USER MOD reduce.3.24.130724 H: found=0, std=0, add=1031, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1027 hydrogens (5 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 83 THR OG1 : rot 180:sc= -0.126 USER MOD Set 1.2: A 113 SER OG : rot -97:sc= -3.83! USER MOD Set 1.3: A 116 HIS : no HD1:sc= -15.1! C(o=-19!,f=-27!) USER MOD Set 2.1: A 88 TYR OH : rot -82:sc= -0.47 USER MOD Set 2.2: A 90 SER OG : rot 130:sc= 0.382 USER MOD Set 2.3: A 92 THR OG1 : rot 62:sc= 0.835 USER MOD Set 3.1: A 54 GLN :FLIP amide:sc= -0.993 F(o=-18!,f=-14) USER MOD Set 3.2: A 55 HIS : no HE2:sc= -12.6! C(o=-14!,f=-18!) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 150:sc= -2.83! (180deg=-4.83!) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 CYS SG : rot 61:sc= 1.51 USER MOD Single : A 31 SER OG : rot 180:sc= -0.664! USER MOD Single : A 32 ASN :FLIP amide:sc= -3.47! C(o=-6.9!,f=-3.5!) USER MOD Single : A 35 HIS : no HE2:sc= -3.37 K(o=-3.4,f=-7!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot -70:sc= -4.9! USER MOD Single : A 52 SER OG : rot 69:sc= 0.676 USER MOD Single : A 57 GLN : amide:sc= -6.03! C(o=-6!,f=-17!) USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 SER OG : rot -69:sc= 1.06 USER MOD Single : A 64 SER OG : rot 62:sc= 0.923 USER MOD Single : A 69 TYR OH : rot 180:sc= -0.218 USER MOD Single : A 71 LYS NZ :NH3+ 160:sc= -0.923 (180deg=-1.79) USER MOD Single : A 72 SER OG : rot 63:sc= 0.437 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0.161! USER MOD Single : A 77 GLN : amide:sc= 0.121 X(o=0.12,f=0) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 MET CE :methyl 175:sc= -2.96! (180deg=-3.11!) USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 ASN :FLIP amide:sc= -5.36! C(o=-7.6!,f=-5.4!) USER MOD Single : A 97 CYS SG : rot 48:sc= -1.71! USER MOD Single : A 106 ASN : amide:sc= -0.154 K(o=-0.15,f=-2!) USER MOD Single : A 107 HIS :FLIP no HD1:sc= -3.58! C(o=-4.1!,f=-3.6!) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 ASN : amide:sc= -0.878 X(o=-0.88,f=-1.2) USER MOD Single : A 110 THR OG1 : rot 37:sc= -1.2 USER MOD Single : A 111 TYR OH : rot 45:sc= -4.48! USER MOD Single : A 114 LYS NZ :NH3+ -150:sc=-0.00076 (180deg=-0.00981) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN :FLIP amide:sc= -0.24 F(o=-0.74,f=-0.24) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ -150:sc= 0.938 (180deg=-0.132) USER MOD Single : A 128 ASN :FLIP amide:sc= -0.372 F(o=-0.99,f=-0.37) USER MOD Single : A 130 SER OG : rot 64:sc= 0.999 USER MOD Single : A 131 CYS SG : rot -11:sc= 0.789 USER MOD Single : A 132 LYS NZ :NH3+ -105:sc= -0.265 (180deg=-3.37!) USER MOD Single : A 137 THR OG1 : rot -66:sc= -0.286 USER MOD Single : A 138 HIS : no HD1:sc= -5.28! C(o=-5.3!,f=-9.4!) USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 GLN : amide:sc= -0.118 K(o=-0.12,f=-0.68) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 SER OG : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot -61:sc= 0.679 USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 24 -10.919 -4.899 14.563 1.00 0.00 N ATOM 2 CA LYS A 24 -10.759 -4.925 13.119 1.00 0.00 C ATOM 3 C LYS A 24 -9.487 -5.697 12.765 1.00 0.00 C ATOM 4 O LYS A 24 -8.435 -5.100 12.542 1.00 0.00 O ATOM 5 CB LYS A 24 -10.795 -3.505 12.550 1.00 0.00 C ATOM 6 CG LYS A 24 -12.141 -2.835 12.833 1.00 0.00 C ATOM 7 CD LYS A 24 -12.780 -2.323 11.540 1.00 0.00 C ATOM 8 CE LYS A 24 -14.218 -1.860 11.786 1.00 0.00 C ATOM 9 NZ LYS A 24 -14.370 -0.431 11.433 1.00 0.00 N ATOM 0 HA LYS A 24 -11.592 -5.451 12.653 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -9.991 -2.913 12.988 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -10.619 -3.536 11.475 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -12.811 -3.546 13.317 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -12.000 -2.006 13.527 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -12.191 -1.497 11.141 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -12.772 -3.112 10.788 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -14.907 -2.462 11.193 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -14.481 -2.012 12.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -15.351 -0.133 11.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -13.727 0.141 12.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -14.139 -0.295 10.428 1.00 0.00 H new ATOM 23 N PRO A 25 -9.627 -7.050 12.725 1.00 0.00 N ATOM 24 CA PRO A 25 -8.502 -7.910 12.402 1.00 0.00 C ATOM 25 C PRO A 25 -8.187 -7.863 10.906 1.00 0.00 C ATOM 26 O PRO A 25 -8.839 -8.538 10.109 1.00 0.00 O ATOM 27 CB PRO A 25 -8.914 -9.293 12.880 1.00 0.00 C ATOM 28 CG PRO A 25 -10.426 -9.249 13.026 1.00 0.00 C ATOM 29 CD PRO A 25 -10.857 -7.792 12.984 1.00 0.00 C ATOM 0 HA PRO A 25 -7.578 -7.594 12.887 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -8.613 -10.059 12.166 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -8.437 -9.537 13.829 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -10.903 -9.811 12.224 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -10.732 -9.711 13.965 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -11.596 -7.620 12.201 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -11.313 -7.486 13.926 1.00 0.00 H new ATOM 37 N LYS A 26 -7.189 -7.060 10.568 1.00 0.00 N ATOM 38 CA LYS A 26 -6.780 -6.917 9.181 1.00 0.00 C ATOM 39 C LYS A 26 -5.521 -6.051 9.112 1.00 0.00 C ATOM 40 O LYS A 26 -5.454 -4.995 9.739 1.00 0.00 O ATOM 41 CB LYS A 26 -7.938 -6.387 8.333 1.00 0.00 C ATOM 42 CG LYS A 26 -7.421 -5.553 7.159 1.00 0.00 C ATOM 43 CD LYS A 26 -6.673 -6.429 6.152 1.00 0.00 C ATOM 44 CE LYS A 26 -5.299 -5.840 5.828 1.00 0.00 C ATOM 45 NZ LYS A 26 -5.316 -5.183 4.501 1.00 0.00 N ATOM 0 H LYS A 26 -6.651 -6.501 11.231 1.00 0.00 H new ATOM 0 HA LYS A 26 -6.523 -7.888 8.757 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -8.530 -7.222 7.958 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -8.599 -5.780 8.952 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -8.256 -5.057 6.665 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -6.758 -4.770 7.528 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -6.556 -7.435 6.556 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -7.259 -6.519 5.237 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -5.016 -5.118 6.594 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -4.547 -6.629 5.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -4.634 -4.398 4.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -5.057 -5.874 3.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -6.269 -4.815 4.308 1.00 0.00 H new ATOM 59 N LEU A 27 -4.553 -6.531 8.344 1.00 0.00 N ATOM 60 CA LEU A 27 -3.299 -5.813 8.185 1.00 0.00 C ATOM 61 C LEU A 27 -2.514 -6.420 7.021 1.00 0.00 C ATOM 62 O LEU A 27 -2.732 -7.574 6.654 1.00 0.00 O ATOM 63 CB LEU A 27 -2.524 -5.790 9.504 1.00 0.00 C ATOM 64 CG LEU A 27 -2.377 -7.135 10.220 1.00 0.00 C ATOM 65 CD1 LEU A 27 -0.904 -7.524 10.358 1.00 0.00 C ATOM 66 CD2 LEU A 27 -3.096 -7.118 11.571 1.00 0.00 C ATOM 0 H LEU A 27 -4.612 -7.407 7.826 1.00 0.00 H new ATOM 0 HA LEU A 27 -3.486 -4.769 7.934 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -1.527 -5.393 9.310 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -3.018 -5.093 10.181 1.00 0.00 H new ATOM 0 HG LEU A 27 -2.856 -7.901 9.611 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.827 -8.483 10.870 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -0.455 -7.604 9.368 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -0.379 -6.762 10.934 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -2.976 -8.085 12.059 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -2.668 -6.338 12.201 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -4.156 -6.919 11.416 1.00 0.00 H new ATOM 78 N LEU A 28 -1.616 -5.616 6.472 1.00 0.00 N ATOM 79 CA LEU A 28 -0.797 -6.059 5.357 1.00 0.00 C ATOM 80 C LEU A 28 0.602 -6.415 5.866 1.00 0.00 C ATOM 81 O LEU A 28 1.066 -5.854 6.858 1.00 0.00 O ATOM 82 CB LEU A 28 -0.797 -5.011 4.242 1.00 0.00 C ATOM 83 CG LEU A 28 -1.069 -5.534 2.830 1.00 0.00 C ATOM 84 CD1 LEU A 28 -0.818 -4.445 1.785 1.00 0.00 C ATOM 85 CD2 LEU A 28 -0.255 -6.798 2.547 1.00 0.00 C ATOM 0 H LEU A 28 -1.437 -4.660 6.779 1.00 0.00 H new ATOM 0 HA LEU A 28 -1.215 -6.963 4.914 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.547 -4.257 4.479 1.00 0.00 H new ATOM 0 HB3 LEU A 28 0.171 -4.509 4.242 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.122 -5.808 2.764 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.018 -4.842 0.790 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.477 -3.598 1.977 1.00 0.00 H new ATOM 0 HD13 LEU A 28 0.220 -4.118 1.843 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.467 -7.149 1.537 1.00 0.00 H new ATOM 0 HD22 LEU A 28 0.808 -6.574 2.638 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.525 -7.573 3.264 1.00 0.00 H new ATOM 97 N TYR A 29 1.233 -7.345 5.165 1.00 0.00 N ATOM 98 CA TYR A 29 2.569 -7.782 5.533 1.00 0.00 C ATOM 99 C TYR A 29 3.492 -7.814 4.313 1.00 0.00 C ATOM 100 O TYR A 29 3.163 -8.426 3.298 1.00 0.00 O ATOM 101 CB TYR A 29 2.412 -9.203 6.077 1.00 0.00 C ATOM 102 CG TYR A 29 3.735 -9.879 6.442 1.00 0.00 C ATOM 103 CD1 TYR A 29 4.393 -9.527 7.604 1.00 0.00 C ATOM 104 CD2 TYR A 29 4.272 -10.841 5.610 1.00 0.00 C ATOM 105 CE1 TYR A 29 5.638 -10.164 7.947 1.00 0.00 C ATOM 106 CE2 TYR A 29 5.517 -11.477 5.954 1.00 0.00 C ATOM 107 CZ TYR A 29 6.139 -11.107 7.105 1.00 0.00 C ATOM 108 OH TYR A 29 7.315 -11.708 7.430 1.00 0.00 O ATOM 0 H TYR A 29 0.844 -7.808 4.344 1.00 0.00 H new ATOM 0 HA TYR A 29 3.008 -7.101 6.262 1.00 0.00 H new ATOM 0 HB2 TYR A 29 1.774 -9.174 6.961 1.00 0.00 H new ATOM 0 HB3 TYR A 29 1.898 -9.811 5.333 1.00 0.00 H new ATOM 0 HD1 TYR A 29 3.974 -8.774 8.255 1.00 0.00 H new ATOM 0 HD2 TYR A 29 3.758 -11.117 4.701 1.00 0.00 H new ATOM 0 HE1 TYR A 29 6.162 -9.899 8.853 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.947 -12.231 5.312 1.00 0.00 H new ATOM 0 HH TYR A 29 7.551 -12.361 6.738 1.00 0.00 H new ATOM 118 N CYS A 30 4.628 -7.148 4.453 1.00 0.00 N ATOM 119 CA CYS A 30 5.601 -7.093 3.375 1.00 0.00 C ATOM 120 C CYS A 30 6.469 -8.350 3.447 1.00 0.00 C ATOM 121 O CYS A 30 6.712 -8.880 4.530 1.00 0.00 O ATOM 122 CB CYS A 30 6.440 -5.815 3.435 1.00 0.00 C ATOM 123 SG CYS A 30 6.522 -5.041 1.779 1.00 0.00 S ATOM 0 H CYS A 30 4.897 -6.642 5.297 1.00 0.00 H new ATOM 0 HA CYS A 30 5.084 -7.065 2.416 1.00 0.00 H new ATOM 0 HB2 CYS A 30 6.004 -5.117 4.150 1.00 0.00 H new ATOM 0 HB3 CYS A 30 7.445 -6.046 3.787 1.00 0.00 H new ATOM 0 HG CYS A 30 5.323 -4.730 1.385 1.00 0.00 H new ATOM 129 N SER A 31 6.914 -8.791 2.279 1.00 0.00 N ATOM 130 CA SER A 31 7.751 -9.976 2.196 1.00 0.00 C ATOM 131 C SER A 31 8.837 -9.926 3.272 1.00 0.00 C ATOM 132 O SER A 31 8.608 -10.335 4.409 1.00 0.00 O ATOM 133 CB SER A 31 8.383 -10.107 0.809 1.00 0.00 C ATOM 134 OG SER A 31 9.622 -10.809 0.852 1.00 0.00 O ATOM 0 H SER A 31 6.711 -8.349 1.383 1.00 0.00 H new ATOM 0 HA SER A 31 7.123 -10.851 2.364 1.00 0.00 H new ATOM 0 HB2 SER A 31 7.694 -10.628 0.144 1.00 0.00 H new ATOM 0 HB3 SER A 31 8.543 -9.114 0.388 1.00 0.00 H new ATOM 0 HG SER A 31 9.993 -10.873 -0.053 1.00 0.00 H new ATOM 140 N ASN A 32 9.996 -9.422 2.875 1.00 0.00 N ATOM 141 CA ASN A 32 11.118 -9.313 3.791 1.00 0.00 C ATOM 142 C ASN A 32 10.871 -8.154 4.758 1.00 0.00 C ATOM 143 O ASN A 32 10.011 -7.310 4.514 1.00 0.00 O ATOM 144 CB ASN A 32 12.420 -9.031 3.038 1.00 0.00 C ATOM 145 CG ASN A 32 13.634 -9.482 3.852 1.00 0.00 C ATOM 146 OD1 ASN A 32 13.989 -8.629 4.809 1.00 0.00 O flip ATOM 147 ND2 ASN A 32 14.210 -10.533 3.627 1.00 0.00 N flip ATOM 0 H ASN A 32 10.182 -9.084 1.931 1.00 0.00 H new ATOM 0 HA ASN A 32 11.209 -10.258 4.326 1.00 0.00 H new ATOM 0 HB2 ASN A 32 12.409 -9.548 2.079 1.00 0.00 H new ATOM 0 HB3 ASN A 32 12.497 -7.965 2.824 1.00 0.00 H new ATOM 0 HD21 ASN A 32 13.885 -11.142 2.876 1.00 0.00 H new ATOM 0 HD22 ASN A 32 15.017 -10.803 4.190 1.00 0.00 H new ATOM 154 N GLY A 33 11.642 -8.149 5.836 1.00 0.00 N ATOM 155 CA GLY A 33 11.518 -7.107 6.841 1.00 0.00 C ATOM 156 C GLY A 33 10.367 -7.408 7.803 1.00 0.00 C ATOM 157 O GLY A 33 10.535 -7.336 9.019 1.00 0.00 O ATOM 0 H GLY A 33 12.355 -8.851 6.035 1.00 0.00 H new ATOM 0 HA2 GLY A 33 12.450 -7.022 7.399 1.00 0.00 H new ATOM 0 HA3 GLY A 33 11.349 -6.146 6.355 1.00 0.00 H new ATOM 161 N GLY A 34 9.223 -7.738 7.222 1.00 0.00 N ATOM 162 CA GLY A 34 8.045 -8.050 8.013 1.00 0.00 C ATOM 163 C GLY A 34 7.272 -6.779 8.370 1.00 0.00 C ATOM 164 O GLY A 34 6.431 -6.791 9.268 1.00 0.00 O ATOM 0 H GLY A 34 9.087 -7.796 6.213 1.00 0.00 H new ATOM 0 HA2 GLY A 34 7.399 -8.729 7.457 1.00 0.00 H new ATOM 0 HA3 GLY A 34 8.342 -8.568 8.925 1.00 0.00 H new ATOM 168 N HIS A 35 7.585 -5.712 7.649 1.00 0.00 N ATOM 169 CA HIS A 35 6.931 -4.435 7.879 1.00 0.00 C ATOM 170 C HIS A 35 5.438 -4.560 7.570 1.00 0.00 C ATOM 171 O HIS A 35 5.056 -5.167 6.570 1.00 0.00 O ATOM 172 CB HIS A 35 7.611 -3.324 7.077 1.00 0.00 C ATOM 173 CG HIS A 35 9.067 -3.119 7.424 1.00 0.00 C ATOM 174 ND1 HIS A 35 10.057 -4.014 7.059 1.00 0.00 N ATOM 175 CD2 HIS A 35 9.688 -2.113 8.105 1.00 0.00 C ATOM 176 CE1 HIS A 35 11.218 -3.557 7.506 1.00 0.00 C ATOM 177 NE2 HIS A 35 10.987 -2.380 8.154 1.00 0.00 N ATOM 0 H HIS A 35 8.283 -5.706 6.905 1.00 0.00 H new ATOM 0 HA HIS A 35 7.028 -4.157 8.929 1.00 0.00 H new ATOM 0 HB2 HIS A 35 7.530 -3.555 6.015 1.00 0.00 H new ATOM 0 HB3 HIS A 35 7.074 -2.390 7.242 1.00 0.00 H new ATOM 0 HD1 HIS A 35 9.917 -4.878 6.535 1.00 0.00 H new ATOM 0 HD2 HIS A 35 9.205 -1.247 8.532 1.00 0.00 H new ATOM 0 HE1 HIS A 35 12.179 -4.034 7.379 1.00 0.00 H new ATOM 185 N PHE A 36 4.634 -3.977 8.446 1.00 0.00 N ATOM 186 CA PHE A 36 3.191 -4.016 8.280 1.00 0.00 C ATOM 187 C PHE A 36 2.644 -2.635 7.912 1.00 0.00 C ATOM 188 O PHE A 36 2.428 -1.796 8.785 1.00 0.00 O ATOM 189 CB PHE A 36 2.596 -4.445 9.622 1.00 0.00 C ATOM 190 CG PHE A 36 3.045 -5.832 10.086 1.00 0.00 C ATOM 191 CD1 PHE A 36 4.286 -6.004 10.616 1.00 0.00 C ATOM 192 CD2 PHE A 36 2.203 -6.894 9.968 1.00 0.00 C ATOM 193 CE1 PHE A 36 4.703 -7.291 11.047 1.00 0.00 C ATOM 194 CE2 PHE A 36 2.620 -8.182 10.399 1.00 0.00 C ATOM 195 CZ PHE A 36 3.861 -8.353 10.929 1.00 0.00 C ATOM 0 H PHE A 36 4.954 -3.474 9.274 1.00 0.00 H new ATOM 0 HA PHE A 36 2.928 -4.707 7.479 1.00 0.00 H new ATOM 0 HB2 PHE A 36 2.871 -3.712 10.381 1.00 0.00 H new ATOM 0 HB3 PHE A 36 1.509 -4.433 9.546 1.00 0.00 H new ATOM 0 HD1 PHE A 36 4.955 -5.161 10.709 1.00 0.00 H new ATOM 0 HD2 PHE A 36 1.218 -6.758 9.547 1.00 0.00 H new ATOM 0 HE1 PHE A 36 5.688 -7.427 11.468 1.00 0.00 H new ATOM 0 HE2 PHE A 36 1.952 -9.025 10.306 1.00 0.00 H new ATOM 0 HZ PHE A 36 4.178 -9.332 11.256 1.00 0.00 H new ATOM 205 N LEU A 37 2.435 -2.442 6.618 1.00 0.00 N ATOM 206 CA LEU A 37 1.918 -1.177 6.124 1.00 0.00 C ATOM 207 C LEU A 37 0.884 -0.633 7.112 1.00 0.00 C ATOM 208 O LEU A 37 0.004 -1.366 7.561 1.00 0.00 O ATOM 209 CB LEU A 37 1.383 -1.337 4.699 1.00 0.00 C ATOM 210 CG LEU A 37 2.090 -0.513 3.621 1.00 0.00 C ATOM 211 CD1 LEU A 37 1.525 -0.827 2.234 1.00 0.00 C ATOM 212 CD2 LEU A 37 2.025 0.981 3.942 1.00 0.00 C ATOM 0 H LEU A 37 2.614 -3.140 5.897 1.00 0.00 H new ATOM 0 HA LEU A 37 2.717 -0.438 6.059 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.447 -2.390 4.424 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.326 -1.071 4.697 1.00 0.00 H new ATOM 0 HG LEU A 37 3.143 -0.794 3.611 1.00 0.00 H new ATOM 0 HD11 LEU A 37 2.044 -0.228 1.486 1.00 0.00 H new ATOM 0 HD12 LEU A 37 1.667 -1.885 2.014 1.00 0.00 H new ATOM 0 HD13 LEU A 37 0.461 -0.591 2.213 1.00 0.00 H new ATOM 0 HD21 LEU A 37 2.535 1.544 3.160 1.00 0.00 H new ATOM 0 HD22 LEU A 37 0.983 1.297 3.996 1.00 0.00 H new ATOM 0 HD23 LEU A 37 2.511 1.169 4.900 1.00 0.00 H new ATOM 224 N ARG A 38 1.025 0.648 7.421 1.00 0.00 N ATOM 225 CA ARG A 38 0.114 1.298 8.347 1.00 0.00 C ATOM 226 C ARG A 38 -0.381 2.623 7.763 1.00 0.00 C ATOM 227 O ARG A 38 0.143 3.095 6.755 1.00 0.00 O ATOM 228 CB ARG A 38 0.793 1.564 9.692 1.00 0.00 C ATOM 229 CG ARG A 38 1.957 2.544 9.535 1.00 0.00 C ATOM 230 CD ARG A 38 2.293 3.215 10.868 1.00 0.00 C ATOM 231 NE ARG A 38 2.886 2.227 11.797 1.00 0.00 N ATOM 232 CZ ARG A 38 3.668 2.549 12.836 1.00 0.00 C ATOM 233 NH1 ARG A 38 3.956 3.833 13.087 1.00 0.00 N ATOM 234 NH2 ARG A 38 4.163 1.585 13.626 1.00 0.00 N ATOM 0 H ARG A 38 1.756 1.253 7.046 1.00 0.00 H new ATOM 0 HA ARG A 38 -0.731 0.628 8.505 1.00 0.00 H new ATOM 0 HB2 ARG A 38 0.066 1.968 10.397 1.00 0.00 H new ATOM 0 HB3 ARG A 38 1.157 0.626 10.111 1.00 0.00 H new ATOM 0 HG2 ARG A 38 2.833 2.016 9.159 1.00 0.00 H new ATOM 0 HG3 ARG A 38 1.701 3.303 8.796 1.00 0.00 H new ATOM 0 HD2 ARG A 38 2.990 4.037 10.705 1.00 0.00 H new ATOM 0 HD3 ARG A 38 1.392 3.643 11.306 1.00 0.00 H new ATOM 0 HE ARG A 38 2.687 1.240 11.636 1.00 0.00 H new ATOM 0 HH11 ARG A 38 3.580 4.567 12.487 1.00 0.00 H new ATOM 0 HH12 ARG A 38 4.552 4.077 13.878 1.00 0.00 H new ATOM 0 HH21 ARG A 38 3.944 0.607 13.436 1.00 0.00 H new ATOM 0 HH22 ARG A 38 4.758 1.830 14.417 1.00 0.00 H new ATOM 248 N ILE A 39 -1.383 3.186 8.422 1.00 0.00 N ATOM 249 CA ILE A 39 -1.954 4.447 7.981 1.00 0.00 C ATOM 250 C ILE A 39 -2.267 5.315 9.201 1.00 0.00 C ATOM 251 O ILE A 39 -3.097 4.948 10.032 1.00 0.00 O ATOM 252 CB ILE A 39 -3.162 4.201 7.075 1.00 0.00 C ATOM 253 CG1 ILE A 39 -3.012 4.944 5.746 1.00 0.00 C ATOM 254 CG2 ILE A 39 -4.466 4.563 7.790 1.00 0.00 C ATOM 255 CD1 ILE A 39 -3.997 4.409 4.704 1.00 0.00 C ATOM 0 H ILE A 39 -1.814 2.792 9.258 1.00 0.00 H new ATOM 0 HA ILE A 39 -1.236 4.998 7.373 1.00 0.00 H new ATOM 0 HB ILE A 39 -3.205 3.136 6.845 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -3.183 6.009 5.900 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -1.992 4.835 5.377 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -5.309 4.379 7.124 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -4.571 3.952 8.686 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -4.447 5.616 8.069 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -3.869 4.954 3.769 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -3.808 3.349 4.535 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -5.017 4.542 5.065 1.00 0.00 H new ATOM 267 N LEU A 40 -1.586 6.450 9.271 1.00 0.00 N ATOM 268 CA LEU A 40 -1.781 7.373 10.376 1.00 0.00 C ATOM 269 C LEU A 40 -2.968 8.288 10.067 1.00 0.00 C ATOM 270 O LEU A 40 -3.152 8.707 8.926 1.00 0.00 O ATOM 271 CB LEU A 40 -0.485 8.127 10.679 1.00 0.00 C ATOM 272 CG LEU A 40 0.813 7.352 10.445 1.00 0.00 C ATOM 273 CD1 LEU A 40 1.977 8.305 10.165 1.00 0.00 C ATOM 274 CD2 LEU A 40 1.109 6.413 11.615 1.00 0.00 C ATOM 0 H LEU A 40 -0.899 6.751 8.580 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.027 6.829 11.288 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.461 9.029 10.067 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.510 8.448 11.720 1.00 0.00 H new ATOM 0 HG LEU A 40 0.685 6.731 9.559 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.888 7.729 10.002 1.00 0.00 H new ATOM 0 HD12 LEU A 40 1.758 8.896 9.276 1.00 0.00 H new ATOM 0 HD13 LEU A 40 2.116 8.970 11.017 1.00 0.00 H new ATOM 0 HD21 LEU A 40 2.037 5.874 11.423 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.210 6.994 12.532 1.00 0.00 H new ATOM 0 HD23 LEU A 40 0.292 5.700 11.725 1.00 0.00 H new ATOM 286 N PRO A 41 -3.762 8.577 11.132 1.00 0.00 N ATOM 287 CA PRO A 41 -4.926 9.435 10.986 1.00 0.00 C ATOM 288 C PRO A 41 -4.513 10.902 10.851 1.00 0.00 C ATOM 289 O PRO A 41 -5.355 11.796 10.917 1.00 0.00 O ATOM 290 CB PRO A 41 -5.770 9.167 12.222 1.00 0.00 C ATOM 291 CG PRO A 41 -4.835 8.524 13.234 1.00 0.00 C ATOM 292 CD PRO A 41 -3.574 8.099 12.499 1.00 0.00 C ATOM 0 HA PRO A 41 -5.493 9.224 10.079 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -6.193 10.092 12.614 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -6.606 8.508 11.989 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -4.594 9.227 14.031 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -5.313 7.663 13.702 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -2.685 8.537 12.953 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -3.446 7.017 12.526 1.00 0.00 H new ATOM 300 N ASP A 42 -3.217 11.104 10.664 1.00 0.00 N ATOM 301 CA ASP A 42 -2.682 12.447 10.519 1.00 0.00 C ATOM 302 C ASP A 42 -2.584 12.794 9.033 1.00 0.00 C ATOM 303 O ASP A 42 -2.672 13.962 8.657 1.00 0.00 O ATOM 304 CB ASP A 42 -1.279 12.549 11.122 1.00 0.00 C ATOM 305 CG ASP A 42 -1.212 13.227 12.492 1.00 0.00 C ATOM 306 OD1 ASP A 42 -1.523 14.436 12.543 1.00 0.00 O ATOM 307 OD2 ASP A 42 -0.852 12.520 13.458 1.00 0.00 O ATOM 0 H ASP A 42 -2.522 10.360 10.610 1.00 0.00 H new ATOM 0 HA ASP A 42 -3.349 13.134 11.040 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -0.864 11.545 11.209 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -0.641 13.099 10.430 1.00 0.00 H new ATOM 312 N GLY A 43 -2.402 11.758 8.226 1.00 0.00 N ATOM 313 CA GLY A 43 -2.290 11.940 6.789 1.00 0.00 C ATOM 314 C GLY A 43 -0.937 11.442 6.277 1.00 0.00 C ATOM 315 O GLY A 43 -0.519 11.794 5.175 1.00 0.00 O ATOM 0 H GLY A 43 -2.329 10.790 8.540 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -3.094 11.401 6.287 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -2.411 12.995 6.542 1.00 0.00 H new ATOM 319 N THR A 44 -0.290 10.632 7.101 1.00 0.00 N ATOM 320 CA THR A 44 1.008 10.083 6.745 1.00 0.00 C ATOM 321 C THR A 44 0.964 8.554 6.766 1.00 0.00 C ATOM 322 O THR A 44 0.534 7.955 7.751 1.00 0.00 O ATOM 323 CB THR A 44 2.048 10.674 7.699 1.00 0.00 C ATOM 324 OG1 THR A 44 2.535 11.824 7.012 1.00 0.00 O ATOM 325 CG2 THR A 44 3.281 9.780 7.847 1.00 0.00 C ATOM 0 H THR A 44 -0.640 10.342 8.014 1.00 0.00 H new ATOM 0 HA THR A 44 1.287 10.355 5.727 1.00 0.00 H new ATOM 0 HB THR A 44 1.594 10.833 8.677 1.00 0.00 H new ATOM 0 HG1 THR A 44 3.214 12.270 7.561 1.00 0.00 H new ATOM 0 HG21 THR A 44 3.987 10.245 8.534 1.00 0.00 H new ATOM 0 HG22 THR A 44 2.981 8.808 8.238 1.00 0.00 H new ATOM 0 HG23 THR A 44 3.754 9.649 6.874 1.00 0.00 H new ATOM 333 N VAL A 45 1.414 7.966 5.668 1.00 0.00 N ATOM 334 CA VAL A 45 1.431 6.518 5.547 1.00 0.00 C ATOM 335 C VAL A 45 2.873 6.019 5.655 1.00 0.00 C ATOM 336 O VAL A 45 3.814 6.807 5.575 1.00 0.00 O ATOM 337 CB VAL A 45 0.747 6.093 4.246 1.00 0.00 C ATOM 338 CG1 VAL A 45 0.777 7.224 3.216 1.00 0.00 C ATOM 339 CG2 VAL A 45 1.383 4.821 3.683 1.00 0.00 C ATOM 0 H VAL A 45 1.770 8.466 4.853 1.00 0.00 H new ATOM 0 HA VAL A 45 0.867 6.060 6.359 1.00 0.00 H new ATOM 0 HB VAL A 45 -0.297 5.874 4.472 1.00 0.00 H new ATOM 0 HG11 VAL A 45 0.284 6.896 2.301 1.00 0.00 H new ATOM 0 HG12 VAL A 45 0.257 8.094 3.616 1.00 0.00 H new ATOM 0 HG13 VAL A 45 1.811 7.489 2.996 1.00 0.00 H new ATOM 0 HG21 VAL A 45 0.878 4.540 2.758 1.00 0.00 H new ATOM 0 HG22 VAL A 45 2.439 5.001 3.480 1.00 0.00 H new ATOM 0 HG23 VAL A 45 1.286 4.014 4.409 1.00 0.00 H new ATOM 349 N ASP A 46 3.002 4.712 5.836 1.00 0.00 N ATOM 350 CA ASP A 46 4.314 4.099 5.955 1.00 0.00 C ATOM 351 C ASP A 46 4.153 2.645 6.405 1.00 0.00 C ATOM 352 O ASP A 46 3.037 2.133 6.473 1.00 0.00 O ATOM 353 CB ASP A 46 5.168 4.824 6.997 1.00 0.00 C ATOM 354 CG ASP A 46 4.402 5.792 7.901 1.00 0.00 C ATOM 355 OD1 ASP A 46 3.237 5.470 8.220 1.00 0.00 O ATOM 356 OD2 ASP A 46 4.998 6.833 8.252 1.00 0.00 O ATOM 0 H ASP A 46 2.219 4.061 5.903 1.00 0.00 H new ATOM 0 HA ASP A 46 4.804 4.158 4.983 1.00 0.00 H new ATOM 0 HB2 ASP A 46 5.661 4.080 7.622 1.00 0.00 H new ATOM 0 HB3 ASP A 46 5.953 5.377 6.481 1.00 0.00 H new ATOM 361 N GLY A 47 5.284 2.022 6.699 1.00 0.00 N ATOM 362 CA GLY A 47 5.283 0.637 7.140 1.00 0.00 C ATOM 363 C GLY A 47 6.071 0.475 8.442 1.00 0.00 C ATOM 364 O GLY A 47 7.003 1.233 8.705 1.00 0.00 O ATOM 0 H GLY A 47 6.208 2.450 6.641 1.00 0.00 H new ATOM 0 HA2 GLY A 47 4.257 0.299 7.287 1.00 0.00 H new ATOM 0 HA3 GLY A 47 5.719 0.005 6.366 1.00 0.00 H new ATOM 368 N THR A 48 5.667 -0.517 9.221 1.00 0.00 N ATOM 369 CA THR A 48 6.324 -0.788 10.488 1.00 0.00 C ATOM 370 C THR A 48 6.773 -2.249 10.554 1.00 0.00 C ATOM 371 O THR A 48 5.959 -3.160 10.414 1.00 0.00 O ATOM 372 CB THR A 48 5.363 -0.397 11.612 1.00 0.00 C ATOM 373 OG1 THR A 48 4.981 0.939 11.293 1.00 0.00 O ATOM 374 CG2 THR A 48 6.065 -0.270 12.966 1.00 0.00 C ATOM 0 H THR A 48 4.893 -1.143 8.999 1.00 0.00 H new ATOM 0 HA THR A 48 7.233 -0.196 10.597 1.00 0.00 H new ATOM 0 HB THR A 48 4.568 -1.139 11.684 1.00 0.00 H new ATOM 0 HG1 THR A 48 5.744 1.539 11.430 1.00 0.00 H new ATOM 0 HG21 THR A 48 5.338 0.009 13.728 1.00 0.00 H new ATOM 0 HG22 THR A 48 6.520 -1.224 13.231 1.00 0.00 H new ATOM 0 HG23 THR A 48 6.838 0.496 12.905 1.00 0.00 H new ATOM 382 N ARG A 49 8.069 -2.427 10.768 1.00 0.00 N ATOM 383 CA ARG A 49 8.636 -3.762 10.855 1.00 0.00 C ATOM 384 C ARG A 49 7.653 -4.713 11.540 1.00 0.00 C ATOM 385 O ARG A 49 7.587 -5.894 11.200 1.00 0.00 O ATOM 386 CB ARG A 49 9.953 -3.751 11.635 1.00 0.00 C ATOM 387 CG ARG A 49 10.896 -4.846 11.133 1.00 0.00 C ATOM 388 CD ARG A 49 12.320 -4.621 11.645 1.00 0.00 C ATOM 389 NE ARG A 49 13.295 -4.891 10.565 1.00 0.00 N ATOM 390 CZ ARG A 49 13.783 -6.106 10.280 1.00 0.00 C ATOM 391 NH1 ARG A 49 13.390 -7.170 10.993 1.00 0.00 N ATOM 392 NH2 ARG A 49 14.665 -6.257 9.283 1.00 0.00 N ATOM 0 H ARG A 49 8.742 -1.669 10.884 1.00 0.00 H new ATOM 0 HA ARG A 49 8.831 -4.106 9.839 1.00 0.00 H new ATOM 0 HB2 ARG A 49 10.433 -2.778 11.532 1.00 0.00 H new ATOM 0 HB3 ARG A 49 9.753 -3.897 12.696 1.00 0.00 H new ATOM 0 HG2 ARG A 49 10.536 -5.820 11.464 1.00 0.00 H new ATOM 0 HG3 ARG A 49 10.896 -4.860 10.043 1.00 0.00 H new ATOM 0 HD2 ARG A 49 12.431 -3.596 11.998 1.00 0.00 H new ATOM 0 HD3 ARG A 49 12.517 -5.274 12.495 1.00 0.00 H new ATOM 0 HE ARG A 49 13.616 -4.103 10.002 1.00 0.00 H new ATOM 0 HH11 ARG A 49 12.719 -7.055 11.753 1.00 0.00 H new ATOM 0 HH12 ARG A 49 13.762 -8.095 10.776 1.00 0.00 H new ATOM 0 HH21 ARG A 49 14.965 -5.447 8.741 1.00 0.00 H new ATOM 0 HH22 ARG A 49 15.036 -7.182 9.066 1.00 0.00 H new ATOM 406 N ASP A 50 6.914 -4.164 12.493 1.00 0.00 N ATOM 407 CA ASP A 50 5.938 -4.949 13.229 1.00 0.00 C ATOM 408 C ASP A 50 4.815 -4.032 13.716 1.00 0.00 C ATOM 409 O ASP A 50 5.050 -3.131 14.520 1.00 0.00 O ATOM 410 CB ASP A 50 6.573 -5.611 14.453 1.00 0.00 C ATOM 411 CG ASP A 50 7.069 -7.041 14.232 1.00 0.00 C ATOM 412 OD1 ASP A 50 8.030 -7.193 13.447 1.00 0.00 O ATOM 413 OD2 ASP A 50 6.475 -7.950 14.851 1.00 0.00 O ATOM 0 H ASP A 50 6.972 -3.185 12.772 1.00 0.00 H new ATOM 0 HA ASP A 50 5.553 -5.720 12.562 1.00 0.00 H new ATOM 0 HB2 ASP A 50 7.412 -4.999 14.784 1.00 0.00 H new ATOM 0 HB3 ASP A 50 5.844 -5.617 15.263 1.00 0.00 H new ATOM 418 N ARG A 51 3.619 -4.292 13.209 1.00 0.00 N ATOM 419 CA ARG A 51 2.459 -3.501 13.582 1.00 0.00 C ATOM 420 C ARG A 51 2.673 -2.862 14.956 1.00 0.00 C ATOM 421 O ARG A 51 2.408 -3.486 15.983 1.00 0.00 O ATOM 422 CB ARG A 51 1.194 -4.361 13.618 1.00 0.00 C ATOM 423 CG ARG A 51 1.435 -5.658 14.392 1.00 0.00 C ATOM 424 CD ARG A 51 1.843 -6.792 13.448 1.00 0.00 C ATOM 425 NE ARG A 51 1.107 -8.028 13.795 1.00 0.00 N ATOM 426 CZ ARG A 51 1.507 -8.904 14.727 1.00 0.00 C ATOM 427 NH1 ARG A 51 2.638 -8.684 15.412 1.00 0.00 N ATOM 428 NH2 ARG A 51 0.776 -9.999 14.975 1.00 0.00 N ATOM 0 H ARG A 51 3.428 -5.040 12.542 1.00 0.00 H new ATOM 0 HA ARG A 51 2.333 -2.722 12.830 1.00 0.00 H new ATOM 0 HB2 ARG A 51 0.382 -3.801 14.083 1.00 0.00 H new ATOM 0 HB3 ARG A 51 0.879 -4.594 12.601 1.00 0.00 H new ATOM 0 HG2 ARG A 51 2.215 -5.502 15.137 1.00 0.00 H new ATOM 0 HG3 ARG A 51 0.530 -5.937 14.932 1.00 0.00 H new ATOM 0 HD2 ARG A 51 1.632 -6.511 12.416 1.00 0.00 H new ATOM 0 HD3 ARG A 51 2.917 -6.966 13.518 1.00 0.00 H new ATOM 0 HE ARG A 51 0.241 -8.226 13.293 1.00 0.00 H new ATOM 0 HH11 ARG A 51 3.194 -7.850 15.224 1.00 0.00 H new ATOM 0 HH12 ARG A 51 2.942 -9.351 16.121 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -0.085 -10.166 14.454 1.00 0.00 H new ATOM 0 HH22 ARG A 51 1.081 -10.666 15.684 1.00 0.00 H new ATOM 442 N SER A 52 3.149 -1.626 14.931 1.00 0.00 N ATOM 443 CA SER A 52 3.401 -0.896 16.162 1.00 0.00 C ATOM 444 C SER A 52 2.666 0.446 16.134 1.00 0.00 C ATOM 445 O SER A 52 3.204 1.462 16.572 1.00 0.00 O ATOM 446 CB SER A 52 4.900 -0.675 16.375 1.00 0.00 C ATOM 447 OG SER A 52 5.315 0.620 15.949 1.00 0.00 O ATOM 0 H SER A 52 3.367 -1.111 14.078 1.00 0.00 H new ATOM 0 HA SER A 52 3.027 -1.491 16.995 1.00 0.00 H new ATOM 0 HB2 SER A 52 5.139 -0.803 17.431 1.00 0.00 H new ATOM 0 HB3 SER A 52 5.460 -1.433 15.827 1.00 0.00 H new ATOM 0 HG SER A 52 4.944 1.297 16.552 1.00 0.00 H new ATOM 453 N ASP A 53 1.447 0.406 15.615 1.00 0.00 N ATOM 454 CA ASP A 53 0.633 1.606 15.525 1.00 0.00 C ATOM 455 C ASP A 53 -0.831 1.245 15.783 1.00 0.00 C ATOM 456 O ASP A 53 -1.287 0.171 15.393 1.00 0.00 O ATOM 457 CB ASP A 53 0.727 2.232 14.132 1.00 0.00 C ATOM 458 CG ASP A 53 0.941 3.747 14.116 1.00 0.00 C ATOM 459 OD1 ASP A 53 1.921 4.188 14.754 1.00 0.00 O ATOM 460 OD2 ASP A 53 0.119 4.429 13.468 1.00 0.00 O ATOM 0 H ASP A 53 1.004 -0.438 15.253 1.00 0.00 H new ATOM 0 HA ASP A 53 0.998 2.317 16.266 1.00 0.00 H new ATOM 0 HB2 ASP A 53 1.547 1.759 13.592 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -0.188 2.004 13.585 1.00 0.00 H new ATOM 465 N GLN A 54 -1.527 2.162 16.439 1.00 0.00 N ATOM 466 CA GLN A 54 -2.930 1.953 16.754 1.00 0.00 C ATOM 467 C GLN A 54 -3.751 1.838 15.468 1.00 0.00 C ATOM 468 O GLN A 54 -4.926 1.475 15.508 1.00 0.00 O ATOM 469 CB GLN A 54 -3.464 3.074 17.648 1.00 0.00 C ATOM 470 CG GLN A 54 -3.222 4.444 17.012 1.00 0.00 C ATOM 471 CD GLN A 54 -1.938 5.080 17.549 1.00 0.00 C ATOM 472 OE1 GLN A 54 -0.925 5.062 16.688 1.00 0.00 O flip ATOM 473 NE2 GLN A 54 -1.873 5.554 18.671 1.00 0.00 N flip ATOM 0 H GLN A 54 -1.145 3.051 16.761 1.00 0.00 H new ATOM 0 HA GLN A 54 -3.023 1.018 17.306 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -4.531 2.931 17.818 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -2.977 3.030 18.622 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -3.155 4.339 15.929 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -4.069 5.099 17.217 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -2.690 5.534 19.281 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -1.001 5.970 18.999 1.00 0.00 H new ATOM 482 N HIS A 55 -3.101 2.155 14.358 1.00 0.00 N ATOM 483 CA HIS A 55 -3.756 2.092 13.063 1.00 0.00 C ATOM 484 C HIS A 55 -2.759 1.612 12.006 1.00 0.00 C ATOM 485 O HIS A 55 -2.033 2.414 11.422 1.00 0.00 O ATOM 486 CB HIS A 55 -4.391 3.438 12.710 1.00 0.00 C ATOM 487 CG HIS A 55 -3.834 4.604 13.491 1.00 0.00 C ATOM 488 ND1 HIS A 55 -2.483 4.903 13.531 1.00 0.00 N ATOM 489 CD2 HIS A 55 -4.459 5.542 14.260 1.00 0.00 C ATOM 490 CE1 HIS A 55 -2.314 5.973 14.294 1.00 0.00 C ATOM 491 NE2 HIS A 55 -3.540 6.368 14.744 1.00 0.00 N ATOM 0 H HIS A 55 -2.127 2.456 14.329 1.00 0.00 H new ATOM 0 HA HIS A 55 -4.571 1.369 13.099 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -4.250 3.626 11.646 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -5.465 3.378 12.884 1.00 0.00 H new ATOM 0 HD1 HIS A 55 -1.743 4.387 13.054 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -5.522 5.602 14.444 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -1.371 6.449 14.520 1.00 0.00 H new ATOM 499 N ILE A 56 -2.757 0.304 11.793 1.00 0.00 N ATOM 500 CA ILE A 56 -1.861 -0.293 10.817 1.00 0.00 C ATOM 501 C ILE A 56 -2.662 -1.211 9.891 1.00 0.00 C ATOM 502 O ILE A 56 -2.089 -1.914 9.060 1.00 0.00 O ATOM 503 CB ILE A 56 -0.695 -0.992 11.517 1.00 0.00 C ATOM 504 CG1 ILE A 56 -1.030 -2.456 11.813 1.00 0.00 C ATOM 505 CG2 ILE A 56 -0.278 -0.233 12.779 1.00 0.00 C ATOM 506 CD1 ILE A 56 -2.366 -2.574 12.548 1.00 0.00 C ATOM 0 H ILE A 56 -3.361 -0.359 12.279 1.00 0.00 H new ATOM 0 HA ILE A 56 -1.411 0.478 10.192 1.00 0.00 H new ATOM 0 HB ILE A 56 0.160 -0.988 10.841 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -1.073 -3.019 10.881 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -0.238 -2.899 12.417 1.00 0.00 H new ATOM 0 HG21 ILE A 56 0.553 -0.751 13.258 1.00 0.00 H new ATOM 0 HG22 ILE A 56 0.031 0.777 12.511 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -1.120 -0.184 13.469 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -2.581 -3.624 12.746 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -2.312 -2.030 13.491 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -3.159 -2.152 11.931 1.00 0.00 H new ATOM 518 N GLN A 57 -3.975 -1.175 10.065 1.00 0.00 N ATOM 519 CA GLN A 57 -4.860 -1.995 9.256 1.00 0.00 C ATOM 520 C GLN A 57 -4.988 -1.408 7.849 1.00 0.00 C ATOM 521 O GLN A 57 -4.803 -0.208 7.654 1.00 0.00 O ATOM 522 CB GLN A 57 -6.232 -2.138 9.917 1.00 0.00 C ATOM 523 CG GLN A 57 -6.092 -2.498 11.398 1.00 0.00 C ATOM 524 CD GLN A 57 -7.465 -2.661 12.055 1.00 0.00 C ATOM 525 OE1 GLN A 57 -8.466 -2.913 11.405 1.00 0.00 O ATOM 526 NE2 GLN A 57 -7.455 -2.503 13.375 1.00 0.00 N ATOM 0 H GLN A 57 -4.447 -0.590 10.755 1.00 0.00 H new ATOM 0 HA GLN A 57 -4.427 -2.992 9.175 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -6.787 -1.205 9.817 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -6.808 -2.908 9.405 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -5.524 -3.423 11.499 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -5.528 -1.720 11.913 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -6.581 -2.293 13.857 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -8.321 -2.592 13.906 1.00 0.00 H new ATOM 535 N LEU A 58 -5.305 -2.282 6.904 1.00 0.00 N ATOM 536 CA LEU A 58 -5.460 -1.865 5.521 1.00 0.00 C ATOM 537 C LEU A 58 -6.562 -2.698 4.862 1.00 0.00 C ATOM 538 O LEU A 58 -7.053 -3.660 5.451 1.00 0.00 O ATOM 539 CB LEU A 58 -4.119 -1.930 4.788 1.00 0.00 C ATOM 540 CG LEU A 58 -3.149 -0.778 5.060 1.00 0.00 C ATOM 541 CD1 LEU A 58 -1.892 -1.276 5.774 1.00 0.00 C ATOM 542 CD2 LEU A 58 -2.816 -0.026 3.769 1.00 0.00 C ATOM 0 H LEU A 58 -5.459 -3.277 7.069 1.00 0.00 H new ATOM 0 HA LEU A 58 -5.774 -0.822 5.471 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -3.626 -2.865 5.056 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -4.315 -1.969 3.716 1.00 0.00 H new ATOM 0 HG LEU A 58 -3.638 -0.070 5.728 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.220 -0.437 5.955 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -2.170 -1.730 6.725 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -1.389 -2.016 5.152 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -2.125 0.788 3.990 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -2.355 -0.711 3.058 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -3.731 0.382 3.339 1.00 0.00 H new ATOM 554 N GLN A 59 -6.917 -2.298 3.650 1.00 0.00 N ATOM 555 CA GLN A 59 -7.951 -2.996 2.906 1.00 0.00 C ATOM 556 C GLN A 59 -7.907 -2.592 1.430 1.00 0.00 C ATOM 557 O GLN A 59 -7.729 -1.418 1.110 1.00 0.00 O ATOM 558 CB GLN A 59 -9.333 -2.730 3.506 1.00 0.00 C ATOM 559 CG GLN A 59 -10.298 -3.876 3.192 1.00 0.00 C ATOM 560 CD GLN A 59 -10.446 -4.813 4.392 1.00 0.00 C ATOM 561 OE1 GLN A 59 -11.135 -4.523 5.357 1.00 0.00 O ATOM 562 NE2 GLN A 59 -9.763 -5.948 4.280 1.00 0.00 N ATOM 0 H GLN A 59 -6.507 -1.500 3.165 1.00 0.00 H new ATOM 0 HA GLN A 59 -7.761 -4.067 2.976 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -9.247 -2.608 4.586 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -9.731 -1.796 3.110 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -11.273 -3.471 2.920 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -9.934 -4.437 2.331 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -9.206 -6.128 3.445 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -9.796 -6.639 5.029 1.00 0.00 H new ATOM 571 N LEU A 60 -8.073 -3.588 0.572 1.00 0.00 N ATOM 572 CA LEU A 60 -8.055 -3.351 -0.861 1.00 0.00 C ATOM 573 C LEU A 60 -9.490 -3.333 -1.390 1.00 0.00 C ATOM 574 O LEU A 60 -10.402 -3.838 -0.736 1.00 0.00 O ATOM 575 CB LEU A 60 -7.155 -4.371 -1.561 1.00 0.00 C ATOM 576 CG LEU A 60 -6.135 -5.087 -0.673 1.00 0.00 C ATOM 577 CD1 LEU A 60 -6.793 -6.224 0.110 1.00 0.00 C ATOM 578 CD2 LEU A 60 -4.939 -5.573 -1.493 1.00 0.00 C ATOM 0 H LEU A 60 -8.221 -4.561 0.842 1.00 0.00 H new ATOM 0 HA LEU A 60 -7.623 -2.375 -1.080 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -7.789 -5.123 -2.031 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.617 -3.862 -2.361 1.00 0.00 H new ATOM 0 HG LEU A 60 -5.755 -4.371 0.056 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -6.046 -6.716 0.733 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -7.584 -5.820 0.742 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -7.218 -6.947 -0.586 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.230 -6.078 -0.838 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -5.282 -6.267 -2.260 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -4.452 -4.721 -1.966 1.00 0.00 H new ATOM 590 N SER A 61 -9.647 -2.747 -2.567 1.00 0.00 N ATOM 591 CA SER A 61 -10.956 -2.657 -3.191 1.00 0.00 C ATOM 592 C SER A 61 -10.817 -2.734 -4.713 1.00 0.00 C ATOM 593 O SER A 61 -11.350 -1.889 -5.431 1.00 0.00 O ATOM 594 CB SER A 61 -11.670 -1.366 -2.788 1.00 0.00 C ATOM 595 OG SER A 61 -12.725 -1.035 -3.687 1.00 0.00 O ATOM 0 H SER A 61 -8.888 -2.329 -3.106 1.00 0.00 H new ATOM 0 HA SER A 61 -11.558 -3.497 -2.845 1.00 0.00 H new ATOM 0 HB2 SER A 61 -12.073 -1.474 -1.781 1.00 0.00 H new ATOM 0 HB3 SER A 61 -10.950 -0.548 -2.757 1.00 0.00 H new ATOM 0 HG SER A 61 -12.347 -0.771 -4.552 1.00 0.00 H new ATOM 601 N ALA A 62 -10.099 -3.754 -5.159 1.00 0.00 N ATOM 602 CA ALA A 62 -9.884 -3.952 -6.582 1.00 0.00 C ATOM 603 C ALA A 62 -11.168 -3.608 -7.340 1.00 0.00 C ATOM 604 O ALA A 62 -12.230 -4.158 -7.051 1.00 0.00 O ATOM 605 CB ALA A 62 -9.425 -5.389 -6.834 1.00 0.00 C ATOM 0 H ALA A 62 -9.659 -4.452 -4.560 1.00 0.00 H new ATOM 0 HA ALA A 62 -9.098 -3.291 -6.947 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -9.264 -5.537 -7.902 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -8.494 -5.573 -6.297 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -10.189 -6.082 -6.483 1.00 0.00 H new ATOM 611 N GLU A 63 -11.028 -2.701 -8.296 1.00 0.00 N ATOM 612 CA GLU A 63 -12.164 -2.278 -9.098 1.00 0.00 C ATOM 613 C GLU A 63 -11.971 -2.700 -10.556 1.00 0.00 C ATOM 614 O GLU A 63 -12.840 -2.467 -11.394 1.00 0.00 O ATOM 615 CB GLU A 63 -12.380 -0.768 -8.988 1.00 0.00 C ATOM 616 CG GLU A 63 -11.163 0.000 -9.509 1.00 0.00 C ATOM 617 CD GLU A 63 -11.548 0.909 -10.678 1.00 0.00 C ATOM 618 OE1 GLU A 63 -12.666 1.465 -10.621 1.00 0.00 O ATOM 619 OE2 GLU A 63 -10.716 1.026 -11.603 1.00 0.00 O ATOM 0 H GLU A 63 -10.146 -2.247 -8.533 1.00 0.00 H new ATOM 0 HA GLU A 63 -13.058 -2.769 -8.714 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -13.265 -0.481 -9.555 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.567 -0.499 -7.948 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -10.734 0.598 -8.705 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -10.394 -0.703 -9.828 1.00 0.00 H new ATOM 626 N SER A 64 -10.825 -3.314 -10.814 1.00 0.00 N ATOM 627 CA SER A 64 -10.507 -3.770 -12.156 1.00 0.00 C ATOM 628 C SER A 64 -9.072 -4.300 -12.202 1.00 0.00 C ATOM 629 O SER A 64 -8.365 -4.275 -11.196 1.00 0.00 O ATOM 630 CB SER A 64 -10.691 -2.647 -13.178 1.00 0.00 C ATOM 631 OG SER A 64 -11.930 -2.754 -13.872 1.00 0.00 O ATOM 0 H SER A 64 -10.106 -3.506 -10.116 1.00 0.00 H new ATOM 0 HA SER A 64 -11.194 -4.576 -12.415 1.00 0.00 H new ATOM 0 HB2 SER A 64 -10.642 -1.684 -12.671 1.00 0.00 H new ATOM 0 HB3 SER A 64 -9.871 -2.672 -13.895 1.00 0.00 H new ATOM 0 HG SER A 64 -12.670 -2.675 -13.234 1.00 0.00 H new ATOM 637 N VAL A 65 -8.685 -4.768 -13.380 1.00 0.00 N ATOM 638 CA VAL A 65 -7.348 -5.302 -13.570 1.00 0.00 C ATOM 639 C VAL A 65 -6.368 -4.148 -13.789 1.00 0.00 C ATOM 640 O VAL A 65 -6.745 -3.100 -14.311 1.00 0.00 O ATOM 641 CB VAL A 65 -7.347 -6.313 -14.719 1.00 0.00 C ATOM 642 CG1 VAL A 65 -8.724 -6.960 -14.881 1.00 0.00 C ATOM 643 CG2 VAL A 65 -6.891 -5.659 -16.025 1.00 0.00 C ATOM 0 H VAL A 65 -9.275 -4.788 -14.212 1.00 0.00 H new ATOM 0 HA VAL A 65 -7.022 -5.840 -12.680 1.00 0.00 H new ATOM 0 HB VAL A 65 -6.634 -7.100 -14.472 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -8.696 -7.674 -15.704 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -8.993 -7.478 -13.960 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -9.465 -6.190 -15.094 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -6.899 -6.399 -16.825 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -7.567 -4.843 -16.279 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -5.881 -5.268 -15.903 1.00 0.00 H new ATOM 653 N GLY A 66 -5.129 -4.380 -13.380 1.00 0.00 N ATOM 654 CA GLY A 66 -4.092 -3.372 -13.525 1.00 0.00 C ATOM 655 C GLY A 66 -4.480 -2.079 -12.805 1.00 0.00 C ATOM 656 O GLY A 66 -3.959 -1.010 -13.118 1.00 0.00 O ATOM 0 H GLY A 66 -4.820 -5.251 -12.948 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -3.153 -3.750 -13.120 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -3.924 -3.167 -14.582 1.00 0.00 H new ATOM 660 N GLU A 67 -5.392 -2.219 -11.854 1.00 0.00 N ATOM 661 CA GLU A 67 -5.856 -1.075 -11.087 1.00 0.00 C ATOM 662 C GLU A 67 -6.812 -1.529 -9.983 1.00 0.00 C ATOM 663 O GLU A 67 -7.845 -2.136 -10.262 1.00 0.00 O ATOM 664 CB GLU A 67 -6.520 -0.039 -11.996 1.00 0.00 C ATOM 665 CG GLU A 67 -7.418 -0.715 -13.033 1.00 0.00 C ATOM 666 CD GLU A 67 -6.851 -0.544 -14.444 1.00 0.00 C ATOM 667 OE1 GLU A 67 -5.668 -0.153 -14.536 1.00 0.00 O ATOM 668 OE2 GLU A 67 -7.614 -0.809 -15.398 1.00 0.00 O ATOM 0 H GLU A 67 -5.822 -3.107 -11.597 1.00 0.00 H new ATOM 0 HA GLU A 67 -4.993 -0.600 -10.620 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.110 0.653 -11.395 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -5.755 0.550 -12.501 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -7.512 -1.776 -12.801 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -8.420 -0.288 -12.986 1.00 0.00 H new ATOM 675 N VAL A 68 -6.435 -1.217 -8.752 1.00 0.00 N ATOM 676 CA VAL A 68 -7.246 -1.586 -7.604 1.00 0.00 C ATOM 677 C VAL A 68 -7.248 -0.434 -6.596 1.00 0.00 C ATOM 678 O VAL A 68 -6.429 0.479 -6.689 1.00 0.00 O ATOM 679 CB VAL A 68 -6.742 -2.901 -7.007 1.00 0.00 C ATOM 680 CG1 VAL A 68 -6.986 -4.067 -7.967 1.00 0.00 C ATOM 681 CG2 VAL A 68 -5.263 -2.802 -6.631 1.00 0.00 C ATOM 0 H VAL A 68 -5.578 -0.713 -8.524 1.00 0.00 H new ATOM 0 HA VAL A 68 -8.279 -1.757 -7.906 1.00 0.00 H new ATOM 0 HB VAL A 68 -7.307 -3.093 -6.095 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -6.619 -4.990 -7.519 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -8.054 -4.159 -8.164 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -6.459 -3.884 -8.903 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.931 -3.750 -6.209 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -4.676 -2.575 -7.521 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -5.127 -2.010 -5.895 1.00 0.00 H new ATOM 691 N TYR A 69 -8.178 -0.515 -5.656 1.00 0.00 N ATOM 692 CA TYR A 69 -8.298 0.509 -4.631 1.00 0.00 C ATOM 693 C TYR A 69 -7.711 0.027 -3.303 1.00 0.00 C ATOM 694 O TYR A 69 -7.283 -1.121 -3.189 1.00 0.00 O ATOM 695 CB TYR A 69 -9.797 0.754 -4.453 1.00 0.00 C ATOM 696 CG TYR A 69 -10.376 1.796 -5.412 1.00 0.00 C ATOM 697 CD1 TYR A 69 -10.179 3.141 -5.169 1.00 0.00 C ATOM 698 CD2 TYR A 69 -11.094 1.393 -6.519 1.00 0.00 C ATOM 699 CE1 TYR A 69 -10.724 4.122 -6.071 1.00 0.00 C ATOM 700 CE2 TYR A 69 -11.638 2.374 -7.421 1.00 0.00 C ATOM 701 CZ TYR A 69 -11.426 3.691 -7.153 1.00 0.00 C ATOM 702 OH TYR A 69 -11.940 4.617 -8.005 1.00 0.00 O ATOM 0 H TYR A 69 -8.856 -1.274 -5.582 1.00 0.00 H new ATOM 0 HA TYR A 69 -7.759 1.410 -4.924 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -10.328 -0.188 -4.593 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -9.983 1.076 -3.428 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -9.616 3.457 -4.303 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -11.248 0.341 -6.709 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -10.578 5.177 -5.892 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -12.202 2.071 -8.291 1.00 0.00 H new ATOM 0 HH TYR A 69 -12.416 4.164 -8.732 1.00 0.00 H new ATOM 712 N ILE A 70 -7.709 0.928 -2.332 1.00 0.00 N ATOM 713 CA ILE A 70 -7.181 0.609 -1.016 1.00 0.00 C ATOM 714 C ILE A 70 -7.780 1.568 0.014 1.00 0.00 C ATOM 715 O ILE A 70 -7.725 2.784 -0.159 1.00 0.00 O ATOM 716 CB ILE A 70 -5.651 0.608 -1.039 1.00 0.00 C ATOM 717 CG1 ILE A 70 -5.117 -0.506 -1.942 1.00 0.00 C ATOM 718 CG2 ILE A 70 -5.082 0.518 0.379 1.00 0.00 C ATOM 719 CD1 ILE A 70 -3.619 -0.724 -1.716 1.00 0.00 C ATOM 0 H ILE A 70 -8.065 1.879 -2.430 1.00 0.00 H new ATOM 0 HA ILE A 70 -7.473 -0.399 -0.722 1.00 0.00 H new ATOM 0 HB ILE A 70 -5.315 1.555 -1.462 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -5.657 -1.431 -1.742 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -5.298 -0.251 -2.986 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -3.993 0.519 0.335 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.422 1.373 0.963 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -5.425 -0.403 0.851 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -3.265 -1.521 -2.370 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.080 0.196 -1.940 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -3.445 -1.003 -0.677 1.00 0.00 H new ATOM 731 N LYS A 71 -8.338 0.984 1.065 1.00 0.00 N ATOM 732 CA LYS A 71 -8.946 1.771 2.124 1.00 0.00 C ATOM 733 C LYS A 71 -8.541 1.193 3.481 1.00 0.00 C ATOM 734 O LYS A 71 -8.741 0.007 3.739 1.00 0.00 O ATOM 735 CB LYS A 71 -10.460 1.861 1.921 1.00 0.00 C ATOM 736 CG LYS A 71 -11.010 3.178 2.473 1.00 0.00 C ATOM 737 CD LYS A 71 -12.169 2.927 3.439 1.00 0.00 C ATOM 738 CE LYS A 71 -11.667 2.336 4.757 1.00 0.00 C ATOM 739 NZ LYS A 71 -10.918 3.353 5.529 1.00 0.00 N ATOM 0 H LYS A 71 -8.382 -0.025 1.205 1.00 0.00 H new ATOM 0 HA LYS A 71 -8.581 2.798 2.094 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -10.693 1.782 0.859 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -10.948 1.022 2.418 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -10.216 3.721 2.986 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -11.348 3.808 1.650 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -12.694 3.862 3.633 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -12.887 2.247 2.982 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -12.511 1.973 5.344 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -11.026 1.478 4.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -10.878 3.070 6.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -9.952 3.432 5.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -11.397 4.272 5.449 1.00 0.00 H new ATOM 753 N SER A 72 -7.977 2.057 4.312 1.00 0.00 N ATOM 754 CA SER A 72 -7.541 1.647 5.636 1.00 0.00 C ATOM 755 C SER A 72 -8.737 1.600 6.589 1.00 0.00 C ATOM 756 O SER A 72 -8.872 2.453 7.464 1.00 0.00 O ATOM 757 CB SER A 72 -6.467 2.591 6.179 1.00 0.00 C ATOM 758 OG SER A 72 -6.027 2.209 7.479 1.00 0.00 O ATOM 0 H SER A 72 -7.812 3.040 4.094 1.00 0.00 H new ATOM 0 HA SER A 72 -7.106 0.651 5.560 1.00 0.00 H new ATOM 0 HB2 SER A 72 -5.616 2.602 5.497 1.00 0.00 H new ATOM 0 HB3 SER A 72 -6.861 3.607 6.214 1.00 0.00 H new ATOM 0 HG SER A 72 -5.603 1.327 7.435 1.00 0.00 H new ATOM 764 N THR A 73 -9.574 0.593 6.387 1.00 0.00 N ATOM 765 CA THR A 73 -10.754 0.423 7.217 1.00 0.00 C ATOM 766 C THR A 73 -10.444 0.799 8.668 1.00 0.00 C ATOM 767 O THR A 73 -9.943 -0.024 9.432 1.00 0.00 O ATOM 768 CB THR A 73 -11.244 -1.017 7.054 1.00 0.00 C ATOM 769 OG1 THR A 73 -12.524 -1.022 7.680 1.00 0.00 O ATOM 770 CG2 THR A 73 -10.423 -2.012 7.878 1.00 0.00 C ATOM 0 H THR A 73 -9.458 -0.113 5.660 1.00 0.00 H new ATOM 0 HA THR A 73 -11.556 1.092 6.905 1.00 0.00 H new ATOM 0 HB THR A 73 -11.204 -1.296 6.001 1.00 0.00 H new ATOM 0 HG1 THR A 73 -12.915 -1.919 7.619 1.00 0.00 H new ATOM 0 HG21 THR A 73 -10.812 -3.019 7.726 1.00 0.00 H new ATOM 0 HG22 THR A 73 -9.381 -1.974 7.561 1.00 0.00 H new ATOM 0 HG23 THR A 73 -10.490 -1.752 8.934 1.00 0.00 H new ATOM 778 N GLU A 74 -10.755 2.042 9.003 1.00 0.00 N ATOM 779 CA GLU A 74 -10.516 2.537 10.348 1.00 0.00 C ATOM 780 C GLU A 74 -10.801 4.038 10.420 1.00 0.00 C ATOM 781 O GLU A 74 -11.549 4.491 11.285 1.00 0.00 O ATOM 782 CB GLU A 74 -9.088 2.228 10.800 1.00 0.00 C ATOM 783 CG GLU A 74 -8.747 2.976 12.090 1.00 0.00 C ATOM 784 CD GLU A 74 -7.567 3.926 11.878 1.00 0.00 C ATOM 785 OE1 GLU A 74 -6.756 3.631 10.973 1.00 0.00 O ATOM 786 OE2 GLU A 74 -7.502 4.926 12.624 1.00 0.00 O ATOM 0 H GLU A 74 -11.171 2.722 8.366 1.00 0.00 H new ATOM 0 HA GLU A 74 -11.196 2.025 11.029 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -8.977 1.155 10.957 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -8.386 2.510 10.016 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -9.616 3.540 12.428 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -8.506 2.261 12.876 1.00 0.00 H new ATOM 793 N THR A 75 -10.190 4.769 9.498 1.00 0.00 N ATOM 794 CA THR A 75 -10.369 6.210 9.446 1.00 0.00 C ATOM 795 C THR A 75 -11.425 6.579 8.403 1.00 0.00 C ATOM 796 O THR A 75 -12.609 6.301 8.587 1.00 0.00 O ATOM 797 CB THR A 75 -9.004 6.846 9.180 1.00 0.00 C ATOM 798 OG1 THR A 75 -8.646 6.372 7.885 1.00 0.00 O ATOM 799 CG2 THR A 75 -7.910 6.291 10.095 1.00 0.00 C ATOM 0 H THR A 75 -9.571 4.390 8.782 1.00 0.00 H new ATOM 0 HA THR A 75 -10.745 6.596 10.393 1.00 0.00 H new ATOM 0 HB THR A 75 -9.075 7.925 9.313 1.00 0.00 H new ATOM 0 HG1 THR A 75 -7.773 6.738 7.633 1.00 0.00 H new ATOM 0 HG21 THR A 75 -6.962 6.776 9.864 1.00 0.00 H new ATOM 0 HG22 THR A 75 -8.173 6.484 11.135 1.00 0.00 H new ATOM 0 HG23 THR A 75 -7.815 5.216 9.938 1.00 0.00 H new ATOM 807 N GLY A 76 -10.959 7.200 7.330 1.00 0.00 N ATOM 808 CA GLY A 76 -11.849 7.610 6.257 1.00 0.00 C ATOM 809 C GLY A 76 -11.056 8.128 5.055 1.00 0.00 C ATOM 810 O GLY A 76 -11.238 9.268 4.630 1.00 0.00 O ATOM 0 H GLY A 76 -9.976 7.429 7.180 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.469 6.767 5.952 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -12.523 8.388 6.616 1.00 0.00 H new ATOM 814 N GLN A 77 -10.193 7.264 4.539 1.00 0.00 N ATOM 815 CA GLN A 77 -9.372 7.619 3.395 1.00 0.00 C ATOM 816 C GLN A 77 -8.855 6.358 2.701 1.00 0.00 C ATOM 817 O GLN A 77 -8.731 5.307 3.327 1.00 0.00 O ATOM 818 CB GLN A 77 -8.215 8.530 3.811 1.00 0.00 C ATOM 819 CG GLN A 77 -8.340 9.908 3.159 1.00 0.00 C ATOM 820 CD GLN A 77 -7.974 11.017 4.148 1.00 0.00 C ATOM 821 OE1 GLN A 77 -6.838 11.453 4.239 1.00 0.00 O ATOM 822 NE2 GLN A 77 -8.997 11.448 4.881 1.00 0.00 N ATOM 0 H GLN A 77 -10.045 6.319 4.893 1.00 0.00 H new ATOM 0 HA GLN A 77 -9.990 8.172 2.687 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -8.204 8.637 4.896 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -7.267 8.073 3.526 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -7.687 9.963 2.288 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -9.360 10.055 2.803 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -9.923 11.040 4.754 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -8.855 12.187 5.570 1.00 0.00 H new ATOM 831 N TYR A 78 -8.566 6.504 1.416 1.00 0.00 N ATOM 832 CA TYR A 78 -8.065 5.389 0.630 1.00 0.00 C ATOM 833 C TYR A 78 -6.621 5.635 0.188 1.00 0.00 C ATOM 834 O TYR A 78 -6.286 6.726 -0.271 1.00 0.00 O ATOM 835 CB TYR A 78 -8.959 5.311 -0.610 1.00 0.00 C ATOM 836 CG TYR A 78 -10.438 5.077 -0.297 1.00 0.00 C ATOM 837 CD1 TYR A 78 -11.159 6.034 0.387 1.00 0.00 C ATOM 838 CD2 TYR A 78 -11.051 3.907 -0.699 1.00 0.00 C ATOM 839 CE1 TYR A 78 -12.551 5.813 0.682 1.00 0.00 C ATOM 840 CE2 TYR A 78 -12.443 3.686 -0.404 1.00 0.00 C ATOM 841 CZ TYR A 78 -13.125 4.650 0.272 1.00 0.00 C ATOM 842 OH TYR A 78 -14.439 4.441 0.550 1.00 0.00 O ATOM 0 H TYR A 78 -8.669 7.378 0.900 1.00 0.00 H new ATOM 0 HA TYR A 78 -8.081 4.470 1.215 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -8.860 6.238 -1.175 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -8.602 4.506 -1.252 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -10.679 6.949 0.701 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -10.487 3.158 -1.234 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -13.126 6.554 1.217 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -12.935 2.775 -0.712 1.00 0.00 H new ATOM 0 HH TYR A 78 -14.714 3.569 0.196 1.00 0.00 H new ATOM 852 N LEU A 79 -5.805 4.603 0.343 1.00 0.00 N ATOM 853 CA LEU A 79 -4.405 4.693 -0.034 1.00 0.00 C ATOM 854 C LEU A 79 -4.295 5.323 -1.425 1.00 0.00 C ATOM 855 O LEU A 79 -5.157 5.110 -2.276 1.00 0.00 O ATOM 856 CB LEU A 79 -3.731 3.324 0.075 1.00 0.00 C ATOM 857 CG LEU A 79 -2.239 3.336 0.413 1.00 0.00 C ATOM 858 CD1 LEU A 79 -1.942 4.311 1.554 1.00 0.00 C ATOM 859 CD2 LEU A 79 -1.735 1.924 0.720 1.00 0.00 C ATOM 0 H LEU A 79 -6.087 3.700 0.725 1.00 0.00 H new ATOM 0 HA LEU A 79 -3.867 5.344 0.655 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -4.251 2.745 0.838 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.865 2.799 -0.871 1.00 0.00 H new ATOM 0 HG LEU A 79 -1.694 3.690 -0.462 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -0.874 4.300 1.774 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -2.241 5.317 1.260 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -2.498 4.012 2.442 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.672 1.961 0.957 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -2.283 1.519 1.571 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -1.891 1.285 -0.149 1.00 0.00 H new ATOM 871 N ALA A 80 -3.227 6.085 -1.611 1.00 0.00 N ATOM 872 CA ALA A 80 -2.994 6.747 -2.883 1.00 0.00 C ATOM 873 C ALA A 80 -1.548 7.245 -2.937 1.00 0.00 C ATOM 874 O ALA A 80 -0.808 7.119 -1.962 1.00 0.00 O ATOM 875 CB ALA A 80 -4.007 7.879 -3.064 1.00 0.00 C ATOM 0 H ALA A 80 -2.514 6.258 -0.903 1.00 0.00 H new ATOM 0 HA ALA A 80 -3.134 6.050 -3.709 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -3.831 8.375 -4.019 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -5.017 7.469 -3.048 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -3.895 8.600 -2.254 1.00 0.00 H new ATOM 881 N MET A 81 -1.188 7.799 -4.085 1.00 0.00 N ATOM 882 CA MET A 81 0.156 8.316 -4.278 1.00 0.00 C ATOM 883 C MET A 81 0.133 9.615 -5.086 1.00 0.00 C ATOM 884 O MET A 81 -0.224 9.612 -6.263 1.00 0.00 O ATOM 885 CB MET A 81 1.004 7.274 -5.010 1.00 0.00 C ATOM 886 CG MET A 81 2.301 6.991 -4.250 1.00 0.00 C ATOM 887 SD MET A 81 3.586 6.512 -5.392 1.00 0.00 S ATOM 888 CE MET A 81 4.091 4.964 -4.660 1.00 0.00 C ATOM 0 H MET A 81 -1.804 7.901 -4.892 1.00 0.00 H new ATOM 0 HA MET A 81 0.588 8.526 -3.300 1.00 0.00 H new ATOM 0 HB2 MET A 81 0.435 6.351 -5.122 1.00 0.00 H new ATOM 0 HB3 MET A 81 1.237 7.629 -6.014 1.00 0.00 H new ATOM 0 HG2 MET A 81 2.608 7.878 -3.695 1.00 0.00 H new ATOM 0 HG3 MET A 81 2.139 6.199 -3.519 1.00 0.00 H new ATOM 0 HE1 MET A 81 4.831 4.483 -5.300 1.00 0.00 H new ATOM 0 HE2 MET A 81 4.527 5.151 -3.679 1.00 0.00 H new ATOM 0 HE3 MET A 81 3.224 4.312 -4.554 1.00 0.00 H new ATOM 898 N ASP A 82 0.518 10.695 -4.422 1.00 0.00 N ATOM 899 CA ASP A 82 0.546 11.998 -5.064 1.00 0.00 C ATOM 900 C ASP A 82 1.707 12.046 -6.059 1.00 0.00 C ATOM 901 O ASP A 82 2.456 11.080 -6.192 1.00 0.00 O ATOM 902 CB ASP A 82 0.756 13.113 -4.038 1.00 0.00 C ATOM 903 CG ASP A 82 -0.379 13.284 -3.027 1.00 0.00 C ATOM 904 OD1 ASP A 82 -1.526 13.472 -3.488 1.00 0.00 O ATOM 905 OD2 ASP A 82 -0.075 13.223 -1.816 1.00 0.00 O ATOM 0 H ASP A 82 0.813 10.694 -3.446 1.00 0.00 H new ATOM 0 HA ASP A 82 -0.409 12.147 -5.567 1.00 0.00 H new ATOM 0 HB2 ASP A 82 1.680 12.916 -3.494 1.00 0.00 H new ATOM 0 HB3 ASP A 82 0.893 14.054 -4.570 1.00 0.00 H new ATOM 910 N THR A 83 1.820 13.181 -6.734 1.00 0.00 N ATOM 911 CA THR A 83 2.876 13.368 -7.713 1.00 0.00 C ATOM 912 C THR A 83 4.248 13.256 -7.045 1.00 0.00 C ATOM 913 O THR A 83 5.266 13.132 -7.726 1.00 0.00 O ATOM 914 CB THR A 83 2.646 14.713 -8.406 1.00 0.00 C ATOM 915 OG1 THR A 83 1.567 14.462 -9.302 1.00 0.00 O ATOM 916 CG2 THR A 83 3.807 15.106 -9.322 1.00 0.00 C ATOM 0 H THR A 83 1.197 13.981 -6.621 1.00 0.00 H new ATOM 0 HA THR A 83 2.854 12.587 -8.473 1.00 0.00 H new ATOM 0 HB THR A 83 2.499 15.488 -7.654 1.00 0.00 H new ATOM 0 HG1 THR A 83 1.351 15.283 -9.792 1.00 0.00 H new ATOM 0 HG21 THR A 83 3.593 16.068 -9.789 1.00 0.00 H new ATOM 0 HG22 THR A 83 4.723 15.183 -8.736 1.00 0.00 H new ATOM 0 HG23 THR A 83 3.933 14.348 -10.095 1.00 0.00 H new ATOM 924 N ASP A 84 4.232 13.303 -5.721 1.00 0.00 N ATOM 925 CA ASP A 84 5.462 13.208 -4.954 1.00 0.00 C ATOM 926 C ASP A 84 5.778 11.735 -4.686 1.00 0.00 C ATOM 927 O ASP A 84 6.635 11.421 -3.861 1.00 0.00 O ATOM 928 CB ASP A 84 5.326 13.916 -3.604 1.00 0.00 C ATOM 929 CG ASP A 84 6.437 14.917 -3.284 1.00 0.00 C ATOM 930 OD1 ASP A 84 6.509 15.935 -4.007 1.00 0.00 O ATOM 931 OD2 ASP A 84 7.189 14.643 -2.324 1.00 0.00 O ATOM 0 H ASP A 84 3.386 13.406 -5.160 1.00 0.00 H new ATOM 0 HA ASP A 84 6.256 13.682 -5.531 1.00 0.00 H new ATOM 0 HB2 ASP A 84 4.369 14.438 -3.579 1.00 0.00 H new ATOM 0 HB3 ASP A 84 5.299 13.163 -2.817 1.00 0.00 H new ATOM 936 N GLY A 85 5.069 10.872 -5.398 1.00 0.00 N ATOM 937 CA GLY A 85 5.263 9.440 -5.247 1.00 0.00 C ATOM 938 C GLY A 85 5.305 9.045 -3.769 1.00 0.00 C ATOM 939 O GLY A 85 5.926 8.047 -3.407 1.00 0.00 O ATOM 0 H GLY A 85 4.359 11.137 -6.081 1.00 0.00 H new ATOM 0 HA2 GLY A 85 4.456 8.905 -5.747 1.00 0.00 H new ATOM 0 HA3 GLY A 85 6.192 9.142 -5.733 1.00 0.00 H new ATOM 943 N LEU A 86 4.636 9.848 -2.955 1.00 0.00 N ATOM 944 CA LEU A 86 4.589 9.595 -1.525 1.00 0.00 C ATOM 945 C LEU A 86 3.194 9.094 -1.146 1.00 0.00 C ATOM 946 O LEU A 86 2.227 9.853 -1.184 1.00 0.00 O ATOM 947 CB LEU A 86 5.030 10.836 -0.747 1.00 0.00 C ATOM 948 CG LEU A 86 5.622 10.583 0.641 1.00 0.00 C ATOM 949 CD1 LEU A 86 5.937 11.900 1.352 1.00 0.00 C ATOM 950 CD2 LEU A 86 4.703 9.687 1.474 1.00 0.00 C ATOM 0 H LEU A 86 4.122 10.675 -3.259 1.00 0.00 H new ATOM 0 HA LEU A 86 5.294 8.810 -1.253 1.00 0.00 H new ATOM 0 HB2 LEU A 86 5.769 11.371 -1.343 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.170 11.497 -0.638 1.00 0.00 H new ATOM 0 HG LEU A 86 6.565 10.051 0.518 1.00 0.00 H new ATOM 0 HD11 LEU A 86 6.356 11.691 2.336 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.658 12.468 0.764 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.022 12.481 1.464 1.00 0.00 H new ATOM 0 HD21 LEU A 86 5.147 9.523 2.456 1.00 0.00 H new ATOM 0 HD22 LEU A 86 3.733 10.170 1.591 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.574 8.729 0.970 1.00 0.00 H new ATOM 962 N LEU A 87 3.135 7.820 -0.789 1.00 0.00 N ATOM 963 CA LEU A 87 1.874 7.209 -0.403 1.00 0.00 C ATOM 964 C LEU A 87 1.068 8.201 0.437 1.00 0.00 C ATOM 965 O LEU A 87 1.616 8.868 1.314 1.00 0.00 O ATOM 966 CB LEU A 87 2.119 5.869 0.294 1.00 0.00 C ATOM 967 CG LEU A 87 1.778 4.618 -0.518 1.00 0.00 C ATOM 968 CD1 LEU A 87 2.591 4.566 -1.812 1.00 0.00 C ATOM 969 CD2 LEU A 87 1.958 3.353 0.324 1.00 0.00 C ATOM 0 H LEU A 87 3.940 7.194 -0.759 1.00 0.00 H new ATOM 0 HA LEU A 87 1.276 6.978 -1.285 1.00 0.00 H new ATOM 0 HB2 LEU A 87 3.170 5.817 0.579 1.00 0.00 H new ATOM 0 HB3 LEU A 87 1.537 5.850 1.215 1.00 0.00 H new ATOM 0 HG LEU A 87 0.727 4.670 -0.801 1.00 0.00 H new ATOM 0 HD11 LEU A 87 2.329 3.667 -2.370 1.00 0.00 H new ATOM 0 HD12 LEU A 87 2.370 5.446 -2.416 1.00 0.00 H new ATOM 0 HD13 LEU A 87 3.654 4.548 -1.573 1.00 0.00 H new ATOM 0 HD21 LEU A 87 1.709 2.478 -0.276 1.00 0.00 H new ATOM 0 HD22 LEU A 87 2.993 3.282 0.657 1.00 0.00 H new ATOM 0 HD23 LEU A 87 1.300 3.397 1.192 1.00 0.00 H new ATOM 981 N TYR A 88 -0.222 8.267 0.141 1.00 0.00 N ATOM 982 CA TYR A 88 -1.109 9.167 0.858 1.00 0.00 C ATOM 983 C TYR A 88 -2.574 8.780 0.643 1.00 0.00 C ATOM 984 O TYR A 88 -2.940 8.291 -0.425 1.00 0.00 O ATOM 985 CB TYR A 88 -0.870 10.557 0.266 1.00 0.00 C ATOM 986 CG TYR A 88 -1.785 10.898 -0.911 1.00 0.00 C ATOM 987 CD1 TYR A 88 -1.612 10.265 -2.126 1.00 0.00 C ATOM 988 CD2 TYR A 88 -2.783 11.839 -0.759 1.00 0.00 C ATOM 989 CE1 TYR A 88 -2.474 10.587 -3.234 1.00 0.00 C ATOM 990 CE2 TYR A 88 -3.645 12.160 -1.867 1.00 0.00 C ATOM 991 CZ TYR A 88 -3.448 11.518 -3.050 1.00 0.00 C ATOM 992 OH TYR A 88 -4.262 11.821 -4.096 1.00 0.00 O ATOM 0 H TYR A 88 -0.674 7.712 -0.586 1.00 0.00 H new ATOM 0 HA TYR A 88 -0.909 9.129 1.929 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -1.009 11.303 1.049 1.00 0.00 H new ATOM 0 HB3 TYR A 88 0.167 10.628 -0.061 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -0.831 9.529 -2.245 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -2.918 12.335 0.191 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -2.350 10.100 -4.190 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -4.430 12.894 -1.761 1.00 0.00 H new ATOM 0 HH TYR A 88 -3.815 12.467 -4.682 1.00 0.00 H new ATOM 1002 N GLY A 89 -3.372 9.012 1.675 1.00 0.00 N ATOM 1003 CA GLY A 89 -4.788 8.693 1.612 1.00 0.00 C ATOM 1004 C GLY A 89 -5.561 9.776 0.855 1.00 0.00 C ATOM 1005 O GLY A 89 -5.263 10.962 0.986 1.00 0.00 O ATOM 0 H GLY A 89 -3.065 9.417 2.559 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -4.926 7.731 1.119 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -5.187 8.594 2.621 1.00 0.00 H new ATOM 1009 N SER A 90 -6.538 9.329 0.080 1.00 0.00 N ATOM 1010 CA SER A 90 -7.355 10.245 -0.697 1.00 0.00 C ATOM 1011 C SER A 90 -8.833 9.877 -0.554 1.00 0.00 C ATOM 1012 O SER A 90 -9.230 8.754 -0.858 1.00 0.00 O ATOM 1013 CB SER A 90 -6.946 10.232 -2.172 1.00 0.00 C ATOM 1014 OG SER A 90 -6.968 11.537 -2.743 1.00 0.00 O ATOM 0 H SER A 90 -6.782 8.344 -0.026 1.00 0.00 H new ATOM 0 HA SER A 90 -7.199 11.253 -0.313 1.00 0.00 H new ATOM 0 HB2 SER A 90 -5.945 9.811 -2.267 1.00 0.00 H new ATOM 0 HB3 SER A 90 -7.619 9.581 -2.729 1.00 0.00 H new ATOM 0 HG SER A 90 -6.119 11.708 -3.202 1.00 0.00 H new ATOM 1020 N GLN A 91 -9.609 10.847 -0.090 1.00 0.00 N ATOM 1021 CA GLN A 91 -11.034 10.640 0.098 1.00 0.00 C ATOM 1022 C GLN A 91 -11.756 10.661 -1.251 1.00 0.00 C ATOM 1023 O GLN A 91 -12.974 10.502 -1.310 1.00 0.00 O ATOM 1024 CB GLN A 91 -11.620 11.685 1.049 1.00 0.00 C ATOM 1025 CG GLN A 91 -13.001 11.259 1.550 1.00 0.00 C ATOM 1026 CD GLN A 91 -13.918 12.470 1.727 1.00 0.00 C ATOM 1027 OE1 GLN A 91 -14.187 12.922 2.828 1.00 0.00 O ATOM 1028 NE2 GLN A 91 -14.382 12.970 0.585 1.00 0.00 N ATOM 0 H GLN A 91 -9.277 11.778 0.161 1.00 0.00 H new ATOM 0 HA GLN A 91 -11.181 9.660 0.552 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -10.950 11.827 1.897 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -11.695 12.645 0.538 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -13.448 10.560 0.843 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -12.901 10.732 2.499 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -14.118 12.544 -0.303 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -15.002 13.780 0.597 1.00 0.00 H new ATOM 1037 N THR A 92 -10.973 10.859 -2.302 1.00 0.00 N ATOM 1038 CA THR A 92 -11.522 10.903 -3.647 1.00 0.00 C ATOM 1039 C THR A 92 -10.994 9.732 -4.477 1.00 0.00 C ATOM 1040 O THR A 92 -9.914 9.817 -5.060 1.00 0.00 O ATOM 1041 CB THR A 92 -11.193 12.271 -4.247 1.00 0.00 C ATOM 1042 OG1 THR A 92 -9.825 12.163 -4.628 1.00 0.00 O ATOM 1043 CG2 THR A 92 -11.202 13.387 -3.200 1.00 0.00 C ATOM 0 H THR A 92 -9.963 10.991 -2.249 1.00 0.00 H new ATOM 0 HA THR A 92 -12.606 10.789 -3.636 1.00 0.00 H new ATOM 0 HB THR A 92 -11.911 12.505 -5.033 1.00 0.00 H new ATOM 0 HG1 THR A 92 -9.728 11.460 -5.304 1.00 0.00 H new ATOM 0 HG21 THR A 92 -10.962 14.337 -3.678 1.00 0.00 H new ATOM 0 HG22 THR A 92 -12.190 13.450 -2.744 1.00 0.00 H new ATOM 0 HG23 THR A 92 -10.460 13.171 -2.431 1.00 0.00 H new ATOM 1051 N PRO A 93 -11.800 8.637 -4.506 1.00 0.00 N ATOM 1052 CA PRO A 93 -11.425 7.450 -5.255 1.00 0.00 C ATOM 1053 C PRO A 93 -11.611 7.669 -6.758 1.00 0.00 C ATOM 1054 O PRO A 93 -12.737 7.675 -7.253 1.00 0.00 O ATOM 1055 CB PRO A 93 -12.306 6.341 -4.703 1.00 0.00 C ATOM 1056 CG PRO A 93 -13.459 7.037 -3.998 1.00 0.00 C ATOM 1057 CD PRO A 93 -13.086 8.501 -3.827 1.00 0.00 C ATOM 0 HA PRO A 93 -10.371 7.197 -5.141 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -12.669 5.696 -5.503 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -11.750 5.708 -4.011 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -14.375 6.942 -4.580 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -13.648 6.576 -3.029 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -13.838 9.155 -4.268 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -13.008 8.769 -2.773 1.00 0.00 H new ATOM 1065 N ASN A 94 -10.490 7.844 -7.441 1.00 0.00 N ATOM 1066 CA ASN A 94 -10.515 8.063 -8.878 1.00 0.00 C ATOM 1067 C ASN A 94 -9.132 7.765 -9.459 1.00 0.00 C ATOM 1068 O ASN A 94 -8.373 6.978 -8.894 1.00 0.00 O ATOM 1069 CB ASN A 94 -10.863 9.516 -9.207 1.00 0.00 C ATOM 1070 CG ASN A 94 -12.003 10.021 -8.321 1.00 0.00 C ATOM 1071 OD1 ASN A 94 -11.631 10.322 -7.080 1.00 0.00 O flip ATOM 1072 ND2 ASN A 94 -13.145 10.131 -8.737 1.00 0.00 N flip ATOM 0 H ASN A 94 -9.558 7.839 -7.027 1.00 0.00 H new ATOM 0 HA ASN A 94 -11.271 7.405 -9.307 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -9.984 10.145 -9.068 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -11.150 9.597 -10.256 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -13.362 9.882 -9.702 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -13.882 10.472 -8.120 1.00 0.00 H new ATOM 1079 N GLU A 95 -8.845 8.409 -10.581 1.00 0.00 N ATOM 1080 CA GLU A 95 -7.566 8.222 -11.245 1.00 0.00 C ATOM 1081 C GLU A 95 -6.434 8.788 -10.385 1.00 0.00 C ATOM 1082 O GLU A 95 -5.807 9.780 -10.753 1.00 0.00 O ATOM 1083 CB GLU A 95 -7.572 8.862 -12.635 1.00 0.00 C ATOM 1084 CG GLU A 95 -7.825 7.814 -13.720 1.00 0.00 C ATOM 1085 CD GLU A 95 -9.260 7.902 -14.244 1.00 0.00 C ATOM 1086 OE1 GLU A 95 -9.513 8.823 -15.050 1.00 0.00 O ATOM 1087 OE2 GLU A 95 -10.070 7.047 -13.827 1.00 0.00 O ATOM 0 H GLU A 95 -9.476 9.061 -11.047 1.00 0.00 H new ATOM 0 HA GLU A 95 -7.398 7.153 -11.374 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -8.342 9.632 -12.681 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -6.617 9.355 -12.816 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.124 7.960 -14.542 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -7.641 6.818 -13.318 1.00 0.00 H new ATOM 1094 N GLU A 96 -6.207 8.132 -9.257 1.00 0.00 N ATOM 1095 CA GLU A 96 -5.161 8.557 -8.342 1.00 0.00 C ATOM 1096 C GLU A 96 -5.030 7.563 -7.186 1.00 0.00 C ATOM 1097 O GLU A 96 -3.960 6.998 -6.968 1.00 0.00 O ATOM 1098 CB GLU A 96 -5.430 9.971 -7.821 1.00 0.00 C ATOM 1099 CG GLU A 96 -4.336 10.413 -6.847 1.00 0.00 C ATOM 1100 CD GLU A 96 -4.132 11.929 -6.903 1.00 0.00 C ATOM 1101 OE1 GLU A 96 -5.056 12.607 -7.403 1.00 0.00 O ATOM 1102 OE2 GLU A 96 -3.059 12.374 -6.444 1.00 0.00 O ATOM 0 H GLU A 96 -6.729 7.309 -8.956 1.00 0.00 H new ATOM 0 HA GLU A 96 -4.217 8.578 -8.886 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -5.480 10.668 -8.658 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -6.399 10.001 -7.323 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -4.605 10.116 -5.833 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -3.401 9.907 -7.090 1.00 0.00 H new ATOM 1109 N CYS A 97 -6.134 7.380 -6.477 1.00 0.00 N ATOM 1110 CA CYS A 97 -6.156 6.464 -5.350 1.00 0.00 C ATOM 1111 C CYS A 97 -5.930 5.046 -5.878 1.00 0.00 C ATOM 1112 O CYS A 97 -5.431 4.183 -5.157 1.00 0.00 O ATOM 1113 CB CYS A 97 -7.459 6.575 -4.555 1.00 0.00 C ATOM 1114 SG CYS A 97 -7.712 5.066 -3.552 1.00 0.00 S ATOM 0 H CYS A 97 -7.020 7.851 -6.661 1.00 0.00 H new ATOM 0 HA CYS A 97 -5.359 6.723 -4.653 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -7.425 7.451 -3.907 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -8.299 6.714 -5.236 1.00 0.00 H new ATOM 0 HG CYS A 97 -6.614 4.777 -2.919 1.00 0.00 H new ATOM 1120 N LEU A 98 -6.307 4.849 -7.133 1.00 0.00 N ATOM 1121 CA LEU A 98 -6.152 3.551 -7.767 1.00 0.00 C ATOM 1122 C LEU A 98 -4.709 3.072 -7.590 1.00 0.00 C ATOM 1123 O LEU A 98 -3.825 3.861 -7.260 1.00 0.00 O ATOM 1124 CB LEU A 98 -6.606 3.609 -9.226 1.00 0.00 C ATOM 1125 CG LEU A 98 -8.081 3.293 -9.483 1.00 0.00 C ATOM 1126 CD1 LEU A 98 -8.321 1.782 -9.508 1.00 0.00 C ATOM 1127 CD2 LEU A 98 -8.978 3.999 -8.465 1.00 0.00 C ATOM 0 H LEU A 98 -6.720 5.567 -7.728 1.00 0.00 H new ATOM 0 HA LEU A 98 -6.795 2.813 -7.287 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -6.396 4.607 -9.612 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.000 2.910 -9.802 1.00 0.00 H new ATOM 0 HG LEU A 98 -8.347 3.678 -10.468 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -9.377 1.584 -9.692 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -7.724 1.332 -10.301 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -8.033 1.352 -8.549 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -10.021 3.758 -8.670 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -8.719 3.666 -7.460 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -8.834 5.077 -8.539 1.00 0.00 H new ATOM 1139 N PHE A 99 -4.516 1.781 -7.818 1.00 0.00 N ATOM 1140 CA PHE A 99 -3.196 1.187 -7.689 1.00 0.00 C ATOM 1141 C PHE A 99 -2.982 0.093 -8.737 1.00 0.00 C ATOM 1142 O PHE A 99 -3.521 -1.005 -8.611 1.00 0.00 O ATOM 1143 CB PHE A 99 -3.122 0.563 -6.294 1.00 0.00 C ATOM 1144 CG PHE A 99 -2.152 1.271 -5.346 1.00 0.00 C ATOM 1145 CD1 PHE A 99 -0.981 1.774 -5.822 1.00 0.00 C ATOM 1146 CD2 PHE A 99 -2.461 1.399 -4.028 1.00 0.00 C ATOM 1147 CE1 PHE A 99 -0.081 2.432 -4.942 1.00 0.00 C ATOM 1148 CE2 PHE A 99 -1.561 2.056 -3.148 1.00 0.00 C ATOM 1149 CZ PHE A 99 -0.390 2.559 -3.624 1.00 0.00 C ATOM 0 H PHE A 99 -5.252 1.130 -8.091 1.00 0.00 H new ATOM 0 HA PHE A 99 -2.429 1.948 -7.836 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -4.118 0.571 -5.851 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -2.824 -0.481 -6.390 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -0.736 1.673 -6.869 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.391 1.001 -3.650 1.00 0.00 H new ATOM 0 HE1 PHE A 99 0.849 2.831 -5.320 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -1.806 2.156 -2.101 1.00 0.00 H new ATOM 0 HZ PHE A 99 0.294 3.059 -2.955 1.00 0.00 H new ATOM 1159 N LEU A 100 -2.194 0.432 -9.747 1.00 0.00 N ATOM 1160 CA LEU A 100 -1.902 -0.508 -10.815 1.00 0.00 C ATOM 1161 C LEU A 100 -1.377 -1.812 -10.212 1.00 0.00 C ATOM 1162 O LEU A 100 -0.190 -1.927 -9.910 1.00 0.00 O ATOM 1163 CB LEU A 100 -0.955 0.122 -11.839 1.00 0.00 C ATOM 1164 CG LEU A 100 -1.591 0.564 -13.158 1.00 0.00 C ATOM 1165 CD1 LEU A 100 -1.005 1.897 -13.629 1.00 0.00 C ATOM 1166 CD2 LEU A 100 -1.460 -0.527 -14.222 1.00 0.00 C ATOM 0 H LEU A 100 -1.749 1.344 -9.848 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.810 -0.754 -11.365 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.480 0.989 -11.380 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -0.164 -0.594 -12.062 1.00 0.00 H new ATOM 0 HG LEU A 100 -2.656 0.722 -12.988 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -1.474 2.189 -14.569 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -1.192 2.663 -12.877 1.00 0.00 H new ATOM 0 HD13 LEU A 100 0.069 1.790 -13.778 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -1.920 -0.187 -15.150 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.405 -0.740 -14.397 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -1.961 -1.432 -13.879 1.00 0.00 H new ATOM 1178 N GLU A 101 -2.286 -2.763 -10.056 1.00 0.00 N ATOM 1179 CA GLU A 101 -1.929 -4.055 -9.494 1.00 0.00 C ATOM 1180 C GLU A 101 -1.497 -5.015 -10.604 1.00 0.00 C ATOM 1181 O GLU A 101 -1.774 -4.776 -11.779 1.00 0.00 O ATOM 1182 CB GLU A 101 -3.088 -4.639 -8.684 1.00 0.00 C ATOM 1183 CG GLU A 101 -2.572 -5.552 -7.569 1.00 0.00 C ATOM 1184 CD GLU A 101 -3.194 -6.946 -7.671 1.00 0.00 C ATOM 1185 OE1 GLU A 101 -4.353 -7.084 -7.225 1.00 0.00 O ATOM 1186 OE2 GLU A 101 -2.495 -7.842 -8.191 1.00 0.00 O ATOM 0 H GLU A 101 -3.269 -2.665 -10.309 1.00 0.00 H new ATOM 0 HA GLU A 101 -1.088 -3.915 -8.814 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -3.679 -3.831 -8.253 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -3.750 -5.201 -9.343 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -1.486 -5.629 -7.630 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -2.807 -5.115 -6.598 1.00 0.00 H new ATOM 1193 N ARG A 102 -0.827 -6.081 -10.193 1.00 0.00 N ATOM 1194 CA ARG A 102 -0.354 -7.078 -11.138 1.00 0.00 C ATOM 1195 C ARG A 102 0.392 -8.194 -10.403 1.00 0.00 C ATOM 1196 O ARG A 102 1.591 -8.083 -10.152 1.00 0.00 O ATOM 1197 CB ARG A 102 0.575 -6.453 -12.180 1.00 0.00 C ATOM 1198 CG ARG A 102 1.245 -5.192 -11.631 1.00 0.00 C ATOM 1199 CD ARG A 102 0.925 -3.977 -12.504 1.00 0.00 C ATOM 1200 NE ARG A 102 2.169 -3.240 -12.821 1.00 0.00 N ATOM 1201 CZ ARG A 102 3.182 -3.748 -13.535 1.00 0.00 C ATOM 1202 NH1 ARG A 102 3.105 -4.998 -14.012 1.00 0.00 N ATOM 1203 NH2 ARG A 102 4.273 -3.007 -13.774 1.00 0.00 N ATOM 0 H ARG A 102 -0.600 -6.276 -9.218 1.00 0.00 H new ATOM 0 HA ARG A 102 -1.225 -7.492 -11.647 1.00 0.00 H new ATOM 0 HB2 ARG A 102 1.337 -7.175 -12.473 1.00 0.00 H new ATOM 0 HB3 ARG A 102 0.007 -6.206 -13.077 1.00 0.00 H new ATOM 0 HG2 ARG A 102 0.906 -5.011 -10.611 1.00 0.00 H new ATOM 0 HG3 ARG A 102 2.324 -5.339 -11.587 1.00 0.00 H new ATOM 0 HD2 ARG A 102 0.438 -4.298 -13.425 1.00 0.00 H new ATOM 0 HD3 ARG A 102 0.226 -3.321 -11.986 1.00 0.00 H new ATOM 0 HE ARG A 102 2.261 -2.285 -12.474 1.00 0.00 H new ATOM 0 HH11 ARG A 102 2.275 -5.563 -13.831 1.00 0.00 H new ATOM 0 HH12 ARG A 102 3.876 -5.385 -14.556 1.00 0.00 H new ATOM 0 HH21 ARG A 102 4.332 -2.055 -13.412 1.00 0.00 H new ATOM 0 HH22 ARG A 102 5.044 -3.395 -14.318 1.00 0.00 H new ATOM 1217 N LEU A 103 -0.348 -9.244 -10.080 1.00 0.00 N ATOM 1218 CA LEU A 103 0.229 -10.379 -9.380 1.00 0.00 C ATOM 1219 C LEU A 103 1.697 -10.529 -9.782 1.00 0.00 C ATOM 1220 O LEU A 103 2.004 -11.116 -10.818 1.00 0.00 O ATOM 1221 CB LEU A 103 -0.606 -11.638 -9.621 1.00 0.00 C ATOM 1222 CG LEU A 103 -0.872 -12.512 -8.393 1.00 0.00 C ATOM 1223 CD1 LEU A 103 -2.062 -13.444 -8.631 1.00 0.00 C ATOM 1224 CD2 LEU A 103 0.386 -13.282 -7.985 1.00 0.00 C ATOM 0 H LEU A 103 -1.342 -9.333 -10.290 1.00 0.00 H new ATOM 0 HA LEU A 103 0.209 -10.212 -8.303 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -1.565 -11.338 -10.044 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.102 -12.246 -10.373 1.00 0.00 H new ATOM 0 HG LEU A 103 -1.135 -11.860 -7.560 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.230 -14.054 -7.743 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -2.953 -12.851 -8.837 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -1.852 -14.092 -9.482 1.00 0.00 H new ATOM 0 HD21 LEU A 103 0.170 -13.895 -7.110 1.00 0.00 H new ATOM 0 HD22 LEU A 103 0.703 -13.923 -8.808 1.00 0.00 H new ATOM 0 HD23 LEU A 103 1.183 -12.577 -7.746 1.00 0.00 H new ATOM 1236 N GLU A 104 2.566 -9.987 -8.941 1.00 0.00 N ATOM 1237 CA GLU A 104 3.995 -10.053 -9.196 1.00 0.00 C ATOM 1238 C GLU A 104 4.470 -11.507 -9.183 1.00 0.00 C ATOM 1239 O GLU A 104 5.024 -11.992 -10.169 1.00 0.00 O ATOM 1240 CB GLU A 104 4.772 -9.213 -8.180 1.00 0.00 C ATOM 1241 CG GLU A 104 6.247 -9.620 -8.147 1.00 0.00 C ATOM 1242 CD GLU A 104 6.456 -10.856 -7.271 1.00 0.00 C ATOM 1243 OE1 GLU A 104 5.801 -10.916 -6.209 1.00 0.00 O ATOM 1244 OE2 GLU A 104 7.266 -11.714 -7.684 1.00 0.00 O ATOM 0 H GLU A 104 2.308 -9.500 -8.083 1.00 0.00 H new ATOM 0 HA GLU A 104 4.188 -9.638 -10.185 1.00 0.00 H new ATOM 0 HB2 GLU A 104 4.688 -8.157 -8.436 1.00 0.00 H new ATOM 0 HB3 GLU A 104 4.334 -9.337 -7.189 1.00 0.00 H new ATOM 0 HG2 GLU A 104 6.594 -9.825 -9.160 1.00 0.00 H new ATOM 0 HG3 GLU A 104 6.847 -8.794 -7.766 1.00 0.00 H new ATOM 1251 N GLU A 105 4.235 -12.163 -8.056 1.00 0.00 N ATOM 1252 CA GLU A 105 4.632 -13.552 -7.902 1.00 0.00 C ATOM 1253 C GLU A 105 3.424 -14.473 -8.084 1.00 0.00 C ATOM 1254 O GLU A 105 2.870 -14.567 -9.178 1.00 0.00 O ATOM 1255 CB GLU A 105 5.299 -13.785 -6.545 1.00 0.00 C ATOM 1256 CG GLU A 105 5.792 -15.228 -6.416 1.00 0.00 C ATOM 1257 CD GLU A 105 7.303 -15.272 -6.182 1.00 0.00 C ATOM 1258 OE1 GLU A 105 8.001 -14.460 -6.827 1.00 0.00 O ATOM 1259 OE2 GLU A 105 7.727 -16.117 -5.364 1.00 0.00 O ATOM 0 H GLU A 105 3.775 -11.758 -7.241 1.00 0.00 H new ATOM 0 HA GLU A 105 5.364 -13.788 -8.675 1.00 0.00 H new ATOM 0 HB2 GLU A 105 6.137 -13.099 -6.425 1.00 0.00 H new ATOM 0 HB3 GLU A 105 4.591 -13.566 -5.746 1.00 0.00 H new ATOM 0 HG2 GLU A 105 5.278 -15.719 -5.590 1.00 0.00 H new ATOM 0 HG3 GLU A 105 5.544 -15.783 -7.321 1.00 0.00 H new ATOM 1266 N ASN A 106 3.051 -15.129 -6.995 1.00 0.00 N ATOM 1267 CA ASN A 106 1.919 -16.039 -7.021 1.00 0.00 C ATOM 1268 C ASN A 106 1.142 -15.917 -5.708 1.00 0.00 C ATOM 1269 O ASN A 106 0.738 -16.923 -5.126 1.00 0.00 O ATOM 1270 CB ASN A 106 2.381 -17.491 -7.163 1.00 0.00 C ATOM 1271 CG ASN A 106 1.327 -18.334 -7.883 1.00 0.00 C ATOM 1272 OD1 ASN A 106 0.487 -17.834 -8.613 1.00 0.00 O ATOM 1273 ND2 ASN A 106 1.417 -19.638 -7.637 1.00 0.00 N ATOM 0 H ASN A 106 3.513 -15.048 -6.089 1.00 0.00 H new ATOM 0 HA ASN A 106 1.294 -15.775 -7.874 1.00 0.00 H new ATOM 0 HB2 ASN A 106 3.319 -17.525 -7.717 1.00 0.00 H new ATOM 0 HB3 ASN A 106 2.577 -17.912 -6.177 1.00 0.00 H new ATOM 0 HD21 ASN A 106 0.758 -20.285 -8.070 1.00 0.00 H new ATOM 0 HD22 ASN A 106 2.145 -19.991 -7.015 1.00 0.00 H new ATOM 1280 N HIS A 107 0.957 -14.677 -5.280 1.00 0.00 N ATOM 1281 CA HIS A 107 0.236 -14.411 -4.047 1.00 0.00 C ATOM 1282 C HIS A 107 0.068 -12.901 -3.867 1.00 0.00 C ATOM 1283 O HIS A 107 -1.041 -12.379 -3.974 1.00 0.00 O ATOM 1284 CB HIS A 107 0.930 -15.077 -2.857 1.00 0.00 C ATOM 1285 CG HIS A 107 0.509 -16.508 -2.623 1.00 0.00 C ATOM 1286 ND1 HIS A 107 1.236 -17.662 -2.620 1.00 0.00 N flip ATOM 1287 CD2 HIS A 107 -0.800 -16.870 -2.355 1.00 0.00 C flip ATOM 1288 CE1 HIS A 107 0.417 -18.674 -2.363 1.00 0.00 C flip ATOM 1289 NE2 HIS A 107 -0.846 -18.185 -2.198 1.00 0.00 N flip ATOM 0 H HIS A 107 1.294 -13.845 -5.765 1.00 0.00 H new ATOM 0 HA HIS A 107 -0.761 -14.848 -4.102 1.00 0.00 H new ATOM 0 HB2 HIS A 107 2.008 -15.047 -3.015 1.00 0.00 H new ATOM 0 HB3 HIS A 107 0.724 -14.497 -1.958 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -1.641 -16.196 -2.286 1.00 0.00 H new ATOM 0 HE1 HIS A 107 0.703 -19.713 -2.296 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -1.679 -18.735 -1.990 1.00 0.00 H new ATOM 1297 N TYR A 108 1.185 -12.242 -3.595 1.00 0.00 N ATOM 1298 CA TYR A 108 1.176 -10.802 -3.399 1.00 0.00 C ATOM 1299 C TYR A 108 0.381 -10.103 -4.504 1.00 0.00 C ATOM 1300 O TYR A 108 -0.100 -10.751 -5.432 1.00 0.00 O ATOM 1301 CB TYR A 108 2.637 -10.356 -3.478 1.00 0.00 C ATOM 1302 CG TYR A 108 3.621 -11.329 -2.824 1.00 0.00 C ATOM 1303 CD1 TYR A 108 3.612 -11.503 -1.455 1.00 0.00 C ATOM 1304 CD2 TYR A 108 4.516 -12.032 -3.604 1.00 0.00 C ATOM 1305 CE1 TYR A 108 4.538 -12.419 -0.840 1.00 0.00 C ATOM 1306 CE2 TYR A 108 5.442 -12.948 -2.989 1.00 0.00 C ATOM 1307 CZ TYR A 108 5.407 -13.096 -1.637 1.00 0.00 C ATOM 1308 OH TYR A 108 6.281 -13.961 -1.056 1.00 0.00 O ATOM 0 H TYR A 108 2.102 -12.679 -3.506 1.00 0.00 H new ATOM 0 HA TYR A 108 0.713 -10.548 -2.446 1.00 0.00 H new ATOM 0 HB2 TYR A 108 2.911 -10.227 -4.525 1.00 0.00 H new ATOM 0 HB3 TYR A 108 2.735 -9.381 -3.001 1.00 0.00 H new ATOM 0 HD1 TYR A 108 2.911 -10.953 -0.845 1.00 0.00 H new ATOM 0 HD2 TYR A 108 4.522 -11.896 -4.675 1.00 0.00 H new ATOM 0 HE1 TYR A 108 4.542 -12.565 0.230 1.00 0.00 H new ATOM 0 HE2 TYR A 108 6.148 -13.505 -3.587 1.00 0.00 H new ATOM 0 HH TYR A 108 6.840 -14.374 -1.747 1.00 0.00 H new ATOM 1318 N ASN A 109 0.267 -8.790 -4.367 1.00 0.00 N ATOM 1319 CA ASN A 109 -0.461 -7.996 -5.342 1.00 0.00 C ATOM 1320 C ASN A 109 0.239 -6.647 -5.519 1.00 0.00 C ATOM 1321 O ASN A 109 -0.349 -5.600 -5.253 1.00 0.00 O ATOM 1322 CB ASN A 109 -1.893 -7.729 -4.875 1.00 0.00 C ATOM 1323 CG ASN A 109 -2.770 -8.969 -5.056 1.00 0.00 C ATOM 1324 OD1 ASN A 109 -3.415 -9.444 -4.136 1.00 0.00 O ATOM 1325 ND2 ASN A 109 -2.756 -9.466 -6.289 1.00 0.00 N ATOM 0 H ASN A 109 0.667 -8.256 -3.595 1.00 0.00 H new ATOM 0 HA ASN A 109 -0.485 -8.551 -6.280 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -1.888 -7.433 -3.826 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -2.314 -6.896 -5.439 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -3.308 -10.295 -6.511 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -2.193 -9.019 -7.013 1.00 0.00 H new ATOM 1332 N THR A 110 1.483 -6.717 -5.968 1.00 0.00 N ATOM 1333 CA THR A 110 2.269 -5.514 -6.184 1.00 0.00 C ATOM 1334 C THR A 110 1.467 -4.491 -6.991 1.00 0.00 C ATOM 1335 O THR A 110 0.914 -4.818 -8.040 1.00 0.00 O ATOM 1336 CB THR A 110 3.583 -5.921 -6.854 1.00 0.00 C ATOM 1337 OG1 THR A 110 3.174 -6.664 -7.999 1.00 0.00 O ATOM 1338 CG2 THR A 110 4.377 -6.929 -6.020 1.00 0.00 C ATOM 0 H THR A 110 1.966 -7.588 -6.188 1.00 0.00 H new ATOM 0 HA THR A 110 2.507 -5.023 -5.241 1.00 0.00 H new ATOM 0 HB THR A 110 4.192 -5.034 -7.028 1.00 0.00 H new ATOM 0 HG1 THR A 110 2.361 -6.266 -8.374 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.300 -7.185 -6.540 1.00 0.00 H new ATOM 0 HG22 THR A 110 4.616 -6.491 -5.051 1.00 0.00 H new ATOM 0 HG23 THR A 110 3.781 -7.830 -5.874 1.00 0.00 H new ATOM 1346 N TYR A 111 1.430 -3.273 -6.471 1.00 0.00 N ATOM 1347 CA TYR A 111 0.705 -2.200 -7.131 1.00 0.00 C ATOM 1348 C TYR A 111 1.666 -1.135 -7.663 1.00 0.00 C ATOM 1349 O TYR A 111 2.879 -1.250 -7.497 1.00 0.00 O ATOM 1350 CB TYR A 111 -0.188 -1.573 -6.058 1.00 0.00 C ATOM 1351 CG TYR A 111 -0.855 -2.591 -5.131 1.00 0.00 C ATOM 1352 CD1 TYR A 111 -0.127 -3.184 -4.120 1.00 0.00 C ATOM 1353 CD2 TYR A 111 -2.185 -2.917 -5.306 1.00 0.00 C ATOM 1354 CE1 TYR A 111 -0.755 -4.142 -3.247 1.00 0.00 C ATOM 1355 CE2 TYR A 111 -2.813 -3.875 -4.433 1.00 0.00 C ATOM 1356 CZ TYR A 111 -2.066 -4.441 -3.447 1.00 0.00 C ATOM 1357 OH TYR A 111 -2.659 -5.345 -2.623 1.00 0.00 O ATOM 0 H TYR A 111 1.890 -3.005 -5.601 1.00 0.00 H new ATOM 0 HA TYR A 111 0.136 -2.585 -7.977 1.00 0.00 H new ATOM 0 HB2 TYR A 111 0.410 -0.887 -5.458 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -0.961 -0.979 -6.545 1.00 0.00 H new ATOM 0 HD1 TYR A 111 0.914 -2.930 -3.983 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -2.755 -2.454 -6.098 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -0.197 -4.612 -2.451 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -3.853 -4.138 -4.558 1.00 0.00 H new ATOM 0 HH TYR A 111 -2.411 -5.153 -1.695 1.00 0.00 H new ATOM 1367 N ILE A 112 1.087 -0.123 -8.292 1.00 0.00 N ATOM 1368 CA ILE A 112 1.877 0.962 -8.850 1.00 0.00 C ATOM 1369 C ILE A 112 1.015 2.223 -8.935 1.00 0.00 C ATOM 1370 O ILE A 112 -0.141 2.162 -9.349 1.00 0.00 O ATOM 1371 CB ILE A 112 2.491 0.545 -10.188 1.00 0.00 C ATOM 1372 CG1 ILE A 112 3.452 -0.632 -10.007 1.00 0.00 C ATOM 1373 CG2 ILE A 112 3.163 1.734 -10.877 1.00 0.00 C ATOM 1374 CD1 ILE A 112 4.306 -0.839 -11.259 1.00 0.00 C ATOM 0 H ILE A 112 0.080 -0.031 -8.428 1.00 0.00 H new ATOM 0 HA ILE A 112 2.719 1.194 -8.198 1.00 0.00 H new ATOM 0 HB ILE A 112 1.688 0.206 -10.842 1.00 0.00 H new ATOM 0 HG12 ILE A 112 4.098 -0.450 -9.148 1.00 0.00 H new ATOM 0 HG13 ILE A 112 2.886 -1.539 -9.794 1.00 0.00 H new ATOM 0 HG21 ILE A 112 3.591 1.410 -11.826 1.00 0.00 H new ATOM 0 HG22 ILE A 112 2.424 2.514 -11.060 1.00 0.00 H new ATOM 0 HG23 ILE A 112 3.953 2.126 -10.237 1.00 0.00 H new ATOM 0 HD11 ILE A 112 4.980 -1.681 -11.104 1.00 0.00 H new ATOM 0 HD12 ILE A 112 3.658 -1.044 -12.111 1.00 0.00 H new ATOM 0 HD13 ILE A 112 4.889 0.061 -11.455 1.00 0.00 H new ATOM 1386 N SER A 113 1.612 3.337 -8.537 1.00 0.00 N ATOM 1387 CA SER A 113 0.914 4.611 -8.563 1.00 0.00 C ATOM 1388 C SER A 113 0.147 4.761 -9.879 1.00 0.00 C ATOM 1389 O SER A 113 0.731 5.105 -10.905 1.00 0.00 O ATOM 1390 CB SER A 113 1.887 5.777 -8.381 1.00 0.00 C ATOM 1391 OG SER A 113 1.210 7.000 -8.103 1.00 0.00 O ATOM 0 H SER A 113 2.572 3.384 -8.195 1.00 0.00 H new ATOM 0 HA SER A 113 0.208 4.630 -7.733 1.00 0.00 H new ATOM 0 HB2 SER A 113 2.575 5.551 -7.567 1.00 0.00 H new ATOM 0 HB3 SER A 113 2.487 5.892 -9.283 1.00 0.00 H new ATOM 0 HG SER A 113 1.105 7.512 -8.932 1.00 0.00 H new ATOM 1397 N LYS A 114 -1.149 4.494 -9.805 1.00 0.00 N ATOM 1398 CA LYS A 114 -2.001 4.595 -10.978 1.00 0.00 C ATOM 1399 C LYS A 114 -2.135 6.065 -11.381 1.00 0.00 C ATOM 1400 O LYS A 114 -2.674 6.374 -12.442 1.00 0.00 O ATOM 1401 CB LYS A 114 -3.341 3.901 -10.727 1.00 0.00 C ATOM 1402 CG LYS A 114 -3.912 3.325 -12.025 1.00 0.00 C ATOM 1403 CD LYS A 114 -5.245 3.989 -12.379 1.00 0.00 C ATOM 1404 CE LYS A 114 -5.865 3.345 -13.621 1.00 0.00 C ATOM 1405 NZ LYS A 114 -6.188 4.376 -14.632 1.00 0.00 N ATOM 0 H LYS A 114 -1.629 4.208 -8.952 1.00 0.00 H new ATOM 0 HA LYS A 114 -1.551 4.073 -11.822 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -3.210 3.102 -9.997 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -4.048 4.611 -10.298 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -3.200 3.474 -12.837 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -4.054 2.250 -11.918 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -5.933 3.903 -11.538 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -5.090 5.053 -12.556 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -5.173 2.616 -14.044 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -6.769 2.803 -13.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -7.008 4.068 -15.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -6.412 5.272 -14.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -5.371 4.514 -15.261 1.00 0.00 H new ATOM 1419 N LYS A 115 -1.637 6.931 -10.511 1.00 0.00 N ATOM 1420 CA LYS A 115 -1.694 8.361 -10.763 1.00 0.00 C ATOM 1421 C LYS A 115 -0.514 8.767 -11.648 1.00 0.00 C ATOM 1422 O LYS A 115 -0.492 9.869 -12.194 1.00 0.00 O ATOM 1423 CB LYS A 115 -1.769 9.135 -9.445 1.00 0.00 C ATOM 1424 CG LYS A 115 -2.515 10.458 -9.628 1.00 0.00 C ATOM 1425 CD LYS A 115 -1.668 11.636 -9.141 1.00 0.00 C ATOM 1426 CE LYS A 115 -1.121 12.443 -10.320 1.00 0.00 C ATOM 1427 NZ LYS A 115 -2.083 13.494 -10.719 1.00 0.00 N ATOM 0 H LYS A 115 -1.192 6.670 -9.631 1.00 0.00 H new ATOM 0 HA LYS A 115 -2.603 8.615 -11.308 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.274 8.530 -8.692 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -0.762 9.329 -9.075 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -2.766 10.596 -10.680 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -3.455 10.429 -9.077 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -2.270 12.282 -8.502 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -0.842 11.268 -8.533 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -0.169 12.898 -10.046 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -0.927 11.780 -11.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -1.696 14.032 -11.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -2.982 13.053 -11.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -2.248 14.136 -9.918 1.00 0.00 H new ATOM 1441 N HIS A 116 0.440 7.854 -11.762 1.00 0.00 N ATOM 1442 CA HIS A 116 1.621 8.103 -12.572 1.00 0.00 C ATOM 1443 C HIS A 116 2.479 6.838 -12.631 1.00 0.00 C ATOM 1444 O HIS A 116 3.621 6.836 -12.175 1.00 0.00 O ATOM 1445 CB HIS A 116 2.391 9.317 -12.049 1.00 0.00 C ATOM 1446 CG HIS A 116 2.008 9.732 -10.649 1.00 0.00 C ATOM 1447 ND1 HIS A 116 1.977 8.846 -9.586 1.00 0.00 N ATOM 1448 CD2 HIS A 116 1.641 10.947 -10.148 1.00 0.00 C ATOM 1449 CE1 HIS A 116 1.606 9.507 -8.500 1.00 0.00 C ATOM 1450 NE2 HIS A 116 1.397 10.809 -8.850 1.00 0.00 N ATOM 0 H HIS A 116 0.419 6.941 -11.307 1.00 0.00 H new ATOM 0 HA HIS A 116 1.323 8.346 -13.592 1.00 0.00 H new ATOM 0 HB2 HIS A 116 3.458 9.095 -12.072 1.00 0.00 H new ATOM 0 HB3 HIS A 116 2.226 10.157 -12.724 1.00 0.00 H new ATOM 0 HD2 HIS A 116 1.562 11.865 -10.711 1.00 0.00 H new ATOM 0 HE1 HIS A 116 1.489 9.089 -7.511 1.00 0.00 H new ATOM 0 HE2 HIS A 116 1.102 11.554 -8.219 1.00 0.00 H new ATOM 1458 N ALA A 117 1.895 5.791 -13.196 1.00 0.00 N ATOM 1459 CA ALA A 117 2.591 4.522 -13.321 1.00 0.00 C ATOM 1460 C ALA A 117 3.667 4.640 -14.402 1.00 0.00 C ATOM 1461 O ALA A 117 4.439 3.707 -14.619 1.00 0.00 O ATOM 1462 CB ALA A 117 1.581 3.413 -13.622 1.00 0.00 C ATOM 0 H ALA A 117 0.947 5.796 -13.572 1.00 0.00 H new ATOM 0 HA ALA A 117 3.089 4.264 -12.387 1.00 0.00 H new ATOM 0 HB1 ALA A 117 2.103 2.461 -13.716 1.00 0.00 H new ATOM 0 HB2 ALA A 117 0.856 3.351 -12.810 1.00 0.00 H new ATOM 0 HB3 ALA A 117 1.063 3.636 -14.555 1.00 0.00 H new ATOM 1468 N GLU A 118 3.685 5.795 -15.051 1.00 0.00 N ATOM 1469 CA GLU A 118 4.654 6.047 -16.104 1.00 0.00 C ATOM 1470 C GLU A 118 6.073 6.038 -15.533 1.00 0.00 C ATOM 1471 O GLU A 118 7.048 6.039 -16.283 1.00 0.00 O ATOM 1472 CB GLU A 118 4.358 7.368 -16.816 1.00 0.00 C ATOM 1473 CG GLU A 118 4.950 8.551 -16.047 1.00 0.00 C ATOM 1474 CD GLU A 118 4.406 9.878 -16.578 1.00 0.00 C ATOM 1475 OE1 GLU A 118 3.287 10.243 -16.155 1.00 0.00 O ATOM 1476 OE2 GLU A 118 5.121 10.499 -17.394 1.00 0.00 O ATOM 0 H GLU A 118 3.044 6.567 -14.868 1.00 0.00 H new ATOM 0 HA GLU A 118 4.575 5.249 -16.842 1.00 0.00 H new ATOM 0 HB2 GLU A 118 4.771 7.342 -17.824 1.00 0.00 H new ATOM 0 HB3 GLU A 118 3.280 7.498 -16.916 1.00 0.00 H new ATOM 0 HG2 GLU A 118 4.714 8.455 -14.987 1.00 0.00 H new ATOM 0 HG3 GLU A 118 6.036 8.539 -16.134 1.00 0.00 H new ATOM 1483 N LYS A 119 6.144 6.028 -14.210 1.00 0.00 N ATOM 1484 CA LYS A 119 7.428 6.019 -13.529 1.00 0.00 C ATOM 1485 C LYS A 119 7.580 4.708 -12.755 1.00 0.00 C ATOM 1486 O LYS A 119 8.552 4.524 -12.024 1.00 0.00 O ATOM 1487 CB LYS A 119 7.583 7.268 -12.660 1.00 0.00 C ATOM 1488 CG LYS A 119 8.924 7.955 -12.921 1.00 0.00 C ATOM 1489 CD LYS A 119 8.970 9.336 -12.263 1.00 0.00 C ATOM 1490 CE LYS A 119 9.770 10.323 -13.116 1.00 0.00 C ATOM 1491 NZ LYS A 119 9.152 11.667 -13.069 1.00 0.00 N ATOM 0 H LYS A 119 5.333 6.026 -13.591 1.00 0.00 H new ATOM 0 HA LYS A 119 8.243 6.060 -14.252 1.00 0.00 H new ATOM 0 HB2 LYS A 119 6.769 7.962 -12.867 1.00 0.00 H new ATOM 0 HB3 LYS A 119 7.509 6.994 -11.607 1.00 0.00 H new ATOM 0 HG2 LYS A 119 9.735 7.337 -12.535 1.00 0.00 H new ATOM 0 HG3 LYS A 119 9.083 8.054 -13.995 1.00 0.00 H new ATOM 0 HD2 LYS A 119 7.956 9.710 -12.123 1.00 0.00 H new ATOM 0 HD3 LYS A 119 9.420 9.257 -11.274 1.00 0.00 H new ATOM 0 HE2 LYS A 119 10.797 10.376 -12.755 1.00 0.00 H new ATOM 0 HE3 LYS A 119 9.812 9.971 -14.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 9.707 12.325 -13.653 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 8.180 11.615 -13.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 9.134 12.007 -12.086 1.00 0.00 H new ATOM 1505 N ASN A 120 6.606 3.830 -12.943 1.00 0.00 N ATOM 1506 CA ASN A 120 6.619 2.541 -12.272 1.00 0.00 C ATOM 1507 C ASN A 120 6.718 2.760 -10.761 1.00 0.00 C ATOM 1508 O ASN A 120 7.414 2.020 -10.068 1.00 0.00 O ATOM 1509 CB ASN A 120 7.824 1.706 -12.709 1.00 0.00 C ATOM 1510 CG ASN A 120 7.382 0.498 -13.537 1.00 0.00 C ATOM 1511 OD1 ASN A 120 6.390 0.757 -14.384 1.00 0.00 O flip ATOM 1512 ND2 ASN A 120 7.907 -0.597 -13.416 1.00 0.00 N flip ATOM 0 H ASN A 120 5.802 3.986 -13.551 1.00 0.00 H new ATOM 0 HA ASN A 120 5.701 2.014 -12.533 1.00 0.00 H new ATOM 0 HB2 ASN A 120 8.506 2.323 -13.294 1.00 0.00 H new ATOM 0 HB3 ASN A 120 8.374 1.368 -11.831 1.00 0.00 H new ATOM 0 HD21 ASN A 120 8.665 -0.728 -12.746 1.00 0.00 H new ATOM 0 HD22 ASN A 120 7.588 -1.381 -13.985 1.00 0.00 H new ATOM 1519 N TRP A 121 6.011 3.779 -10.295 1.00 0.00 N ATOM 1520 CA TRP A 121 6.011 4.104 -8.879 1.00 0.00 C ATOM 1521 C TRP A 121 5.228 3.014 -8.144 1.00 0.00 C ATOM 1522 O TRP A 121 4.008 3.102 -8.013 1.00 0.00 O ATOM 1523 CB TRP A 121 5.451 5.507 -8.638 1.00 0.00 C ATOM 1524 CG TRP A 121 6.421 6.634 -8.997 1.00 0.00 C ATOM 1525 CD1 TRP A 121 7.732 6.542 -9.259 1.00 0.00 C ATOM 1526 CD2 TRP A 121 6.101 8.036 -9.124 1.00 0.00 C ATOM 1527 NE1 TRP A 121 8.278 7.777 -9.544 1.00 0.00 N ATOM 1528 CE2 TRP A 121 7.255 8.714 -9.460 1.00 0.00 C ATOM 1529 CE3 TRP A 121 4.877 8.708 -8.962 1.00 0.00 C ATOM 1530 CZ2 TRP A 121 7.300 10.099 -9.661 1.00 0.00 C ATOM 1531 CZ3 TRP A 121 4.939 10.092 -9.166 1.00 0.00 C ATOM 1532 CH2 TRP A 121 6.092 10.790 -9.504 1.00 0.00 C ATOM 0 H TRP A 121 5.434 4.390 -10.873 1.00 0.00 H new ATOM 0 HA TRP A 121 7.028 4.126 -8.489 1.00 0.00 H new ATOM 0 HB2 TRP A 121 4.538 5.628 -9.221 1.00 0.00 H new ATOM 0 HB3 TRP A 121 5.173 5.601 -7.588 1.00 0.00 H new ATOM 0 HD1 TRP A 121 8.291 5.618 -9.248 1.00 0.00 H new ATOM 0 HE1 TRP A 121 9.253 7.967 -9.774 1.00 0.00 H new ATOM 0 HE3 TRP A 121 3.962 8.198 -8.701 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 8.216 10.607 -9.923 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 4.026 10.657 -9.053 1.00 0.00 H new ATOM 0 HH2 TRP A 121 6.057 11.860 -9.645 1.00 0.00 H new ATOM 1543 N PHE A 122 5.962 2.011 -7.684 1.00 0.00 N ATOM 1544 CA PHE A 122 5.351 0.905 -6.966 1.00 0.00 C ATOM 1545 C PHE A 122 4.977 1.317 -5.541 1.00 0.00 C ATOM 1546 O PHE A 122 5.233 2.447 -5.129 1.00 0.00 O ATOM 1547 CB PHE A 122 6.391 -0.216 -6.904 1.00 0.00 C ATOM 1548 CG PHE A 122 6.326 -1.190 -8.082 1.00 0.00 C ATOM 1549 CD1 PHE A 122 6.977 -0.900 -9.240 1.00 0.00 C ATOM 1550 CD2 PHE A 122 5.619 -2.347 -7.970 1.00 0.00 C ATOM 1551 CE1 PHE A 122 6.917 -1.804 -10.334 1.00 0.00 C ATOM 1552 CE2 PHE A 122 5.560 -3.250 -9.064 1.00 0.00 C ATOM 1553 CZ PHE A 122 6.210 -2.960 -10.222 1.00 0.00 C ATOM 0 H PHE A 122 6.974 1.941 -7.794 1.00 0.00 H new ATOM 0 HA PHE A 122 4.441 0.588 -7.475 1.00 0.00 H new ATOM 0 HB2 PHE A 122 7.386 0.227 -6.867 1.00 0.00 H new ATOM 0 HB3 PHE A 122 6.255 -0.773 -5.977 1.00 0.00 H new ATOM 0 HD1 PHE A 122 7.540 0.018 -9.328 1.00 0.00 H new ATOM 0 HD2 PHE A 122 5.103 -2.578 -7.050 1.00 0.00 H new ATOM 0 HE1 PHE A 122 7.433 -1.573 -11.254 1.00 0.00 H new ATOM 0 HE2 PHE A 122 4.998 -4.168 -8.976 1.00 0.00 H new ATOM 0 HZ PHE A 122 6.165 -3.648 -11.053 1.00 0.00 H new ATOM 1563 N VAL A 123 4.376 0.377 -4.826 1.00 0.00 N ATOM 1564 CA VAL A 123 3.964 0.628 -3.455 1.00 0.00 C ATOM 1565 C VAL A 123 4.695 -0.340 -2.522 1.00 0.00 C ATOM 1566 O VAL A 123 4.258 -1.474 -2.332 1.00 0.00 O ATOM 1567 CB VAL A 123 2.441 0.532 -3.341 1.00 0.00 C ATOM 1568 CG1 VAL A 123 1.957 -0.889 -3.636 1.00 0.00 C ATOM 1569 CG2 VAL A 123 1.964 0.999 -1.964 1.00 0.00 C ATOM 0 H VAL A 123 4.164 -0.560 -5.170 1.00 0.00 H new ATOM 0 HA VAL A 123 4.237 1.639 -3.153 1.00 0.00 H new ATOM 0 HB VAL A 123 2.007 1.195 -4.089 1.00 0.00 H new ATOM 0 HG11 VAL A 123 0.871 -0.929 -3.548 1.00 0.00 H new ATOM 0 HG12 VAL A 123 2.250 -1.170 -4.648 1.00 0.00 H new ATOM 0 HG13 VAL A 123 2.405 -1.581 -2.923 1.00 0.00 H new ATOM 0 HG21 VAL A 123 0.878 0.921 -1.909 1.00 0.00 H new ATOM 0 HG22 VAL A 123 2.412 0.373 -1.192 1.00 0.00 H new ATOM 0 HG23 VAL A 123 2.261 2.036 -1.808 1.00 0.00 H new ATOM 1579 N GLY A 124 5.795 0.144 -1.965 1.00 0.00 N ATOM 1580 CA GLY A 124 6.591 -0.664 -1.056 1.00 0.00 C ATOM 1581 C GLY A 124 7.209 0.199 0.046 1.00 0.00 C ATOM 1582 O GLY A 124 7.088 1.423 0.022 1.00 0.00 O ATOM 0 H GLY A 124 6.154 1.085 -2.125 1.00 0.00 H new ATOM 0 HA2 GLY A 124 5.966 -1.438 -0.610 1.00 0.00 H new ATOM 0 HA3 GLY A 124 7.380 -1.172 -1.611 1.00 0.00 H new ATOM 1586 N LEU A 125 7.856 -0.473 0.986 1.00 0.00 N ATOM 1587 CA LEU A 125 8.493 0.216 2.095 1.00 0.00 C ATOM 1588 C LEU A 125 9.888 -0.371 2.322 1.00 0.00 C ATOM 1589 O LEU A 125 10.025 -1.553 2.632 1.00 0.00 O ATOM 1590 CB LEU A 125 7.599 0.174 3.336 1.00 0.00 C ATOM 1591 CG LEU A 125 6.124 -0.148 3.090 1.00 0.00 C ATOM 1592 CD1 LEU A 125 5.841 -1.633 3.324 1.00 0.00 C ATOM 1593 CD2 LEU A 125 5.218 0.748 3.936 1.00 0.00 C ATOM 0 H LEU A 125 7.953 -1.488 1.003 1.00 0.00 H new ATOM 0 HA LEU A 125 8.626 1.272 1.861 1.00 0.00 H new ATOM 0 HB2 LEU A 125 8.002 -0.568 4.025 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.661 1.140 3.837 1.00 0.00 H new ATOM 0 HG LEU A 125 5.899 0.062 2.045 1.00 0.00 H new ATOM 0 HD11 LEU A 125 4.785 -1.835 3.142 1.00 0.00 H new ATOM 0 HD12 LEU A 125 6.447 -2.231 2.643 1.00 0.00 H new ATOM 0 HD13 LEU A 125 6.088 -1.893 4.353 1.00 0.00 H new ATOM 0 HD21 LEU A 125 4.175 0.498 3.742 1.00 0.00 H new ATOM 0 HD22 LEU A 125 5.437 0.593 4.992 1.00 0.00 H new ATOM 0 HD23 LEU A 125 5.395 1.792 3.678 1.00 0.00 H new ATOM 1605 N LYS A 126 10.888 0.483 2.158 1.00 0.00 N ATOM 1606 CA LYS A 126 12.267 0.064 2.341 1.00 0.00 C ATOM 1607 C LYS A 126 12.332 -0.995 3.443 1.00 0.00 C ATOM 1608 O LYS A 126 11.803 -0.793 4.535 1.00 0.00 O ATOM 1609 CB LYS A 126 13.166 1.275 2.599 1.00 0.00 C ATOM 1610 CG LYS A 126 14.619 0.967 2.234 1.00 0.00 C ATOM 1611 CD LYS A 126 15.571 1.985 2.867 1.00 0.00 C ATOM 1612 CE LYS A 126 16.774 1.288 3.504 1.00 0.00 C ATOM 1613 NZ LYS A 126 18.001 2.093 3.312 1.00 0.00 N ATOM 0 H LYS A 126 10.770 1.463 1.900 1.00 0.00 H new ATOM 0 HA LYS A 126 12.648 -0.399 1.430 1.00 0.00 H new ATOM 0 HB2 LYS A 126 12.813 2.125 2.015 1.00 0.00 H new ATOM 0 HB3 LYS A 126 13.104 1.561 3.649 1.00 0.00 H new ATOM 0 HG2 LYS A 126 14.878 -0.037 2.571 1.00 0.00 H new ATOM 0 HG3 LYS A 126 14.736 0.979 1.150 1.00 0.00 H new ATOM 0 HD2 LYS A 126 15.914 2.689 2.108 1.00 0.00 H new ATOM 0 HD3 LYS A 126 15.040 2.564 3.622 1.00 0.00 H new ATOM 0 HE2 LYS A 126 16.593 1.138 4.568 1.00 0.00 H new ATOM 0 HE3 LYS A 126 16.906 0.301 3.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 18.808 1.605 3.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 18.181 2.215 2.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 17.877 3.026 3.756 1.00 0.00 H new ATOM 1627 N LYS A 127 12.984 -2.102 3.119 1.00 0.00 N ATOM 1628 CA LYS A 127 13.125 -3.193 4.068 1.00 0.00 C ATOM 1629 C LYS A 127 14.016 -2.743 5.227 1.00 0.00 C ATOM 1630 O LYS A 127 15.055 -3.347 5.487 1.00 0.00 O ATOM 1631 CB LYS A 127 13.625 -4.455 3.362 1.00 0.00 C ATOM 1632 CG LYS A 127 14.961 -4.200 2.662 1.00 0.00 C ATOM 1633 CD LYS A 127 16.134 -4.642 3.539 1.00 0.00 C ATOM 1634 CE LYS A 127 17.140 -5.466 2.733 1.00 0.00 C ATOM 1635 NZ LYS A 127 18.524 -5.140 3.145 1.00 0.00 N ATOM 0 H LYS A 127 13.421 -2.267 2.212 1.00 0.00 H new ATOM 0 HA LYS A 127 12.157 -3.456 4.494 1.00 0.00 H new ATOM 0 HB2 LYS A 127 13.739 -5.261 4.087 1.00 0.00 H new ATOM 0 HB3 LYS A 127 12.885 -4.785 2.632 1.00 0.00 H new ATOM 0 HG2 LYS A 127 14.988 -4.739 1.715 1.00 0.00 H new ATOM 0 HG3 LYS A 127 15.056 -3.140 2.429 1.00 0.00 H new ATOM 0 HD2 LYS A 127 16.629 -3.766 3.959 1.00 0.00 H new ATOM 0 HD3 LYS A 127 15.764 -5.232 4.378 1.00 0.00 H new ATOM 0 HE2 LYS A 127 16.951 -6.529 2.882 1.00 0.00 H new ATOM 0 HE3 LYS A 127 17.014 -5.266 1.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 19.166 -5.268 2.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 18.567 -4.152 3.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 18.813 -5.770 3.920 1.00 0.00 H new ATOM 1649 N ASN A 128 13.576 -1.686 5.894 1.00 0.00 N ATOM 1650 CA ASN A 128 14.320 -1.148 7.020 1.00 0.00 C ATOM 1651 C ASN A 128 13.344 -0.528 8.022 1.00 0.00 C ATOM 1652 O ASN A 128 13.468 -0.740 9.227 1.00 0.00 O ATOM 1653 CB ASN A 128 15.290 -0.055 6.567 1.00 0.00 C ATOM 1654 CG ASN A 128 16.741 -0.525 6.689 1.00 0.00 C ATOM 1655 OD1 ASN A 128 17.252 -1.001 5.557 1.00 0.00 O flip ATOM 1656 ND2 ASN A 128 17.356 -0.460 7.740 1.00 0.00 N flip ATOM 0 H ASN A 128 12.713 -1.188 5.676 1.00 0.00 H new ATOM 0 HA ASN A 128 14.882 -1.964 7.473 1.00 0.00 H new ATOM 0 HB2 ASN A 128 15.078 0.219 5.533 1.00 0.00 H new ATOM 0 HB3 ASN A 128 15.142 0.841 7.170 1.00 0.00 H new ATOM 0 HD21 ASN A 128 16.904 -0.083 8.573 1.00 0.00 H new ATOM 0 HD22 ASN A 128 18.323 -0.782 7.786 1.00 0.00 H new ATOM 1663 N GLY A 129 12.395 0.225 7.486 1.00 0.00 N ATOM 1664 CA GLY A 129 11.398 0.877 8.318 1.00 0.00 C ATOM 1665 C GLY A 129 11.123 2.301 7.831 1.00 0.00 C ATOM 1666 O GLY A 129 11.426 3.268 8.528 1.00 0.00 O ATOM 0 H GLY A 129 12.295 0.398 6.486 1.00 0.00 H new ATOM 0 HA2 GLY A 129 10.474 0.299 8.304 1.00 0.00 H new ATOM 0 HA3 GLY A 129 11.742 0.903 9.352 1.00 0.00 H new ATOM 1670 N SER A 130 10.553 2.384 6.638 1.00 0.00 N ATOM 1671 CA SER A 130 10.235 3.674 6.050 1.00 0.00 C ATOM 1672 C SER A 130 9.825 3.495 4.586 1.00 0.00 C ATOM 1673 O SER A 130 10.539 2.859 3.812 1.00 0.00 O ATOM 1674 CB SER A 130 11.420 4.636 6.155 1.00 0.00 C ATOM 1675 OG SER A 130 11.401 5.376 7.372 1.00 0.00 O ATOM 0 H SER A 130 10.303 1.579 6.063 1.00 0.00 H new ATOM 0 HA SER A 130 9.402 4.106 6.605 1.00 0.00 H new ATOM 0 HB2 SER A 130 12.351 4.073 6.088 1.00 0.00 H new ATOM 0 HB3 SER A 130 11.403 5.326 5.311 1.00 0.00 H new ATOM 0 HG SER A 130 11.500 4.762 8.130 1.00 0.00 H new ATOM 1681 N CYS A 131 8.678 4.067 4.252 1.00 0.00 N ATOM 1682 CA CYS A 131 8.165 3.978 2.896 1.00 0.00 C ATOM 1683 C CYS A 131 9.259 4.451 1.937 1.00 0.00 C ATOM 1684 O CYS A 131 10.366 4.773 2.363 1.00 0.00 O ATOM 1685 CB CYS A 131 6.872 4.778 2.726 1.00 0.00 C ATOM 1686 SG CYS A 131 5.725 3.887 1.613 1.00 0.00 S ATOM 0 H CYS A 131 8.089 4.594 4.897 1.00 0.00 H new ATOM 0 HA CYS A 131 7.907 2.944 2.670 1.00 0.00 H new ATOM 0 HB2 CYS A 131 6.401 4.934 3.697 1.00 0.00 H new ATOM 0 HB3 CYS A 131 7.096 5.764 2.318 1.00 0.00 H new ATOM 0 HG CYS A 131 6.355 2.907 1.035 1.00 0.00 H new ATOM 1692 N LYS A 132 8.910 4.478 0.659 1.00 0.00 N ATOM 1693 CA LYS A 132 9.848 4.907 -0.365 1.00 0.00 C ATOM 1694 C LYS A 132 9.314 6.169 -1.044 1.00 0.00 C ATOM 1695 O LYS A 132 8.190 6.594 -0.777 1.00 0.00 O ATOM 1696 CB LYS A 132 10.141 3.762 -1.336 1.00 0.00 C ATOM 1697 CG LYS A 132 11.648 3.557 -1.504 1.00 0.00 C ATOM 1698 CD LYS A 132 12.325 3.334 -0.151 1.00 0.00 C ATOM 1699 CE LYS A 132 13.345 4.437 0.140 1.00 0.00 C ATOM 1700 NZ LYS A 132 12.831 5.358 1.179 1.00 0.00 N ATOM 0 H LYS A 132 7.990 4.210 0.309 1.00 0.00 H new ATOM 0 HA LYS A 132 10.807 5.168 0.082 1.00 0.00 H new ATOM 0 HB2 LYS A 132 9.684 2.843 -0.969 1.00 0.00 H new ATOM 0 HB3 LYS A 132 9.690 3.977 -2.304 1.00 0.00 H new ATOM 0 HG2 LYS A 132 11.832 2.700 -2.152 1.00 0.00 H new ATOM 0 HG3 LYS A 132 12.085 4.427 -1.994 1.00 0.00 H new ATOM 0 HD2 LYS A 132 11.572 3.313 0.637 1.00 0.00 H new ATOM 0 HD3 LYS A 132 12.821 2.364 -0.144 1.00 0.00 H new ATOM 0 HE2 LYS A 132 14.284 3.994 0.471 1.00 0.00 H new ATOM 0 HE3 LYS A 132 13.559 4.993 -0.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 12.532 6.250 0.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 12.019 4.921 1.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 13.581 5.551 1.873 1.00 0.00 H new ATOM 1714 N ARG A 133 10.143 6.733 -1.910 1.00 0.00 N ATOM 1715 CA ARG A 133 9.768 7.938 -2.629 1.00 0.00 C ATOM 1716 C ARG A 133 9.542 7.623 -4.110 1.00 0.00 C ATOM 1717 O ARG A 133 10.132 6.687 -4.646 1.00 0.00 O ATOM 1718 CB ARG A 133 10.849 9.014 -2.503 1.00 0.00 C ATOM 1719 CG ARG A 133 10.228 10.411 -2.450 1.00 0.00 C ATOM 1720 CD ARG A 133 10.958 11.297 -1.439 1.00 0.00 C ATOM 1721 NE ARG A 133 10.968 12.700 -1.910 1.00 0.00 N ATOM 1722 CZ ARG A 133 11.401 13.736 -1.177 1.00 0.00 C ATOM 1723 NH1 ARG A 133 11.862 13.532 0.064 1.00 0.00 N ATOM 1724 NH2 ARG A 133 11.373 14.975 -1.687 1.00 0.00 N ATOM 0 H ARG A 133 11.073 6.377 -2.130 1.00 0.00 H new ATOM 0 HA ARG A 133 8.845 8.314 -2.188 1.00 0.00 H new ATOM 0 HB2 ARG A 133 11.438 8.839 -1.602 1.00 0.00 H new ATOM 0 HB3 ARG A 133 11.533 8.948 -3.349 1.00 0.00 H new ATOM 0 HG2 ARG A 133 10.270 10.869 -3.438 1.00 0.00 H new ATOM 0 HG3 ARG A 133 9.175 10.335 -2.179 1.00 0.00 H new ATOM 0 HD2 ARG A 133 10.468 11.234 -0.467 1.00 0.00 H new ATOM 0 HD3 ARG A 133 11.980 10.943 -1.304 1.00 0.00 H new ATOM 0 HE ARG A 133 10.624 12.891 -2.851 1.00 0.00 H new ATOM 0 HH11 ARG A 133 11.884 12.589 0.451 1.00 0.00 H new ATOM 0 HH12 ARG A 133 12.191 14.320 0.622 1.00 0.00 H new ATOM 0 HH21 ARG A 133 11.022 15.130 -2.632 1.00 0.00 H new ATOM 0 HH22 ARG A 133 11.702 15.763 -1.130 1.00 0.00 H new ATOM 1738 N GLY A 134 8.685 8.424 -4.728 1.00 0.00 N ATOM 1739 CA GLY A 134 8.374 8.242 -6.135 1.00 0.00 C ATOM 1740 C GLY A 134 9.612 7.802 -6.918 1.00 0.00 C ATOM 1741 O GLY A 134 9.608 6.746 -7.551 1.00 0.00 O ATOM 0 H GLY A 134 8.197 9.200 -4.280 1.00 0.00 H new ATOM 0 HA2 GLY A 134 7.587 7.496 -6.243 1.00 0.00 H new ATOM 0 HA3 GLY A 134 7.989 9.174 -6.550 1.00 0.00 H new ATOM 1745 N PRO A 135 10.669 8.654 -6.849 1.00 0.00 N ATOM 1746 CA PRO A 135 11.912 8.364 -7.544 1.00 0.00 C ATOM 1747 C PRO A 135 12.702 7.271 -6.822 1.00 0.00 C ATOM 1748 O PRO A 135 13.883 7.446 -6.526 1.00 0.00 O ATOM 1749 CB PRO A 135 12.650 9.691 -7.601 1.00 0.00 C ATOM 1750 CG PRO A 135 12.013 10.569 -6.536 1.00 0.00 C ATOM 1751 CD PRO A 135 10.710 9.913 -6.110 1.00 0.00 C ATOM 0 HA PRO A 135 11.751 7.970 -8.547 1.00 0.00 H new ATOM 0 HB2 PRO A 135 13.714 9.554 -7.409 1.00 0.00 H new ATOM 0 HB3 PRO A 135 12.560 10.146 -8.587 1.00 0.00 H new ATOM 0 HG2 PRO A 135 12.682 10.680 -5.682 1.00 0.00 H new ATOM 0 HG3 PRO A 135 11.827 11.569 -6.927 1.00 0.00 H new ATOM 0 HD2 PRO A 135 10.687 9.741 -5.034 1.00 0.00 H new ATOM 0 HD3 PRO A 135 9.853 10.542 -6.351 1.00 0.00 H new ATOM 1759 N ARG A 136 12.018 6.167 -6.558 1.00 0.00 N ATOM 1760 CA ARG A 136 12.641 5.046 -5.875 1.00 0.00 C ATOM 1761 C ARG A 136 11.582 4.020 -5.465 1.00 0.00 C ATOM 1762 O ARG A 136 11.663 3.437 -4.385 1.00 0.00 O ATOM 1763 CB ARG A 136 13.399 5.511 -4.631 1.00 0.00 C ATOM 1764 CG ARG A 136 14.892 5.670 -4.926 1.00 0.00 C ATOM 1765 CD ARG A 136 15.737 4.873 -3.930 1.00 0.00 C ATOM 1766 NE ARG A 136 17.163 5.243 -4.066 1.00 0.00 N ATOM 1767 CZ ARG A 136 18.182 4.455 -3.694 1.00 0.00 C ATOM 1768 NH1 ARG A 136 17.937 3.251 -3.161 1.00 0.00 N ATOM 1769 NH2 ARG A 136 19.445 4.873 -3.856 1.00 0.00 N ATOM 0 H ARG A 136 11.039 6.025 -6.805 1.00 0.00 H new ATOM 0 HA ARG A 136 13.348 4.588 -6.567 1.00 0.00 H new ATOM 0 HB2 ARG A 136 12.990 6.460 -4.285 1.00 0.00 H new ATOM 0 HB3 ARG A 136 13.259 4.791 -3.825 1.00 0.00 H new ATOM 0 HG2 ARG A 136 15.104 5.332 -5.940 1.00 0.00 H new ATOM 0 HG3 ARG A 136 15.165 6.724 -4.878 1.00 0.00 H new ATOM 0 HD2 ARG A 136 15.397 5.070 -2.913 1.00 0.00 H new ATOM 0 HD3 ARG A 136 15.611 3.805 -4.107 1.00 0.00 H new ATOM 0 HE ARG A 136 17.385 6.154 -4.468 1.00 0.00 H new ATOM 0 HH11 ARG A 136 16.975 2.934 -3.038 1.00 0.00 H new ATOM 0 HH12 ARG A 136 18.712 2.651 -2.878 1.00 0.00 H new ATOM 0 HH21 ARG A 136 19.631 5.790 -4.262 1.00 0.00 H new ATOM 0 HH22 ARG A 136 20.221 4.274 -3.573 1.00 0.00 H new ATOM 1783 N THR A 137 10.614 3.830 -6.350 1.00 0.00 N ATOM 1784 CA THR A 137 9.542 2.884 -6.093 1.00 0.00 C ATOM 1785 C THR A 137 9.409 1.899 -7.257 1.00 0.00 C ATOM 1786 O THR A 137 8.385 1.870 -7.937 1.00 0.00 O ATOM 1787 CB THR A 137 8.264 3.681 -5.824 1.00 0.00 C ATOM 1788 OG1 THR A 137 8.724 5.011 -5.603 1.00 0.00 O ATOM 1789 CG2 THR A 137 7.599 3.292 -4.501 1.00 0.00 C ATOM 0 H THR A 137 10.550 4.315 -7.245 1.00 0.00 H new ATOM 0 HA THR A 137 9.754 2.274 -5.215 1.00 0.00 H new ATOM 0 HB THR A 137 7.561 3.527 -6.643 1.00 0.00 H new ATOM 0 HG1 THR A 137 9.255 5.041 -4.780 1.00 0.00 H new ATOM 0 HG21 THR A 137 6.697 3.887 -4.359 1.00 0.00 H new ATOM 0 HG22 THR A 137 7.337 2.234 -4.523 1.00 0.00 H new ATOM 0 HG23 THR A 137 8.290 3.477 -3.678 1.00 0.00 H new ATOM 1797 N HIS A 138 10.461 1.116 -7.450 1.00 0.00 N ATOM 1798 CA HIS A 138 10.475 0.132 -8.519 1.00 0.00 C ATOM 1799 C HIS A 138 10.965 -1.211 -7.974 1.00 0.00 C ATOM 1800 O HIS A 138 11.989 -1.273 -7.296 1.00 0.00 O ATOM 1801 CB HIS A 138 11.305 0.630 -9.704 1.00 0.00 C ATOM 1802 CG HIS A 138 11.235 2.123 -9.919 1.00 0.00 C ATOM 1803 ND1 HIS A 138 11.437 3.037 -8.900 1.00 0.00 N ATOM 1804 CD2 HIS A 138 10.983 2.850 -11.045 1.00 0.00 C ATOM 1805 CE1 HIS A 138 11.310 4.257 -9.402 1.00 0.00 C ATOM 1806 NE2 HIS A 138 11.028 4.139 -10.731 1.00 0.00 N ATOM 0 H HIS A 138 11.309 1.143 -6.884 1.00 0.00 H new ATOM 0 HA HIS A 138 9.463 -0.016 -8.896 1.00 0.00 H new ATOM 0 HB2 HIS A 138 12.346 0.344 -9.551 1.00 0.00 H new ATOM 0 HB3 HIS A 138 10.965 0.127 -10.609 1.00 0.00 H new ATOM 0 HD2 HIS A 138 10.781 2.446 -12.026 1.00 0.00 H new ATOM 0 HE1 HIS A 138 11.412 5.182 -8.855 1.00 0.00 H new ATOM 0 HE2 HIS A 138 10.877 4.914 -11.377 1.00 0.00 H new ATOM 1814 N TYR A 139 10.211 -2.253 -8.291 1.00 0.00 N ATOM 1815 CA TYR A 139 10.556 -3.591 -7.842 1.00 0.00 C ATOM 1816 C TYR A 139 11.959 -3.981 -8.309 1.00 0.00 C ATOM 1817 O TYR A 139 12.671 -3.167 -8.895 1.00 0.00 O ATOM 1818 CB TYR A 139 9.536 -4.529 -8.491 1.00 0.00 C ATOM 1819 CG TYR A 139 9.874 -4.915 -9.932 1.00 0.00 C ATOM 1820 CD1 TYR A 139 9.661 -4.014 -10.956 1.00 0.00 C ATOM 1821 CD2 TYR A 139 10.392 -6.164 -10.209 1.00 0.00 C ATOM 1822 CE1 TYR A 139 9.980 -4.377 -12.312 1.00 0.00 C ATOM 1823 CE2 TYR A 139 10.710 -6.527 -11.565 1.00 0.00 C ATOM 1824 CZ TYR A 139 10.488 -5.616 -12.550 1.00 0.00 C ATOM 1825 OH TYR A 139 10.789 -5.959 -13.831 1.00 0.00 O ATOM 0 H TYR A 139 9.362 -2.198 -8.854 1.00 0.00 H new ATOM 0 HA TYR A 139 10.542 -3.646 -6.754 1.00 0.00 H new ATOM 0 HB2 TYR A 139 9.459 -5.436 -7.891 1.00 0.00 H new ATOM 0 HB3 TYR A 139 8.556 -4.051 -8.474 1.00 0.00 H new ATOM 0 HD1 TYR A 139 9.255 -3.037 -10.740 1.00 0.00 H new ATOM 0 HD2 TYR A 139 10.559 -6.869 -9.408 1.00 0.00 H new ATOM 0 HE1 TYR A 139 9.820 -3.681 -13.122 1.00 0.00 H new ATOM 0 HE2 TYR A 139 11.116 -7.501 -11.795 1.00 0.00 H new ATOM 0 HH TYR A 139 11.144 -6.872 -13.850 1.00 0.00 H new ATOM 1835 N GLY A 140 12.315 -5.227 -8.032 1.00 0.00 N ATOM 1836 CA GLY A 140 13.621 -5.735 -8.417 1.00 0.00 C ATOM 1837 C GLY A 140 14.051 -6.887 -7.505 1.00 0.00 C ATOM 1838 O GLY A 140 14.840 -7.740 -7.908 1.00 0.00 O ATOM 0 H GLY A 140 11.722 -5.900 -7.546 1.00 0.00 H new ATOM 0 HA2 GLY A 140 13.592 -6.077 -9.452 1.00 0.00 H new ATOM 0 HA3 GLY A 140 14.357 -4.932 -8.367 1.00 0.00 H new ATOM 1842 N GLN A 141 13.514 -6.873 -6.294 1.00 0.00 N ATOM 1843 CA GLN A 141 13.833 -7.905 -5.322 1.00 0.00 C ATOM 1844 C GLN A 141 12.550 -8.542 -4.785 1.00 0.00 C ATOM 1845 O GLN A 141 12.143 -9.608 -5.243 1.00 0.00 O ATOM 1846 CB GLN A 141 14.684 -7.341 -4.183 1.00 0.00 C ATOM 1847 CG GLN A 141 16.145 -7.775 -4.323 1.00 0.00 C ATOM 1848 CD GLN A 141 16.914 -6.822 -5.241 1.00 0.00 C ATOM 1849 OE1 GLN A 141 17.195 -5.684 -4.902 1.00 0.00 O ATOM 1850 NE2 GLN A 141 17.237 -7.349 -6.419 1.00 0.00 N ATOM 0 H GLN A 141 12.860 -6.163 -5.964 1.00 0.00 H new ATOM 0 HA GLN A 141 14.418 -8.678 -5.820 1.00 0.00 H new ATOM 0 HB2 GLN A 141 14.623 -6.253 -4.183 1.00 0.00 H new ATOM 0 HB3 GLN A 141 14.290 -7.683 -3.226 1.00 0.00 H new ATOM 0 HG2 GLN A 141 16.617 -7.799 -3.341 1.00 0.00 H new ATOM 0 HG3 GLN A 141 16.191 -8.788 -4.724 1.00 0.00 H new ATOM 0 HE21 GLN A 141 16.971 -8.309 -6.639 1.00 0.00 H new ATOM 0 HE22 GLN A 141 17.751 -6.793 -7.103 1.00 0.00 H new ATOM 1859 N LYS A 142 11.948 -7.861 -3.820 1.00 0.00 N ATOM 1860 CA LYS A 142 10.720 -8.347 -3.215 1.00 0.00 C ATOM 1861 C LYS A 142 10.363 -7.465 -2.017 1.00 0.00 C ATOM 1862 O LYS A 142 9.929 -7.966 -0.981 1.00 0.00 O ATOM 1863 CB LYS A 142 10.844 -9.833 -2.871 1.00 0.00 C ATOM 1864 CG LYS A 142 12.144 -10.113 -2.114 1.00 0.00 C ATOM 1865 CD LYS A 142 13.171 -10.793 -3.022 1.00 0.00 C ATOM 1866 CE LYS A 142 13.937 -11.880 -2.267 1.00 0.00 C ATOM 1867 NZ LYS A 142 13.428 -13.221 -2.631 1.00 0.00 N ATOM 0 H LYS A 142 12.288 -6.977 -3.443 1.00 0.00 H new ATOM 0 HA LYS A 142 9.893 -8.275 -3.921 1.00 0.00 H new ATOM 0 HB2 LYS A 142 9.992 -10.142 -2.265 1.00 0.00 H new ATOM 0 HB3 LYS A 142 10.817 -10.425 -3.786 1.00 0.00 H new ATOM 0 HG2 LYS A 142 12.554 -9.179 -1.731 1.00 0.00 H new ATOM 0 HG3 LYS A 142 11.938 -10.748 -1.252 1.00 0.00 H new ATOM 0 HD2 LYS A 142 12.666 -11.231 -3.883 1.00 0.00 H new ATOM 0 HD3 LYS A 142 13.870 -10.050 -3.406 1.00 0.00 H new ATOM 0 HE2 LYS A 142 15.000 -11.812 -2.500 1.00 0.00 H new ATOM 0 HE3 LYS A 142 13.835 -11.725 -1.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 13.959 -13.947 -2.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 12.419 -13.287 -2.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 13.547 -13.372 -3.653 1.00 0.00 H new ATOM 1881 N ALA A 143 10.559 -6.168 -2.199 1.00 0.00 N ATOM 1882 CA ALA A 143 10.263 -5.212 -1.145 1.00 0.00 C ATOM 1883 C ALA A 143 8.864 -4.633 -1.366 1.00 0.00 C ATOM 1884 O ALA A 143 8.442 -3.728 -0.648 1.00 0.00 O ATOM 1885 CB ALA A 143 11.344 -4.130 -1.119 1.00 0.00 C ATOM 0 H ALA A 143 10.919 -5.756 -3.060 1.00 0.00 H new ATOM 0 HA ALA A 143 10.268 -5.701 -0.171 1.00 0.00 H new ATOM 0 HB1 ALA A 143 11.122 -3.413 -0.329 1.00 0.00 H new ATOM 0 HB2 ALA A 143 12.314 -4.589 -0.930 1.00 0.00 H new ATOM 0 HB3 ALA A 143 11.367 -3.615 -2.080 1.00 0.00 H new ATOM 1891 N ILE A 144 8.183 -5.179 -2.363 1.00 0.00 N ATOM 1892 CA ILE A 144 6.840 -4.728 -2.688 1.00 0.00 C ATOM 1893 C ILE A 144 5.854 -5.877 -2.471 1.00 0.00 C ATOM 1894 O ILE A 144 4.667 -5.648 -2.247 1.00 0.00 O ATOM 1895 CB ILE A 144 6.799 -4.140 -4.100 1.00 0.00 C ATOM 1896 CG1 ILE A 144 7.223 -5.180 -5.139 1.00 0.00 C ATOM 1897 CG2 ILE A 144 7.640 -2.865 -4.188 1.00 0.00 C ATOM 1898 CD1 ILE A 144 7.678 -4.506 -6.435 1.00 0.00 C ATOM 0 H ILE A 144 8.536 -5.930 -2.957 1.00 0.00 H new ATOM 0 HA ILE A 144 6.538 -3.919 -2.022 1.00 0.00 H new ATOM 0 HB ILE A 144 5.769 -3.862 -4.325 1.00 0.00 H new ATOM 0 HG12 ILE A 144 8.033 -5.790 -4.739 1.00 0.00 H new ATOM 0 HG13 ILE A 144 6.390 -5.852 -5.347 1.00 0.00 H new ATOM 0 HG21 ILE A 144 7.594 -2.468 -5.202 1.00 0.00 H new ATOM 0 HG22 ILE A 144 7.251 -2.124 -3.490 1.00 0.00 H new ATOM 0 HG23 ILE A 144 8.675 -3.094 -3.935 1.00 0.00 H new ATOM 0 HD11 ILE A 144 7.974 -5.267 -7.157 1.00 0.00 H new ATOM 0 HD12 ILE A 144 6.858 -3.916 -6.845 1.00 0.00 H new ATOM 0 HD13 ILE A 144 8.526 -3.854 -6.227 1.00 0.00 H new ATOM 1910 N LEU A 145 6.383 -7.090 -2.545 1.00 0.00 N ATOM 1911 CA LEU A 145 5.565 -8.276 -2.359 1.00 0.00 C ATOM 1912 C LEU A 145 4.740 -8.126 -1.079 1.00 0.00 C ATOM 1913 O LEU A 145 5.203 -8.476 0.006 1.00 0.00 O ATOM 1914 CB LEU A 145 6.432 -9.536 -2.388 1.00 0.00 C ATOM 1915 CG LEU A 145 7.607 -9.518 -3.368 1.00 0.00 C ATOM 1916 CD1 LEU A 145 8.081 -10.939 -3.682 1.00 0.00 C ATOM 1917 CD2 LEU A 145 7.252 -8.740 -4.636 1.00 0.00 C ATOM 0 H LEU A 145 7.368 -7.277 -2.731 1.00 0.00 H new ATOM 0 HA LEU A 145 4.859 -8.384 -3.183 1.00 0.00 H new ATOM 0 HB2 LEU A 145 6.823 -9.707 -1.385 1.00 0.00 H new ATOM 0 HB3 LEU A 145 5.795 -10.386 -2.631 1.00 0.00 H new ATOM 0 HG LEU A 145 8.439 -8.998 -2.893 1.00 0.00 H new ATOM 0 HD11 LEU A 145 8.917 -10.898 -4.381 1.00 0.00 H new ATOM 0 HD12 LEU A 145 8.401 -11.427 -2.762 1.00 0.00 H new ATOM 0 HD13 LEU A 145 7.263 -11.505 -4.128 1.00 0.00 H new ATOM 0 HD21 LEU A 145 8.104 -8.743 -5.315 1.00 0.00 H new ATOM 0 HD22 LEU A 145 6.398 -9.210 -5.124 1.00 0.00 H new ATOM 0 HD23 LEU A 145 7.000 -7.712 -4.374 1.00 0.00 H new ATOM 1929 N PHE A 146 3.533 -7.607 -1.248 1.00 0.00 N ATOM 1930 CA PHE A 146 2.640 -7.407 -0.119 1.00 0.00 C ATOM 1931 C PHE A 146 1.734 -8.622 0.085 1.00 0.00 C ATOM 1932 O PHE A 146 0.961 -8.981 -0.803 1.00 0.00 O ATOM 1933 CB PHE A 146 1.774 -6.188 -0.445 1.00 0.00 C ATOM 1934 CG PHE A 146 2.378 -4.857 0.007 1.00 0.00 C ATOM 1935 CD1 PHE A 146 3.108 -4.795 1.153 1.00 0.00 C ATOM 1936 CD2 PHE A 146 2.185 -3.736 -0.738 1.00 0.00 C ATOM 1937 CE1 PHE A 146 3.669 -3.560 1.572 1.00 0.00 C ATOM 1938 CE2 PHE A 146 2.746 -2.500 -0.319 1.00 0.00 C ATOM 1939 CZ PHE A 146 3.476 -2.438 0.827 1.00 0.00 C ATOM 0 H PHE A 146 3.152 -7.319 -2.149 1.00 0.00 H new ATOM 0 HA PHE A 146 3.219 -7.263 0.793 1.00 0.00 H new ATOM 0 HB2 PHE A 146 1.606 -6.152 -1.521 1.00 0.00 H new ATOM 0 HB3 PHE A 146 0.799 -6.311 0.026 1.00 0.00 H new ATOM 0 HD1 PHE A 146 3.261 -5.686 1.744 1.00 0.00 H new ATOM 0 HD2 PHE A 146 1.605 -3.785 -1.648 1.00 0.00 H new ATOM 0 HE1 PHE A 146 4.249 -3.511 2.482 1.00 0.00 H new ATOM 0 HE2 PHE A 146 2.593 -1.609 -0.910 1.00 0.00 H new ATOM 0 HZ PHE A 146 3.902 -1.498 1.146 1.00 0.00 H new ATOM 1949 N LEU A 147 1.858 -9.223 1.259 1.00 0.00 N ATOM 1950 CA LEU A 147 1.059 -10.391 1.591 1.00 0.00 C ATOM 1951 C LEU A 147 -0.019 -9.995 2.603 1.00 0.00 C ATOM 1952 O LEU A 147 0.284 -9.727 3.764 1.00 0.00 O ATOM 1953 CB LEU A 147 1.956 -11.536 2.064 1.00 0.00 C ATOM 1954 CG LEU A 147 1.493 -12.947 1.695 1.00 0.00 C ATOM 1955 CD1 LEU A 147 0.435 -13.451 2.678 1.00 0.00 C ATOM 1956 CD2 LEU A 147 1.002 -13.002 0.247 1.00 0.00 C ATOM 0 H LEU A 147 2.500 -8.923 1.993 1.00 0.00 H new ATOM 0 HA LEU A 147 0.544 -10.765 0.706 1.00 0.00 H new ATOM 0 HB2 LEU A 147 2.954 -11.383 1.653 1.00 0.00 H new ATOM 0 HB3 LEU A 147 2.046 -11.477 3.149 1.00 0.00 H new ATOM 0 HG LEU A 147 2.349 -13.618 1.770 1.00 0.00 H new ATOM 0 HD11 LEU A 147 0.123 -14.456 2.393 1.00 0.00 H new ATOM 0 HD12 LEU A 147 0.854 -13.473 3.684 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -0.427 -12.784 2.658 1.00 0.00 H new ATOM 0 HD21 LEU A 147 0.679 -14.016 0.011 1.00 0.00 H new ATOM 0 HD22 LEU A 147 0.165 -12.315 0.120 1.00 0.00 H new ATOM 0 HD23 LEU A 147 1.812 -12.714 -0.423 1.00 0.00 H new ATOM 1968 N PRO A 148 -1.286 -9.971 2.111 1.00 0.00 N ATOM 1969 CA PRO A 148 -2.411 -9.613 2.959 1.00 0.00 C ATOM 1970 C PRO A 148 -2.765 -10.757 3.912 1.00 0.00 C ATOM 1971 O PRO A 148 -2.744 -11.923 3.523 1.00 0.00 O ATOM 1972 CB PRO A 148 -3.537 -9.272 1.997 1.00 0.00 C ATOM 1973 CG PRO A 148 -3.150 -9.896 0.665 1.00 0.00 C ATOM 1974 CD PRO A 148 -1.682 -10.283 0.741 1.00 0.00 C ATOM 0 HA PRO A 148 -2.193 -8.767 3.611 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -4.488 -9.668 2.353 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -3.657 -8.193 1.903 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -3.766 -10.772 0.461 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -3.317 -9.191 -0.150 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -1.539 -11.341 0.519 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -1.087 -9.723 0.020 1.00 0.00 H new ATOM 1982 N LEU A 149 -3.082 -10.382 5.143 1.00 0.00 N ATOM 1983 CA LEU A 149 -3.439 -11.362 6.155 1.00 0.00 C ATOM 1984 C LEU A 149 -4.691 -10.889 6.896 1.00 0.00 C ATOM 1985 O LEU A 149 -4.648 -10.642 8.100 1.00 0.00 O ATOM 1986 CB LEU A 149 -2.249 -11.642 7.074 1.00 0.00 C ATOM 1987 CG LEU A 149 -1.758 -10.461 7.914 1.00 0.00 C ATOM 1988 CD1 LEU A 149 -2.087 -10.665 9.394 1.00 0.00 C ATOM 1989 CD2 LEU A 149 -0.265 -10.211 7.688 1.00 0.00 C ATOM 0 H LEU A 149 -3.099 -9.413 5.462 1.00 0.00 H new ATOM 0 HA LEU A 149 -3.684 -12.317 5.691 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -2.519 -12.454 7.748 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -1.419 -11.998 6.463 1.00 0.00 H new ATOM 0 HG LEU A 149 -2.288 -9.566 7.587 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -1.727 -9.811 9.968 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -3.166 -10.756 9.518 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -1.603 -11.573 9.753 1.00 0.00 H new ATOM 0 HD21 LEU A 149 0.059 -9.367 8.297 1.00 0.00 H new ATOM 0 HD22 LEU A 149 0.300 -11.100 7.971 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -0.089 -9.989 6.636 1.00 0.00 H new ATOM 2001 N PRO A 150 -5.806 -10.774 6.126 1.00 0.00 N ATOM 2002 CA PRO A 150 -7.068 -10.335 6.697 1.00 0.00 C ATOM 2003 C PRO A 150 -7.713 -11.449 7.524 1.00 0.00 C ATOM 2004 O PRO A 150 -7.295 -12.603 7.450 1.00 0.00 O ATOM 2005 CB PRO A 150 -7.914 -9.914 5.506 1.00 0.00 C ATOM 2006 CG PRO A 150 -7.274 -10.565 4.290 1.00 0.00 C ATOM 2007 CD PRO A 150 -5.895 -11.057 4.697 1.00 0.00 C ATOM 0 HA PRO A 150 -6.948 -9.507 7.396 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -8.947 -10.241 5.626 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -7.932 -8.829 5.404 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -7.886 -11.394 3.935 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -7.198 -9.851 3.470 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -5.780 -12.122 4.497 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -5.111 -10.542 4.142 1.00 0.00 H new ATOM 2015 N VAL A 151 -8.721 -11.063 8.293 1.00 0.00 N ATOM 2016 CA VAL A 151 -9.427 -12.015 9.133 1.00 0.00 C ATOM 2017 C VAL A 151 -10.683 -11.353 9.702 1.00 0.00 C ATOM 2018 O VAL A 151 -11.009 -11.535 10.874 1.00 0.00 O ATOM 2019 CB VAL A 151 -8.491 -12.552 10.218 1.00 0.00 C ATOM 2020 CG1 VAL A 151 -7.799 -13.836 9.758 1.00 0.00 C ATOM 2021 CG2 VAL A 151 -7.465 -11.493 10.629 1.00 0.00 C ATOM 0 H VAL A 151 -9.065 -10.105 8.352 1.00 0.00 H new ATOM 0 HA VAL A 151 -9.750 -12.875 8.546 1.00 0.00 H new ATOM 0 HB VAL A 151 -9.095 -12.792 11.093 1.00 0.00 H new ATOM 0 HG11 VAL A 151 -7.140 -14.197 10.547 1.00 0.00 H new ATOM 0 HG12 VAL A 151 -8.550 -14.595 9.537 1.00 0.00 H new ATOM 0 HG13 VAL A 151 -7.214 -13.633 8.861 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -6.812 -11.900 11.401 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -6.869 -11.208 9.762 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -7.983 -10.616 11.017 1.00 0.00 H new ATOM 2031 N SER A 152 -11.354 -10.597 8.846 1.00 0.00 N ATOM 2032 CA SER A 152 -12.568 -9.906 9.249 1.00 0.00 C ATOM 2033 C SER A 152 -13.630 -10.920 9.678 1.00 0.00 C ATOM 2034 O SER A 152 -14.497 -11.289 8.887 1.00 0.00 O ATOM 2035 CB SER A 152 -13.101 -9.025 8.117 1.00 0.00 C ATOM 2036 OG SER A 152 -14.184 -8.203 8.546 1.00 0.00 O ATOM 0 H SER A 152 -11.081 -10.447 7.875 1.00 0.00 H new ATOM 0 HA SER A 152 -12.330 -9.260 10.094 1.00 0.00 H new ATOM 0 HB2 SER A 152 -12.296 -8.396 7.738 1.00 0.00 H new ATOM 0 HB3 SER A 152 -13.429 -9.655 7.291 1.00 0.00 H new ATOM 0 HG SER A 152 -14.495 -7.655 7.796 1.00 0.00 H new ATOM 2042 N SER A 153 -13.527 -11.343 10.929 1.00 0.00 N ATOM 2043 CA SER A 153 -14.468 -12.307 11.473 1.00 0.00 C ATOM 2044 C SER A 153 -15.052 -11.785 12.787 1.00 0.00 C ATOM 2045 O SER A 153 -14.925 -12.431 13.827 1.00 0.00 O ATOM 2046 CB SER A 153 -13.799 -13.666 11.692 1.00 0.00 C ATOM 2047 OG SER A 153 -14.675 -14.597 12.323 1.00 0.00 O ATOM 0 H SER A 153 -12.806 -11.036 11.582 1.00 0.00 H new ATOM 0 HA SER A 153 -15.275 -12.441 10.753 1.00 0.00 H new ATOM 0 HB2 SER A 153 -13.473 -14.068 10.733 1.00 0.00 H new ATOM 0 HB3 SER A 153 -12.906 -13.536 12.304 1.00 0.00 H new ATOM 0 HG SER A 153 -14.934 -14.257 13.205 1.00 0.00 H new ATOM 2053 N ASP A 154 -15.679 -10.622 12.698 1.00 0.00 N ATOM 2054 CA ASP A 154 -16.283 -10.005 13.868 1.00 0.00 C ATOM 2055 C ASP A 154 -17.450 -9.120 13.427 1.00 0.00 C ATOM 2056 O ASP A 154 -17.654 -8.905 12.233 1.00 0.00 O ATOM 2057 CB ASP A 154 -15.275 -9.125 14.608 1.00 0.00 C ATOM 2058 CG ASP A 154 -15.672 -8.748 16.037 1.00 0.00 C ATOM 2059 OD1 ASP A 154 -16.495 -7.816 16.170 1.00 0.00 O ATOM 2060 OD2 ASP A 154 -15.145 -9.399 16.964 1.00 0.00 O ATOM 0 H ASP A 154 -15.782 -10.090 11.834 1.00 0.00 H new ATOM 0 HA ASP A 154 -16.623 -10.800 14.532 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -14.316 -9.643 14.638 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -15.125 -8.210 14.035 1.00 0.00 H new TER 2065 ASP A 154 HETATM 2066 C1 NTS A 178 16.488 -5.151 -0.981 1.00 0.00 C HETATM 2067 C2 NTS A 178 15.969 -6.262 -0.316 1.00 0.00 C HETATM 2068 C3 NTS A 178 14.687 -6.721 -0.610 1.00 0.00 C HETATM 2069 C4 NTS A 178 13.921 -6.068 -1.574 1.00 0.00 C HETATM 2070 C5 NTS A 178 13.658 -4.311 -3.204 1.00 0.00 C HETATM 2071 C6 NTS A 178 14.158 -3.199 -3.879 1.00 0.00 C HETATM 2072 C7 NTS A 178 15.439 -2.734 -3.590 1.00 0.00 C HETATM 2073 C8 NTS A 178 16.217 -3.379 -2.629 1.00 0.00 C HETATM 2074 C9 NTS A 178 15.722 -4.494 -1.948 1.00 0.00 C HETATM 2075 C10 NTS A 178 14.436 -4.957 -2.242 1.00 0.00 C HETATM 2076 O11 NTS A 178 18.896 -5.757 0.616 1.00 0.00 O HETATM 2077 O12 NTS A 178 18.112 -2.958 0.188 1.00 0.00 O HETATM 2078 O13 NTS A 178 19.173 -4.544 -2.046 1.00 0.00 O HETATM 2079 O31 NTS A 178 14.757 -8.272 1.897 1.00 0.00 O HETATM 2080 O32 NTS A 178 14.407 -9.661 -0.669 1.00 0.00 O HETATM 2081 O33 NTS A 178 12.231 -8.000 0.419 1.00 0.00 O HETATM 2082 O61 NTS A 178 13.704 -2.847 -6.770 1.00 0.00 O HETATM 2083 O62 NTS A 178 13.316 -0.577 -4.945 1.00 0.00 O HETATM 2084 O63 NTS A 178 11.418 -2.829 -4.923 1.00 0.00 O HETATM 2085 S1 NTS A 178 18.169 -4.597 -0.553 1.00 0.00 S HETATM 2086 S3 NTS A 178 14.016 -8.170 0.260 1.00 0.00 S HETATM 2087 S6 NTS A 178 13.143 -2.358 -5.131 1.00 0.00 S HETATM 0 H8 NTS A 178 17.219 -3.011 -2.408 1.00 0.00 H new HETATM 0 H7 NTS A 178 15.834 -1.865 -4.116 1.00 0.00 H new HETATM 0 H5 NTS A 178 12.656 -4.677 -3.428 1.00 0.00 H new HETATM 0 H4 NTS A 178 12.918 -6.426 -1.806 1.00 0.00 H new HETATM 0 H2 NTS A 178 16.569 -6.773 0.437 1.00 0.00 H new