.00 H new ATOM 0 HB3 LYS A 79 12.504 3.680 2.607 1.00 0.00 H new ATOM 0 HG2 LYS A 79 14.567 2.827 1.738 1.00 0.00 H new ATOM 0 HG3 LYS A 79 13.875 1.556 2.726 1.00 0.00 H new ATOM 0 HD2 LYS A 79 14.654 0.501 0.715 1.00 0.00 H new ATOM 0 HD3 LYS A 79 12.905 0.533 0.610 1.00 0.00 H new ATOM 0 HE2 LYS A 79 12.963 2.463 -0.891 1.00 0.00 H new ATOM 0 HE3 LYS A 79 14.692 2.644 -0.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 14.187 1.535 -2.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 15.026 0.479 -1.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 13.351 0.304 -1.928 1.00 0.00 H new ATOM 1216 N LYS A 80 10.043 3.353 3.851 1.00 0.00 N ATOM 1217 CA LYS A 80 9.519 3.712 5.164 1.00 0.00 C ATOM 1218 C LYS A 80 8.653 2.581 5.710 1.00 0.00 C ATOM 1219 O LYS A 80 8.820 2.151 6.850 1.00 0.00 O ATOM 1220 CB LYS A 80 8.695 5.008 5.072 1.00 0.00 C ATOM 1221 CG LYS A 80 9.520 6.286 5.232 1.00 0.00 C ATOM 1222 CD LYS A 80 8.736 7.535 4.820 1.00 0.00 C ATOM 1223 CE LYS A 80 7.339 7.577 5.436 1.00 0.00 C ATOM 1224 NZ LYS A 80 7.373 7.450 6.919 1.00 0.00 N ATOM 0 H LYS A 80 9.817 4.022 3.115 1.00 0.00 H new ATOM 0 HA LYS A 80 10.357 3.875 5.842 1.00 0.00 H new ATOM 0 HB2 LYS A 80 8.187 5.035 4.108 1.00 0.00 H new ATOM 0 HB3 LYS A 80 7.922 4.989 5.840 1.00 0.00 H new ATOM 0 HG2 LYS A 80 9.837 6.384 6.270 1.00 0.00 H new ATOM 0 HG3 LYS A 80 10.424 6.211 4.628 1.00 0.00 H new ATOM 0 HD2 LYS A 80 9.290 8.424 5.122 1.00 0.00 H new ATOM 0 HD3 LYS A 80 8.652 7.566 3.734 1.00 0.00 H new ATOM 0 HE2 LYS A 80 6.852 8.514 5.165 1.00 0.00 H new ATOM 0 HE3 LYS A 80 6.735 6.771 5.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 6.686 8.108 7.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 7.130 6.476 7.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 8.327 7.678 7.265 1.00 0.00 H new ATOM 1238 N PHE A 81 7.751 2.085 4.870 1.00 0.00 N ATOM 1239 CA PHE A 81 6.822 1.035 5.267 1.00 0.00 C ATOM 1240 C PHE A 81 7.575 -0.251 5.598 1.00 0.00 C ATOM 1241 O PHE A 81 7.428 -0.802 6.691 1.00 0.00 O ATOM 1242 CB PHE A 81 5.796 0.776 4.150 1.00 0.00 C ATOM 1243 CG PHE A 81 4.861 -0.376 4.430 1.00 0.00 C ATOM 1244 CD1 PHE A 81 3.778 -0.217 5.284 1.00 0.00 C ATOM 1245 CD2 PHE A 81 5.067 -1.616 3.841 1.00 0.00 C ATOM 1246 CE1 PHE A 81 2.923 -1.272 5.542 1.00 0.00 C ATOM 1247 CE2 PHE A 81 4.215 -2.671 4.097 1.00 0.00 C ATOM 1248 CZ PHE A 81 3.141 -2.499 4.948 1.00 0.00 C ATOM 0 H PHE A 81 7.644 2.396 3.904 1.00 0.00 H new ATOM 0 HA PHE A 81 6.292 1.366 6.160 1.00 0.00 H new ATOM 0 HB2 PHE A 81 5.206 1.680 3.996 1.00 0.00 H new ATOM 0 HB3 PHE A 81 6.329 0.580 3.220 1.00 0.00 H new ATOM 0 HD1 PHE A 81 3.602 0.741 5.751 1.00 0.00 H new ATOM 0 HD2 PHE A 81 5.905 -1.757 3.174 1.00 0.00 H new ATOM 0 HE1 PHE A 81 2.084 -1.136 6.209 1.00 0.00 H new ATOM 0 HE2 PHE A 81 4.388 -3.630 3.632 1.00 0.00 H new ATOM 0 HZ PHE A 81 2.473 -3.323 5.149 1.00 0.00 H new ATOM 1258 N ALA A 82 8.394 -0.710 4.653 1.00 0.00 N ATOM 1259 CA ALA A 82 9.116 -1.970 4.803 1.00 0.00 C ATOM 1260 C ALA A 82 9.931 -2.000 6.098 1.00 0.00 C ATOM 1261 O ALA A 82 9.921 -2.997 6.826 1.00 0.00 O ATOM 1262 CB ALA A 82 10.014 -2.218 3.596 1.00 0.00 C ATOM 0 H ALA A 82 8.574 -0.226 3.773 1.00 0.00 H new ATOM 0 HA ALA A 82 8.379 -2.771 4.860 1.00 0.00 H new ATOM 0 HB1 ALA A 82 10.544 -3.161 3.725 1.00 0.00 H new ATOM 0 HB2 ALA A 82 9.405 -2.264 2.693 1.00 0.00 H new ATOM 0 HB3 ALA A 82 10.735 -1.406 3.506 1.00 0.00 H new ATOM 1268 N THR A 83 10.616 -0.900 6.391 1.00 0.00 N ATOM 1269 CA THR A 83 11.458 -0.822 7.579 1.00 0.00 C ATOM 1270 C THR A 83 10.625 -0.696 8.858 1.00 0.00 C ATOM 1271 O THR A 83 10.845 -1.434 9.823 1.00 0.00 O ATOM 1272 CB THR A 83 12.450 0.361 7.481 1.00 0.00 C ATOM 1273 OG1 THR A 83 13.003 0.420 6.158 1.00 0.00 O ATOM 1274 CG2 THR A 83 13.579 0.227 8.503 1.00 0.00 C ATOM 0 H THR A 83 10.605 -0.052 5.824 1.00 0.00 H new ATOM 0 HA THR A 83 12.022 -1.754 7.629 1.00 0.00 H new ATOM 0 HB THR A 83 11.904 1.279 7.696 1.00 0.00 H new ATOM 0 HG1 THR A 83 12.382 0.892 5.565 1.00 0.00 H new ATOM 0 HG21 THR A 83 14.258 1.074 8.408 1.00 0.00 H new ATOM 0 HG22 THR A 83 13.159 0.210 9.509 1.00 0.00 H new ATOM 0 HG23 THR A 83 14.125 -0.699 8.322 1.00 0.00 H new ATOM 1282 N SER A 84 9.657 0.216 8.860 1.00 0.00 N ATOM 1283 CA SER A 84 8.864 0.488 10.059 1.00 0.00 C ATOM 1284 C SER A 84 7.950 -0.684 10.416 1.00 0.00 C ATOM 1285 O SER A 84 7.474 -0.785 11.547 1.00 0.00 O ATOM 1286 CB SER A 84 8.040 1.766 9.874 1.00 0.00 C ATOM 1287 OG SER A 84 8.851 2.828 9.394 1.00 0.00 O ATOM 0 H SER A 84 9.402 0.779 8.048 1.00 0.00 H new ATOM 0 HA SER A 84 9.560 0.627 10.887 1.00 0.00 H new ATOM 0 HB2 SER A 84 7.226 1.580 9.174 1.00 0.00 H new ATOM 0 HB3 SER A 84 7.585 2.051 10.823 1.00 0.00 H new ATOM 0 HG SER A 84 8.743 2.909 8.423 1.00 0.00 H new ATOM 1293 N SER A 85 7.709 -1.573 9.457 1.00 0.00 N ATOM 1294 CA SER A 85 6.892 -2.759 9.707 1.00 0.00 C ATOM 1295 C SER A 85 7.772 -3.940 10.112 1.00 0.00 C ATOM 1296 O SER A 85 7.272 -5.016 10.441 1.00 0.00 O ATOM 1297 CB SER A 85 6.057 -3.105 8.468 1.00 0.00 C ATOM 1298 OG SER A 85 5.309 -1.983 8.027 1.00 0.00 O ATOM 0 H SER A 85 8.065 -1.497 8.504 1.00 0.00 H new ATOM 0 HA SER A 85 6.211 -2.543 10.530 1.00 0.00 H new ATOM 0 HB2 SER A 85 6.713 -3.446 7.667 1.00 0.00 H new ATOM 0 HB3 SER A 85 5.381 -3.928 8.699 1.00 0.00 H new ATOM 0 HG SER A 85 5.883 -1.398 7.490 1.00 0.00 H new ATOM 1304 N GLY A 86 9.088 -3.722 10.100 1.00 0.00 N ATOM 1305 CA GLY A 86 10.030 -4.770 10.450 1.00 0.00 C ATOM 1306 C GLY A 86 9.974 -5.938 9.485 1.00 0.00 C ATOM 1307 O GLY A 86 10.083 -7.098 9.891 1.00 0.00 O ATOM 0 H GLY A 86 9.518 -2.831 9.852 1.00 0.00 H new ATOM 0 HA2 GLY A 86 11.040 -4.359 10.462 1.00 0.00 H new ATOM 0 HA3 GLY A 86 9.818 -5.124 11.459 1.00 0.00 H new ATOM 1311 N ILE A 87 9.807 -5.629 8.203 1.00 0.00 N ATOM 1312 CA ILE A 87 9.703 -6.658 7.164 1.00 0.00 C ATOM 1313 C ILE A 87 11.085 -7.193 6.780 1.00 0.00 C ATOM 1314 O ILE A 87 11.188 -8.165 6.039 1.00 0.00 O ATOM 1315 CB ILE A 87 8.980 -6.127 5.895 1.00 0.00 C ATOM 1316 CG1 ILE A 87 7.708 -5.355 6.280 1.00 0.00 C ATOM 1317 CG2 ILE A 87 8.636 -7.272 4.940 1.00 0.00 C ATOM 1318 CD1 ILE A 87 6.936 -4.818 5.092 1.00 0.00 C ATOM 0 H ILE A 87 9.740 -4.673 7.854 1.00 0.00 H new ATOM 0 HA ILE A 87 9.108 -7.470 7.583 1.00 0.00 H new ATOM 0 HB ILE A 87 9.660 -5.447 5.382 1.00 0.00 H new ATOM 0 HG12 ILE A 87 7.057 -6.011 6.858 1.00 0.00 H new ATOM 0 HG13 ILE A 87 7.981 -4.524 6.930 1.00 0.00 H new ATOM 0 HG21 ILE A 87 8.131 -6.873 4.060 1.00 0.00 H new ATOM 0 HG22 ILE A 87 9.552 -7.778 4.634 1.00 0.00 H new ATOM 0 HG23 ILE A 87 7.980 -7.982 5.444 1.00 0.00 H new ATOM 0 HD11 ILE A 87 6.052 -4.286 5.443 1.00 0.00 H new ATOM 0 HD12 ILE A 87 7.569 -4.136 4.525 1.00 0.00 H new ATOM 0 HD13 ILE A 87 6.631 -5.646 4.452 1.00 0.00 H new ATOM 1330 N GLU A 88 12.134 -6.540 7.296 1.00 0.00 N ATOM 1331 CA GLU A 88 13.538 -6.888 7.003 1.00 0.00 C ATOM 1332 C GLU A 88 13.757 -8.394 6.784 1.00 0.00 C ATOM 1333 O GLU A 88 14.545 -8.789 5.925 1.00 0.00 O ATOM 1334 CB GLU A 88 14.442 -6.391 8.138 1.00 0.00 C ATOM 1335 CG GLU A 88 14.445 -4.871 8.294 1.00 0.00 C ATOM 1336 CD GLU A 88 14.678 -4.428 9.728 1.00 0.00 C ATOM 1337 OE1 GLU A 88 13.710 -4.423 10.518 1.00 0.00 O ATOM 1338 OE2 GLU A 88 15.829 -4.083 10.075 1.00 0.00 O ATOM 0 H GLU A 88 12.036 -5.750 7.933 1.00 0.00 H new ATOM 0 HA GLU A 88 13.796 -6.394 6.066 1.00 0.00 H new ATOM 0 HB2 GLU A 88 14.118 -6.844 9.075 1.00 0.00 H new ATOM 0 HB3 GLU A 88 15.461 -6.732 7.956 1.00 0.00 H new ATOM 0 HG2 GLU A 88 15.220 -4.446 7.657 1.00 0.00 H new ATOM 0 HG3 GLU A 88 13.492 -4.472 7.945 1.00 0.00 H new ATOM 1345 N ASN A 89 13.079 -9.225 7.570 1.00 0.00 N ATOM 1346 CA ASN A 89 13.129 -10.677 7.383 1.00 0.00 C ATOM 1347 C ASN A 89 11.731 -11.219 7.098 1.00 0.00 C ATOM 1348 O ASN A 89 10.926 -11.384 8.019 1.00 0.00 O ATOM 1349 CB ASN A 89 13.710 -11.366 8.628 1.00 0.00 C ATOM 1350 CG ASN A 89 13.738 -12.884 8.501 1.00 0.00 C ATOM 1351 OD1 ASN A 89 14.741 -13.469 8.089 1.00 0.00 O ATOM 1352 ND2 ASN A 89 12.635 -13.532 8.850 1.00 0.00 N ATOM 0 H ASN A 89 12.488 -8.921 8.343 1.00 0.00 H new ATOM 0 HA ASN A 89 13.777 -10.890 6.533 1.00 0.00 H new ATOM 0 HB2 ASN A 89 14.723 -11.001 8.801 1.00 0.00 H new ATOM 0 HB3 ASN A 89 13.118 -11.089 9.501 1.00 0.00 H new ATOM 0 HD21 ASN A 89 12.598 -14.549 8.782 1.00 0.00 H new ATOM 0 HD22 ASN A 89 11.824 -13.013 9.187 1.00 0.00 H new ATOM 1359 N GLY A 90 11.439 -11.486 5.827 1.00 0.00 N ATOM 1360 CA GLY A 90 10.142 -12.031 5.471 1.00 0.00 C ATOM 1361 C GLY A 90 9.801 -11.867 4.002 1.00 0.00 C ATOM 1362 O GLY A 90 10.687 -11.862 3.138 1.00 0.00 O ATOM 0 H GLY A 90 12.074 -11.335 5.043 1.00 0.00 H new ATOM 0 HA2 GLY A 90 10.119 -13.091 5.725 1.00 0.00 H new ATOM 0 HA3 GLY A 90 9.374 -11.543 6.071 1.00 0.00 H new ATOM 1366 N TYR A 91 8.506 -11.724 3.732 1.00 0.00 N ATOM 1367 CA TYR A 91 7.980 -11.657 2.374 1.00 0.00 C ATOM 1368 C TYR A 91 7.492 -10.240 2.066 1.00 0.00 C ATOM 1369 O TYR A 91 6.709 -9.666 2.826 1.00 0.00 O ATOM 1370 CB TYR A 91 6.820 -12.663 2.234 1.00 0.00 C ATOM 1371 CG TYR A 91 6.783 -13.452 0.935 1.00 0.00 C ATOM 1372 CD1 TYR A 91 7.901 -13.563 0.113 1.00 0.00 C ATOM 1373 CD2 TYR A 91 5.616 -14.099 0.542 1.00 0.00 C ATOM 1374 CE1 TYR A 91 7.852 -14.288 -1.062 1.00 0.00 C ATOM 1375 CE2 TYR A 91 5.559 -14.826 -0.630 1.00 0.00 C ATOM 1376 CZ TYR A 91 6.680 -14.920 -1.428 1.00 0.00 C ATOM 1377 OH TYR A 91 6.622 -15.644 -2.599 1.00 0.00 O ATOM 0 H TYR A 91 7.789 -11.651 4.454 1.00 0.00 H new ATOM 0 HA TYR A 91 8.768 -11.910 1.665 1.00 0.00 H new ATOM 0 HB2 TYR A 91 6.873 -13.368 3.064 1.00 0.00 H new ATOM 0 HB3 TYR A 91 5.880 -12.121 2.335 1.00 0.00 H new ATOM 0 HD1 TYR A 91 8.821 -13.075 0.398 1.00 0.00 H new ATOM 0 HD2 TYR A 91 4.737 -14.031 1.166 1.00 0.00 H new ATOM 0 HE1 TYR A 91 8.727 -14.360 -1.692 1.00 0.00 H new ATOM 0 HE2 TYR A 91 4.642 -15.318 -0.920 1.00 0.00 H new ATOM 0 HH TYR A 91 6.398 -16.576 -2.396 1.00 0.00 H new ATOM 1387 N ILE A 92 7.956 -9.684 0.956 1.00 0.00 N ATOM 1388 CA ILE A 92 7.558 -8.347 0.525 1.00 0.00 C ATOM 1389 C ILE A 92 6.579 -8.440 -0.642 1.00 0.00 C ATOM 1390 O ILE A 92 6.798 -9.201 -1.582 1.00 0.00 O ATOM 1391 CB ILE A 92 8.793 -7.498 0.111 1.00 0.00 C ATOM 1392 CG1 ILE A 92 9.553 -7.023 1.363 1.00 0.00 C ATOM 1393 CG2 ILE A 92 8.382 -6.307 -0.761 1.00 0.00 C ATOM 1394 CD1 ILE A 92 10.708 -6.087 1.071 1.00 0.00 C ATOM 0 H ILE A 92 8.617 -10.143 0.329 1.00 0.00 H new ATOM 0 HA ILE A 92 7.071 -7.854 1.367 1.00 0.00 H new ATOM 0 HB ILE A 92 9.456 -8.127 -0.483 1.00 0.00 H new ATOM 0 HG12 ILE A 92 8.853 -6.521 2.030 1.00 0.00 H new ATOM 0 HG13 ILE A 92 9.932 -7.895 1.896 1.00 0.00 H new ATOM 0 HG21 ILE A 92 9.268 -5.733 -1.034 1.00 0.00 H new ATOM 0 HG22 ILE A 92 7.892 -6.670 -1.665 1.00 0.00 H new ATOM 0 HG23 ILE A 92 7.694 -5.670 -0.206 1.00 0.00 H new ATOM 0 HD11 ILE A 92 11.189 -5.800 2.006 1.00 0.00 H new ATOM 0 HD12 ILE A 92 11.432 -6.591 0.430 1.00 0.00 H new ATOM 0 HD13 ILE A 92 10.335 -5.196 0.566 1.00 0.00 H new ATOM 1406 N TYR A 93 5.493 -7.681 -0.569 1.00 0.00 N ATOM 1407 CA TYR A 93 4.492 -7.645 -1.639 1.00 0.00 C ATOM 1408 C TYR A 93 4.414 -6.253 -2.262 1.00 0.00 C ATOM 1409 O TYR A 93 4.586 -5.243 -1.573 1.00 0.00 O ATOM 1410 CB TYR A 93 3.114 -8.039 -1.094 1.00 0.00 C ATOM 1411 CG TYR A 93 2.914 -9.535 -0.935 1.00 0.00 C ATOM 1412 CD1 TYR A 93 3.608 -10.252 0.032 1.00 0.00 C ATOM 1413 CD2 TYR A 93 2.033 -10.229 -1.756 1.00 0.00 C ATOM 1414 CE1 TYR A 93 3.431 -11.615 0.171 1.00 0.00 C ATOM 1415 CE2 TYR A 93 1.851 -11.589 -1.621 1.00 0.00 C ATOM 1416 CZ TYR A 93 2.553 -12.279 -0.658 1.00 0.00 C ATOM 1417 OH TYR A 93 2.377 -13.638 -0.525 1.00 0.00 O ATOM 0 H TYR A 93 5.278 -7.077 0.224 1.00 0.00 H new ATOM 0 HA TYR A 93 4.794 -8.358 -2.406 1.00 0.00 H new ATOM 0 HB2 TYR A 93 2.967 -7.559 -0.126 1.00 0.00 H new ATOM 0 HB3 TYR A 93 2.346 -7.650 -1.763 1.00 0.00 H new ATOM 0 HD1 TYR A 93 4.296 -9.736 0.685 1.00 0.00 H new ATOM 0 HD2 TYR A 93 1.481 -9.693 -2.514 1.00 0.00 H new ATOM 0 HE1 TYR A 93 3.979 -12.158 0.927 1.00 0.00 H new ATOM 0 HE2 TYR A 93 1.161 -12.111 -2.268 1.00 0.00 H new ATOM 0 HH TYR A 93 3.251 -14.075 -0.448 1.00 0.00 H new ATOM 1427 N VAL A 94 4.146 -6.209 -3.565 1.00 0.00 N ATOM 1428 CA VAL A 94 3.974 -4.951 -4.285 1.00 0.00 C ATOM 1429 C VAL A 94 2.743 -5.030 -5.186 1.00 0.00 C ATOM 1430 O VAL A 94 2.641 -5.920 -6.055 1.00 0.00 O ATOM 1431 CB VAL A 94 5.229 -4.577 -5.129 1.00 0.00 C ATOM 1432 CG1 VAL A 94 6.005 -3.442 -4.466 1.00 0.00 C ATOM 1433 CG2 VAL A 94 6.130 -5.794 -5.334 1.00 0.00 C ATOM 0 H VAL A 94 4.043 -7.040 -4.148 1.00 0.00 H new ATOM 0 HA VAL A 94 3.837 -4.166 -3.541 1.00 0.00 H new ATOM 0 HB VAL A 94 4.889 -4.237 -6.107 1.00 0.00 H new ATOM 0 HG11 VAL A 94 6.878 -3.196 -5.071 1.00 0.00 H new ATOM 0 HG12 VAL A 94 5.364 -2.565 -4.380 1.00 0.00 H new ATOM 0 HG13 VAL A 94 6.328 -3.754 -3.473 1.00 0.00 H new ATOM 0 HG21 VAL A 94 6.999 -5.508 -5.926 1.00 0.00 H new ATOM 0 HG22 VAL A 94 6.459 -6.171 -4.365 1.00 0.00 H new ATOM 0 HG23 VAL A 94 5.576 -6.573 -5.857 1.00 0.00 H new ATOM 1443 N LEU A 95 1.815 -4.095 -4.963 1.00 0.00 N ATOM 1444 CA LEU A 95 0.533 -4.061 -5.668 1.00 0.00 C ATOM 1445 C LEU A 95 0.439 -2.799 -6.525 1.00 0.00 C ATOM 1446 O LEU A 95 0.877 -1.732 -6.103 1.00 0.00 O ATOM 1447 CB LEU A 95 -0.653 -4.105 -4.672 1.00 0.00 C ATOM 1448 CG LEU A 95 -0.355 -4.663 -3.260 1.00 0.00 C ATOM 1449 CD1 LEU A 95 0.323 -3.615 -2.379 1.00 0.00 C ATOM 1450 CD2 LEU A 95 -1.638 -5.155 -2.591 1.00 0.00 C ATOM 0 H LEU A 95 1.933 -3.340 -4.287 1.00 0.00 H new ATOM 0 HA LEU A 95 0.477 -4.941 -6.309 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -1.043 -3.093 -4.563 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -1.447 -4.706 -5.115 1.00 0.00 H new ATOM 0 HG LEU A 95 0.328 -5.504 -3.378 1.00 0.00 H new ATOM 0 HD11 LEU A 95 0.519 -4.039 -1.394 1.00 0.00 H new ATOM 0 HD12 LEU A 95 1.264 -3.309 -2.836 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -0.329 -2.748 -2.278 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -1.405 -5.543 -1.599 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -2.342 -4.328 -2.501 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -2.083 -5.946 -3.195 1.00 0.00 H new ATOM 1462 N ASN A 96 -0.127 -2.916 -7.722 1.00 0.00 N ATOM 1463 CA ASN A 96 -0.268 -1.760 -8.615 1.00 0.00 C ATOM 1464 C ASN A 96 -1.477 -0.919 -8.207 1.00 0.00 C ATOM 1465 O ASN A 96 -2.540 -1.462 -7.895 1.00 0.00 O ATOM 1466 CB ASN A 96 -0.403 -2.207 -10.076 1.00 0.00 C ATOM 1467 CG ASN A 96 -0.033 -1.109 -11.063 1.00 0.00 C ATOM 1468 OD1 ASN A 96 0.128 0.058 -10.692 1.00 0.00 O ATOM 1469 ND2 ASN A 96 0.103 -1.476 -12.328 1.00 0.00 N ATOM 0 H ASN A 96 -0.494 -3.790 -8.098 1.00 0.00 H new ATOM 0 HA ASN A 96 0.632 -1.152 -8.526 1.00 0.00 H new ATOM 0 HB2 ASN A 96 0.236 -3.074 -10.247 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -1.429 -2.525 -10.261 1.00 0.00 H new ATOM 0 HD21 ASN A 96 0.349 -0.784 -13.036 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -0.038 -2.450 -12.594 1.00 0.00 H new ATOM 1476 N ARG A 97 -1.321 0.405 -8.233 1.00 0.00 N ATOM 1477 CA ARG A 97 -2.345 1.309 -7.707 1.00 0.00 C ATOM 1478 C ARG A 97 -3.617 1.304 -8.563 1.00 0.00 C ATOM 1479 O ARG A 97 -4.732 1.301 -8.034 1.00 0.00 O ATOM 1480 CB ARG A 97 -1.783 2.742 -7.562 1.00 0.00 C ATOM 1481 CG ARG A 97 -1.864 3.601 -8.827 1.00 0.00 C ATOM 1482 CD ARG A 97 -0.857 3.161 -9.887 1.00 0.00 C ATOM 1483 NE ARG A 97 -1.095 3.812 -11.175 1.00 0.00 N ATOM 1484 CZ ARG A 97 -0.727 3.306 -12.355 1.00 0.00 C ATOM 1485 NH1 ARG A 97 -0.140 2.117 -12.429 1.00 0.00 N ATOM 1486 NH2 ARG A 97 -0.970 3.983 -13.469 1.00 0.00 N ATOM 0 H ARG A 97 -0.498 0.874 -8.611 1.00 0.00 H new ATOM 0 HA ARG A 97 -2.625 0.942 -6.719 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -2.323 3.248 -6.762 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -0.740 2.677 -7.251 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -2.871 3.544 -9.239 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -1.684 4.644 -8.568 1.00 0.00 H new ATOM 0 HD2 ARG A 97 0.152 3.392 -9.546 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -0.912 2.080 -10.012 1.00 0.00 H new ATOM 0 HE ARG A 97 -1.574 4.713 -11.172 1.00 0.00 H new ATOM 0 HH11 ARG A 97 0.034 1.580 -11.579 1.00 0.00 H new ATOM 0 HH12 ARG A 97 0.137 1.740 -13.336 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -1.437 4.889 -13.424 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -0.690 3.598 -14.371 1.00 0.00 H new ATOM 1500 N ASP A 98 -3.452 1.275 -9.883 1.00 0.00 N ATOM 1501 CA ASP A 98 -4.588 1.410 -10.796 1.00 0.00 C ATOM 1502 C ASP A 98 -5.308 0.078 -10.981 1.00 0.00 C ATOM 1503 O ASP A 98 -6.401 0.030 -11.546 1.00 0.00 O ATOM 1504 CB ASP A 98 -4.144 1.983 -12.151 1.00 0.00 C ATOM 1505 CG ASP A 98 -3.331 1.007 -12.990 1.00 0.00 C ATOM 1506 OD1 ASP A 98 -2.529 0.242 -12.416 1.00 0.00 O ATOM 1507 OD2 ASP A 98 -3.474 1.022 -14.233 1.00 0.00 O ATOM 0 H ASP A 98 -2.549 1.160 -10.344 1.00 0.00 H new ATOM 0 HA ASP A 98 -5.291 2.112 -10.347 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -5.027 2.286 -12.715 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -3.552 2.882 -11.979 1.00 0.00 H new ATOM 1512 N LEU A 99 -4.700 -1.000 -10.490 1.00 0.00 N ATOM 1513 CA LEU A 99 -5.350 -2.309 -10.493 1.00 0.00 C ATOM 1514 C LEU A 99 -6.513 -2.292 -9.506 1.00 0.00 C ATOM 1515 O LEU A 99 -7.602 -2.794 -9.788 1.00 0.00 O ATOM 1516 CB LEU A 99 -4.349 -3.421 -10.129 1.00 0.00 C ATOM 1517 CG LEU A 99 -3.552 -4.007 -11.309 1.00 0.00 C ATOM 1518 CD1 LEU A 99 -2.659 -5.152 -10.838 1.00 0.00 C ATOM 1519 CD2 LEU A 99 -4.492 -4.473 -12.420 1.00 0.00 C ATOM 0 H LEU A 99 -3.763 -0.994 -10.087 1.00 0.00 H new ATOM 0 HA LEU A 99 -5.726 -2.518 -11.495 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -3.644 -3.026 -9.397 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -4.893 -4.231 -9.643 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.914 -3.221 -11.714 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.104 -5.553 -11.686 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -1.959 -4.783 -10.088 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -3.275 -5.939 -10.403 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -3.907 -4.883 -13.243 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -5.161 -5.241 -12.032 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -5.079 -3.627 -12.778 1.00 0.00 H new ATOM 1531 N PHE A 100 -6.264 -1.692 -8.346 1.00 0.00 N ATOM 1532 CA PHE A 100 -7.296 -1.491 -7.334 1.00 0.00 C ATOM 1533 C PHE A 100 -8.320 -0.476 -7.838 1.00 0.00 C ATOM 1534 O PHE A 100 -9.532 -0.674 -7.695 1.00 0.00 O ATOM 1535 CB PHE A 100 -6.652 -1.012 -6.021 1.00 0.00 C ATOM 1536 CG PHE A 100 -6.327 -2.120 -5.047 1.00 0.00 C ATOM 1537 CD1 PHE A 100 -7.305 -3.015 -4.642 1.00 0.00 C ATOM 1538 CD2 PHE A 100 -5.047 -2.256 -4.526 1.00 0.00 C ATOM 1539 CE1 PHE A 100 -7.015 -4.022 -3.740 1.00 0.00 C ATOM 1540 CE2 PHE A 100 -4.754 -3.257 -3.623 1.00 0.00 C ATOM 1541 CZ PHE A 100 -5.739 -4.142 -3.229 1.00 0.00 C ATOM 0 H PHE A 100 -5.347 -1.333 -8.082 1.00 0.00 H new ATOM 0 HA PHE A 100 -7.808 -2.434 -7.142 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -5.736 -0.470 -6.256 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -7.325 -0.305 -5.537 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -8.306 -2.925 -5.036 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -4.271 -1.570 -4.832 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -7.786 -4.714 -3.436 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -3.755 -3.349 -3.224 1.00 0.00 H new ATOM 0 HZ PHE A 100 -5.511 -4.926 -2.522 1.00 0.00 H new ATOM 1551 N GLY A 101 -7.821 0.601 -8.442 1.00 0.00 N ATOM 1552 CA GLY A 101 -8.693 1.604 -9.032 1.00 0.00 C ATOM 1553 C GLY A 101 -9.613 1.010 -10.083 1.00 0.00 C ATOM 1554 O GLY A 101 -10.782 1.389 -10.191 1.00 0.00 O ATOM 0 H GLY A 101 -6.824 0.797 -8.533 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -9.291 2.071 -8.249 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -8.088 2.391 -9.483 1.00 0.00 H new ATOM 1558 N GLN A 102 -9.081 0.066 -10.859 1.00 0.00 N ATOM 1559 CA GLN A 102 -9.864 -0.633 -11.871 1.00 0.00 C ATOM 1560 C GLN A 102 -10.870 -1.572 -11.208 1.00 0.00 C ATOM 1561 O GLN A 102 -12.024 -1.659 -11.631 1.00 0.00 O ATOM 1562 CB GLN A 102 -8.948 -1.421 -12.820 1.00 0.00 C ATOM 1563 CG GLN A 102 -9.674 -2.011 -14.028 1.00 0.00 C ATOM 1564 CD GLN A 102 -10.515 -0.979 -14.768 1.00 0.00 C ATOM 1565 OE1 GLN A 102 -10.038 -0.315 -15.689 1.00 0.00 O ATOM 1566 NE2 GLN A 102 -11.770 -0.834 -14.367 1.00 0.00 N ATOM 0 H GLN A 102 -8.107 -0.231 -10.804 1.00 0.00 H new ATOM 0 HA GLN A 102 -10.408 0.109 -12.456 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -8.152 -0.764 -13.171 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -8.472 -2.229 -12.264 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -8.942 -2.437 -14.714 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -10.316 -2.828 -13.698 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -12.129 -1.403 -13.600 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -12.376 -0.154 -14.825 1.00 0.00 H new ATOM 1575 N TYR A 103 -10.423 -2.264 -10.161 1.00 0.00 N ATOM 1576 CA TYR A 103 -11.293 -3.157 -9.394 1.00 0.00 C ATOM 1577 C TYR A 103 -12.392 -2.354 -8.698 1.00 0.00 C ATOM 1578 O TYR A 103 -13.415 -2.904 -8.293 1.00 0.00 O ATOM 1579 CB TYR A 103 -10.479 -3.957 -8.366 1.00 0.00 C ATOM 1580 CG TYR A 103 -11.145 -5.252 -7.933 1.00 0.00 C ATOM 1581 CD1 TYR A 103 -11.612 -6.167 -8.876 1.00 0.00 C ATOM 1582 CD2 TYR A 103 -11.312 -5.562 -6.586 1.00 0.00 C ATOM 1583 CE1 TYR A 103 -12.221 -7.345 -8.489 1.00 0.00 C ATOM 1584 CE2 TYR A 103 -11.919 -6.740 -6.193 1.00 0.00 C ATOM 1585 CZ TYR A 103 -12.372 -7.628 -7.149 1.00 0.00 C ATOM 1586 OH TYR A 103 -12.983 -8.800 -6.764 1.00 0.00 O ATOM 0 H TYR A 103 -9.461 -2.224 -9.823 1.00 0.00 H new ATOM 0 HA TYR A 103 -11.758 -3.862 -10.083 1.00 0.00 H new ATOM 0 HB2 TYR A 103 -9.501 -4.186 -8.789 1.00 0.00 H new ATOM 0 HB3 TYR A 103 -10.309 -3.335 -7.487 1.00 0.00 H new ATOM 0 HD1 TYR A 103 -11.495 -5.951 -9.928 1.00 0.00 H new ATOM 0 HD2 TYR A 103 -10.961 -4.870 -5.835 1.00 0.00 H new ATOM 0 HE1 TYR A 103 -12.577 -8.041 -9.234 1.00 0.00 H new ATOM 0 HE2 TYR A 103 -12.038 -6.965 -5.143 1.00 0.00 H new ATOM 0 HH TYR A 103 -12.821 -9.491 -7.440 1.00 0.00 H new ATOM 1596 N SER A 104 -12.145 -1.053 -8.561 1.00 0.00 N ATOM 1597 CA SER A 104 -13.133 -0.101 -8.061 1.00 0.00 C ATOM 1598 C SER A 104 -13.364 -0.252 -6.558 1.00 0.00 C ATOM 1599 O SER A 104 -14.491 -0.129 -6.072 1.00 0.00 O ATOM 1600 CB SER A 104 -14.452 -0.226 -8.843 1.00 0.00 C ATOM 1601 OG SER A 104 -14.210 -0.226 -10.244 1.00 0.00 O ATOM 0 H SER A 104 -11.248 -0.628 -8.795 1.00 0.00 H new ATOM 0 HA SER A 104 -12.733 0.900 -8.221 1.00 0.00 H new ATOM 0 HB2 SER A 104 -14.963 -1.145 -8.558 1.00 0.00 H new ATOM 0 HB3 SER A 104 -15.114 0.601 -8.584 1.00 0.00 H new ATOM 0 HG SER A 104 -15.061 -0.308 -10.723 1.00 0.00 H new ATOM 1607 N ILE A 105 -12.284 -0.518 -5.827 1.00 0.00 N ATOM 1608 CA ILE A 105 -12.328 -0.501 -4.364 1.00 0.00 C ATOM 1609 C ILE A 105 -12.346 0.953 -3.879 1.00 0.00 C ATOM 1610 O ILE A 105 -12.079 1.867 -4.666 1.00 0.00 O ATOM 1611 CB ILE A 105 -11.144 -1.297 -3.725 1.00 0.00 C ATOM 1612 CG1 ILE A 105 -9.939 -0.391 -3.395 1.00 0.00 C ATOM 1613 CG2 ILE A 105 -10.721 -2.448 -4.634 1.00 0.00 C ATOM 1614 CD1 ILE A 105 -9.367 0.354 -4.581 1.00 0.00 C ATOM 0 H ILE A 105 -11.371 -0.747 -6.220 1.00 0.00 H new ATOM 0 HA ILE A 105 -13.240 -1.004 -4.042 1.00 0.00 H new ATOM 0 HB ILE A 105 -11.503 -1.706 -2.781 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -10.242 0.334 -2.639 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -9.152 -1.002 -2.953 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -9.896 -2.991 -4.173 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -11.563 -3.124 -4.781 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -10.401 -2.052 -5.598 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -8.525 0.965 -4.255 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -9.028 -0.361 -5.331 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -10.135 0.996 -5.013 1.00 0.00 H new ATOM 1626 N PHE A 106 -12.658 1.184 -2.610 1.00 0.00 N ATOM 1627 CA PHE A 106 -12.790 2.553 -2.120 1.00 0.00 C ATOM 1628 C PHE A 106 -11.409 3.189 -1.939 1.00 0.00 C ATOM 1629 O PHE A 106 -10.651 2.819 -1.042 1.00 0.00 O ATOM 1630 CB PHE A 106 -13.587 2.604 -0.804 1.00 0.00 C ATOM 1631 CG PHE A 106 -14.202 3.957 -0.492 1.00 0.00 C ATOM 1632 CD1 PHE A 106 -13.610 5.139 -0.925 1.00 0.00 C ATOM 1633 CD2 PHE A 106 -15.374 4.041 0.244 1.00 0.00 C ATOM 1634 CE1 PHE A 106 -14.172 6.365 -0.632 1.00 0.00 C ATOM 1635 CE2 PHE A 106 -15.940 5.265 0.540 1.00 0.00 C ATOM 1636 CZ PHE A 106 -15.338 6.427 0.102 1.00 0.00 C ATOM 0 H PHE A 106 -12.822 0.458 -1.912 1.00 0.00 H new ATOM 0 HA PHE A 106 -13.344 3.124 -2.865 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -14.382 1.859 -0.846 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -12.928 2.321 0.017 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -12.696 5.097 -1.499 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -15.851 3.136 0.591 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -13.700 7.273 -0.977 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -16.854 5.313 1.114 1.00 0.00 H new ATOM 0 HZ PHE A 106 -15.780 7.385 0.334 1.00 0.00 H new ATOM 1646 N GLU A 107 -11.095 4.139 -2.809 1.00 0.00 N ATOM 1647 CA GLU A 107 -9.860 4.905 -2.708 1.00 0.00 C ATOM 1648 C GLU A 107 -10.107 6.136 -1.837 1.00 0.00 C ATOM 1649 O GLU A 107 -10.681 7.129 -2.296 1.00 0.00 O ATOM 1650 CB GLU A 107 -9.379 5.317 -4.110 1.00 0.00 C ATOM 1651 CG GLU A 107 -8.009 5.986 -4.128 1.00 0.00 C ATOM 1652 CD GLU A 107 -7.719 6.686 -5.446 1.00 0.00 C ATOM 1653 OE1 GLU A 107 -7.439 5.997 -6.449 1.00 0.00 O ATOM 1654 OE2 GLU A 107 -7.770 7.936 -5.488 1.00 0.00 O ATOM 0 H GLU A 107 -11.684 4.399 -3.600 1.00 0.00 H new ATOM 0 HA GLU A 107 -9.082 4.294 -2.250 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -9.347 4.432 -4.746 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -10.109 5.998 -4.547 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -7.951 6.710 -3.316 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -7.240 5.236 -3.942 1.00 0.00 H new ATOM 1661 N TYR A 108 -9.704 6.049 -0.572 1.00 0.00 N ATOM 1662 CA TYR A 108 -9.910 7.132 0.386 1.00 0.00 C ATOM 1663 C TYR A 108 -8.572 7.766 0.748 1.00 0.00 C ATOM 1664 O TYR A 108 -7.717 7.127 1.354 1.00 0.00 O ATOM 1665 CB TYR A 108 -10.609 6.603 1.651 1.00 0.00 C ATOM 1666 CG TYR A 108 -11.010 7.690 2.636 1.00 0.00 C ATOM 1667 CD1 TYR A 108 -12.226 8.356 2.512 1.00 0.00 C ATOM 1668 CD2 TYR A 108 -10.173 8.047 3.689 1.00 0.00 C ATOM 1669 CE1 TYR A 108 -12.593 9.345 3.405 1.00 0.00 C ATOM 1670 CE2 TYR A 108 -10.534 9.035 4.587 1.00 0.00 C ATOM 1671 CZ TYR A 108 -11.745 9.681 4.441 1.00 0.00 C ATOM 1672 OH TYR A 108 -12.111 10.668 5.334 1.00 0.00 O ATOM 0 H TYR A 108 -9.230 5.233 -0.184 1.00 0.00 H new ATOM 0 HA TYR A 108 -10.548 7.889 -0.070 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -11.499 6.047 1.356 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -9.945 5.899 2.153 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -12.894 8.096 1.704 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -9.225 7.544 3.807 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -13.539 9.853 3.293 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -9.872 9.300 5.398 1.00 0.00 H new ATOM 0 HH TYR A 108 -11.404 10.782 6.003 1.00 0.00 H new ATOM 1682 N GLU A 109 -8.393 9.021 0.368 1.00 0.00 N ATOM 1683 CA GLU A 109 -7.149 9.734 0.626 1.00 0.00 C ATOM 1684 C GLU A 109 -7.278 10.593 1.882 1.00 0.00 C ATOM 1685 O GLU A 109 -8.062 11.545 1.917 1.00 0.00 O ATOM 1686 CB GLU A 109 -6.762 10.613 -0.578 1.00 0.00 C ATOM 1687 CG GLU A 109 -7.303 10.114 -1.922 1.00 0.00 C ATOM 1688 CD GLU A 109 -8.618 10.774 -2.319 1.00 0.00 C ATOM 1689 OE1 GLU A 109 -9.604 10.663 -1.561 1.00 0.00 O ATOM 1690 OE2 GLU A 109 -8.674 11.406 -3.395 1.00 0.00 O ATOM 0 H GLU A 109 -9.098 9.571 -0.123 1.00 0.00 H new ATOM 0 HA GLU A 109 -6.362 8.996 0.782 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -7.127 11.626 -0.406 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -5.675 10.671 -0.636 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -6.561 10.301 -2.698 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -7.446 9.035 -1.871 1.00 0.00 H new ATOM 1697 N VAL A 110 -6.520 10.241 2.912 1.00 0.00 N ATOM 1698 CA VAL A 110 -6.467 11.031 4.137 1.00 0.00 C ATOM 1699 C VAL A 110 -5.398 12.106 3.988 1.00 0.00 C ATOM 1700 O VAL A 110 -4.206 11.805 3.849 1.00 0.00 O ATOM 1701 CB VAL A 110 -6.177 10.161 5.397 1.00 0.00 C ATOM 1702 CG1 VAL A 110 -5.212 9.022 5.074 1.00 0.00 C ATOM 1703 CG2 VAL A 110 -5.644 11.019 6.551 1.00 0.00 C ATOM 0 H VAL A 110 -5.930 9.409 2.924 1.00 0.00 H new ATOM 0 HA VAL A 110 -7.447 11.485 4.286 1.00 0.00 H new ATOM 0 HB VAL A 110 -7.121 9.718 5.715 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -5.030 8.434 5.973 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -5.647 8.384 4.305 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -4.270 9.435 4.713 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -5.451 10.385 7.416 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -4.719 11.507 6.244 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -6.383 11.776 6.813 1.00 0.00 H new ATOM 1713 N GLU A 111 -5.828 13.357 3.993 1.00 0.00 N ATOM 1714 CA GLU A 111 -4.925 14.472 3.781 1.00 0.00 C ATOM 1715 C GLU A 111 -4.600 15.176 5.091 1.00 0.00 C ATOM 1716 O GLU A 111 -5.472 15.393 5.936 1.00 0.00 O ATOM 1717 CB GLU A 111 -5.525 15.473 2.787 1.00 0.00 C ATOM 1718 CG GLU A 111 -6.928 15.946 3.155 1.00 0.00 C ATOM 1719 CD GLU A 111 -7.417 17.070 2.258 1.00 0.00 C ATOM 1720 OE1 GLU A 111 -7.026 18.234 2.488 1.00 0.00 O ATOM 1721 OE2 GLU A 111 -8.183 16.797 1.309 1.00 0.00 O ATOM 0 H GLU A 111 -6.801 13.625 4.142 1.00 0.00 H new ATOM 0 HA GLU A 111 -4.000 14.071 3.367 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -4.867 16.339 2.717 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -5.555 15.015 1.798 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -7.620 15.106 3.090 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -6.934 16.284 4.191 1.00 0.00 H new ATOM 1728 N HIS A 112 -3.335 15.506 5.254 1.00 0.00 N ATOM 1729 CA HIS A 112 -2.885 16.342 6.353 1.00 0.00 C ATOM 1730 C HIS A 112 -2.993 17.807 5.905 1.00 0.00 C ATOM 1731 O HIS A 112 -3.335 18.058 4.742 1.00 0.00 O ATOM 1732 CB HIS A 112 -1.444 15.945 6.726 1.00 0.00 C ATOM 1733 CG HIS A 112 -1.356 14.951 7.851 1.00 0.00 C ATOM 1734 ND1 HIS A 112 -0.202 14.284 8.199 1.00 0.00 N ATOM 1735 CD2 HIS A 112 -2.312 14.511 8.711 1.00 0.00 C ATOM 1736 CE1 HIS A 112 -0.483 13.481 9.233 1.00 0.00 C ATOM 1737 NE2 HIS A 112 -1.752 13.581 9.583 1.00 0.00 N ATOM 0 H HIS A 112 -2.588 15.203 4.629 1.00 0.00 H new ATOM 0 HA HIS A 112 -3.499 16.209 7.244 1.00 0.00 H new ATOM 0 HB2 HIS A 112 -0.954 15.527 5.847 1.00 0.00 H new ATOM 0 HB3 HIS A 112 -0.891 16.842 7.003 1.00 0.00 H new ATOM 0 HD1 HIS A 112 0.707 14.384 7.748 1.00 0.00 H new ATOM 0 HD2 HIS A 112 -3.343 14.832 8.717 1.00 0.00 H new ATOM 0 HE1 HIS A 112 0.235 12.836 9.717 1.00 0.00 H new ATOM 1745 N PRO A 113 -2.740 18.800 6.792 1.00 0.00 N ATOM 1746 CA PRO A 113 -2.861 20.219 6.426 1.00 0.00 C ATOM 1747 C PRO A 113 -2.128 20.555 5.123 1.00 0.00 C ATOM 1748 O PRO A 113 -1.223 19.827 4.699 1.00 0.00 O ATOM 1749 CB PRO A 113 -2.251 20.961 7.619 1.00 0.00 C ATOM 1750 CG PRO A 113 -2.410 20.025 8.771 1.00 0.00 C ATOM 1751 CD PRO A 113 -2.332 18.631 8.204 1.00 0.00 C ATOM 0 HA PRO A 113 -3.896 20.501 6.234 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -1.202 21.198 7.443 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -2.764 21.905 7.802 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -1.628 20.186 9.513 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -3.364 20.187 9.273 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -1.324 18.223 8.283 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -2.995 17.947 8.733 1.00 0.00 H new ATOM 1759 N GLU A 114 -2.525 21.668 4.513 1.00 0.00 N ATOM 1760 CA GLU A 114 -2.084 22.046 3.163 1.00 0.00 C ATOM 1761 C GLU A 114 -0.577 21.851 2.930 1.00 0.00 C ATOM 1762 O GLU A 114 -0.180 21.021 2.108 1.00 0.00 O ATOM 1763 CB GLU A 114 -2.489 23.502 2.834 1.00 0.00 C ATOM 1764 CG GLU A 114 -2.964 24.322 4.034 1.00 0.00 C ATOM 1765 CD GLU A 114 -1.818 24.899 4.849 1.00 0.00 C ATOM 1766 OE1 GLU A 114 -1.259 24.171 5.697 1.00 0.00 O ATOM 1767 OE2 GLU A 114 -1.477 26.083 4.648 1.00 0.00 O ATOM 0 H GLU A 114 -3.164 22.340 4.938 1.00 0.00 H new ATOM 0 HA GLU A 114 -2.596 21.364 2.484 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -1.636 24.008 2.381 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -3.283 23.484 2.087 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -3.599 25.136 3.683 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -3.579 23.692 4.677 1.00 0.00 H new ATOM 1774 N ASN A 115 0.268 22.602 3.639 1.00 0.00 N ATOM 1775 CA ASN A 115 1.694 22.646 3.288 1.00 0.00 C ATOM 1776 C ASN A 115 2.594 21.636 4.027 1.00 0.00 C ATOM 1777 O ASN A 115 3.712 21.399 3.564 1.00 0.00 O ATOM 1778 CB ASN A 115 2.280 24.054 3.415 1.00 0.00 C ATOM 1779 CG ASN A 115 3.583 24.194 2.627 1.00 0.00 C ATOM 1780 OD1 ASN A 115 3.795 23.300 1.651 1.00 0.00 O flip ATOM 1781 ND2 ASN A 115 4.389 25.090 2.886 1.00 0.00 N flip ATOM 0 H ASN A 115 0.002 23.175 4.440 1.00 0.00 H new ATOM 0 HA ASN A 115 1.699 22.339 2.242 1.00 0.00 H new ATOM 0 HB2 ASN A 115 1.556 24.784 3.054 1.00 0.00 H new ATOM 0 HB3 ASN A 115 2.463 24.279 4.466 1.00 0.00 H new ATOM 0 HD21 ASN A 115 4.192 25.752 3.637 1.00 0.00 H new ATOM 0 HD22 ASN A 115 5.253 25.170 2.350 1.00 0.00 H new ATOM 1788 N PRO A 116 2.192 21.034 5.177 1.00 0.00 N ATOM 1789 CA PRO A 116 2.913 19.869 5.723 1.00 0.00 C ATOM 1790 C PRO A 116 3.259 18.844 4.635 1.00 0.00 C ATOM 1791 O PRO A 116 4.114 17.977 4.826 1.00 0.00 O ATOM 1792 CB PRO A 116 1.918 19.300 6.729 1.00 0.00 C ATOM 1793 CG PRO A 116 1.228 20.509 7.255 1.00 0.00 C ATOM 1794 CD PRO A 116 1.102 21.459 6.082 1.00 0.00 C ATOM 0 HA PRO A 116 3.874 20.133 6.164 1.00 0.00 H new ATOM 0 HB2 PRO A 116 1.218 18.612 6.256 1.00 0.00 H new ATOM 0 HB3 PRO A 116 2.421 18.747 7.523 1.00 0.00 H new ATOM 0 HG2 PRO A 116 0.248 20.255 7.659 1.00 0.00 H new ATOM 0 HG3 PRO A 116 1.799 20.963 8.065 1.00 0.00 H new ATOM 0 HD2 PRO A 116 0.127 21.377 5.602 1.00 0.00 H new ATOM 0 HD3 PRO A 116 1.219 22.497 6.392 1.00 0.00 H new ATOM 1802 N ASN A 117 2.551 18.944 3.505 1.00 0.00 N ATOM 1803 CA ASN A 117 2.912 18.250 2.267 1.00 0.00 C ATOM 1804 C ASN A 117 2.612 16.750 2.353 1.00 0.00 C ATOM 1805 O ASN A 117 3.049 15.969 1.504 1.00 0.00 O ATOM 1806 CB ASN A 117 4.400 18.479 1.922 1.00 0.00 C ATOM 1807 CG ASN A 117 4.618 18.849 0.462 1.00 0.00 C ATOM 1808 OD1 ASN A 117 3.909 18.375 -0.426 1.00 0.00 O ATOM 1809 ND2 ASN A 117 5.590 19.712 0.205 1.00 0.00 N ATOM 0 H ASN A 117 1.707 19.512 3.424 1.00 0.00 H new ATOM 0 HA ASN A 117 2.299 18.670 1.469 1.00 0.00 H new ATOM 0 HB2 ASN A 117 4.797 19.272 2.556 1.00 0.00 H new ATOM 0 HB3 ASN A 117 4.964 17.575 2.151 1.00 0.00 H new ATOM 0 HD21 ASN A 117 5.771 20.005 -0.755 1.00 0.00 H new ATOM 0 HD22 ASN A 117 6.157 20.083 0.967 1.00 0.00 H new ATOM 1816 N GLU A 118 1.869 16.350 3.382 1.00 0.00 N ATOM 1817 CA GLU A 118 1.572 14.938 3.616 1.00 0.00 C ATOM 1818 C GLU A 118 0.143 14.601 3.192 1.00 0.00 C ATOM 1819 O GLU A 118 -0.821 15.195 3.679 1.00 0.00 O ATOM 1820 CB GLU A 118 1.785 14.580 5.095 1.00 0.00 C ATOM 1821 CG GLU A 118 3.255 14.431 5.485 1.00 0.00 C ATOM 1822 CD GLU A 118 3.451 13.979 6.925 1.00 0.00 C ATOM 1823 OE1 GLU A 118 2.592 14.286 7.780 1.00 0.00 O ATOM 1824 OE2 GLU A 118 4.473 13.317 7.217 1.00 0.00 O ATOM 0 H GLU A 118 1.461 16.984 4.068 1.00 0.00 H new ATOM 0 HA GLU A 118 2.257 14.346 3.009 1.00 0.00 H new ATOM 0 HB2 GLU A 118 1.330 15.352 5.716 1.00 0.00 H new ATOM 0 HB3 GLU A 118 1.264 13.648 5.313 1.00 0.00 H new ATOM 0 HG2 GLU A 118 3.730 13.712 4.818 1.00 0.00 H new ATOM 0 HG3 GLU A 118 3.761 15.385 5.338 1.00 0.00 H new ATOM 1831 N LYS A 119 0.024 13.646 2.277 1.00 0.00 N ATOM 1832 CA LYS A 119 -1.270 13.168 1.802 1.00 0.00 C ATOM 1833 C LYS A 119 -1.195 11.661 1.565 1.00 0.00 C ATOM 1834 O LYS A 119 -0.521 11.206 0.638 1.00 0.00 O ATOM 1835 CB LYS A 119 -1.669 13.900 0.509 1.00 0.00 C ATOM 1836 CG LYS A 119 -3.173 13.910 0.240 1.00 0.00 C ATOM 1837 CD LYS A 119 -3.507 14.543 -1.111 1.00 0.00 C ATOM 1838 CE LYS A 119 -3.123 16.023 -1.169 1.00 0.00 C ATOM 1839 NZ LYS A 119 -4.161 16.894 -0.556 1.00 0.00 N ATOM 0 H LYS A 119 0.821 13.181 1.843 1.00 0.00 H new ATOM 0 HA LYS A 119 -2.031 13.374 2.555 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -1.313 14.929 0.561 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -1.163 13.430 -0.334 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -3.553 12.889 0.266 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -3.680 14.459 1.033 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -2.986 14.003 -1.902 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -4.575 14.439 -1.305 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -2.175 16.172 -0.653 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -2.970 16.317 -2.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -3.860 17.888 -0.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -5.060 16.773 -1.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -4.289 16.632 0.442 1.00 0.00 H new ATOM 1853 N GLU A 120 -1.865 10.894 2.417 1.00 0.00 N ATOM 1854 CA GLU A 120 -1.802 9.439 2.357 1.00 0.00 C ATOM 1855 C GLU A 120 -3.040 8.877 1.664 1.00 0.00 C ATOM 1856 O GLU A 120 -4.166 9.269 1.969 1.00 0.00 O ATOM 1857 CB GLU A 120 -1.675 8.857 3.772 1.00 0.00 C ATOM 1858 CG GLU A 120 -1.465 7.345 3.805 1.00 0.00 C ATOM 1859 CD GLU A 120 -1.873 6.728 5.132 1.00 0.00 C ATOM 1860 OE1 GLU A 120 -1.024 6.658 6.049 1.00 0.00 O ATOM 1861 OE2 GLU A 120 -3.047 6.323 5.270 1.00 0.00 O ATOM 0 H GLU A 120 -2.461 11.258 3.161 1.00 0.00 H new ATOM 0 HA GLU A 120 -0.924 9.154 1.778 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -0.840 9.341 4.279 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -2.575 9.101 4.336 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -2.040 6.884 3.002 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -0.415 7.123 3.613 1.00 0.00 H new ATOM 1868 N VAL A 121 -2.824 7.963 0.727 1.00 0.00 N ATOM 1869 CA VAL A 121 -3.915 7.319 0.014 1.00 0.00 C ATOM 1870 C VAL A 121 -4.216 5.961 0.641 1.00 0.00 C ATOM 1871 O VAL A 121 -3.457 5.002 0.471 1.00 0.00 O ATOM 1872 CB VAL A 121 -3.590 7.137 -1.491 1.00 0.00 C ATOM 1873 CG1 VAL A 121 -4.805 6.603 -2.252 1.00 0.00 C ATOM 1874 CG2 VAL A 121 -3.105 8.455 -2.097 1.00 0.00 C ATOM 0 H VAL A 121 -1.896 7.650 0.443 1.00 0.00 H new ATOM 0 HA VAL A 121 -4.789 7.966 0.093 1.00 0.00 H new ATOM 0 HB VAL A 121 -2.790 6.403 -1.581 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -4.551 6.484 -3.305 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -5.098 5.638 -1.838 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -5.633 7.306 -2.155 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -2.881 8.309 -3.154 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -3.882 9.212 -1.992 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -2.205 8.785 -1.578 1.00 0.00 H new ATOM 1884 N THR A 122 -5.303 5.894 1.394 1.00 0.00 N ATOM 1885 CA THR A 122 -5.743 4.650 1.992 1.00 0.00 C ATOM 1886 C THR A 122 -6.584 3.854 0.994 1.00 0.00 C ATOM 1887 O THR A 122 -7.674 4.279 0.593 1.00 0.00 O ATOM 1888 CB THR A 122 -6.562 4.902 3.277 1.00 0.00 C ATOM 1889 OG1 THR A 122 -5.883 5.852 4.117 1.00 0.00 O ATOM 1890 CG2 THR A 122 -6.788 3.601 4.041 1.00 0.00 C ATOM 0 H THR A 122 -5.898 6.695 1.605 1.00 0.00 H new ATOM 0 HA THR A 122 -4.855 4.077 2.259 1.00 0.00 H new ATOM 0 HB THR A 122 -7.533 5.306 2.990 1.00 0.00 H new ATOM 0 HG1 THR A 122 -5.953 5.570 5.053 1.00 0.00 H new ATOM 0 HG21 THR A 122 -7.367 3.804 4.942 1.00 0.00 H new ATOM 0 HG22 THR A 122 -7.333 2.899 3.410 1.00 0.00 H new ATOM 0 HG23 THR A 122 -5.826 3.170 4.317 1.00 0.00 H new ATOM 1898 N ILE A 123 -6.068 2.703 0.590 1.00 0.00 N ATOM 1899 CA ILE A 123 -6.762 1.830 -0.336 1.00 0.00 C ATOM 1900 C ILE A 123 -7.674 0.885 0.436 1.00 0.00 C ATOM 1901 O ILE A 123 -7.220 -0.103 1.031 1.00 0.00 O ATOM 1902 CB ILE A 123 -5.763 1.015 -1.197 1.00 0.00 C ATOM 1903 CG1 ILE A 123 -4.905 1.958 -2.058 1.00 0.00 C ATOM 1904 CG2 ILE A 123 -6.500 0.003 -2.073 1.00 0.00 C ATOM 1905 CD1 ILE A 123 -5.706 2.804 -3.030 1.00 0.00 C ATOM 0 H ILE A 123 -5.160 2.352 0.895 1.00 0.00 H new ATOM 0 HA ILE A 123 -7.358 2.448 -1.007 1.00 0.00 H new ATOM 0 HB ILE A 123 -5.103 0.463 -0.527 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -4.337 2.617 -1.401 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -4.182 1.365 -2.618 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -5.778 -0.557 -2.668 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -7.061 -0.685 -1.441 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.187 0.528 -2.736 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -5.030 3.442 -3.600 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -6.254 2.154 -3.712 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -6.411 3.425 -2.477 1.00 0.00 H new ATOM 1917 N ARG A 124 -8.957 1.220 0.456 1.00 0.00 N ATOM 1918 CA ARG A 124 -9.954 0.416 1.136 1.00 0.00 C ATOM 1919 C ARG A 124 -10.461 -0.680 0.208 1.00 0.00 C ATOM 1920 O ARG A 124 -11.397 -0.472 -0.578 1.00 0.00 O ATOM 1921 CB ARG A 124 -11.117 1.291 1.618 1.00 0.00 C ATOM 1922 CG ARG A 124 -12.012 0.604 2.648 1.00 0.00 C ATOM 1923 CD ARG A 124 -13.496 0.731 2.318 1.00 0.00 C ATOM 1924 NE ARG A 124 -14.026 -0.450 1.635 1.00 0.00 N ATOM 1925 CZ ARG A 124 -14.243 -1.628 2.220 1.00 0.00 C ATOM 1926 NH1 ARG A 124 -13.940 -1.821 3.501 1.00 0.00 N ATOM 1927 NH2 ARG A 124 -14.774 -2.615 1.519 1.00 0.00 N ATOM 0 H ARG A 124 -9.331 2.053 0.002 1.00 0.00 H new ATOM 0 HA ARG A 124 -9.493 -0.047 2.008 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -10.716 2.208 2.051 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -11.722 1.582 0.759 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -11.746 -0.451 2.707 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -11.825 1.036 3.631 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -14.056 0.895 3.239 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -13.651 1.609 1.690 1.00 0.00 H new ATOM 0 HE ARG A 124 -14.245 -0.366 0.642 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -13.536 -1.062 4.049 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -14.112 -2.728 3.935 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -15.014 -2.472 0.538 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -14.943 -3.520 1.959 1.00 0.00 H new ATOM 1941 N ALA A 125 -9.828 -1.845 0.306 1.00 0.00 N ATOM 1942 CA ALA A 125 -10.221 -3.000 -0.482 1.00 0.00 C ATOM 1943 C ALA A 125 -11.585 -3.490 -0.017 1.00 0.00 C ATOM 1944 O ALA A 125 -11.941 -3.321 1.152 1.00 0.00 O ATOM 1945 CB ALA A 125 -9.177 -4.104 -0.366 1.00 0.00 C ATOM 0 H ALA A 125 -9.037 -2.011 0.928 1.00 0.00 H new ATOM 0 HA ALA A 125 -10.289 -2.715 -1.532 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -9.487 -4.962 -0.962 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -8.217 -3.737 -0.730 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -9.079 -4.404 0.677 1.00 0.00 H new ATOM 1951 N GLU A 126 -12.337 -4.107 -0.925 1.00 0.00 N ATOM 1952 CA GLU A 126 -13.733 -4.450 -0.663 1.00 0.00 C ATOM 1953 C GLU A 126 -13.871 -5.493 0.453 1.00 0.00 C ATOM 1954 O GLU A 126 -14.965 -5.722 0.962 1.00 0.00 O ATOM 1955 CB GLU A 126 -14.424 -4.910 -1.958 1.00 0.00 C ATOM 1956 CG GLU A 126 -15.071 -3.765 -2.743 1.00 0.00 C ATOM 1957 CD GLU A 126 -16.074 -2.967 -1.915 1.00 0.00 C ATOM 1958 OE1 GLU A 126 -15.643 -2.128 -1.087 1.00 0.00 O ATOM 1959 OE2 GLU A 126 -17.295 -3.182 -2.083 1.00 0.00 O ATOM 0 H GLU A 126 -12.003 -4.380 -1.849 1.00 0.00 H new ATOM 0 HA GLU A 126 -14.236 -3.550 -0.308 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -13.692 -5.408 -2.594 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -15.187 -5.648 -1.711 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -14.292 -3.094 -3.105 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -15.574 -4.172 -3.620 1.00 0.00 H new ATOM 1966 N ASP A 127 -12.755 -6.089 0.849 1.00 0.00 N ATOM 1967 CA ASP A 127 -12.724 -7.023 1.973 1.00 0.00 C ATOM 1968 C ASP A 127 -11.399 -6.872 2.715 1.00 0.00 C ATOM 1969 O ASP A 127 -10.407 -6.415 2.135 1.00 0.00 O ATOM 1970 CB ASP A 127 -12.918 -8.477 1.503 1.00 0.00 C ATOM 1971 CG ASP A 127 -13.368 -9.419 2.616 1.00 0.00 C ATOM 1972 OD1 ASP A 127 -13.659 -8.938 3.739 1.00 0.00 O ATOM 1973 OD2 ASP A 127 -13.434 -10.643 2.366 1.00 0.00 O ATOM 0 H ASP A 127 -11.849 -5.942 0.405 1.00 0.00 H new ATOM 0 HA ASP A 127 -13.549 -6.787 2.645 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -13.655 -8.496 0.701 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -11.981 -8.844 1.084 1.00 0.00 H new ATOM 1978 N CYS A 128 -11.389 -7.253 3.985 1.00 0.00 N ATOM 1979 CA CYS A 128 -10.227 -7.053 4.844 1.00 0.00 C ATOM 1980 C CYS A 128 -9.055 -7.935 4.414 1.00 0.00 C ATOM 1981 O CYS A 128 -9.216 -9.134 4.173 1.00 0.00 O ATOM 1982 CB CYS A 128 -10.586 -7.343 6.308 1.00 0.00 C ATOM 1983 SG CYS A 128 -9.141 -7.526 7.409 1.00 0.00 S ATOM 0 H CYS A 128 -12.178 -7.706 4.447 1.00 0.00 H new ATOM 0 HA CYS A 128 -9.923 -6.011 4.748 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -11.215 -6.536 6.683 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -11.180 -8.256 6.351 1.00 0.00 H new ATOM 1988 N GLY A 129 -7.875 -7.322 4.318 1.00 0.00 N ATOM 1989 CA GLY A 129 -6.655 -8.059 4.049 1.00 0.00 C ATOM 1990 C GLY A 129 -6.338 -8.165 2.574 1.00 0.00 C ATOM 1991 O GLY A 129 -5.756 -9.154 2.138 1.00 0.00 O ATOM 0 H GLY A 129 -7.745 -6.316 4.424 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -5.824 -7.572 4.559 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -6.743 -9.061 4.468 1.00 0.00 H new ATOM 1995 N CYS A 130 -6.697 -7.130 1.809 1.00 0.00 N ATOM 1996 CA CYS A 130 -6.421 -7.089 0.370 1.00 0.00 C ATOM 1997 C CYS A 130 -7.122 -8.253 -0.341 1.00 0.00 C ATOM 1998 O CYS A 130 -6.478 -9.198 -0.795 1.00 0.00 O ATOM 1999 CB CYS A 130 -4.900 -7.112 0.106 1.00 0.00 C ATOM 2000 SG CYS A 130 -3.892 -6.618 1.528 1.00 0.00 S ATOM 0 H CYS A 130 -7.182 -6.306 2.164 1.00 0.00 H new ATOM 0 HA CYS A 130 -6.816 -6.157 -0.034 1.00 0.00 H new ATOM 0 HB2 CYS A 130 -4.611 -8.118 -0.198 1.00 0.00 H new ATOM 0 HB3 CYS A 130 -4.678 -6.449 -0.730 1.00 0.00 H new ATOM 0 HG CYS A 130 -2.685 -7.079 1.385 1.00 0.00 H new ATOM 2006 N ILE A 131 -8.454 -8.155 -0.417 1.00 0.00 N ATOM 2007 CA ILE A 131 -9.319 -9.216 -0.963 1.00 0.00 C ATOM 2008 C ILE A 131 -8.721 -9.955 -2.187 1.00 0.00 C ATOM 2009 O ILE A 131 -8.608 -11.184 -2.151 1.00 0.00 O ATOM 2010 CB ILE A 131 -10.769 -8.685 -1.276 1.00 0.00 C ATOM 2011 CG1 ILE A 131 -11.358 -9.318 -2.553 1.00 0.00 C ATOM 2012 CG2 ILE A 131 -10.806 -7.158 -1.372 1.00 0.00 C ATOM 2013 CD1 ILE A 131 -12.745 -8.814 -2.909 1.00 0.00 C ATOM 0 H ILE A 131 -8.969 -7.333 -0.100 1.00 0.00 H new ATOM 0 HA ILE A 131 -9.386 -9.961 -0.170 1.00 0.00 H new ATOM 0 HB ILE A 131 -11.393 -8.989 -0.436 1.00 0.00 H new ATOM 0 HG12 ILE A 131 -10.685 -9.120 -3.388 1.00 0.00 H new ATOM 0 HG13 ILE A 131 -11.397 -10.400 -2.425 1.00 0.00 H new ATOM 0 HG21 ILE A 131 -11.823 -6.832 -1.589 1.00 0.00 H new ATOM 0 HG22 ILE A 131 -10.480 -6.726 -0.426 1.00 0.00 H new ATOM 0 HG23 ILE A 131 -10.141 -6.827 -2.170 1.00 0.00 H new ATOM 0 HD11 ILE A 131 -13.089 -9.307 -3.818 1.00 0.00 H new ATOM 0 HD12 ILE A 131 -13.433 -9.036 -2.093 1.00 0.00 H new ATOM 0 HD13 ILE A 131 -12.710 -7.737 -3.071 1.00 0.00 H new ATOM 2025 N PRO A 132 -8.316 -9.254 -3.281 1.00 0.00 N ATOM 2026 CA PRO A 132 -7.862 -9.908 -4.500 1.00 0.00 C ATOM 2027 C PRO A 132 -6.343 -10.100 -4.531 1.00 0.00 C ATOM 2028 O PRO A 132 -5.585 -9.154 -4.333 1.00 0.00 O ATOM 2029 CB PRO A 132 -8.314 -8.927 -5.598 1.00 0.00 C ATOM 2030 CG PRO A 132 -8.548 -7.605 -4.909 1.00 0.00 C ATOM 2031 CD PRO A 132 -8.239 -7.798 -3.441 1.00 0.00 C ATOM 0 HA PRO A 132 -8.267 -10.914 -4.609 1.00 0.00 H new ATOM 0 HB2 PRO A 132 -7.554 -8.833 -6.373 1.00 0.00 H new ATOM 0 HB3 PRO A 132 -9.224 -9.279 -6.085 1.00 0.00 H new ATOM 0 HG2 PRO A 132 -7.910 -6.831 -5.337 1.00 0.00 H new ATOM 0 HG3 PRO A 132 -9.579 -7.279 -5.044 1.00 0.00 H new ATOM 0 HD2 PRO A 132 -7.252 -7.414 -3.182 1.00 0.00 H new ATOM 0 HD3 PRO A 132 -8.959 -7.283 -2.805 1.00 0.00 H new ATOM 2039 N GLU A 133 -5.907 -11.325 -4.801 1.00 0.00 N ATOM 2040 CA GLU A 133 -4.481 -11.642 -4.884 1.00 0.00 C ATOM 2041 C GLU A 133 -3.923 -11.253 -6.255 1.00 0.00 C ATOM 2042 O GLU A 133 -2.714 -11.312 -6.491 1.00 0.00 O ATOM 2043 CB GLU A 133 -4.252 -13.141 -4.627 1.00 0.00 C ATOM 2044 CG GLU A 133 -4.891 -13.660 -3.335 1.00 0.00 C ATOM 2045 CD GLU A 133 -6.380 -13.958 -3.466 1.00 0.00 C ATOM 2046 OE1 GLU A 133 -6.893 -14.006 -4.603 1.00 0.00 O ATOM 2047 OE2 GLU A 133 -7.047 -14.149 -2.429 1.00 0.00 O ATOM 0 H GLU A 133 -6.523 -12.121 -4.967 1.00 0.00 H new ATOM 0 HA GLU A 133 -3.956 -11.069 -4.120 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -4.649 -13.708 -5.469 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -3.180 -13.333 -4.592 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -4.374 -14.567 -3.023 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -4.745 -12.922 -2.546 1.00 0.00 H new ATOM 2054 N GLU A 134 -4.815 -10.853 -7.157 1.00 0.00 N ATOM 2055 CA GLU A 134 -4.435 -10.478 -8.519 1.00 0.00 C ATOM 2056 C GLU A 134 -3.963 -9.026 -8.588 1.00 0.00 C ATOM 2057 O GLU A 134 -3.519 -8.559 -9.636 1.00 0.00 O ATOM 2058 CB GLU A 134 -5.612 -10.709 -9.476 1.00 0.00 C ATOM 2059 CG GLU A 134 -6.218 -12.109 -9.366 1.00 0.00 C ATOM 2060 CD GLU A 134 -6.837 -12.593 -10.667 1.00 0.00 C ATOM 2061 OE1 GLU A 134 -6.122 -12.624 -11.690 1.00 0.00 O ATOM 2062 OE2 GLU A 134 -8.032 -12.949 -10.671 1.00 0.00 O ATOM 0 H GLU A 134 -5.815 -10.779 -6.968 1.00 0.00 H new ATOM 0 HA GLU A 134 -3.600 -11.109 -8.824 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -6.386 -9.969 -9.273 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -5.276 -10.546 -10.500 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -5.444 -12.811 -9.056 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -6.979 -12.109 -8.586 1.00 0.00 H new ATOM 2069 N VAL A 135 -4.060 -8.317 -7.467 1.00 0.00 N ATOM 2070 CA VAL A 135 -3.546 -6.950 -7.378 1.00 0.00 C ATOM 2071 C VAL A 135 -2.046 -6.967 -7.115 1.00 0.00 C ATOM 2072 O VAL A 135 -1.374 -5.938 -7.202 1.00 0.00 O ATOM 2073 CB VAL A 135 -4.244 -6.142 -6.259 1.00 0.00 C ATOM 2074 CG1 VAL A 135 -5.748 -6.086 -6.498 1.00 0.00 C ATOM 2075 CG2 VAL A 135 -3.920 -6.731 -4.885 1.00 0.00 C ATOM 0 H VAL A 135 -4.488 -8.664 -6.609 1.00 0.00 H new ATOM 0 HA VAL A 135 -3.754 -6.467 -8.332 1.00 0.00 H new ATOM 0 HB VAL A 135 -3.864 -5.121 -6.280 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -6.222 -5.514 -5.701 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -5.946 -5.606 -7.456 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -6.153 -7.098 -6.508 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -4.421 -6.148 -4.112 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -4.265 -7.764 -4.841 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -2.843 -6.701 -4.721 1.00 0.00 H new ATOM 2085 N ILE A 136 -1.525 -8.154 -6.824 1.00 0.00 N ATOM 2086 CA ILE A 136 -0.122 -8.318 -6.488 1.00 0.00 C ATOM 2087 C ILE A 136 0.680 -8.482 -7.768 1.00 0.00 C ATOM 2088 O ILE A 136 0.867 -9.596 -8.265 1.00 0.00 O ATOM 2089 CB ILE A 136 0.112 -9.557 -5.581 1.00 0.00 C ATOM 2090 CG1 ILE A 136 -0.865 -9.564 -4.391 1.00 0.00 C ATOM 2091 CG2 ILE A 136 1.561 -9.601 -5.095 1.00 0.00 C ATOM 2092 CD1 ILE A 136 -0.683 -8.405 -3.432 1.00 0.00 C ATOM 0 H ILE A 136 -2.062 -9.021 -6.815 1.00 0.00 H new ATOM 0 HA ILE A 136 0.200 -7.432 -5.940 1.00 0.00 H new ATOM 0 HB ILE A 136 -0.078 -10.452 -6.174 1.00 0.00 H new ATOM 0 HG12 ILE A 136 -1.886 -9.548 -4.773 1.00 0.00 H new ATOM 0 HG13 ILE A 136 -0.745 -10.498 -3.842 1.00 0.00 H new ATOM 0 HG21 ILE A 136 1.706 -10.476 -4.461 1.00 0.00 H new ATOM 0 HG22 ILE A 136 2.231 -9.660 -5.953 1.00 0.00 H new ATOM 0 HG23 ILE A 136 1.781 -8.699 -4.524 1.00 0.00 H new ATOM 0 HD11 ILE A 136 -1.409 -8.485 -2.623 1.00 0.00 H new ATOM 0 HD12 ILE A 136 0.325 -8.430 -3.018 1.00 0.00 H new ATOM 0 HD13 ILE A 136 -0.834 -7.466 -3.964 1.00 0.00 H new ATOM 2104 N ILE A 137 1.129 -7.357 -8.309 1.00 0.00 N ATOM 2105 CA ILE A 137 1.887 -7.359 -9.548 1.00 0.00 C ATOM 2106 C ILE A 137 3.192 -8.101 -9.347 1.00 0.00 C ATOM 2107 O ILE A 137 3.663 -8.799 -10.248 1.00 0.00 O ATOM 2108 CB ILE A 137 2.185 -5.928 -10.080 1.00 0.00 C ATOM 2109 CG1 ILE A 137 2.564 -4.976 -8.931 1.00 0.00 C ATOM 2110 CG2 ILE A 137 0.987 -5.387 -10.860 1.00 0.00 C ATOM 2111 CD1 ILE A 137 3.161 -3.660 -9.393 1.00 0.00 C ATOM 0 H ILE A 137 0.980 -6.432 -7.907 1.00 0.00 H new ATOM 0 HA ILE A 137 1.271 -7.860 -10.295 1.00 0.00 H new ATOM 0 HB ILE A 137 3.038 -5.989 -10.756 1.00 0.00 H new ATOM 0 HG12 ILE A 137 1.675 -4.771 -8.335 1.00 0.00 H new ATOM 0 HG13 ILE A 137 3.278 -5.478 -8.277 1.00 0.00 H new ATOM 0 HG21 ILE A 137 1.213 -4.385 -11.225 1.00 0.00 H new ATOM 0 HG22 ILE A 137 0.777 -6.042 -11.705 1.00 0.00 H new ATOM 0 HG23 ILE A 137 0.115 -5.347 -10.207 1.00 0.00 H new ATOM 0 HD11 ILE A 137 3.401 -3.045 -8.526 1.00 0.00 H new ATOM 0 HD12 ILE A 137 4.069 -3.853 -9.964 1.00 0.00 H new ATOM 0 HD13 ILE A 137 2.442 -3.135 -10.022 1.00 0.00 H new ATOM 2123 N ALA A 138 3.765 -7.974 -8.151 1.00 0.00 N ATOM 2124 CA ALA A 138 5.004 -8.675 -7.850 1.00 0.00 C ATOM 2125 C ALA A 138 5.174 -8.904 -6.356 1.00 0.00 C ATOM 2126 O ALA A 138 4.440 -8.346 -5.536 1.00 0.00 O ATOM 2127 CB ALA A 138 6.197 -7.908 -8.414 1.00 0.00 C ATOM 0 H ALA A 138 3.397 -7.403 -7.390 1.00 0.00 H new ATOM 0 HA ALA A 138 4.955 -9.654 -8.327 1.00 0.00 H new ATOM 0 HB1 ALA A 138 7.117 -8.444 -8.181 1.00 0.00 H new ATOM 0 HB2 ALA A 138 6.093 -7.818 -9.495 1.00 0.00 H new ATOM 0 HB3 ALA A 138 6.234 -6.914 -7.969 1.00 0.00 H new ATOM 2133 N LYS A 139 6.141 -9.746 -6.019 1.00 0.00 N ATOM 2134 CA LYS A 139 6.533 -9.974 -4.639 1.00 0.00 C ATOM 2135 C LYS A 139 8.012 -10.335 -4.587 1.00 0.00 C ATOM 2136 O LYS A 139 8.604 -10.730 -5.597 1.00 0.00 O ATOM 2137 CB LYS A 139 5.659 -11.063 -3.976 1.00 0.00 C ATOM 2138 CG LYS A 139 6.262 -12.476 -3.972 1.00 0.00 C ATOM 2139 CD LYS A 139 5.437 -13.449 -4.810 1.00 0.00 C ATOM 2140 CE LYS A 139 4.158 -13.902 -4.089 1.00 0.00 C ATOM 2141 NZ LYS A 139 4.156 -15.365 -3.808 1.00 0.00 N ATOM 0 H LYS A 139 6.675 -10.290 -6.697 1.00 0.00 H new ATOM 0 HA LYS A 139 6.375 -9.058 -4.070 1.00 0.00 H new ATOM 0 HB2 LYS A 139 5.459 -10.768 -2.946 1.00 0.00 H new ATOM 0 HB3 LYS A 139 4.698 -11.097 -4.490 1.00 0.00 H new ATOM 0 HG2 LYS A 139 7.280 -12.437 -4.358 1.00 0.00 H new ATOM 0 HG3 LYS A 139 6.324 -12.842 -2.947 1.00 0.00 H new ATOM 0 HD2 LYS A 139 5.170 -12.975 -5.755 1.00 0.00 H new ATOM 0 HD3 LYS A 139 6.044 -14.322 -5.051 1.00 0.00 H new ATOM 0 HE2 LYS A 139 4.058 -13.354 -3.152 1.00 0.00 H new ATOM 0 HE3 LYS A 139 3.291 -13.650 -4.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 3.290 -15.618 -3.291 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 4.190 -15.891 -4.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 4.987 -15.609 -3.232 1.00 0.00 H new ATOM 2155 N GLU A 140 8.598 -10.181 -3.417 1.00 0.00 N ATOM 2156 CA GLU A 140 10.028 -10.383 -3.213 1.00 0.00 C ATOM 2157 C GLU A 140 10.272 -11.059 -1.874 1.00 0.00 C ATOM 2158 O GLU A 140 9.410 -11.038 -0.996 1.00 0.00 O ATOM 2159 CB GLU A 140 10.773 -9.038 -3.242 1.00 0.00 C ATOM 2160 CG GLU A 140 10.750 -8.328 -4.593 1.00 0.00 C ATOM 2161 CD GLU A 140 11.829 -7.263 -4.706 1.00 0.00 C ATOM 2162 OE1 GLU A 140 12.982 -7.614 -5.041 1.00 0.00 O ATOM 2163 OE2 GLU A 140 11.536 -6.076 -4.442 1.00 0.00 O ATOM 0 H GLU A 140 8.096 -9.910 -2.571 1.00 0.00 H new ATOM 0 HA GLU A 140 10.402 -11.016 -4.018 1.00 0.00 H new ATOM 0 HB2 GLU A 140 10.335 -8.379 -2.492 1.00 0.00 H new ATOM 0 HB3 GLU A 140 11.810 -9.206 -2.952 1.00 0.00 H new ATOM 0 HG2 GLU A 140 10.883 -9.062 -5.388 1.00 0.00 H new ATOM 0 HG3 GLU A 140 9.773 -7.869 -4.743 1.00 0.00 H new ATOM 2170 N LEU A 141 11.444 -11.657 -1.724 1.00 0.00 N ATOM 2171 CA LEU A 141 11.887 -12.169 -0.435 1.00 0.00 C ATOM 2172 C LEU A 141 12.951 -11.236 0.125 1.00 0.00 C ATOM 2173 O LEU A 141 13.688 -10.601 -0.639 1.00 0.00 O ATOM 2174 CB LEU A 141 12.446 -13.595 -0.566 1.00 0.00 C ATOM 2175 CG LEU A 141 13.042 -14.184 0.735 1.00 0.00 C ATOM 2176 CD1 LEU A 141 12.544 -15.607 0.974 1.00 0.00 C ATOM 2177 CD2 LEU A 141 14.572 -14.143 0.711 1.00 0.00 C ATOM 0 H LEU A 141 12.109 -11.800 -2.484 1.00 0.00 H new ATOM 0 HA LEU A 141 11.034 -12.211 0.243 1.00 0.00 H new ATOM 0 HB2 LEU A 141 11.648 -14.252 -0.913 1.00 0.00 H new ATOM 0 HB3 LEU A 141 13.218 -13.598 -1.336 1.00 0.00 H new ATOM 0 HG LEU A 141 12.701 -13.563 1.563 1.00 0.00 H new ATOM 0 HD11 LEU A 141 12.979 -15.995 1.895 1.00 0.00 H new ATOM 0 HD12 LEU A 141 11.457 -15.603 1.060 1.00 0.00 H new ATOM 0 HD13 LEU A 141 12.839 -16.241 0.138 1.00 0.00 H new ATOM 0 HD21 LEU A 141 14.962 -14.563 1.638 1.00 0.00 H new ATOM 0 HD22 LEU A 141 14.938 -14.726 -0.134 1.00 0.00 H new ATOM 0 HD23 LEU A 141 14.907 -13.110 0.612 1.00 0.00 H new ATOM 2189 N ILE A 142 13.027 -11.138 1.444 1.00 0.00 N ATOM 2190 CA ILE A 142 14.032 -10.307 2.088 1.00 0.00 C ATOM 2191 C ILE A 142 14.601 -11.014 3.321 1.00 0.00 C ATOM 2192 O ILE A 142 13.855 -11.531 4.156 1.00 0.00 O ATOM 2193 CB ILE A 142 13.448 -8.921 2.449 1.00 0.00 C ATOM 2194 CG1 ILE A 142 14.552 -7.977 2.953 1.00 0.00 C ATOM 2195 CG2 ILE A 142 12.317 -9.047 3.463 1.00 0.00 C ATOM 2196 CD1 ILE A 142 14.097 -6.541 3.126 1.00 0.00 C ATOM 0 H ILE A 142 12.404 -11.624 2.089 1.00 0.00 H new ATOM 0 HA ILE A 142 14.851 -10.146 1.387 1.00 0.00 H new ATOM 0 HB ILE A 142 13.026 -8.486 1.543 1.00 0.00 H new ATOM 0 HG12 ILE A 142 14.926 -8.347 3.907 1.00 0.00 H new ATOM 0 HG13 ILE A 142 15.387 -8.002 2.252 1.00 0.00 H new ATOM 0 HG21 ILE A 142 11.926 -8.057 3.697 1.00 0.00 H new ATOM 0 HG22 ILE A 142 11.520 -9.662 3.045 1.00 0.00 H new ATOM 0 HG23 ILE A 142 12.695 -9.513 4.373 1.00 0.00 H new ATOM 0 HD11 ILE A 142 14.930 -5.936 3.484 1.00 0.00 H new ATOM 0 HD12 ILE A 142 13.750 -6.151 2.169 1.00 0.00 H new ATOM 0 HD13 ILE A 142 13.283 -6.502 3.850 1.00 0.00 H new ATOM 2208 N GLU A 143 15.929 -11.048 3.410 1.00 0.00 N ATOM 2209 CA GLU A 143 16.629 -11.808 4.447 1.00 0.00 C ATOM 2210 C GLU A 143 17.549 -10.894 5.263 1.00 0.00 C ATOM 2211 O GLU A 143 18.638 -11.299 5.682 1.00 0.00 O ATOM 2212 CB GLU A 143 17.434 -12.939 3.789 1.00 0.00 C ATOM 2213 CG GLU A 143 17.719 -14.124 4.706 1.00 0.00 C ATOM 2214 CD GLU A 143 18.498 -15.230 4.010 1.00 0.00 C ATOM 2215 OE1 GLU A 143 19.452 -14.912 3.265 1.00 0.00 O ATOM 2216 OE2 GLU A 143 18.165 -16.419 4.205 1.00 0.00 O ATOM 0 H GLU A 143 16.549 -10.552 2.769 1.00 0.00 H new ATOM 0 HA GLU A 143 15.897 -12.238 5.131 1.00 0.00 H new ATOM 0 HB2 GLU A 143 16.890 -13.295 2.914 1.00 0.00 H new ATOM 0 HB3 GLU A 143 18.381 -12.535 3.433 1.00 0.00 H new ATOM 0 HG2 GLU A 143 18.281 -13.780 5.574 1.00 0.00 H new ATOM 0 HG3 GLU A 143 16.776 -14.527 5.076 1.00 0.00 H new ATOM 2223 N ILE A 144 17.092 -9.661 5.480 1.00 0.00 N ATOM 2224 CA ILE A 144 17.839 -8.650 6.234 1.00 0.00 C ATOM 2225 C ILE A 144 19.178 -8.317 5.568 1.00 0.00 C ATOM 2226 O ILE A 144 19.279 -7.351 4.813 1.00 0.00 O ATOM 2227 CB ILE A 144 18.094 -9.080 7.709 1.00 0.00 C ATOM 2228 CG1 ILE A 144 16.788 -9.537 8.377 1.00 0.00 C ATOM 2229 CG2 ILE A 144 18.731 -7.937 8.502 1.00 0.00 C ATOM 2230 CD1 ILE A 144 16.986 -10.155 9.746 1.00 0.00 C ATOM 0 H ILE A 144 16.189 -9.332 5.137 1.00 0.00 H new ATOM 0 HA ILE A 144 17.211 -7.759 6.236 1.00 0.00 H new ATOM 0 HB ILE A 144 18.787 -9.922 7.702 1.00 0.00 H new ATOM 0 HG12 ILE A 144 16.119 -8.682 8.468 1.00 0.00 H new ATOM 0 HG13 ILE A 144 16.294 -10.261 7.730 1.00 0.00 H new ATOM 0 HG21 ILE A 144 18.901 -8.258 9.530 1.00 0.00 H new ATOM 0 HG22 ILE A 144 19.682 -7.663 8.045 1.00 0.00 H new ATOM 0 HG23 ILE A 144 18.064 -7.075 8.497 1.00 0.00 H new ATOM 0 HD11 ILE A 144 16.020 -10.453 10.154 1.00 0.00 H new ATOM 0 HD12 ILE A 144 17.629 -11.031 9.660 1.00 0.00 H new ATOM 0 HD13 ILE A 144 17.451 -9.427 10.410 1.00 0.00 H new ATOM 2242 N ASN A 145 20.192 -9.140 5.834 1.00 0.00 N ATOM 2243 CA ASN A 145 21.559 -8.844 5.415 1.00 0.00 C ATOM 2244 C ASN A 145 21.836 -9.342 4.000 1.00 0.00 C ATOM 2245 O ASN A 145 21.368 -10.409 3.592 1.00 0.00 O ATOM 2246 CB ASN A 145 22.569 -9.474 6.388 1.00 0.00 C ATOM 2247 CG ASN A 145 24.006 -9.079 6.072 1.00 0.00 C ATOM 2248 OD1 ASN A 145 24.461 -7.997 6.446 1.00 0.00 O ATOM 2249 ND2 ASN A 145 24.730 -9.948 5.381 1.00 0.00 N ATOM 0 H ASN A 145 20.090 -10.020 6.340 1.00 0.00 H new ATOM 0 HA ASN A 145 21.672 -7.760 5.424 1.00 0.00 H new ATOM 0 HB2 ASN A 145 22.327 -9.169 7.406 1.00 0.00 H new ATOM 0 HB3 ASN A 145 22.477 -10.559 6.350 1.00 0.00 H new ATOM 0 HD21 ASN A 145 25.697 -9.730 5.142 1.00 0.00 H new ATOM 0 HD22 ASN A 145 24.320 -10.835 5.088 1.00 0.00 H new ATOM 2256 N LEU A 146 22.612 -8.552 3.266 1.00 0.00 N ATOM 2257 CA LEU A 146 23.088 -8.920 1.936 1.00 0.00 C ATOM 2258 C LEU A 146 24.592 -8.664 1.857 1.00 0.00 C ATOM 2259 O LEU A 146 25.120 -7.851 2.621 1.00 0.00 O ATOM 2260 CB LEU A 146 22.309 -8.166 0.824 1.00 0.00 C ATOM 2261 CG LEU A 146 22.520 -6.630 0.678 1.00 0.00 C ATOM 2262 CD1 LEU A 146 22.595 -5.920 2.028 1.00 0.00 C ATOM 2263 CD2 LEU A 146 23.753 -6.312 -0.172 1.00 0.00 C ATOM 0 H LEU A 146 22.930 -7.634 3.577 1.00 0.00 H new ATOM 0 HA LEU A 146 22.904 -9.981 1.768 1.00 0.00 H new ATOM 0 HB2 LEU A 146 22.564 -8.627 -0.130 1.00 0.00 H new ATOM 0 HB3 LEU A 146 21.246 -8.340 0.988 1.00 0.00 H new ATOM 0 HG LEU A 146 21.640 -6.246 0.161 1.00 0.00 H new ATOM 0 HD11 LEU A 146 22.743 -4.852 1.870 1.00 0.00 H new ATOM 0 HD12 LEU A 146 21.666 -6.081 2.576 1.00 0.00 H new ATOM 0 HD13 LEU A 146 23.430 -6.320 2.604 1.00 0.00 H new ATOM 0 HD21 LEU A 146 23.870 -5.231 -0.253 1.00 0.00 H new ATOM 0 HD22 LEU A 146 24.639 -6.739 0.298 1.00 0.00 H new ATOM 0 HD23 LEU A 146 23.629 -6.739 -1.167 1.00 0.00 H new ATOM 2275 N GLU A 147 25.270 -9.359 0.939 1.00 0.00 N ATOM 2276 CA GLU A 147 26.731 -9.297 0.818 1.00 0.00 C ATOM 2277 C GLU A 147 27.388 -9.937 2.048 1.00 0.00 C ATOM 2278 O GLU A 147 27.241 -9.449 3.172 1.00 0.00 O ATOM 2279 CB GLU A 147 27.222 -7.846 0.621 1.00 0.00 C ATOM 2280 CG GLU A 147 28.265 -7.685 -0.488 1.00 0.00 C ATOM 2281 CD GLU A 147 29.667 -8.089 -0.049 1.00 0.00 C ATOM 2282 OE1 GLU A 147 29.901 -9.298 0.177 1.00 0.00 O ATOM 2283 OE2 GLU A 147 30.535 -7.203 0.081 1.00 0.00 O ATOM 0 H GLU A 147 24.825 -9.978 0.261 1.00 0.00 H new ATOM 0 HA GLU A 147 27.023 -9.860 -0.069 1.00 0.00 H new ATOM 0 HB2 GLU A 147 26.365 -7.211 0.394 1.00 0.00 H new ATOM 0 HB3 GLU A 147 27.646 -7.487 1.559 1.00 0.00 H new ATOM 0 HG2 GLU A 147 27.971 -8.289 -1.346 1.00 0.00 H new ATOM 0 HG3 GLU A 147 28.279 -6.646 -0.818 1.00 0.00 H new ATOM 2290 N HIS A 148 28.118 -11.026 1.825 1.00 0.00 N ATOM 2291 CA HIS A 148 28.693 -11.815 2.916 1.00 0.00 C ATOM 2292 C HIS A 148 29.772 -11.036 3.665 1.00 0.00 C ATOM 2293 O HIS A 148 30.031 -11.300 4.841 1.00 0.00 O ATOM 2294 CB HIS A 148 29.260 -13.136 2.377 1.00 0.00 C ATOM 2295 CG HIS A 148 28.202 -14.097 1.925 1.00 0.00 C ATOM 2296 ND1 HIS A 148 28.425 -15.077 0.983 1.00 0.00 N ATOM 2297 CD2 HIS A 148 26.901 -14.221 2.288 1.00 0.00 C ATOM 2298 CE1 HIS A 148 27.313 -15.757 0.783 1.00 0.00 C ATOM 2299 NE2 HIS A 148 26.373 -15.258 1.562 1.00 0.00 N ATOM 0 H HIS A 148 28.328 -11.386 0.894 1.00 0.00 H new ATOM 0 HA HIS A 148 27.894 -12.035 3.624 1.00 0.00 H new ATOM 0 HB2 HIS A 148 29.927 -12.923 1.542 1.00 0.00 H new ATOM 0 HB3 HIS A 148 29.862 -13.608 3.153 1.00 0.00 H new ATOM 0 HD2 HIS A 148 26.378 -13.616 3.014 1.00 0.00 H new ATOM 0 HE1 HIS A 148 27.192 -16.583 0.097 1.00 0.00 H new ATOM 0 HE2 HIS A 148 25.410 -15.589 1.616 1.00 0.00 H new ATOM 2308 N HIS A 149 30.400 -10.075 2.992 1.00 0.00 N ATOM 2309 CA HIS A 149 31.404 -9.229 3.638 1.00 0.00 C ATOM 2310 C HIS A 149 30.729 -8.291 4.634 1.00 0.00 C ATOM 2311 O HIS A 149 31.364 -7.805 5.572 1.00 0.00 O ATOM 2312 CB HIS A 149 32.189 -8.411 2.604 1.00 0.00 C ATOM 2313 CG HIS A 149 32.963 -9.242 1.621 1.00 0.00 C ATOM 2314 ND1 HIS A 149 33.649 -10.390 1.965 1.00 0.00 N ATOM 2315 CD2 HIS A 149 33.164 -9.074 0.294 1.00 0.00 C ATOM 2316 CE1 HIS A 149 34.237 -10.886 0.892 1.00 0.00 C ATOM 2317 NE2 HIS A 149 33.957 -10.107 -0.132 1.00 0.00 N ATOM 0 H HIS A 149 30.235 -9.863 2.008 1.00 0.00 H new ATOM 0 HA HIS A 149 32.105 -9.877 4.164 1.00 0.00 H new ATOM 0 HB2 HIS A 149 31.494 -7.775 2.057 1.00 0.00 H new ATOM 0 HB3 HIS A 149 32.880 -7.751 3.128 1.00 0.00 H new ATOM 0 HD2 HIS A 149 32.772 -8.274 -0.317 1.00 0.00 H new ATOM 0 HE1 HIS A 149 34.844 -11.779 0.860 1.00 0.00 H new ATOM 0 HE2 HIS A 149 34.279 -10.250 -1.089 1.00 0.00 H new ATOM 2326 N HIS A 150 29.430 -8.059 4.414 1.00 0.00 N ATOM 2327 CA HIS A 150 28.602 -7.199 5.266 1.00 0.00 C ATOM 2328 C HIS A 150 29.062 -5.735 5.186 1.00 0.00 C ATOM 2329 O HIS A 150 30.238 -5.419 5.394 1.00 0.00 O ATOM 2330 CB HIS A 150 28.563 -7.741 6.717 1.00 0.00 C ATOM 2331 CG HIS A 150 29.197 -6.869 7.763 1.00 0.00 C ATOM 2332 ND1 HIS A 150 30.561 -6.702 7.879 1.00 0.00 N ATOM 2333 CD2 HIS A 150 28.648 -6.145 8.768 1.00 0.00 C ATOM 2334 CE1 HIS A 150 30.821 -5.923 8.908 1.00 0.00 C ATOM 2335 NE2 HIS A 150 29.678 -5.570 9.466 1.00 0.00 N ATOM 0 H HIS A 150 28.919 -8.467 3.631 1.00 0.00 H new ATOM 0 HA HIS A 150 27.577 -7.219 4.895 1.00 0.00 H new ATOM 0 HB2 HIS A 150 27.522 -7.908 6.994 1.00 0.00 H new ATOM 0 HB3 HIS A 150 29.057 -8.713 6.734 1.00 0.00 H new ATOM 0 HD1 HIS A 150 31.260 -7.118 7.263 1.00 0.00 H new ATOM 0 HD2 HIS A 150 27.594 -6.040 8.980 1.00 0.00 H new ATOM 0 HE1 HIS A 150 31.804 -5.623 9.240 1.00 0.00 H new ATOM 2344 N HIS A 151 28.125 -4.845 4.858 1.00 0.00 N ATOM 2345 CA HIS A 151 28.440 -3.439 4.600 1.00 0.00 C ATOM 2346 C HIS A 151 27.567 -2.513 5.442 1.00 0.00 C ATOM 2347 O HIS A 151 26.357 -2.707 5.541 1.00 0.00 O ATOM 2348 CB HIS A 151 28.219 -3.106 3.114 1.00 0.00 C ATOM 2349 CG HIS A 151 29.339 -3.526 2.212 1.00 0.00 C ATOM 2350 ND1 HIS A 151 30.151 -2.630 1.558 1.00 0.00 N ATOM 2351 CD2 HIS A 151 29.764 -4.756 1.841 1.00 0.00 C ATOM 2352 CE1 HIS A 151 31.025 -3.289 0.823 1.00 0.00 C ATOM 2353 NE2 HIS A 151 30.813 -4.585 0.974 1.00 0.00 N ATOM 0 H HIS A 151 27.136 -5.075 4.764 1.00 0.00 H new ATOM 0 HA HIS A 151 29.486 -3.285 4.867 1.00 0.00 H new ATOM 0 HB2 HIS A 151 27.300 -3.587 2.779 1.00 0.00 H new ATOM 0 HB3 HIS A 151 28.071 -2.031 3.013 1.00 0.00 H new ATOM 0 HD1 HIS A 151 30.087 -1.615 1.630 1.00 0.00 H new ATOM 0 HD2 HIS A 151 29.353 -5.700 2.168 1.00 0.00 H new ATOM 0 HE1 HIS A 151 31.787 -2.844 0.201 1.00 0.00 H new ATOM 0 HE2 HIS A 151 31.341 -5.332 0.522 1.00 0.00 H new ATOM 2362 N HIS A 152 28.193 -1.510 6.048 1.00 0.00 N ATOM 2363 CA HIS A 152 27.468 -0.419 6.697 1.00 0.00 C ATOM 2364 C HIS A 152 27.386 0.765 5.735 1.00 0.00 C ATOM 2365 O HIS A 152 26.664 1.737 5.970 1.00 0.00 O ATOM 2366 CB HIS A 152 28.167 -0.006 8.000 1.00 0.00 C ATOM 2367 CG HIS A 152 27.361 0.935 8.847 1.00 0.00 C ATOM 2368 ND1 HIS A 152 27.857 2.124 9.333 1.00 0.00 N ATOM 2369 CD2 HIS A 152 26.082 0.857 9.287 1.00 0.00 C ATOM 2370 CE1 HIS A 152 26.922 2.736 10.033 1.00 0.00 C ATOM 2371 NE2 HIS A 152 25.836 1.989 10.020 1.00 0.00 N ATOM 0 H HIS A 152 29.208 -1.428 6.104 1.00 0.00 H new ATOM 0 HA HIS A 152 26.462 -0.753 6.949 1.00 0.00 H new ATOM 0 HB2 HIS A 152 28.392 -0.901 8.580 1.00 0.00 H new ATOM 0 HB3 HIS A 152 29.120 0.464 7.757 1.00 0.00 H new ATOM 0 HD2 HIS A 152 25.386 0.053 9.096 1.00 0.00 H new ATOM 0 HE1 HIS A 152 27.028 3.688 10.532 1.00 0.00 H new ATOM 0 HE2 HIS A 152 24.955 2.216 10.481 1.00 0.00 H new ATOM 2380 N HIS A 153 28.148 0.656 4.650 1.00 0.00 N ATOM 2381 CA HIS A 153 28.185 1.660 3.595 1.00 0.00 C ATOM 2382 C HIS A 153 28.798 1.041 2.338 1.00 0.00 C ATOM 2383 O HIS A 153 28.449 1.473 1.220 1.00 0.00 O ATOM 2384 CB HIS A 153 29.005 2.880 4.042 1.00 0.00 C ATOM 2385 CG HIS A 153 29.082 3.969 3.014 1.00 0.00 C ATOM 2386 ND1 HIS A 153 30.197 4.191 2.235 1.00 0.00 N ATOM 2387 CD2 HIS A 153 28.174 4.901 2.638 1.00 0.00 C ATOM 2388 CE1 HIS A 153 29.972 5.211 1.429 1.00 0.00 C ATOM 2389 NE2 HIS A 153 28.752 5.661 1.652 1.00 0.00 N ATOM 2390 OXT HIS A 153 29.623 0.111 2.479 1.00 0.00 O ATOM 0 H HIS A 153 28.762 -0.140 4.478 1.00 0.00 H new ATOM 0 HA HIS A 153 27.170 1.995 3.379 1.00 0.00 H new ATOM 0 HB2 HIS A 153 28.568 3.285 4.954 1.00 0.00 H new ATOM 0 HB3 HIS A 153 30.016 2.555 4.290 1.00 0.00 H new ATOM 0 HD2 HIS A 153 27.179 5.024 3.040 1.00 0.00 H new ATOM 0 HE1 HIS A 153 30.669 5.611 0.708 1.00 0.00 H new ATOM 0 HE2 HIS A 153 28.311 6.445 1.171 1.00 0.00 H new TER 2399 HIS A 153