USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1080 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 69 ASN : amide:sc= 0.99 K(o=1.5,f=-8) USER MOD Set 1.2: A 71 LYS NZ :NH3+ 138:sc= 0.462 (180deg=-2.43!) USER MOD Set 2.1: A 62 HIS : no HD1:sc= -3.24! C(o=-7.4!,f=-11!) USER MOD Set 2.2: A 68 MET CE :methyl -140:sc= -1.79 (180deg=-3.16!) USER MOD Set 2.3: A 118 GLN : amide:sc= -2.37! C(o=-7.4!,f=-8!) USER MOD Set 3.1: A 65 THR OG1 : rot 180:sc= -0.0259 USER MOD Set 3.2: A 67 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 48 MET CE :methyl 160:sc= -2.63! (180deg=-1.77!) USER MOD Set 4.2: A 50 MET CE :methyl 173:sc= -1.01 (180deg=-1.13) USER MOD Set 5.1: A 26 GLN : amide:sc= 0.129 K(o=2.4,f=-7.8!) USER MOD Set 5.2: A 28 LYS NZ :NH3+ 165:sc= 2.28 (180deg=1.16) USER MOD Set 6.1: A 8 LYS NZ :NH3+ -176:sc= 1.48 (180deg=0.214) USER MOD Set 6.2: A 128 THR OG1 : rot 180:sc= 0.994 USER MOD Single : A 1 GLY N :NH3+ 139:sc= 0.012 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 11 TYR OH : rot 165:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 GLN : amide:sc=-0.00704 K(o=-0.007,f=-2.5!) USER MOD Single : A 16 LYS NZ :NH3+ 169:sc= -0.0324 (180deg=-0.211) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= -5.34! C(o=-5.3!,f=-4.4!) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ -147:sc= 1.5 (180deg=1.21) USER MOD Single : A 40 ASN : amide:sc= 1.63 K(o=1.6,f=-7.2!) USER MOD Single : A 43 ASN : amide:sc= -2.74! C(o=-2.7!,f=-11!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 LYS NZ :NH3+ 157:sc= 0.0428 (180deg=-0.625) USER MOD Single : A 59 CYS SG : rot 38:sc= 1.13 USER MOD Single : A 61 ASN : amide:sc= -0.188 K(o=-0.19,f=-0.87) USER MOD Single : A 66 THR OG1 : rot -68:sc= 1.14 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot -130:sc=-0.000907 USER MOD Single : A 81 MET CE :methyl -158:sc= 0 (180deg=-0.213) USER MOD Single : A 85 SER OG : rot 180:sc= 0.133 USER MOD Single : A 88 SER OG : rot -152:sc= -1.86! USER MOD Single : A 93 LYS NZ :NH3+ 171:sc= 1.9 (180deg=1.47) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00229) USER MOD Single : A 103 THR OG1 : rot -170:sc= -0.488 USER MOD Single : A 111 LYS NZ :NH3+ -167:sc=0.000236 (180deg=-0.151) USER MOD Single : A 112 GLN : amide:sc= -0.359 X(o=-0.36,f=-0.32) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 CYS SG : rot 72:sc= -0.336 USER MOD Single : A 127 GLN : amide:sc= -0.0146 K(o=-0.015,f=-1.1) USER MOD Single : A 130 LYS NZ :NH3+ -153:sc= -0.731 (180deg=-1.71!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -15.516 -13.000 -4.833 1.00 0.00 N ATOM 2 CA GLY A 1 -15.725 -13.536 -6.178 1.00 0.00 C ATOM 3 C GLY A 1 -15.855 -12.425 -7.183 1.00 0.00 C ATOM 4 O GLY A 1 -16.573 -11.450 -6.925 1.00 0.00 O ATOM 0 H1 GLY A 1 -16.074 -13.550 -4.149 1.00 0.00 H new ATOM 0 H2 GLY A 1 -14.508 -13.063 -4.587 1.00 0.00 H new ATOM 0 H3 GLY A 1 -15.817 -12.005 -4.805 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -14.891 -14.182 -6.450 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -16.624 -14.152 -6.193 1.00 0.00 H new ATOM 10 N SER A 2 -15.144 -12.565 -8.314 1.00 0.00 N ATOM 11 CA SER A 2 -15.106 -11.592 -9.408 1.00 0.00 C ATOM 12 C SER A 2 -14.394 -10.294 -9.001 1.00 0.00 C ATOM 13 O SER A 2 -14.857 -9.543 -8.121 1.00 0.00 O ATOM 14 CB SER A 2 -16.506 -11.333 -9.959 1.00 0.00 C ATOM 15 OG SER A 2 -17.103 -12.566 -10.347 1.00 0.00 O ATOM 0 H SER A 2 -14.564 -13.384 -8.493 1.00 0.00 H new ATOM 0 HA SER A 2 -14.513 -12.026 -10.213 1.00 0.00 H new ATOM 0 HB2 SER A 2 -17.120 -10.842 -9.204 1.00 0.00 H new ATOM 0 HB3 SER A 2 -16.452 -10.659 -10.814 1.00 0.00 H new ATOM 0 HG SER A 2 -18.002 -12.398 -10.699 1.00 0.00 H new ATOM 21 N GLY A 3 -13.267 -10.045 -9.613 1.00 0.00 N ATOM 22 CA GLY A 3 -12.519 -8.874 -9.287 1.00 0.00 C ATOM 23 C GLY A 3 -11.052 -9.065 -9.517 1.00 0.00 C ATOM 24 O GLY A 3 -10.250 -8.934 -8.600 1.00 0.00 O ATOM 0 H GLY A 3 -12.854 -10.636 -10.334 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -12.875 -8.037 -9.888 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -12.691 -8.612 -8.243 1.00 0.00 H new ATOM 28 N GLU A 4 -10.700 -9.384 -10.736 1.00 0.00 N ATOM 29 CA GLU A 4 -9.308 -9.525 -11.120 1.00 0.00 C ATOM 30 C GLU A 4 -8.872 -8.229 -11.765 1.00 0.00 C ATOM 31 O GLU A 4 -7.716 -8.046 -12.151 1.00 0.00 O ATOM 32 CB GLU A 4 -9.128 -10.690 -12.101 1.00 0.00 C ATOM 33 CG GLU A 4 -9.402 -12.063 -11.506 1.00 0.00 C ATOM 34 CD GLU A 4 -8.481 -12.390 -10.352 1.00 0.00 C ATOM 35 OE1 GLU A 4 -7.282 -12.661 -10.584 1.00 0.00 O ATOM 36 OE2 GLU A 4 -8.937 -12.409 -9.198 1.00 0.00 O ATOM 0 H GLU A 4 -11.363 -9.554 -11.492 1.00 0.00 H new ATOM 0 HA GLU A 4 -8.701 -9.739 -10.241 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -9.792 -10.538 -12.952 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -8.108 -10.671 -12.485 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -10.436 -12.107 -11.165 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -9.290 -12.820 -12.282 1.00 0.00 H new ATOM 43 N GLU A 5 -9.812 -7.326 -11.831 1.00 0.00 N ATOM 44 CA GLU A 5 -9.714 -6.097 -12.396 1.00 0.00 C ATOM 45 C GLU A 5 -10.799 -5.311 -11.754 1.00 0.00 C ATOM 46 O GLU A 5 -11.786 -5.902 -11.244 1.00 0.00 O ATOM 47 CB GLU A 5 -9.951 -6.142 -13.895 1.00 0.00 C ATOM 48 CG GLU A 5 -11.384 -6.444 -14.221 1.00 0.00 C ATOM 49 CD GLU A 5 -11.758 -7.923 -14.132 1.00 0.00 C ATOM 50 OE1 GLU A 5 -11.620 -8.643 -15.159 1.00 0.00 O ATOM 51 OE2 GLU A 5 -12.212 -8.389 -13.052 1.00 0.00 O ATOM 0 H GLU A 5 -10.738 -7.494 -11.439 1.00 0.00 H new ATOM 0 HA GLU A 5 -8.719 -5.675 -12.252 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -9.671 -5.186 -14.337 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -9.308 -6.900 -14.343 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -12.024 -5.879 -13.543 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -11.596 -6.089 -15.229 1.00 0.00 H new ATOM 58 N ASP A 6 -10.542 -4.065 -11.708 1.00 0.00 N ATOM 59 CA ASP A 6 -11.417 -2.968 -11.231 1.00 0.00 C ATOM 60 C ASP A 6 -10.557 -1.839 -10.825 1.00 0.00 C ATOM 61 O ASP A 6 -10.843 -0.680 -11.038 1.00 0.00 O ATOM 62 CB ASP A 6 -12.305 -3.404 -10.073 1.00 0.00 C ATOM 63 CG ASP A 6 -12.956 -2.279 -9.263 1.00 0.00 C ATOM 64 OD1 ASP A 6 -12.311 -1.702 -8.365 1.00 0.00 O ATOM 65 OD2 ASP A 6 -14.161 -2.000 -9.474 1.00 0.00 O ATOM 0 H ASP A 6 -9.640 -3.709 -12.023 1.00 0.00 H new ATOM 0 HA ASP A 6 -12.085 -2.672 -12.039 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -13.094 -4.044 -10.468 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -11.709 -4.015 -9.395 1.00 0.00 H new ATOM 70 N GLU A 7 -9.476 -2.202 -10.355 1.00 0.00 N ATOM 71 CA GLU A 7 -8.551 -1.319 -9.845 1.00 0.00 C ATOM 72 C GLU A 7 -7.550 -0.995 -10.881 1.00 0.00 C ATOM 73 O GLU A 7 -7.130 -1.829 -11.692 1.00 0.00 O ATOM 74 CB GLU A 7 -7.991 -1.803 -8.478 1.00 0.00 C ATOM 75 CG GLU A 7 -7.358 -3.200 -8.459 1.00 0.00 C ATOM 76 CD GLU A 7 -8.348 -4.329 -8.601 1.00 0.00 C ATOM 77 OE1 GLU A 7 -8.997 -4.716 -7.602 1.00 0.00 O ATOM 78 OE2 GLU A 7 -8.474 -4.856 -9.715 1.00 0.00 O ATOM 0 H GLU A 7 -9.184 -3.178 -10.308 1.00 0.00 H new ATOM 0 HA GLU A 7 -9.025 -0.370 -9.596 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -7.244 -1.084 -8.141 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -8.802 -1.785 -7.750 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -6.629 -3.267 -9.266 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -6.811 -3.326 -7.524 1.00 0.00 H new ATOM 85 N LYS A 8 -7.227 0.226 -10.872 1.00 0.00 N ATOM 86 CA LYS A 8 -6.446 0.832 -11.891 1.00 0.00 C ATOM 87 C LYS A 8 -5.067 1.268 -11.386 1.00 0.00 C ATOM 88 O LYS A 8 -4.897 1.511 -10.198 1.00 0.00 O ATOM 89 CB LYS A 8 -7.237 1.979 -12.560 1.00 0.00 C ATOM 90 CG LYS A 8 -7.658 3.112 -11.612 1.00 0.00 C ATOM 91 CD LYS A 8 -8.702 4.047 -12.245 1.00 0.00 C ATOM 92 CE LYS A 8 -10.070 3.356 -12.390 1.00 0.00 C ATOM 93 NZ LYS A 8 -11.104 4.246 -12.991 1.00 0.00 N ATOM 0 H LYS A 8 -7.503 0.870 -10.131 1.00 0.00 H new ATOM 0 HA LYS A 8 -6.244 0.084 -12.658 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -6.629 2.401 -13.360 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -8.131 1.562 -13.024 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -8.065 2.684 -10.696 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -6.779 3.691 -11.329 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -8.809 4.942 -11.632 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -8.353 4.372 -13.225 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -9.959 2.466 -13.009 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -10.409 3.022 -11.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -12.020 3.755 -13.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -11.185 5.115 -12.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -10.829 4.490 -13.964 1.00 0.00 H new ATOM 107 N VAL A 9 -4.104 1.384 -12.290 1.00 0.00 N ATOM 108 CA VAL A 9 -2.734 1.666 -11.942 1.00 0.00 C ATOM 109 C VAL A 9 -2.571 3.109 -11.563 1.00 0.00 C ATOM 110 O VAL A 9 -2.867 4.017 -12.336 1.00 0.00 O ATOM 111 CB VAL A 9 -1.740 1.330 -13.098 1.00 0.00 C ATOM 112 CG1 VAL A 9 -0.292 1.548 -12.665 1.00 0.00 C ATOM 113 CG2 VAL A 9 -1.930 -0.090 -13.597 1.00 0.00 C ATOM 0 H VAL A 9 -4.262 1.283 -13.293 1.00 0.00 H new ATOM 0 HA VAL A 9 -2.495 1.025 -11.093 1.00 0.00 H new ATOM 0 HB VAL A 9 -1.960 2.013 -13.919 1.00 0.00 H new ATOM 0 HG11 VAL A 9 0.375 1.305 -13.492 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -0.151 2.590 -12.378 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -0.066 0.904 -11.815 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -1.222 -0.291 -14.401 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -1.757 -0.789 -12.779 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -2.947 -0.212 -13.970 1.00 0.00 H new ATOM 123 N LEU A 10 -2.150 3.292 -10.379 1.00 0.00 N ATOM 124 CA LEU A 10 -1.843 4.601 -9.861 1.00 0.00 C ATOM 125 C LEU A 10 -0.364 4.910 -10.103 1.00 0.00 C ATOM 126 O LEU A 10 -0.023 5.967 -10.611 1.00 0.00 O ATOM 127 CB LEU A 10 -2.243 4.691 -8.358 1.00 0.00 C ATOM 128 CG LEU A 10 -2.206 6.081 -7.651 1.00 0.00 C ATOM 129 CD1 LEU A 10 -2.943 6.002 -6.327 1.00 0.00 C ATOM 130 CD2 LEU A 10 -0.782 6.558 -7.382 1.00 0.00 C ATOM 0 H LEU A 10 -1.999 2.536 -9.712 1.00 0.00 H new ATOM 0 HA LEU A 10 -2.424 5.360 -10.384 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -3.256 4.299 -8.262 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -1.588 4.021 -7.802 1.00 0.00 H new ATOM 0 HG LEU A 10 -2.685 6.793 -8.324 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -2.915 6.975 -5.836 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -3.979 5.715 -6.504 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -2.465 5.259 -5.688 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -0.811 7.530 -6.889 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -0.273 5.840 -6.739 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -0.243 6.646 -8.326 1.00 0.00 H new ATOM 142 N TYR A 11 0.493 3.976 -9.764 1.00 0.00 N ATOM 143 CA TYR A 11 1.947 4.166 -9.902 1.00 0.00 C ATOM 144 C TYR A 11 2.650 2.821 -9.859 1.00 0.00 C ATOM 145 O TYR A 11 2.146 1.883 -9.224 1.00 0.00 O ATOM 146 CB TYR A 11 2.446 5.087 -8.774 1.00 0.00 C ATOM 147 CG TYR A 11 3.905 5.493 -8.816 1.00 0.00 C ATOM 148 CD1 TYR A 11 4.331 6.510 -9.660 1.00 0.00 C ATOM 149 CD2 TYR A 11 4.846 4.886 -7.993 1.00 0.00 C ATOM 150 CE1 TYR A 11 5.652 6.906 -9.689 1.00 0.00 C ATOM 151 CE2 TYR A 11 6.167 5.283 -8.013 1.00 0.00 C ATOM 152 CZ TYR A 11 6.565 6.293 -8.864 1.00 0.00 C ATOM 153 OH TYR A 11 7.887 6.700 -8.883 1.00 0.00 O ATOM 0 H TYR A 11 0.223 3.067 -9.387 1.00 0.00 H new ATOM 0 HA TYR A 11 2.171 4.633 -10.861 1.00 0.00 H new ATOM 0 HB2 TYR A 11 1.841 5.994 -8.784 1.00 0.00 H new ATOM 0 HB3 TYR A 11 2.259 4.590 -7.822 1.00 0.00 H new ATOM 0 HD1 TYR A 11 3.616 6.999 -10.305 1.00 0.00 H new ATOM 0 HD2 TYR A 11 4.539 4.092 -7.328 1.00 0.00 H new ATOM 0 HE1 TYR A 11 5.968 7.694 -10.357 1.00 0.00 H new ATOM 0 HE2 TYR A 11 6.887 4.805 -7.365 1.00 0.00 H new ATOM 0 HH TYR A 11 8.348 6.350 -8.093 1.00 0.00 H new ATOM 163 N SER A 12 3.757 2.707 -10.574 1.00 0.00 N ATOM 164 CA SER A 12 4.542 1.533 -10.611 1.00 0.00 C ATOM 165 C SER A 12 6.050 1.828 -10.353 1.00 0.00 C ATOM 166 O SER A 12 6.603 2.796 -10.916 1.00 0.00 O ATOM 167 CB SER A 12 4.322 0.882 -11.956 1.00 0.00 C ATOM 168 OG SER A 12 4.494 1.798 -13.033 1.00 0.00 O ATOM 0 H SER A 12 4.125 3.462 -11.153 1.00 0.00 H new ATOM 0 HA SER A 12 4.237 0.858 -9.811 1.00 0.00 H new ATOM 0 HB2 SER A 12 5.018 0.051 -12.074 1.00 0.00 H new ATOM 0 HB3 SER A 12 3.316 0.463 -11.995 1.00 0.00 H new ATOM 0 HG SER A 12 4.344 1.335 -13.884 1.00 0.00 H new ATOM 174 N GLN A 13 6.703 1.036 -9.473 1.00 0.00 N ATOM 175 CA GLN A 13 8.151 1.213 -9.208 1.00 0.00 C ATOM 176 C GLN A 13 8.904 -0.048 -8.834 1.00 0.00 C ATOM 177 O GLN A 13 8.372 -0.934 -8.211 1.00 0.00 O ATOM 178 CB GLN A 13 8.435 2.373 -8.253 1.00 0.00 C ATOM 179 CG GLN A 13 9.257 3.498 -8.859 1.00 0.00 C ATOM 180 CD GLN A 13 10.684 3.094 -9.143 1.00 0.00 C ATOM 181 OE1 GLN A 13 11.011 2.589 -10.224 1.00 0.00 O ATOM 182 NE2 GLN A 13 11.539 3.299 -8.187 1.00 0.00 N ATOM 0 H GLN A 13 6.263 0.283 -8.944 1.00 0.00 H new ATOM 0 HA GLN A 13 8.564 1.484 -10.180 1.00 0.00 H new ATOM 0 HB2 GLN A 13 7.486 2.780 -7.903 1.00 0.00 H new ATOM 0 HB3 GLN A 13 8.958 1.988 -7.378 1.00 0.00 H new ATOM 0 HG2 GLN A 13 8.786 3.827 -9.785 1.00 0.00 H new ATOM 0 HG3 GLN A 13 9.254 4.350 -8.180 1.00 0.00 H new ATOM 0 HE21 GLN A 13 11.232 3.718 -7.309 1.00 0.00 H new ATOM 0 HE22 GLN A 13 12.518 3.041 -8.314 1.00 0.00 H new ATOM 191 N ARG A 14 10.189 -0.051 -9.164 1.00 0.00 N ATOM 192 CA ARG A 14 11.061 -1.166 -8.923 1.00 0.00 C ATOM 193 C ARG A 14 11.450 -1.184 -7.465 1.00 0.00 C ATOM 194 O ARG A 14 12.009 -0.217 -6.933 1.00 0.00 O ATOM 195 CB ARG A 14 12.295 -1.091 -9.833 1.00 0.00 C ATOM 196 CG ARG A 14 13.314 -2.209 -9.630 1.00 0.00 C ATOM 197 CD ARG A 14 14.415 -2.124 -10.671 1.00 0.00 C ATOM 198 NE ARG A 14 15.480 -3.120 -10.470 1.00 0.00 N ATOM 199 CZ ARG A 14 15.834 -4.054 -11.366 1.00 0.00 C ATOM 200 NH1 ARG A 14 15.043 -4.320 -12.395 1.00 0.00 N ATOM 201 NH2 ARG A 14 16.961 -4.756 -11.204 1.00 0.00 N ATOM 0 H ARG A 14 10.651 0.740 -9.613 1.00 0.00 H new ATOM 0 HA ARG A 14 10.542 -2.095 -9.158 1.00 0.00 H new ATOM 0 HB2 ARG A 14 11.964 -1.106 -10.871 1.00 0.00 H new ATOM 0 HB3 ARG A 14 12.791 -0.134 -9.670 1.00 0.00 H new ATOM 0 HG2 ARG A 14 13.744 -2.139 -8.631 1.00 0.00 H new ATOM 0 HG3 ARG A 14 12.818 -3.177 -9.696 1.00 0.00 H new ATOM 0 HD2 ARG A 14 13.981 -2.260 -11.662 1.00 0.00 H new ATOM 0 HD3 ARG A 14 14.851 -1.125 -10.649 1.00 0.00 H new ATOM 0 HE ARG A 14 15.986 -3.099 -9.585 1.00 0.00 H new ATOM 0 HH11 ARG A 14 14.164 -3.815 -12.507 1.00 0.00 H new ATOM 0 HH12 ARG A 14 15.313 -5.030 -13.076 1.00 0.00 H new ATOM 0 HH21 ARG A 14 17.558 -4.583 -10.395 1.00 0.00 H new ATOM 0 HH22 ARG A 14 17.224 -5.464 -11.889 1.00 0.00 H new ATOM 215 N VAL A 15 11.123 -2.265 -6.844 1.00 0.00 N ATOM 216 CA VAL A 15 11.244 -2.443 -5.434 1.00 0.00 C ATOM 217 C VAL A 15 11.630 -3.914 -5.134 1.00 0.00 C ATOM 218 O VAL A 15 11.727 -4.739 -6.059 1.00 0.00 O ATOM 219 CB VAL A 15 9.870 -2.112 -4.795 1.00 0.00 C ATOM 220 CG1 VAL A 15 8.852 -3.208 -5.062 1.00 0.00 C ATOM 221 CG2 VAL A 15 9.965 -1.742 -3.319 1.00 0.00 C ATOM 0 H VAL A 15 10.748 -3.084 -7.323 1.00 0.00 H new ATOM 0 HA VAL A 15 12.015 -1.790 -5.025 1.00 0.00 H new ATOM 0 HB VAL A 15 9.508 -1.211 -5.290 1.00 0.00 H new ATOM 0 HG11 VAL A 15 7.901 -2.942 -4.600 1.00 0.00 H new ATOM 0 HG12 VAL A 15 8.713 -3.322 -6.137 1.00 0.00 H new ATOM 0 HG13 VAL A 15 9.210 -4.148 -4.641 1.00 0.00 H new ATOM 0 HG21 VAL A 15 8.969 -1.522 -2.934 1.00 0.00 H new ATOM 0 HG22 VAL A 15 10.394 -2.575 -2.762 1.00 0.00 H new ATOM 0 HG23 VAL A 15 10.600 -0.864 -3.204 1.00 0.00 H new ATOM 231 N LYS A 16 11.885 -4.210 -3.881 1.00 0.00 N ATOM 232 CA LYS A 16 12.141 -5.559 -3.409 1.00 0.00 C ATOM 233 C LYS A 16 11.128 -5.864 -2.318 1.00 0.00 C ATOM 234 O LYS A 16 10.993 -5.036 -1.394 1.00 0.00 O ATOM 235 CB LYS A 16 13.547 -5.634 -2.806 1.00 0.00 C ATOM 236 CG LYS A 16 14.665 -5.345 -3.783 1.00 0.00 C ATOM 237 CD LYS A 16 16.021 -5.455 -3.117 1.00 0.00 C ATOM 238 CE LYS A 16 17.144 -5.248 -4.118 1.00 0.00 C ATOM 239 NZ LYS A 16 17.063 -3.932 -4.791 1.00 0.00 N ATOM 0 H LYS A 16 11.922 -3.508 -3.142 1.00 0.00 H new ATOM 0 HA LYS A 16 12.063 -6.270 -4.232 1.00 0.00 H new ATOM 0 HB2 LYS A 16 13.612 -4.927 -1.979 1.00 0.00 H new ATOM 0 HB3 LYS A 16 13.696 -6.629 -2.387 1.00 0.00 H new ATOM 0 HG2 LYS A 16 14.610 -6.043 -4.618 1.00 0.00 H new ATOM 0 HG3 LYS A 16 14.540 -4.344 -4.196 1.00 0.00 H new ATOM 0 HD2 LYS A 16 16.099 -4.714 -2.321 1.00 0.00 H new ATOM 0 HD3 LYS A 16 16.122 -6.435 -2.651 1.00 0.00 H new ATOM 0 HE2 LYS A 16 18.103 -5.334 -3.607 1.00 0.00 H new ATOM 0 HE3 LYS A 16 17.110 -6.039 -4.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 17.941 -3.758 -5.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 16.256 -3.927 -5.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 16.935 -3.185 -4.079 1.00 0.00 H new ATOM 253 N LEU A 17 10.408 -7.008 -2.386 1.00 0.00 N ATOM 254 CA LEU A 17 9.444 -7.293 -1.355 1.00 0.00 C ATOM 255 C LEU A 17 9.948 -8.437 -0.579 1.00 0.00 C ATOM 256 O LEU A 17 10.662 -9.289 -1.108 1.00 0.00 O ATOM 257 CB LEU A 17 8.053 -7.642 -1.892 1.00 0.00 C ATOM 258 CG LEU A 17 6.912 -7.697 -0.878 1.00 0.00 C ATOM 259 CD1 LEU A 17 6.687 -6.333 -0.251 1.00 0.00 C ATOM 260 CD2 LEU A 17 5.656 -8.153 -1.562 1.00 0.00 C ATOM 0 H LEU A 17 10.486 -7.710 -3.122 1.00 0.00 H new ATOM 0 HA LEU A 17 9.328 -6.392 -0.753 1.00 0.00 H new ATOM 0 HB2 LEU A 17 7.792 -6.910 -2.657 1.00 0.00 H new ATOM 0 HB3 LEU A 17 8.114 -8.612 -2.386 1.00 0.00 H new ATOM 0 HG LEU A 17 7.178 -8.401 -0.089 1.00 0.00 H new ATOM 0 HD11 LEU A 17 5.870 -6.393 0.468 1.00 0.00 H new ATOM 0 HD12 LEU A 17 7.596 -6.012 0.258 1.00 0.00 H new ATOM 0 HD13 LEU A 17 6.433 -5.613 -1.029 1.00 0.00 H new ATOM 0 HD21 LEU A 17 4.842 -8.192 -0.839 1.00 0.00 H new ATOM 0 HD22 LEU A 17 5.401 -7.454 -2.358 1.00 0.00 H new ATOM 0 HD23 LEU A 17 5.812 -9.145 -1.987 1.00 0.00 H new ATOM 272 N PHE A 18 9.606 -8.450 0.638 1.00 0.00 N ATOM 273 CA PHE A 18 9.992 -9.438 1.580 1.00 0.00 C ATOM 274 C PHE A 18 8.799 -9.783 2.442 1.00 0.00 C ATOM 275 O PHE A 18 7.953 -8.956 2.654 1.00 0.00 O ATOM 276 CB PHE A 18 11.095 -8.873 2.480 1.00 0.00 C ATOM 277 CG PHE A 18 12.389 -8.538 1.786 1.00 0.00 C ATOM 278 CD1 PHE A 18 12.573 -7.306 1.180 1.00 0.00 C ATOM 279 CD2 PHE A 18 13.413 -9.458 1.732 1.00 0.00 C ATOM 280 CE1 PHE A 18 13.751 -7.008 0.536 1.00 0.00 C ATOM 281 CE2 PHE A 18 14.591 -9.164 1.088 1.00 0.00 C ATOM 282 CZ PHE A 18 14.760 -7.937 0.488 1.00 0.00 C ATOM 0 H PHE A 18 9.009 -7.729 1.043 1.00 0.00 H new ATOM 0 HA PHE A 18 10.353 -10.324 1.057 1.00 0.00 H new ATOM 0 HB2 PHE A 18 10.719 -7.972 2.964 1.00 0.00 H new ATOM 0 HB3 PHE A 18 11.302 -9.596 3.269 1.00 0.00 H new ATOM 0 HD1 PHE A 18 11.782 -6.571 1.214 1.00 0.00 H new ATOM 0 HD2 PHE A 18 13.288 -10.423 2.202 1.00 0.00 H new ATOM 0 HE1 PHE A 18 13.882 -6.043 0.068 1.00 0.00 H new ATOM 0 HE2 PHE A 18 15.384 -9.896 1.053 1.00 0.00 H new ATOM 0 HZ PHE A 18 15.685 -7.706 -0.020 1.00 0.00 H new ATOM 292 N ARG A 19 8.721 -10.996 2.889 1.00 0.00 N ATOM 293 CA ARG A 19 7.784 -11.415 3.791 1.00 0.00 C ATOM 294 C ARG A 19 8.452 -11.839 5.027 1.00 0.00 C ATOM 295 O ARG A 19 9.549 -12.365 5.019 1.00 0.00 O ATOM 296 CB ARG A 19 6.911 -12.498 3.232 1.00 0.00 C ATOM 297 CG ARG A 19 7.596 -13.700 2.554 1.00 0.00 C ATOM 298 CD ARG A 19 8.060 -14.712 3.585 1.00 0.00 C ATOM 299 NE ARG A 19 8.902 -15.775 3.045 1.00 0.00 N ATOM 300 CZ ARG A 19 9.464 -16.722 3.805 1.00 0.00 C ATOM 301 NH1 ARG A 19 9.044 -16.892 5.054 1.00 0.00 N ATOM 302 NH2 ARG A 19 10.376 -17.527 3.298 1.00 0.00 N ATOM 0 H ARG A 19 9.360 -11.735 2.597 1.00 0.00 H new ATOM 0 HA ARG A 19 7.122 -10.579 4.017 1.00 0.00 H new ATOM 0 HB2 ARG A 19 6.292 -12.880 4.044 1.00 0.00 H new ATOM 0 HB3 ARG A 19 6.238 -12.043 2.505 1.00 0.00 H new ATOM 0 HG2 ARG A 19 6.903 -14.174 1.859 1.00 0.00 H new ATOM 0 HG3 ARG A 19 8.448 -13.355 1.968 1.00 0.00 H new ATOM 0 HD2 ARG A 19 8.611 -14.190 4.367 1.00 0.00 H new ATOM 0 HD3 ARG A 19 7.185 -15.161 4.056 1.00 0.00 H new ATOM 0 HE ARG A 19 9.070 -15.797 2.039 1.00 0.00 H new ATOM 0 HH11 ARG A 19 8.299 -16.303 5.426 1.00 0.00 H new ATOM 0 HH12 ARG A 19 9.467 -17.611 5.641 1.00 0.00 H new ATOM 0 HH21 ARG A 19 10.656 -17.430 2.322 1.00 0.00 H new ATOM 0 HH22 ARG A 19 10.801 -18.247 3.881 1.00 0.00 H new ATOM 316 N PHE A 20 7.798 -11.609 6.028 1.00 0.00 N ATOM 317 CA PHE A 20 8.240 -11.825 7.336 1.00 0.00 C ATOM 318 C PHE A 20 7.927 -13.228 7.682 1.00 0.00 C ATOM 319 O PHE A 20 6.815 -13.703 7.479 1.00 0.00 O ATOM 320 CB PHE A 20 7.491 -10.920 8.290 1.00 0.00 C ATOM 321 CG PHE A 20 8.161 -10.686 9.608 1.00 0.00 C ATOM 322 CD1 PHE A 20 9.151 -9.730 9.727 1.00 0.00 C ATOM 323 CD2 PHE A 20 7.790 -11.408 10.728 1.00 0.00 C ATOM 324 CE1 PHE A 20 9.762 -9.498 10.938 1.00 0.00 C ATOM 325 CE2 PHE A 20 8.398 -11.182 11.941 1.00 0.00 C ATOM 326 CZ PHE A 20 9.386 -10.225 12.047 1.00 0.00 C ATOM 0 H PHE A 20 6.852 -11.231 5.986 1.00 0.00 H new ATOM 0 HA PHE A 20 9.308 -11.620 7.411 1.00 0.00 H new ATOM 0 HB2 PHE A 20 7.335 -9.957 7.804 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.505 -11.348 8.473 1.00 0.00 H new ATOM 0 HD1 PHE A 20 9.449 -9.159 8.860 1.00 0.00 H new ATOM 0 HD2 PHE A 20 7.015 -12.156 10.649 1.00 0.00 H new ATOM 0 HE1 PHE A 20 10.535 -8.748 11.019 1.00 0.00 H new ATOM 0 HE2 PHE A 20 8.102 -11.753 12.809 1.00 0.00 H new ATOM 0 HZ PHE A 20 9.865 -10.046 12.998 1.00 0.00 H new ATOM 336 N ASP A 21 8.874 -13.872 8.150 1.00 0.00 N ATOM 337 CA ASP A 21 8.715 -15.214 8.615 1.00 0.00 C ATOM 338 C ASP A 21 8.314 -15.167 10.010 1.00 0.00 C ATOM 339 O ASP A 21 8.921 -14.553 10.793 1.00 0.00 O ATOM 340 CB ASP A 21 9.941 -16.120 8.510 1.00 0.00 C ATOM 341 CG ASP A 21 9.468 -17.540 8.244 1.00 0.00 C ATOM 342 OD1 ASP A 21 8.658 -18.047 9.019 1.00 0.00 O ATOM 343 OD2 ASP A 21 9.878 -18.144 7.232 1.00 0.00 O ATOM 0 H ASP A 21 9.822 -13.506 8.239 1.00 0.00 H new ATOM 0 HA ASP A 21 7.970 -15.656 7.953 1.00 0.00 H new ATOM 0 HB2 ASP A 21 10.595 -15.781 7.706 1.00 0.00 H new ATOM 0 HB3 ASP A 21 10.522 -16.080 9.432 1.00 0.00 H new ATOM 348 N ALA A 22 7.248 -15.702 10.245 1.00 0.00 N ATOM 349 CA ALA A 22 6.692 -15.833 11.569 1.00 0.00 C ATOM 350 C ALA A 22 7.535 -16.813 12.368 1.00 0.00 C ATOM 351 O ALA A 22 7.775 -16.634 13.554 1.00 0.00 O ATOM 352 CB ALA A 22 5.259 -16.292 11.494 1.00 0.00 C ATOM 0 H ALA A 22 6.658 -16.104 9.516 1.00 0.00 H new ATOM 0 HA ALA A 22 6.704 -14.864 12.068 1.00 0.00 H new ATOM 0 HB1 ALA A 22 4.854 -16.386 12.502 1.00 0.00 H new ATOM 0 HB2 ALA A 22 4.673 -15.564 10.934 1.00 0.00 H new ATOM 0 HB3 ALA A 22 5.212 -17.259 10.993 1.00 0.00 H new ATOM 358 N GLU A 23 8.026 -17.815 11.674 1.00 0.00 N ATOM 359 CA GLU A 23 8.837 -18.845 12.245 1.00 0.00 C ATOM 360 C GLU A 23 10.282 -18.405 12.362 1.00 0.00 C ATOM 361 O GLU A 23 11.006 -18.862 13.235 1.00 0.00 O ATOM 362 CB GLU A 23 8.743 -20.076 11.387 1.00 0.00 C ATOM 363 CG GLU A 23 7.385 -20.722 11.432 1.00 0.00 C ATOM 364 CD GLU A 23 7.122 -21.430 12.731 1.00 0.00 C ATOM 365 OE1 GLU A 23 6.671 -20.797 13.701 1.00 0.00 O ATOM 366 OE2 GLU A 23 7.352 -22.661 12.797 1.00 0.00 O ATOM 0 H GLU A 23 7.864 -17.931 10.674 1.00 0.00 H new ATOM 0 HA GLU A 23 8.472 -19.061 13.249 1.00 0.00 H new ATOM 0 HB2 GLU A 23 8.980 -19.813 10.356 1.00 0.00 H new ATOM 0 HB3 GLU A 23 9.493 -20.797 11.712 1.00 0.00 H new ATOM 0 HG2 GLU A 23 6.620 -19.961 11.276 1.00 0.00 H new ATOM 0 HG3 GLU A 23 7.298 -21.434 10.611 1.00 0.00 H new ATOM 373 N VAL A 24 10.714 -17.505 11.481 1.00 0.00 N ATOM 374 CA VAL A 24 12.128 -17.076 11.525 1.00 0.00 C ATOM 375 C VAL A 24 12.246 -15.694 12.049 1.00 0.00 C ATOM 376 O VAL A 24 13.337 -15.199 12.345 1.00 0.00 O ATOM 377 CB VAL A 24 12.866 -17.136 10.162 1.00 0.00 C ATOM 378 CG1 VAL A 24 14.384 -17.188 10.326 1.00 0.00 C ATOM 379 CG2 VAL A 24 12.380 -18.269 9.372 1.00 0.00 C ATOM 0 H VAL A 24 10.144 -17.070 10.756 1.00 0.00 H new ATOM 0 HA VAL A 24 12.607 -17.796 12.188 1.00 0.00 H new ATOM 0 HB VAL A 24 12.643 -16.213 9.626 1.00 0.00 H new ATOM 0 HG11 VAL A 24 14.855 -17.229 9.344 1.00 0.00 H new ATOM 0 HG12 VAL A 24 14.724 -16.297 10.854 1.00 0.00 H new ATOM 0 HG13 VAL A 24 14.658 -18.075 10.897 1.00 0.00 H new ATOM 0 HG21 VAL A 24 12.906 -18.300 8.418 1.00 0.00 H new ATOM 0 HG22 VAL A 24 12.561 -19.196 9.916 1.00 0.00 H new ATOM 0 HG23 VAL A 24 11.311 -18.156 9.193 1.00 0.00 H new ATOM 389 N SER A 25 11.106 -15.089 12.194 1.00 0.00 N ATOM 390 CA SER A 25 10.980 -13.687 12.433 1.00 0.00 C ATOM 391 C SER A 25 11.699 -12.945 11.388 1.00 0.00 C ATOM 392 O SER A 25 12.186 -11.844 11.636 1.00 0.00 O ATOM 393 CB SER A 25 11.458 -13.345 13.790 1.00 0.00 C ATOM 394 OG SER A 25 10.462 -13.562 14.781 1.00 0.00 O ATOM 0 H SER A 25 10.211 -15.575 12.147 1.00 0.00 H new ATOM 0 HA SER A 25 9.929 -13.400 12.387 1.00 0.00 H new ATOM 0 HB2 SER A 25 12.338 -13.944 14.025 1.00 0.00 H new ATOM 0 HB3 SER A 25 11.768 -12.300 13.812 1.00 0.00 H new ATOM 0 HG SER A 25 10.820 -13.325 15.662 1.00 0.00 H new ATOM 400 N GLN A 26 11.727 -13.467 10.160 1.00 0.00 N ATOM 401 CA GLN A 26 12.582 -12.729 9.292 1.00 0.00 C ATOM 402 C GLN A 26 11.980 -12.401 7.945 1.00 0.00 C ATOM 403 O GLN A 26 11.276 -13.194 7.370 1.00 0.00 O ATOM 404 CB GLN A 26 13.969 -13.394 9.155 1.00 0.00 C ATOM 405 CG GLN A 26 14.948 -12.645 8.249 1.00 0.00 C ATOM 406 CD GLN A 26 16.306 -13.298 8.142 1.00 0.00 C ATOM 407 OE1 GLN A 26 16.962 -13.211 7.092 1.00 0.00 O ATOM 408 NE2 GLN A 26 16.776 -13.884 9.214 1.00 0.00 N ATOM 0 H GLN A 26 11.235 -14.284 9.797 1.00 0.00 H new ATOM 0 HA GLN A 26 12.714 -11.764 9.781 1.00 0.00 H new ATOM 0 HB2 GLN A 26 14.412 -13.488 10.147 1.00 0.00 H new ATOM 0 HB3 GLN A 26 13.836 -14.404 8.768 1.00 0.00 H new ATOM 0 HG2 GLN A 26 14.515 -12.564 7.252 1.00 0.00 H new ATOM 0 HG3 GLN A 26 15.073 -11.630 8.626 1.00 0.00 H new ATOM 0 HE21 GLN A 26 16.206 -13.936 10.058 1.00 0.00 H new ATOM 0 HE22 GLN A 26 17.712 -14.289 9.205 1.00 0.00 H new ATOM 417 N TRP A 27 12.330 -11.247 7.442 1.00 0.00 N ATOM 418 CA TRP A 27 11.939 -10.775 6.189 1.00 0.00 C ATOM 419 C TRP A 27 12.780 -11.421 5.072 1.00 0.00 C ATOM 420 O TRP A 27 13.988 -11.223 4.974 1.00 0.00 O ATOM 421 CB TRP A 27 12.017 -9.236 6.209 1.00 0.00 C ATOM 422 CG TRP A 27 12.916 -8.659 7.284 1.00 0.00 C ATOM 423 CD1 TRP A 27 12.537 -8.301 8.549 1.00 0.00 C ATOM 424 CD2 TRP A 27 14.320 -8.370 7.197 1.00 0.00 C ATOM 425 NE1 TRP A 27 13.610 -7.840 9.251 1.00 0.00 N ATOM 426 CE2 TRP A 27 14.715 -7.860 8.450 1.00 0.00 C ATOM 427 CE3 TRP A 27 15.279 -8.497 6.191 1.00 0.00 C ATOM 428 CZ2 TRP A 27 16.024 -7.477 8.722 1.00 0.00 C ATOM 429 CZ3 TRP A 27 16.576 -8.115 6.464 1.00 0.00 C ATOM 430 CH2 TRP A 27 16.939 -7.612 7.719 1.00 0.00 C ATOM 0 H TRP A 27 12.930 -10.592 7.944 1.00 0.00 H new ATOM 0 HA TRP A 27 10.909 -11.058 5.971 1.00 0.00 H new ATOM 0 HB2 TRP A 27 12.370 -8.891 5.237 1.00 0.00 H new ATOM 0 HB3 TRP A 27 11.012 -8.837 6.343 1.00 0.00 H new ATOM 0 HD1 TRP A 27 11.531 -8.373 8.936 1.00 0.00 H new ATOM 0 HE1 TRP A 27 13.591 -7.529 10.222 1.00 0.00 H new ATOM 0 HE3 TRP A 27 15.011 -8.886 5.220 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 16.305 -7.088 9.689 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 17.327 -8.206 5.693 1.00 0.00 H new ATOM 0 HH2 TRP A 27 17.965 -7.325 7.897 1.00 0.00 H new ATOM 441 N LYS A 28 12.132 -12.263 4.315 1.00 0.00 N ATOM 442 CA LYS A 28 12.711 -12.973 3.176 1.00 0.00 C ATOM 443 C LYS A 28 11.909 -12.642 1.960 1.00 0.00 C ATOM 444 O LYS A 28 10.699 -12.508 2.047 1.00 0.00 O ATOM 445 CB LYS A 28 12.735 -14.486 3.436 1.00 0.00 C ATOM 446 CG LYS A 28 13.645 -14.938 4.588 1.00 0.00 C ATOM 447 CD LYS A 28 15.082 -15.276 4.137 1.00 0.00 C ATOM 448 CE LYS A 28 15.849 -14.112 3.512 1.00 0.00 C ATOM 449 NZ LYS A 28 16.048 -12.973 4.439 1.00 0.00 N ATOM 0 H LYS A 28 11.150 -12.491 4.469 1.00 0.00 H new ATOM 0 HA LYS A 28 13.744 -12.660 3.025 1.00 0.00 H new ATOM 0 HB2 LYS A 28 11.718 -14.818 3.646 1.00 0.00 H new ATOM 0 HB3 LYS A 28 13.053 -14.990 2.524 1.00 0.00 H new ATOM 0 HG2 LYS A 28 13.684 -14.151 5.341 1.00 0.00 H new ATOM 0 HG3 LYS A 28 13.206 -15.814 5.066 1.00 0.00 H new ATOM 0 HD2 LYS A 28 15.642 -15.640 4.998 1.00 0.00 H new ATOM 0 HD3 LYS A 28 15.039 -16.093 3.416 1.00 0.00 H new ATOM 0 HE2 LYS A 28 16.821 -14.468 3.172 1.00 0.00 H new ATOM 0 HE3 LYS A 28 15.311 -13.764 2.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 16.776 -12.337 4.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 15.154 -12.452 4.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 16.353 -13.330 5.367 1.00 0.00 H new ATOM 463 N GLU A 29 12.586 -12.519 0.842 1.00 0.00 N ATOM 464 CA GLU A 29 12.049 -12.027 -0.352 1.00 0.00 C ATOM 465 C GLU A 29 10.782 -12.675 -0.819 1.00 0.00 C ATOM 466 O GLU A 29 10.620 -13.897 -0.842 1.00 0.00 O ATOM 467 CB GLU A 29 13.073 -11.789 -1.492 1.00 0.00 C ATOM 468 CG GLU A 29 14.094 -12.892 -1.736 1.00 0.00 C ATOM 469 CD GLU A 29 15.151 -12.944 -0.658 1.00 0.00 C ATOM 470 OE1 GLU A 29 16.088 -12.129 -0.689 1.00 0.00 O ATOM 471 OE2 GLU A 29 15.042 -13.782 0.257 1.00 0.00 O ATOM 0 H GLU A 29 13.569 -12.778 0.763 1.00 0.00 H new ATOM 0 HA GLU A 29 11.735 -11.029 -0.046 1.00 0.00 H new ATOM 0 HB2 GLU A 29 12.520 -11.626 -2.417 1.00 0.00 H new ATOM 0 HB3 GLU A 29 13.613 -10.867 -1.277 1.00 0.00 H new ATOM 0 HG2 GLU A 29 13.582 -13.853 -1.786 1.00 0.00 H new ATOM 0 HG3 GLU A 29 14.572 -12.734 -2.703 1.00 0.00 H new ATOM 478 N ARG A 30 9.904 -11.813 -1.150 1.00 0.00 N ATOM 479 CA ARG A 30 8.568 -12.136 -1.634 1.00 0.00 C ATOM 480 C ARG A 30 8.594 -12.041 -3.128 1.00 0.00 C ATOM 481 O ARG A 30 7.835 -12.699 -3.830 1.00 0.00 O ATOM 482 CB ARG A 30 7.582 -11.094 -1.148 1.00 0.00 C ATOM 483 CG ARG A 30 6.518 -11.540 -0.163 1.00 0.00 C ATOM 484 CD ARG A 30 5.559 -12.564 -0.750 1.00 0.00 C ATOM 485 NE ARG A 30 4.392 -12.745 0.118 1.00 0.00 N ATOM 486 CZ ARG A 30 4.023 -13.863 0.742 1.00 0.00 C ATOM 487 NH1 ARG A 30 4.673 -15.016 0.530 1.00 0.00 N ATOM 488 NH2 ARG A 30 2.982 -13.833 1.564 1.00 0.00 N ATOM 0 H ARG A 30 10.077 -10.809 -1.099 1.00 0.00 H new ATOM 0 HA ARG A 30 8.280 -13.127 -1.283 1.00 0.00 H new ATOM 0 HB2 ARG A 30 8.148 -10.285 -0.687 1.00 0.00 H new ATOM 0 HB3 ARG A 30 7.079 -10.675 -2.019 1.00 0.00 H new ATOM 0 HG2 ARG A 30 7.000 -11.965 0.717 1.00 0.00 H new ATOM 0 HG3 ARG A 30 5.953 -10.670 0.172 1.00 0.00 H new ATOM 0 HD2 ARG A 30 5.235 -12.240 -1.739 1.00 0.00 H new ATOM 0 HD3 ARG A 30 6.072 -13.517 -0.879 1.00 0.00 H new ATOM 0 HE ARG A 30 3.799 -11.927 0.260 1.00 0.00 H new ATOM 0 HH11 ARG A 30 5.462 -15.046 -0.116 1.00 0.00 H new ATOM 0 HH12 ARG A 30 4.379 -15.864 1.015 1.00 0.00 H new ATOM 0 HH21 ARG A 30 2.474 -12.961 1.712 1.00 0.00 H new ATOM 0 HH22 ARG A 30 2.689 -14.682 2.048 1.00 0.00 H new ATOM 502 N GLY A 31 9.442 -11.163 -3.587 1.00 0.00 N ATOM 503 CA GLY A 31 9.620 -10.930 -4.966 1.00 0.00 C ATOM 504 C GLY A 31 10.218 -9.586 -5.184 1.00 0.00 C ATOM 505 O GLY A 31 9.939 -8.664 -4.455 1.00 0.00 O ATOM 0 H GLY A 31 10.033 -10.586 -2.989 1.00 0.00 H new ATOM 0 HA2 GLY A 31 10.266 -11.698 -5.392 1.00 0.00 H new ATOM 0 HA3 GLY A 31 8.662 -10.998 -5.481 1.00 0.00 H new ATOM 509 N LEU A 32 11.076 -9.505 -6.118 1.00 0.00 N ATOM 510 CA LEU A 32 11.724 -8.278 -6.494 1.00 0.00 C ATOM 511 C LEU A 32 11.146 -7.880 -7.848 1.00 0.00 C ATOM 512 O LEU A 32 10.999 -8.746 -8.735 1.00 0.00 O ATOM 513 CB LEU A 32 13.267 -8.476 -6.652 1.00 0.00 C ATOM 514 CG LEU A 32 14.052 -9.295 -5.573 1.00 0.00 C ATOM 515 CD1 LEU A 32 13.699 -8.906 -4.151 1.00 0.00 C ATOM 516 CD2 LEU A 32 13.933 -10.803 -5.786 1.00 0.00 C ATOM 0 H LEU A 32 11.370 -10.308 -6.673 1.00 0.00 H new ATOM 0 HA LEU A 32 11.559 -7.521 -5.728 1.00 0.00 H new ATOM 0 HB2 LEU A 32 13.438 -8.956 -7.615 1.00 0.00 H new ATOM 0 HB3 LEU A 32 13.720 -7.486 -6.705 1.00 0.00 H new ATOM 0 HG LEU A 32 15.099 -9.028 -5.714 1.00 0.00 H new ATOM 0 HD11 LEU A 32 14.278 -9.511 -3.454 1.00 0.00 H new ATOM 0 HD12 LEU A 32 13.929 -7.852 -3.994 1.00 0.00 H new ATOM 0 HD13 LEU A 32 12.636 -9.074 -3.981 1.00 0.00 H new ATOM 0 HD21 LEU A 32 14.495 -11.325 -5.012 1.00 0.00 H new ATOM 0 HD22 LEU A 32 12.884 -11.096 -5.734 1.00 0.00 H new ATOM 0 HD23 LEU A 32 14.335 -11.065 -6.765 1.00 0.00 H new ATOM 528 N GLY A 33 10.811 -6.629 -8.029 1.00 0.00 N ATOM 529 CA GLY A 33 10.235 -6.231 -9.285 1.00 0.00 C ATOM 530 C GLY A 33 9.669 -4.841 -9.266 1.00 0.00 C ATOM 531 O GLY A 33 10.316 -3.936 -8.824 1.00 0.00 O ATOM 0 H GLY A 33 10.923 -5.885 -7.341 1.00 0.00 H new ATOM 0 HA2 GLY A 33 10.997 -6.295 -10.062 1.00 0.00 H new ATOM 0 HA3 GLY A 33 9.446 -6.933 -9.553 1.00 0.00 H new ATOM 535 N ASN A 34 8.446 -4.712 -9.691 1.00 0.00 N ATOM 536 CA ASN A 34 7.746 -3.449 -9.846 1.00 0.00 C ATOM 537 C ASN A 34 6.522 -3.538 -9.108 1.00 0.00 C ATOM 538 O ASN A 34 5.714 -4.467 -9.294 1.00 0.00 O ATOM 539 CB ASN A 34 7.408 -3.212 -11.287 1.00 0.00 C ATOM 540 CG ASN A 34 6.597 -1.946 -11.527 1.00 0.00 C ATOM 541 OD1 ASN A 34 7.151 -0.874 -11.742 1.00 0.00 O ATOM 542 ND2 ASN A 34 5.279 -2.079 -11.522 1.00 0.00 N ATOM 0 H ASN A 34 7.875 -5.515 -9.954 1.00 0.00 H new ATOM 0 HA ASN A 34 8.376 -2.634 -9.489 1.00 0.00 H new ATOM 0 HB2 ASN A 34 8.332 -3.155 -11.863 1.00 0.00 H new ATOM 0 HB3 ASN A 34 6.849 -4.068 -11.665 1.00 0.00 H new ATOM 0 HD21 ASN A 34 4.684 -1.270 -11.702 1.00 0.00 H new ATOM 0 HD22 ASN A 34 4.859 -2.990 -11.338 1.00 0.00 H new ATOM 549 N LEU A 35 6.383 -2.624 -8.268 1.00 0.00 N ATOM 550 CA LEU A 35 5.284 -2.505 -7.527 1.00 0.00 C ATOM 551 C LEU A 35 4.307 -1.698 -8.283 1.00 0.00 C ATOM 552 O LEU A 35 4.665 -0.697 -8.859 1.00 0.00 O ATOM 553 CB LEU A 35 5.618 -1.891 -6.161 1.00 0.00 C ATOM 554 CG LEU A 35 5.923 -0.350 -6.072 1.00 0.00 C ATOM 555 CD1 LEU A 35 4.650 0.502 -5.981 1.00 0.00 C ATOM 556 CD2 LEU A 35 6.839 -0.026 -4.914 1.00 0.00 C ATOM 0 H LEU A 35 7.088 -1.910 -8.087 1.00 0.00 H new ATOM 0 HA LEU A 35 4.849 -3.483 -7.323 1.00 0.00 H new ATOM 0 HB2 LEU A 35 4.783 -2.100 -5.493 1.00 0.00 H new ATOM 0 HB3 LEU A 35 6.484 -2.421 -5.765 1.00 0.00 H new ATOM 0 HG LEU A 35 6.429 -0.096 -7.003 1.00 0.00 H new ATOM 0 HD11 LEU A 35 4.921 1.556 -5.922 1.00 0.00 H new ATOM 0 HD12 LEU A 35 4.036 0.334 -6.866 1.00 0.00 H new ATOM 0 HD13 LEU A 35 4.087 0.222 -5.090 1.00 0.00 H new ATOM 0 HD21 LEU A 35 7.025 1.048 -4.887 1.00 0.00 H new ATOM 0 HD22 LEU A 35 6.369 -0.336 -3.981 1.00 0.00 H new ATOM 0 HD23 LEU A 35 7.784 -0.555 -5.038 1.00 0.00 H new ATOM 568 N LYS A 36 3.139 -2.148 -8.362 1.00 0.00 N ATOM 569 CA LYS A 36 2.148 -1.372 -8.914 1.00 0.00 C ATOM 570 C LYS A 36 1.098 -1.136 -7.860 1.00 0.00 C ATOM 571 O LYS A 36 0.858 -1.982 -6.995 1.00 0.00 O ATOM 572 CB LYS A 36 1.552 -1.984 -10.199 1.00 0.00 C ATOM 573 CG LYS A 36 0.844 -3.317 -9.997 1.00 0.00 C ATOM 574 CD LYS A 36 0.170 -3.823 -11.271 1.00 0.00 C ATOM 575 CE LYS A 36 1.167 -4.152 -12.374 1.00 0.00 C ATOM 576 NZ LYS A 36 0.493 -4.668 -13.584 1.00 0.00 N ATOM 0 H LYS A 36 2.845 -3.071 -8.043 1.00 0.00 H new ATOM 0 HA LYS A 36 2.576 -0.421 -9.231 1.00 0.00 H new ATOM 0 HB2 LYS A 36 0.846 -1.274 -10.630 1.00 0.00 H new ATOM 0 HB3 LYS A 36 2.352 -2.119 -10.926 1.00 0.00 H new ATOM 0 HG2 LYS A 36 1.565 -4.059 -9.653 1.00 0.00 H new ATOM 0 HG3 LYS A 36 0.095 -3.211 -9.212 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -0.415 -4.713 -11.039 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -0.528 -3.068 -11.632 1.00 0.00 H new ATOM 0 HE2 LYS A 36 1.737 -3.258 -12.628 1.00 0.00 H new ATOM 0 HE3 LYS A 36 1.880 -4.892 -12.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 1.203 -4.881 -14.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -0.030 -5.535 -13.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -0.169 -3.952 -13.945 1.00 0.00 H new ATOM 590 N ILE A 37 0.504 -0.022 -7.914 1.00 0.00 N ATOM 591 CA ILE A 37 -0.561 0.279 -7.050 1.00 0.00 C ATOM 592 C ILE A 37 -1.761 0.288 -7.870 1.00 0.00 C ATOM 593 O ILE A 37 -1.821 0.988 -8.892 1.00 0.00 O ATOM 594 CB ILE A 37 -0.408 1.688 -6.419 1.00 0.00 C ATOM 595 CG1 ILE A 37 0.682 1.688 -5.353 1.00 0.00 C ATOM 596 CG2 ILE A 37 -1.754 2.206 -5.842 1.00 0.00 C ATOM 597 CD1 ILE A 37 0.247 1.100 -4.011 1.00 0.00 C ATOM 0 H ILE A 37 0.743 0.723 -8.568 1.00 0.00 H new ATOM 0 HA ILE A 37 -0.594 -0.452 -6.243 1.00 0.00 H new ATOM 0 HB ILE A 37 -0.109 2.374 -7.212 1.00 0.00 H new ATOM 0 HG12 ILE A 37 1.537 1.123 -5.724 1.00 0.00 H new ATOM 0 HG13 ILE A 37 1.020 2.712 -5.196 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.607 3.195 -5.409 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -2.493 2.266 -6.641 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -2.107 1.521 -5.071 1.00 0.00 H new ATOM 0 HD11 ILE A 37 1.081 1.138 -3.310 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -0.588 1.678 -3.614 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -0.063 0.064 -4.151 1.00 0.00 H new ATOM 609 N LEU A 38 -2.685 -0.502 -7.495 1.00 0.00 N ATOM 610 CA LEU A 38 -3.915 -0.442 -8.156 1.00 0.00 C ATOM 611 C LEU A 38 -4.910 0.146 -7.180 1.00 0.00 C ATOM 612 O LEU A 38 -4.955 -0.228 -6.025 1.00 0.00 O ATOM 613 CB LEU A 38 -4.357 -1.835 -8.625 1.00 0.00 C ATOM 614 CG LEU A 38 -3.455 -2.570 -9.628 1.00 0.00 C ATOM 615 CD1 LEU A 38 -3.975 -3.973 -9.879 1.00 0.00 C ATOM 616 CD2 LEU A 38 -3.396 -1.829 -10.929 1.00 0.00 C ATOM 0 H LEU A 38 -2.613 -1.188 -6.744 1.00 0.00 H new ATOM 0 HA LEU A 38 -3.843 0.177 -9.051 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.464 -2.467 -7.744 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.347 -1.740 -9.071 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.454 -2.624 -9.200 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -3.325 -4.480 -10.592 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -3.989 -4.529 -8.942 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -4.985 -3.919 -10.284 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -2.752 -2.367 -11.625 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -4.399 -1.751 -11.349 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -2.994 -0.830 -10.761 1.00 0.00 H new ATOM 628 N LYS A 39 -5.660 1.072 -7.629 1.00 0.00 N ATOM 629 CA LYS A 39 -6.669 1.686 -6.828 1.00 0.00 C ATOM 630 C LYS A 39 -7.983 1.373 -7.442 1.00 0.00 C ATOM 631 O LYS A 39 -8.156 1.504 -8.649 1.00 0.00 O ATOM 632 CB LYS A 39 -6.454 3.206 -6.705 1.00 0.00 C ATOM 633 CG LYS A 39 -7.553 3.948 -5.927 1.00 0.00 C ATOM 634 CD LYS A 39 -7.219 5.427 -5.781 1.00 0.00 C ATOM 635 CE LYS A 39 -8.391 6.240 -5.230 1.00 0.00 C ATOM 636 NZ LYS A 39 -8.786 5.870 -3.845 1.00 0.00 N ATOM 0 H LYS A 39 -5.599 1.440 -8.578 1.00 0.00 H new ATOM 0 HA LYS A 39 -6.625 1.294 -5.812 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -5.497 3.386 -6.216 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -6.385 3.632 -7.706 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -8.507 3.837 -6.443 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -7.670 3.499 -4.941 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -6.360 5.539 -5.119 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -6.927 5.828 -6.752 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -8.128 7.298 -5.252 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -9.250 6.112 -5.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -9.813 5.992 -3.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -8.533 4.877 -3.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -8.288 6.482 -3.167 1.00 0.00 H new ATOM 650 N ASN A 40 -8.889 0.956 -6.624 1.00 0.00 N ATOM 651 CA ASN A 40 -10.194 0.490 -7.051 1.00 0.00 C ATOM 652 C ASN A 40 -11.016 1.517 -7.735 1.00 0.00 C ATOM 653 O ASN A 40 -10.887 2.700 -7.480 1.00 0.00 O ATOM 654 CB ASN A 40 -10.982 -0.121 -5.905 1.00 0.00 C ATOM 655 CG ASN A 40 -10.416 -1.438 -5.512 1.00 0.00 C ATOM 656 OD1 ASN A 40 -9.584 -1.547 -4.607 1.00 0.00 O ATOM 657 ND2 ASN A 40 -10.816 -2.428 -6.225 1.00 0.00 N ATOM 0 H ASN A 40 -8.754 0.923 -5.613 1.00 0.00 H new ATOM 0 HA ASN A 40 -9.976 -0.280 -7.791 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -10.969 0.554 -5.049 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -12.024 -0.242 -6.200 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -10.443 -3.362 -6.055 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -11.507 -2.280 -6.961 1.00 0.00 H new ATOM 664 N GLU A 41 -11.819 1.048 -8.668 1.00 0.00 N ATOM 665 CA GLU A 41 -12.748 1.852 -9.428 1.00 0.00 C ATOM 666 C GLU A 41 -13.874 2.273 -8.480 1.00 0.00 C ATOM 667 O GLU A 41 -14.597 3.236 -8.717 1.00 0.00 O ATOM 668 CB GLU A 41 -13.303 0.975 -10.518 1.00 0.00 C ATOM 669 CG GLU A 41 -13.309 1.565 -11.915 1.00 0.00 C ATOM 670 CD GLU A 41 -14.212 2.749 -12.056 1.00 0.00 C ATOM 671 OE1 GLU A 41 -15.408 2.561 -12.343 1.00 0.00 O ATOM 672 OE2 GLU A 41 -13.755 3.895 -11.898 1.00 0.00 O ATOM 0 H GLU A 41 -11.842 0.061 -8.925 1.00 0.00 H new ATOM 0 HA GLU A 41 -12.277 2.735 -9.858 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -12.727 0.050 -10.540 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -14.326 0.708 -10.255 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -12.294 1.858 -12.182 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -13.616 0.797 -12.625 1.00 0.00 H new ATOM 679 N VAL A 42 -13.975 1.535 -7.370 1.00 0.00 N ATOM 680 CA VAL A 42 -14.852 1.800 -6.315 1.00 0.00 C ATOM 681 C VAL A 42 -14.267 2.995 -5.562 1.00 0.00 C ATOM 682 O VAL A 42 -14.954 3.712 -4.822 1.00 0.00 O ATOM 683 CB VAL A 42 -14.864 0.545 -5.426 1.00 0.00 C ATOM 684 CG1 VAL A 42 -15.572 0.788 -4.165 1.00 0.00 C ATOM 685 CG2 VAL A 42 -15.473 -0.631 -6.159 1.00 0.00 C ATOM 0 H VAL A 42 -13.403 0.705 -7.213 1.00 0.00 H new ATOM 0 HA VAL A 42 -15.869 2.027 -6.635 1.00 0.00 H new ATOM 0 HB VAL A 42 -13.828 0.303 -5.187 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -15.561 -0.119 -3.561 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -15.078 1.593 -3.620 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -16.603 1.072 -4.376 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -15.470 -1.506 -5.509 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -16.498 -0.392 -6.441 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -14.890 -0.843 -7.055 1.00 0.00 H new ATOM 695 N ASN A 43 -12.959 3.179 -5.791 1.00 0.00 N ATOM 696 CA ASN A 43 -12.154 4.272 -5.285 1.00 0.00 C ATOM 697 C ASN A 43 -11.988 4.135 -3.786 1.00 0.00 C ATOM 698 O ASN A 43 -11.492 5.022 -3.100 1.00 0.00 O ATOM 699 CB ASN A 43 -12.792 5.592 -5.760 1.00 0.00 C ATOM 700 CG ASN A 43 -12.135 6.877 -5.278 1.00 0.00 C ATOM 701 OD1 ASN A 43 -11.191 7.361 -5.891 1.00 0.00 O ATOM 702 ND2 ASN A 43 -12.657 7.467 -4.227 1.00 0.00 N ATOM 0 H ASN A 43 -12.418 2.531 -6.364 1.00 0.00 H new ATOM 0 HA ASN A 43 -11.137 4.258 -5.678 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -12.793 5.597 -6.850 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -13.834 5.601 -5.441 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -12.277 8.355 -3.899 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -13.443 7.037 -3.739 1.00 0.00 H new ATOM 709 N GLY A 44 -12.276 2.936 -3.318 1.00 0.00 N ATOM 710 CA GLY A 44 -12.287 2.686 -1.898 1.00 0.00 C ATOM 711 C GLY A 44 -10.925 2.386 -1.346 1.00 0.00 C ATOM 712 O GLY A 44 -10.362 3.174 -0.585 1.00 0.00 O ATOM 0 H GLY A 44 -12.503 2.129 -3.898 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -12.698 3.555 -1.385 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -12.951 1.848 -1.687 1.00 0.00 H new ATOM 716 N LYS A 45 -10.394 1.257 -1.715 1.00 0.00 N ATOM 717 CA LYS A 45 -9.098 0.858 -1.255 1.00 0.00 C ATOM 718 C LYS A 45 -8.138 0.777 -2.403 1.00 0.00 C ATOM 719 O LYS A 45 -8.515 0.973 -3.577 1.00 0.00 O ATOM 720 CB LYS A 45 -9.140 -0.476 -0.500 1.00 0.00 C ATOM 721 CG LYS A 45 -9.946 -0.430 0.781 1.00 0.00 C ATOM 722 CD LYS A 45 -9.853 -1.734 1.542 1.00 0.00 C ATOM 723 CE LYS A 45 -10.653 -1.661 2.828 1.00 0.00 C ATOM 724 NZ LYS A 45 -10.563 -2.901 3.621 1.00 0.00 N ATOM 0 H LYS A 45 -10.846 0.590 -2.341 1.00 0.00 H new ATOM 0 HA LYS A 45 -8.754 1.618 -0.554 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -9.560 -1.240 -1.155 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -8.120 -0.782 -0.266 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -9.587 0.385 1.409 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -10.989 -0.217 0.548 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -10.225 -2.550 0.922 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -8.810 -1.955 1.769 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -10.295 -0.824 3.427 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -11.698 -1.460 2.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -11.127 -2.800 4.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -10.929 -3.698 3.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -9.570 -3.081 3.872 1.00 0.00 H new ATOM 738 N LEU A 46 -6.902 0.557 -2.079 1.00 0.00 N ATOM 739 CA LEU A 46 -5.908 0.426 -2.999 1.00 0.00 C ATOM 740 C LEU A 46 -5.122 -0.764 -2.643 1.00 0.00 C ATOM 741 O LEU A 46 -5.052 -1.160 -1.482 1.00 0.00 O ATOM 742 CB LEU A 46 -4.950 1.564 -2.972 1.00 0.00 C ATOM 743 CG LEU A 46 -5.476 2.991 -3.022 1.00 0.00 C ATOM 744 CD1 LEU A 46 -5.981 3.454 -1.661 1.00 0.00 C ATOM 745 CD2 LEU A 46 -4.411 3.913 -3.555 1.00 0.00 C ATOM 0 H LEU A 46 -6.584 0.466 -1.114 1.00 0.00 H new ATOM 0 HA LEU A 46 -6.378 0.372 -3.981 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -4.355 1.468 -2.064 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -4.270 1.438 -3.814 1.00 0.00 H new ATOM 0 HG LEU A 46 -6.330 3.017 -3.699 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -6.348 4.477 -1.738 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -6.790 2.802 -1.332 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -5.166 3.414 -0.938 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -4.795 4.932 -3.588 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -3.538 3.875 -2.904 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -4.128 3.600 -4.560 1.00 0.00 H new ATOM 757 N ARG A 47 -4.526 -1.278 -3.604 1.00 0.00 N ATOM 758 CA ARG A 47 -3.651 -2.393 -3.497 1.00 0.00 C ATOM 759 C ARG A 47 -2.321 -1.978 -3.987 1.00 0.00 C ATOM 760 O ARG A 47 -2.198 -1.142 -4.862 1.00 0.00 O ATOM 761 CB ARG A 47 -4.042 -3.556 -4.389 1.00 0.00 C ATOM 762 CG ARG A 47 -5.047 -3.251 -5.498 1.00 0.00 C ATOM 763 CD ARG A 47 -6.494 -3.282 -5.011 1.00 0.00 C ATOM 764 NE ARG A 47 -6.978 -4.651 -4.849 1.00 0.00 N ATOM 765 CZ ARG A 47 -8.131 -5.000 -4.271 1.00 0.00 C ATOM 766 NH1 ARG A 47 -8.976 -4.075 -3.845 1.00 0.00 N ATOM 767 NH2 ARG A 47 -8.467 -6.282 -4.185 1.00 0.00 N ATOM 0 H ARG A 47 -4.621 -0.932 -4.559 1.00 0.00 H new ATOM 0 HA ARG A 47 -3.680 -2.706 -2.453 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -3.137 -3.955 -4.848 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -4.455 -4.345 -3.761 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -4.831 -2.269 -5.918 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -4.924 -3.976 -6.303 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -6.570 -2.754 -4.061 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -7.129 -2.753 -5.721 1.00 0.00 H new ATOM 0 HE ARG A 47 -6.387 -5.402 -5.206 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -8.749 -3.087 -3.957 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -9.854 -4.350 -3.405 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -7.845 -6.998 -4.560 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -9.347 -6.550 -3.744 1.00 0.00 H new ATOM 781 N MET A 48 -1.383 -2.551 -3.432 1.00 0.00 N ATOM 782 CA MET A 48 -0.055 -2.452 -3.781 1.00 0.00 C ATOM 783 C MET A 48 0.339 -3.882 -4.034 1.00 0.00 C ATOM 784 O MET A 48 0.282 -4.722 -3.145 1.00 0.00 O ATOM 785 CB MET A 48 0.641 -1.891 -2.532 1.00 0.00 C ATOM 786 CG MET A 48 2.094 -1.490 -2.635 1.00 0.00 C ATOM 787 SD MET A 48 3.245 -2.851 -2.629 1.00 0.00 S ATOM 788 CE MET A 48 4.753 -1.910 -2.552 1.00 0.00 C ATOM 0 H MET A 48 -1.529 -3.170 -2.635 1.00 0.00 H new ATOM 0 HA MET A 48 0.184 -1.824 -4.640 1.00 0.00 H new ATOM 0 HB2 MET A 48 0.078 -1.017 -2.204 1.00 0.00 H new ATOM 0 HB3 MET A 48 0.559 -2.638 -1.743 1.00 0.00 H new ATOM 0 HG2 MET A 48 2.235 -0.917 -3.552 1.00 0.00 H new ATOM 0 HG3 MET A 48 2.333 -0.826 -1.804 1.00 0.00 H new ATOM 0 HE1 MET A 48 5.560 -2.546 -2.188 1.00 0.00 H new ATOM 0 HE2 MET A 48 5.002 -1.540 -3.547 1.00 0.00 H new ATOM 0 HE3 MET A 48 4.621 -1.067 -1.874 1.00 0.00 H new ATOM 798 N LEU A 49 0.685 -4.145 -5.208 1.00 0.00 N ATOM 799 CA LEU A 49 1.111 -5.457 -5.623 1.00 0.00 C ATOM 800 C LEU A 49 2.269 -5.377 -6.499 1.00 0.00 C ATOM 801 O LEU A 49 2.464 -4.397 -7.182 1.00 0.00 O ATOM 802 CB LEU A 49 0.110 -6.232 -6.382 1.00 0.00 C ATOM 803 CG LEU A 49 -0.517 -5.560 -7.612 1.00 0.00 C ATOM 804 CD1 LEU A 49 -1.083 -6.598 -8.523 1.00 0.00 C ATOM 805 CD2 LEU A 49 -1.628 -4.610 -7.195 1.00 0.00 C ATOM 0 H LEU A 49 0.692 -3.454 -5.958 1.00 0.00 H new ATOM 0 HA LEU A 49 1.314 -5.960 -4.677 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.579 -7.161 -6.707 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -0.695 -6.503 -5.699 1.00 0.00 H new ATOM 0 HG LEU A 49 0.261 -4.997 -8.127 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -1.526 -6.115 -9.394 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -0.289 -7.271 -8.846 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -1.848 -7.167 -7.995 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -2.060 -4.144 -8.081 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -2.401 -5.165 -6.664 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -1.221 -3.839 -6.541 1.00 0.00 H new ATOM 817 N MET A 50 3.039 -6.387 -6.522 1.00 0.00 N ATOM 818 CA MET A 50 4.121 -6.410 -7.266 1.00 0.00 C ATOM 819 C MET A 50 4.271 -7.718 -7.894 1.00 0.00 C ATOM 820 O MET A 50 3.961 -8.784 -7.338 1.00 0.00 O ATOM 821 CB MET A 50 5.306 -6.080 -6.503 1.00 0.00 C ATOM 822 CG MET A 50 5.500 -6.919 -5.302 1.00 0.00 C ATOM 823 SD MET A 50 6.869 -6.310 -4.378 1.00 0.00 S ATOM 824 CE MET A 50 6.152 -4.845 -3.674 1.00 0.00 C ATOM 0 H MET A 50 2.882 -7.236 -5.979 1.00 0.00 H new ATOM 0 HA MET A 50 4.007 -5.650 -8.039 1.00 0.00 H new ATOM 0 HB2 MET A 50 6.180 -6.178 -7.147 1.00 0.00 H new ATOM 0 HB3 MET A 50 5.250 -5.035 -6.199 1.00 0.00 H new ATOM 0 HG2 MET A 50 4.599 -6.908 -4.688 1.00 0.00 H new ATOM 0 HG3 MET A 50 5.675 -7.955 -5.593 1.00 0.00 H new ATOM 0 HE1 MET A 50 6.849 -4.406 -2.960 1.00 0.00 H new ATOM 0 HE2 MET A 50 5.943 -4.126 -4.466 1.00 0.00 H new ATOM 0 HE3 MET A 50 5.224 -5.103 -3.164 1.00 0.00 H new ATOM 834 N ARG A 51 4.656 -7.576 -9.006 1.00 0.00 N ATOM 835 CA ARG A 51 5.015 -8.578 -9.955 1.00 0.00 C ATOM 836 C ARG A 51 6.490 -8.497 -10.052 1.00 0.00 C ATOM 837 O ARG A 51 7.082 -7.407 -9.956 1.00 0.00 O ATOM 838 CB ARG A 51 4.393 -8.206 -11.279 1.00 0.00 C ATOM 839 CG ARG A 51 4.516 -9.087 -12.508 1.00 0.00 C ATOM 840 CD ARG A 51 3.777 -8.395 -13.639 1.00 0.00 C ATOM 841 NE ARG A 51 3.552 -9.231 -14.807 1.00 0.00 N ATOM 842 CZ ARG A 51 3.248 -8.754 -16.014 1.00 0.00 C ATOM 843 NH1 ARG A 51 3.414 -7.465 -16.284 1.00 0.00 N ATOM 844 NH2 ARG A 51 2.803 -9.565 -16.947 1.00 0.00 N ATOM 0 H ARG A 51 4.768 -6.641 -9.398 1.00 0.00 H new ATOM 0 HA ARG A 51 4.683 -9.579 -9.679 1.00 0.00 H new ATOM 0 HB2 ARG A 51 3.327 -8.070 -11.097 1.00 0.00 H new ATOM 0 HB3 ARG A 51 4.797 -7.231 -11.551 1.00 0.00 H new ATOM 0 HG2 ARG A 51 5.564 -9.237 -12.769 1.00 0.00 H new ATOM 0 HG3 ARG A 51 4.091 -10.072 -12.318 1.00 0.00 H new ATOM 0 HD2 ARG A 51 2.814 -8.044 -13.267 1.00 0.00 H new ATOM 0 HD3 ARG A 51 4.343 -7.514 -13.941 1.00 0.00 H new ATOM 0 HE ARG A 51 3.631 -10.242 -14.696 1.00 0.00 H new ATOM 0 HH11 ARG A 51 3.775 -6.836 -15.567 1.00 0.00 H new ATOM 0 HH12 ARG A 51 3.180 -7.103 -17.209 1.00 0.00 H new ATOM 0 HH21 ARG A 51 2.690 -10.559 -16.747 1.00 0.00 H new ATOM 0 HH22 ARG A 51 2.570 -9.201 -17.871 1.00 0.00 H new ATOM 858 N ARG A 52 7.070 -9.595 -10.238 1.00 0.00 N ATOM 859 CA ARG A 52 8.420 -9.702 -10.359 1.00 0.00 C ATOM 860 C ARG A 52 8.684 -9.368 -11.778 1.00 0.00 C ATOM 861 O ARG A 52 8.059 -9.913 -12.657 1.00 0.00 O ATOM 862 CB ARG A 52 8.841 -11.094 -9.955 1.00 0.00 C ATOM 863 CG ARG A 52 8.497 -11.501 -8.516 1.00 0.00 C ATOM 864 CD ARG A 52 9.012 -12.913 -8.243 1.00 0.00 C ATOM 865 NE ARG A 52 8.666 -13.447 -6.924 1.00 0.00 N ATOM 866 CZ ARG A 52 9.407 -14.351 -6.251 1.00 0.00 C ATOM 867 NH1 ARG A 52 10.636 -14.656 -6.658 1.00 0.00 N ATOM 868 NH2 ARG A 52 8.930 -14.904 -5.157 1.00 0.00 N ATOM 0 H ARG A 52 6.577 -10.485 -10.312 1.00 0.00 H new ATOM 0 HA ARG A 52 8.995 -9.038 -9.714 1.00 0.00 H new ATOM 0 HB2 ARG A 52 8.376 -11.807 -10.636 1.00 0.00 H new ATOM 0 HB3 ARG A 52 9.919 -11.181 -10.090 1.00 0.00 H new ATOM 0 HG2 ARG A 52 8.944 -10.798 -7.813 1.00 0.00 H new ATOM 0 HG3 ARG A 52 7.418 -11.461 -8.365 1.00 0.00 H new ATOM 0 HD2 ARG A 52 8.616 -13.583 -9.006 1.00 0.00 H new ATOM 0 HD3 ARG A 52 10.097 -12.916 -8.348 1.00 0.00 H new ATOM 0 HE ARG A 52 7.808 -13.113 -6.485 1.00 0.00 H new ATOM 0 HH11 ARG A 52 11.026 -14.205 -7.486 1.00 0.00 H new ATOM 0 HH12 ARG A 52 11.189 -15.341 -6.142 1.00 0.00 H new ATOM 0 HH21 ARG A 52 8.002 -14.649 -4.820 1.00 0.00 H new ATOM 0 HH22 ARG A 52 9.488 -15.588 -4.646 1.00 0.00 H new ATOM 882 N GLU A 53 9.527 -8.413 -11.943 1.00 0.00 N ATOM 883 CA GLU A 53 9.860 -7.750 -13.231 1.00 0.00 C ATOM 884 C GLU A 53 10.096 -8.702 -14.302 1.00 0.00 C ATOM 885 O GLU A 53 9.220 -8.947 -15.142 1.00 0.00 O ATOM 886 CB GLU A 53 11.068 -6.822 -13.077 1.00 0.00 C ATOM 887 CG GLU A 53 11.268 -5.847 -14.231 1.00 0.00 C ATOM 888 CD GLU A 53 12.562 -5.090 -14.121 1.00 0.00 C ATOM 889 OE1 GLU A 53 13.610 -5.632 -14.525 1.00 0.00 O ATOM 890 OE2 GLU A 53 12.578 -3.935 -13.633 1.00 0.00 O ATOM 0 H GLU A 53 10.053 -8.024 -11.161 1.00 0.00 H new ATOM 0 HA GLU A 53 8.988 -7.156 -13.506 1.00 0.00 H new ATOM 0 HB2 GLU A 53 10.958 -6.254 -12.153 1.00 0.00 H new ATOM 0 HB3 GLU A 53 11.966 -7.430 -12.972 1.00 0.00 H new ATOM 0 HG2 GLU A 53 11.249 -6.394 -15.173 1.00 0.00 H new ATOM 0 HG3 GLU A 53 10.438 -5.141 -14.255 1.00 0.00 H new ATOM 897 N GLN A 54 11.217 -9.269 -14.282 1.00 0.00 N ATOM 898 CA GLN A 54 11.554 -10.130 -15.347 1.00 0.00 C ATOM 899 C GLN A 54 10.958 -11.510 -15.147 1.00 0.00 C ATOM 900 O GLN A 54 10.994 -12.372 -16.031 1.00 0.00 O ATOM 901 CB GLN A 54 13.034 -10.173 -15.621 1.00 0.00 C ATOM 902 CG GLN A 54 13.598 -8.850 -16.062 1.00 0.00 C ATOM 903 CD GLN A 54 15.086 -8.899 -16.235 1.00 0.00 C ATOM 904 OE1 GLN A 54 15.839 -8.630 -15.303 1.00 0.00 O ATOM 905 NE2 GLN A 54 15.523 -9.246 -17.403 1.00 0.00 N ATOM 0 H GLN A 54 11.923 -9.164 -13.553 1.00 0.00 H new ATOM 0 HA GLN A 54 11.106 -9.711 -16.248 1.00 0.00 H new ATOM 0 HB2 GLN A 54 13.554 -10.499 -14.720 1.00 0.00 H new ATOM 0 HB3 GLN A 54 13.232 -10.919 -16.391 1.00 0.00 H new ATOM 0 HG2 GLN A 54 13.134 -8.555 -17.003 1.00 0.00 H new ATOM 0 HG3 GLN A 54 13.344 -8.086 -15.328 1.00 0.00 H new ATOM 0 HE21 GLN A 54 14.864 -9.461 -18.151 1.00 0.00 H new ATOM 0 HE22 GLN A 54 16.527 -9.304 -17.575 1.00 0.00 H new ATOM 914 N VAL A 55 10.404 -11.698 -13.990 1.00 0.00 N ATOM 915 CA VAL A 55 9.817 -12.919 -13.606 1.00 0.00 C ATOM 916 C VAL A 55 8.311 -12.945 -13.993 1.00 0.00 C ATOM 917 O VAL A 55 7.638 -13.973 -13.880 1.00 0.00 O ATOM 918 CB VAL A 55 10.039 -13.023 -12.083 1.00 0.00 C ATOM 919 CG1 VAL A 55 9.209 -14.102 -11.454 1.00 0.00 C ATOM 920 CG2 VAL A 55 11.509 -13.265 -11.788 1.00 0.00 C ATOM 0 H VAL A 55 10.352 -10.975 -13.272 1.00 0.00 H new ATOM 0 HA VAL A 55 10.262 -13.774 -14.115 1.00 0.00 H new ATOM 0 HB VAL A 55 9.723 -12.075 -11.647 1.00 0.00 H new ATOM 0 HG11 VAL A 55 9.403 -14.132 -10.382 1.00 0.00 H new ATOM 0 HG12 VAL A 55 8.153 -13.895 -11.625 1.00 0.00 H new ATOM 0 HG13 VAL A 55 9.467 -15.064 -11.897 1.00 0.00 H new ATOM 0 HG21 VAL A 55 11.657 -13.337 -10.710 1.00 0.00 H new ATOM 0 HG22 VAL A 55 11.827 -14.194 -12.261 1.00 0.00 H new ATOM 0 HG23 VAL A 55 12.100 -12.438 -12.181 1.00 0.00 H new ATOM 930 N LEU A 56 7.832 -11.805 -14.546 1.00 0.00 N ATOM 931 CA LEU A 56 6.519 -11.572 -15.100 1.00 0.00 C ATOM 932 C LEU A 56 5.342 -11.944 -14.139 1.00 0.00 C ATOM 933 O LEU A 56 4.153 -11.889 -14.492 1.00 0.00 O ATOM 934 CB LEU A 56 6.549 -12.531 -16.218 1.00 0.00 C ATOM 935 CG LEU A 56 5.300 -12.774 -16.919 1.00 0.00 C ATOM 936 CD1 LEU A 56 4.950 -11.631 -17.851 1.00 0.00 C ATOM 937 CD2 LEU A 56 5.242 -14.134 -17.584 1.00 0.00 C ATOM 0 H LEU A 56 8.417 -10.972 -14.611 1.00 0.00 H new ATOM 0 HA LEU A 56 6.342 -10.523 -15.339 1.00 0.00 H new ATOM 0 HB2 LEU A 56 7.281 -12.179 -16.945 1.00 0.00 H new ATOM 0 HB3 LEU A 56 6.912 -13.485 -15.835 1.00 0.00 H new ATOM 0 HG LEU A 56 4.517 -12.805 -16.161 1.00 0.00 H new ATOM 0 HD11 LEU A 56 4.010 -11.849 -18.357 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.847 -10.711 -17.276 1.00 0.00 H new ATOM 0 HD13 LEU A 56 5.741 -11.510 -18.591 1.00 0.00 H new ATOM 0 HD21 LEU A 56 4.283 -14.251 -18.089 1.00 0.00 H new ATOM 0 HD22 LEU A 56 6.049 -14.218 -18.312 1.00 0.00 H new ATOM 0 HD23 LEU A 56 5.352 -14.913 -16.829 1.00 0.00 H new ATOM 949 N LYS A 57 5.662 -12.177 -12.948 1.00 0.00 N ATOM 950 CA LYS A 57 4.685 -12.679 -12.028 1.00 0.00 C ATOM 951 C LYS A 57 4.475 -11.907 -10.687 1.00 0.00 C ATOM 952 O LYS A 57 5.354 -11.907 -9.833 1.00 0.00 O ATOM 953 CB LYS A 57 5.084 -14.093 -11.827 1.00 0.00 C ATOM 954 CG LYS A 57 4.149 -14.961 -11.035 1.00 0.00 C ATOM 955 CD LYS A 57 4.739 -16.352 -10.893 1.00 0.00 C ATOM 956 CE LYS A 57 3.811 -17.269 -10.145 1.00 0.00 C ATOM 957 NZ LYS A 57 2.537 -17.456 -10.860 1.00 0.00 N ATOM 0 H LYS A 57 6.594 -12.036 -12.558 1.00 0.00 H new ATOM 0 HA LYS A 57 3.692 -12.547 -12.457 1.00 0.00 H new ATOM 0 HB2 LYS A 57 5.220 -14.549 -12.808 1.00 0.00 H new ATOM 0 HB3 LYS A 57 6.056 -14.104 -11.333 1.00 0.00 H new ATOM 0 HG2 LYS A 57 3.979 -14.525 -10.050 1.00 0.00 H new ATOM 0 HG3 LYS A 57 3.180 -15.015 -11.531 1.00 0.00 H new ATOM 0 HD2 LYS A 57 4.942 -16.765 -11.881 1.00 0.00 H new ATOM 0 HD3 LYS A 57 5.693 -16.292 -10.370 1.00 0.00 H new ATOM 0 HE2 LYS A 57 4.293 -18.236 -10.001 1.00 0.00 H new ATOM 0 HE3 LYS A 57 3.615 -16.860 -9.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 2.096 -18.348 -10.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 1.899 -16.663 -10.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 2.715 -17.489 -11.884 1.00 0.00 H new ATOM 971 N VAL A 58 3.376 -11.145 -10.598 1.00 0.00 N ATOM 972 CA VAL A 58 2.725 -10.724 -9.318 1.00 0.00 C ATOM 973 C VAL A 58 2.732 -11.823 -8.262 1.00 0.00 C ATOM 974 O VAL A 58 2.532 -13.004 -8.544 1.00 0.00 O ATOM 975 CB VAL A 58 1.255 -10.259 -9.583 1.00 0.00 C ATOM 976 CG1 VAL A 58 0.376 -11.383 -10.117 1.00 0.00 C ATOM 977 CG2 VAL A 58 0.647 -9.636 -8.343 1.00 0.00 C ATOM 0 H VAL A 58 2.893 -10.789 -11.423 1.00 0.00 H new ATOM 0 HA VAL A 58 3.314 -9.894 -8.927 1.00 0.00 H new ATOM 0 HB VAL A 58 1.302 -9.497 -10.361 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -0.634 -11.007 -10.284 1.00 0.00 H new ATOM 0 HG12 VAL A 58 0.787 -11.750 -11.057 1.00 0.00 H new ATOM 0 HG13 VAL A 58 0.345 -12.196 -9.392 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -0.375 -9.322 -8.557 1.00 0.00 H new ATOM 0 HG22 VAL A 58 0.640 -10.367 -7.534 1.00 0.00 H new ATOM 0 HG23 VAL A 58 1.237 -8.770 -8.044 1.00 0.00 H new ATOM 987 N CYS A 59 3.025 -11.420 -7.059 1.00 0.00 N ATOM 988 CA CYS A 59 3.038 -12.320 -5.954 1.00 0.00 C ATOM 989 C CYS A 59 2.168 -11.814 -4.807 1.00 0.00 C ATOM 990 O CYS A 59 1.386 -12.574 -4.237 1.00 0.00 O ATOM 991 CB CYS A 59 4.471 -12.516 -5.463 1.00 0.00 C ATOM 992 SG CYS A 59 5.610 -13.071 -6.745 1.00 0.00 S ATOM 0 H CYS A 59 3.261 -10.456 -6.822 1.00 0.00 H new ATOM 0 HA CYS A 59 2.629 -13.272 -6.293 1.00 0.00 H new ATOM 0 HB2 CYS A 59 4.835 -11.576 -5.049 1.00 0.00 H new ATOM 0 HB3 CYS A 59 4.471 -13.243 -4.651 1.00 0.00 H new ATOM 0 HG CYS A 59 5.318 -12.485 -7.868 1.00 0.00 H new ATOM 998 N ALA A 60 2.189 -10.515 -4.548 1.00 0.00 N ATOM 999 CA ALA A 60 1.645 -10.034 -3.332 1.00 0.00 C ATOM 1000 C ALA A 60 0.808 -8.889 -3.579 1.00 0.00 C ATOM 1001 O ALA A 60 1.240 -7.926 -4.153 1.00 0.00 O ATOM 1002 CB ALA A 60 2.729 -9.578 -2.430 1.00 0.00 C ATOM 0 H ALA A 60 2.575 -9.802 -5.166 1.00 0.00 H new ATOM 0 HA ALA A 60 1.076 -10.848 -2.883 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.297 -9.211 -1.499 1.00 0.00 H new ATOM 0 HB2 ALA A 60 3.399 -10.411 -2.216 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.290 -8.776 -2.911 1.00 0.00 H new ATOM 1008 N ASN A 61 -0.369 -9.027 -3.196 1.00 0.00 N ATOM 1009 CA ASN A 61 -1.316 -7.947 -3.176 1.00 0.00 C ATOM 1010 C ASN A 61 -1.559 -7.475 -1.768 1.00 0.00 C ATOM 1011 O ASN A 61 -2.285 -8.101 -0.993 1.00 0.00 O ATOM 1012 CB ASN A 61 -2.600 -8.383 -3.738 1.00 0.00 C ATOM 1013 CG ASN A 61 -3.662 -7.284 -3.838 1.00 0.00 C ATOM 1014 OD1 ASN A 61 -3.809 -6.652 -4.860 1.00 0.00 O ATOM 1015 ND2 ASN A 61 -4.397 -7.048 -2.764 1.00 0.00 N ATOM 0 H ASN A 61 -0.750 -9.914 -2.868 1.00 0.00 H new ATOM 0 HA ASN A 61 -0.899 -7.135 -3.771 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -2.425 -8.792 -4.733 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -2.993 -9.194 -3.125 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -5.109 -6.318 -2.784 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -4.252 -7.596 -1.916 1.00 0.00 H new ATOM 1022 N HIS A 62 -0.947 -6.437 -1.463 1.00 0.00 N ATOM 1023 CA HIS A 62 -1.097 -5.748 -0.187 1.00 0.00 C ATOM 1024 C HIS A 62 -1.927 -4.452 -0.329 1.00 0.00 C ATOM 1025 O HIS A 62 -1.604 -3.616 -1.101 1.00 0.00 O ATOM 1026 CB HIS A 62 0.313 -5.461 0.388 1.00 0.00 C ATOM 1027 CG HIS A 62 0.433 -4.282 1.314 1.00 0.00 C ATOM 1028 ND1 HIS A 62 0.122 -4.334 2.631 1.00 0.00 N ATOM 1029 CD2 HIS A 62 0.834 -3.010 1.081 1.00 0.00 C ATOM 1030 CE1 HIS A 62 0.311 -3.176 3.178 1.00 0.00 C ATOM 1031 NE2 HIS A 62 0.750 -2.339 2.266 1.00 0.00 N ATOM 0 H HIS A 62 -0.284 -5.983 -2.091 1.00 0.00 H new ATOM 0 HA HIS A 62 -1.648 -6.386 0.503 1.00 0.00 H new ATOM 0 HB2 HIS A 62 0.651 -6.349 0.921 1.00 0.00 H new ATOM 0 HB3 HIS A 62 0.998 -5.310 -0.447 1.00 0.00 H new ATOM 0 HD2 HIS A 62 1.159 -2.603 0.135 1.00 0.00 H new ATOM 0 HE1 HIS A 62 0.136 -2.937 4.217 1.00 0.00 H new ATOM 0 HE2 HIS A 62 0.987 -1.358 2.417 1.00 0.00 H new ATOM 1039 N TRP A 63 -2.950 -4.295 0.457 1.00 0.00 N ATOM 1040 CA TRP A 63 -3.732 -3.061 0.465 1.00 0.00 C ATOM 1041 C TRP A 63 -3.058 -2.073 1.379 1.00 0.00 C ATOM 1042 O TRP A 63 -2.593 -2.423 2.465 1.00 0.00 O ATOM 1043 CB TRP A 63 -5.147 -3.303 1.001 1.00 0.00 C ATOM 1044 CG TRP A 63 -5.873 -4.403 0.308 1.00 0.00 C ATOM 1045 CD1 TRP A 63 -6.646 -4.318 -0.812 1.00 0.00 C ATOM 1046 CD2 TRP A 63 -5.884 -5.768 0.706 1.00 0.00 C ATOM 1047 NE1 TRP A 63 -7.132 -5.563 -1.136 1.00 0.00 N ATOM 1048 CE2 TRP A 63 -6.676 -6.468 -0.213 1.00 0.00 C ATOM 1049 CE3 TRP A 63 -5.293 -6.466 1.760 1.00 0.00 C ATOM 1050 CZ2 TRP A 63 -6.887 -7.832 -0.112 1.00 0.00 C ATOM 1051 CZ3 TRP A 63 -5.507 -7.814 1.857 1.00 0.00 C ATOM 1052 CH2 TRP A 63 -6.296 -8.487 0.927 1.00 0.00 C ATOM 0 H TRP A 63 -3.277 -5.004 1.113 1.00 0.00 H new ATOM 0 HA TRP A 63 -3.796 -2.689 -0.558 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -5.088 -3.533 2.065 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -5.724 -2.383 0.905 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -6.846 -3.410 -1.362 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -7.733 -5.778 -1.932 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -4.679 -5.952 2.485 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -7.498 -8.358 -0.830 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -5.056 -8.366 2.669 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -6.443 -9.552 1.032 1.00 0.00 H new ATOM 1063 N ILE A 64 -2.996 -0.856 0.958 1.00 0.00 N ATOM 1064 CA ILE A 64 -2.368 0.141 1.689 1.00 0.00 C ATOM 1065 C ILE A 64 -3.468 0.993 2.346 1.00 0.00 C ATOM 1066 O ILE A 64 -4.214 1.704 1.684 1.00 0.00 O ATOM 1067 CB ILE A 64 -1.323 0.911 0.764 1.00 0.00 C ATOM 1068 CG1 ILE A 64 -0.681 2.135 1.439 1.00 0.00 C ATOM 1069 CG2 ILE A 64 -1.915 1.272 -0.604 1.00 0.00 C ATOM 1070 CD1 ILE A 64 -1.590 3.313 1.508 1.00 0.00 C ATOM 0 H ILE A 64 -3.395 -0.540 0.074 1.00 0.00 H new ATOM 0 HA ILE A 64 -1.754 -0.240 2.505 1.00 0.00 H new ATOM 0 HB ILE A 64 -0.513 0.200 0.599 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -0.371 1.864 2.448 1.00 0.00 H new ATOM 0 HG13 ILE A 64 0.221 2.412 0.892 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -1.166 1.795 -1.198 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -2.217 0.361 -1.121 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -2.783 1.916 -0.466 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -1.076 4.141 1.995 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -1.880 3.609 0.500 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -2.481 3.052 2.080 1.00 0.00 H new ATOM 1082 N THR A 65 -3.635 0.776 3.619 1.00 0.00 N ATOM 1083 CA THR A 65 -4.640 1.437 4.400 1.00 0.00 C ATOM 1084 C THR A 65 -4.128 1.746 5.798 1.00 0.00 C ATOM 1085 O THR A 65 -3.134 1.178 6.245 1.00 0.00 O ATOM 1086 CB THR A 65 -5.932 0.568 4.463 1.00 0.00 C ATOM 1087 OG1 THR A 65 -6.904 1.119 5.367 1.00 0.00 O ATOM 1088 CG2 THR A 65 -5.623 -0.884 4.831 1.00 0.00 C ATOM 0 H THR A 65 -3.064 0.121 4.154 1.00 0.00 H new ATOM 0 HA THR A 65 -4.882 2.384 3.918 1.00 0.00 H new ATOM 0 HB THR A 65 -6.361 0.578 3.461 1.00 0.00 H new ATOM 0 HG1 THR A 65 -7.700 0.548 5.379 1.00 0.00 H new ATOM 0 HG21 THR A 65 -6.550 -1.456 4.864 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.957 -1.315 4.083 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.141 -0.917 5.808 1.00 0.00 H new ATOM 1096 N THR A 66 -4.829 2.622 6.480 1.00 0.00 N ATOM 1097 CA THR A 66 -4.551 2.976 7.867 1.00 0.00 C ATOM 1098 C THR A 66 -5.025 1.882 8.820 1.00 0.00 C ATOM 1099 O THR A 66 -4.852 1.962 10.031 1.00 0.00 O ATOM 1100 CB THR A 66 -5.142 4.313 8.261 1.00 0.00 C ATOM 1101 OG1 THR A 66 -6.081 4.768 7.256 1.00 0.00 O ATOM 1102 CG2 THR A 66 -4.060 5.335 8.496 1.00 0.00 C ATOM 0 H THR A 66 -5.625 3.122 6.085 1.00 0.00 H new ATOM 0 HA THR A 66 -3.468 3.069 7.948 1.00 0.00 H new ATOM 0 HB THR A 66 -5.683 4.185 9.199 1.00 0.00 H new ATOM 0 HG1 THR A 66 -5.597 4.994 6.435 1.00 0.00 H new ATOM 0 HG21 THR A 66 -4.513 6.286 8.778 1.00 0.00 H new ATOM 0 HG22 THR A 66 -3.405 4.994 9.297 1.00 0.00 H new ATOM 0 HG23 THR A 66 -3.479 5.466 7.583 1.00 0.00 H new ATOM 1110 N THR A 67 -5.630 0.867 8.242 1.00 0.00 N ATOM 1111 CA THR A 67 -6.119 -0.297 8.944 1.00 0.00 C ATOM 1112 C THR A 67 -4.919 -1.256 9.182 1.00 0.00 C ATOM 1113 O THR A 67 -5.013 -2.302 9.828 1.00 0.00 O ATOM 1114 CB THR A 67 -7.212 -0.948 8.033 1.00 0.00 C ATOM 1115 OG1 THR A 67 -8.332 -0.050 7.908 1.00 0.00 O ATOM 1116 CG2 THR A 67 -7.685 -2.300 8.525 1.00 0.00 C ATOM 0 H THR A 67 -5.800 0.829 7.237 1.00 0.00 H new ATOM 0 HA THR A 67 -6.555 -0.056 9.913 1.00 0.00 H new ATOM 0 HB THR A 67 -6.749 -1.122 7.062 1.00 0.00 H new ATOM 0 HG1 THR A 67 -9.016 -0.457 7.336 1.00 0.00 H new ATOM 0 HG21 THR A 67 -8.442 -2.690 7.845 1.00 0.00 H new ATOM 0 HG22 THR A 67 -6.841 -2.989 8.563 1.00 0.00 H new ATOM 0 HG23 THR A 67 -8.113 -2.195 9.522 1.00 0.00 H new ATOM 1124 N MET A 68 -3.790 -0.816 8.719 1.00 0.00 N ATOM 1125 CA MET A 68 -2.607 -1.479 8.792 1.00 0.00 C ATOM 1126 C MET A 68 -1.588 -0.523 9.371 1.00 0.00 C ATOM 1127 O MET A 68 -1.767 0.694 9.369 1.00 0.00 O ATOM 1128 CB MET A 68 -2.275 -1.916 7.382 1.00 0.00 C ATOM 1129 CG MET A 68 -0.860 -2.360 7.107 1.00 0.00 C ATOM 1130 SD MET A 68 0.230 -0.982 6.620 1.00 0.00 S ATOM 1131 CE MET A 68 -0.575 -0.368 5.140 1.00 0.00 C ATOM 0 H MET A 68 -3.709 0.088 8.253 1.00 0.00 H new ATOM 0 HA MET A 68 -2.630 -2.361 9.432 1.00 0.00 H new ATOM 0 HB2 MET A 68 -2.943 -2.736 7.118 1.00 0.00 H new ATOM 0 HB3 MET A 68 -2.505 -1.089 6.710 1.00 0.00 H new ATOM 0 HG2 MET A 68 -0.455 -2.840 7.998 1.00 0.00 H new ATOM 0 HG3 MET A 68 -0.866 -3.110 6.316 1.00 0.00 H new ATOM 0 HE1 MET A 68 0.179 -0.107 4.397 1.00 0.00 H new ATOM 0 HE2 MET A 68 -1.231 -1.139 4.736 1.00 0.00 H new ATOM 0 HE3 MET A 68 -1.163 0.516 5.386 1.00 0.00 H new ATOM 1141 N ASN A 69 -0.585 -1.093 9.834 1.00 0.00 N ATOM 1142 CA ASN A 69 0.538 -0.454 10.488 1.00 0.00 C ATOM 1143 C ASN A 69 1.794 -0.763 9.748 1.00 0.00 C ATOM 1144 O ASN A 69 2.027 -1.913 9.331 1.00 0.00 O ATOM 1145 CB ASN A 69 0.659 -0.978 11.922 1.00 0.00 C ATOM 1146 CG ASN A 69 2.031 -0.733 12.582 1.00 0.00 C ATOM 1147 OD1 ASN A 69 2.932 -1.572 12.492 1.00 0.00 O ATOM 1148 ND2 ASN A 69 2.199 0.378 13.248 1.00 0.00 N ATOM 0 H ASN A 69 -0.476 -2.106 9.783 1.00 0.00 H new ATOM 0 HA ASN A 69 0.379 0.624 10.501 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -0.112 -0.508 12.533 1.00 0.00 H new ATOM 0 HB3 ASN A 69 0.457 -2.049 11.922 1.00 0.00 H new ATOM 0 HD21 ASN A 69 3.090 0.567 13.708 1.00 0.00 H new ATOM 0 HD22 ASN A 69 1.440 1.056 13.308 1.00 0.00 H new ATOM 1155 N LEU A 70 2.584 0.238 9.592 1.00 0.00 N ATOM 1156 CA LEU A 70 3.799 0.147 9.024 1.00 0.00 C ATOM 1157 C LEU A 70 4.848 0.406 10.043 1.00 0.00 C ATOM 1158 O LEU A 70 4.753 1.321 10.859 1.00 0.00 O ATOM 1159 CB LEU A 70 3.863 0.954 7.769 1.00 0.00 C ATOM 1160 CG LEU A 70 3.711 2.458 7.773 1.00 0.00 C ATOM 1161 CD1 LEU A 70 4.933 3.101 8.359 1.00 0.00 C ATOM 1162 CD2 LEU A 70 3.526 2.866 6.353 1.00 0.00 C ATOM 0 H LEU A 70 2.345 1.184 9.890 1.00 0.00 H new ATOM 0 HA LEU A 70 3.999 -0.867 8.676 1.00 0.00 H new ATOM 0 HB2 LEU A 70 4.825 0.737 7.305 1.00 0.00 H new ATOM 0 HB3 LEU A 70 3.093 0.562 7.104 1.00 0.00 H new ATOM 0 HG LEU A 70 2.862 2.772 8.380 1.00 0.00 H new ATOM 0 HD11 LEU A 70 4.811 4.184 8.356 1.00 0.00 H new ATOM 0 HD12 LEU A 70 5.071 2.754 9.383 1.00 0.00 H new ATOM 0 HD13 LEU A 70 5.806 2.833 7.764 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.411 3.948 6.298 1.00 0.00 H new ATOM 0 HD22 LEU A 70 4.397 2.564 5.771 1.00 0.00 H new ATOM 0 HD23 LEU A 70 2.635 2.385 5.949 1.00 0.00 H new ATOM 1174 N LYS A 71 5.753 -0.450 10.044 1.00 0.00 N ATOM 1175 CA LYS A 71 6.820 -0.487 11.018 1.00 0.00 C ATOM 1176 C LYS A 71 8.149 -0.759 10.301 1.00 0.00 C ATOM 1177 O LYS A 71 8.163 -1.510 9.335 1.00 0.00 O ATOM 1178 CB LYS A 71 6.504 -1.631 11.991 1.00 0.00 C ATOM 1179 CG LYS A 71 7.411 -1.745 13.197 1.00 0.00 C ATOM 1180 CD LYS A 71 7.131 -3.007 14.041 1.00 0.00 C ATOM 1181 CE LYS A 71 5.721 -3.071 14.676 1.00 0.00 C ATOM 1182 NZ LYS A 71 4.621 -3.391 13.712 1.00 0.00 N ATOM 0 H LYS A 71 5.810 -1.196 9.351 1.00 0.00 H new ATOM 0 HA LYS A 71 6.902 0.459 11.553 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.479 -1.510 12.342 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.544 -2.571 11.441 1.00 0.00 H new ATOM 0 HG2 LYS A 71 8.449 -1.759 12.865 1.00 0.00 H new ATOM 0 HG3 LYS A 71 7.288 -0.861 13.823 1.00 0.00 H new ATOM 0 HD2 LYS A 71 7.269 -3.885 13.410 1.00 0.00 H new ATOM 0 HD3 LYS A 71 7.874 -3.066 14.836 1.00 0.00 H new ATOM 0 HE2 LYS A 71 5.725 -3.823 15.465 1.00 0.00 H new ATOM 0 HE3 LYS A 71 5.505 -2.113 15.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 3.963 -4.067 14.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 4.110 -2.519 13.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 5.026 -3.809 12.850 1.00 0.00 H new ATOM 1196 N PRO A 72 9.260 -0.117 10.710 1.00 0.00 N ATOM 1197 CA PRO A 72 10.580 -0.379 10.128 1.00 0.00 C ATOM 1198 C PRO A 72 11.223 -1.662 10.697 1.00 0.00 C ATOM 1199 O PRO A 72 11.047 -1.992 11.886 1.00 0.00 O ATOM 1200 CB PRO A 72 11.414 0.855 10.527 1.00 0.00 C ATOM 1201 CG PRO A 72 10.472 1.772 11.249 1.00 0.00 C ATOM 1202 CD PRO A 72 9.337 0.925 11.738 1.00 0.00 C ATOM 0 HA PRO A 72 10.520 -0.535 9.051 1.00 0.00 H new ATOM 0 HB2 PRO A 72 12.250 0.571 11.167 1.00 0.00 H new ATOM 0 HB3 PRO A 72 11.836 1.342 9.648 1.00 0.00 H new ATOM 0 HG2 PRO A 72 10.974 2.265 12.082 1.00 0.00 H new ATOM 0 HG3 PRO A 72 10.111 2.557 10.585 1.00 0.00 H new ATOM 0 HD2 PRO A 72 9.536 0.508 12.725 1.00 0.00 H new ATOM 0 HD3 PRO A 72 8.409 1.492 11.813 1.00 0.00 H new ATOM 1210 N LEU A 73 11.976 -2.367 9.851 1.00 0.00 N ATOM 1211 CA LEU A 73 12.626 -3.596 10.177 1.00 0.00 C ATOM 1212 C LEU A 73 13.757 -3.341 11.154 1.00 0.00 C ATOM 1213 O LEU A 73 14.093 -2.190 11.440 1.00 0.00 O ATOM 1214 CB LEU A 73 13.280 -4.143 8.914 1.00 0.00 C ATOM 1215 CG LEU A 73 12.564 -3.955 7.580 1.00 0.00 C ATOM 1216 CD1 LEU A 73 13.394 -4.556 6.450 1.00 0.00 C ATOM 1217 CD2 LEU A 73 11.190 -4.573 7.609 1.00 0.00 C ATOM 0 H LEU A 73 12.144 -2.070 8.890 1.00 0.00 H new ATOM 0 HA LEU A 73 11.890 -4.281 10.599 1.00 0.00 H new ATOM 0 HB2 LEU A 73 14.266 -3.686 8.828 1.00 0.00 H new ATOM 0 HB3 LEU A 73 13.435 -5.212 9.058 1.00 0.00 H new ATOM 0 HG LEU A 73 12.447 -2.886 7.404 1.00 0.00 H new ATOM 0 HD11 LEU A 73 12.874 -4.416 5.502 1.00 0.00 H new ATOM 0 HD12 LEU A 73 14.364 -4.061 6.408 1.00 0.00 H new ATOM 0 HD13 LEU A 73 13.538 -5.621 6.631 1.00 0.00 H new ATOM 0 HD21 LEU A 73 10.703 -4.424 6.645 1.00 0.00 H new ATOM 0 HD22 LEU A 73 11.275 -5.641 7.811 1.00 0.00 H new ATOM 0 HD23 LEU A 73 10.596 -4.102 8.392 1.00 0.00 H new ATOM 1229 N SER A 74 14.363 -4.403 11.633 1.00 0.00 N ATOM 1230 CA SER A 74 15.549 -4.284 12.428 1.00 0.00 C ATOM 1231 C SER A 74 16.621 -3.669 11.625 1.00 0.00 C ATOM 1232 O SER A 74 16.946 -4.172 10.540 1.00 0.00 O ATOM 1233 CB SER A 74 16.074 -5.623 12.844 1.00 0.00 C ATOM 1234 OG SER A 74 15.239 -6.251 13.808 1.00 0.00 O ATOM 0 H SER A 74 14.047 -5.361 11.481 1.00 0.00 H new ATOM 0 HA SER A 74 15.283 -3.689 13.301 1.00 0.00 H new ATOM 0 HB2 SER A 74 16.161 -6.265 11.968 1.00 0.00 H new ATOM 0 HB3 SER A 74 17.077 -5.507 13.255 1.00 0.00 H new ATOM 0 HG SER A 74 15.617 -7.122 14.050 1.00 0.00 H new ATOM 1240 N GLY A 75 17.128 -2.575 12.077 1.00 0.00 N ATOM 1241 CA GLY A 75 18.250 -2.041 11.420 1.00 0.00 C ATOM 1242 C GLY A 75 17.880 -1.135 10.241 1.00 0.00 C ATOM 1243 O GLY A 75 18.717 -0.379 9.732 1.00 0.00 O ATOM 0 H GLY A 75 16.787 -2.048 12.881 1.00 0.00 H new ATOM 0 HA2 GLY A 75 18.846 -1.473 12.134 1.00 0.00 H new ATOM 0 HA3 GLY A 75 18.876 -2.858 11.061 1.00 0.00 H new ATOM 1247 N SER A 76 16.638 -1.233 9.786 1.00 0.00 N ATOM 1248 CA SER A 76 16.111 -0.426 8.795 1.00 0.00 C ATOM 1249 C SER A 76 15.307 0.663 9.442 1.00 0.00 C ATOM 1250 O SER A 76 14.721 0.479 10.510 1.00 0.00 O ATOM 1251 CB SER A 76 15.242 -1.300 7.955 1.00 0.00 C ATOM 1252 OG SER A 76 16.004 -2.330 7.337 1.00 0.00 O ATOM 0 H SER A 76 15.974 -1.921 10.141 1.00 0.00 H new ATOM 0 HA SER A 76 16.883 0.039 8.182 1.00 0.00 H new ATOM 0 HB2 SER A 76 14.459 -1.741 8.572 1.00 0.00 H new ATOM 0 HB3 SER A 76 14.746 -0.701 7.191 1.00 0.00 H new ATOM 0 HG SER A 76 15.802 -2.356 6.378 1.00 0.00 H new ATOM 1258 N ASP A 77 15.323 1.786 8.842 1.00 0.00 N ATOM 1259 CA ASP A 77 14.614 2.900 9.304 1.00 0.00 C ATOM 1260 C ASP A 77 13.671 3.281 8.283 1.00 0.00 C ATOM 1261 O ASP A 77 12.543 3.693 8.556 1.00 0.00 O ATOM 1262 CB ASP A 77 15.521 4.093 9.505 1.00 0.00 C ATOM 1263 CG ASP A 77 16.526 3.900 10.601 1.00 0.00 C ATOM 1264 OD1 ASP A 77 17.634 3.391 10.337 1.00 0.00 O ATOM 1265 OD2 ASP A 77 16.225 4.256 11.755 1.00 0.00 O ATOM 0 H ASP A 77 15.850 1.958 7.986 1.00 0.00 H new ATOM 0 HA ASP A 77 14.142 2.632 10.249 1.00 0.00 H new ATOM 0 HB2 ASP A 77 16.047 4.301 8.573 1.00 0.00 H new ATOM 0 HB3 ASP A 77 14.912 4.969 9.730 1.00 0.00 H new ATOM 1270 N ARG A 78 14.128 3.179 7.077 1.00 0.00 N ATOM 1271 CA ARG A 78 13.411 3.690 6.022 1.00 0.00 C ATOM 1272 C ARG A 78 12.841 2.602 5.121 1.00 0.00 C ATOM 1273 O ARG A 78 12.105 2.874 4.208 1.00 0.00 O ATOM 1274 CB ARG A 78 14.233 4.764 5.333 1.00 0.00 C ATOM 1275 CG ARG A 78 14.600 5.955 6.217 1.00 0.00 C ATOM 1276 CD ARG A 78 13.394 6.683 6.796 1.00 0.00 C ATOM 1277 NE ARG A 78 13.159 6.417 8.215 1.00 0.00 N ATOM 1278 CZ ARG A 78 13.231 7.358 9.182 1.00 0.00 C ATOM 1279 NH1 ARG A 78 13.647 8.598 8.889 1.00 0.00 N ATOM 1280 NH2 ARG A 78 12.898 7.056 10.432 1.00 0.00 N ATOM 0 H ARG A 78 15.011 2.734 6.826 1.00 0.00 H new ATOM 0 HA ARG A 78 12.510 4.185 6.385 1.00 0.00 H new ATOM 0 HB2 ARG A 78 15.151 4.313 4.955 1.00 0.00 H new ATOM 0 HB3 ARG A 78 13.678 5.128 4.469 1.00 0.00 H new ATOM 0 HG2 ARG A 78 15.231 5.608 7.035 1.00 0.00 H new ATOM 0 HG3 ARG A 78 15.193 6.660 5.634 1.00 0.00 H new ATOM 0 HD2 ARG A 78 13.529 7.756 6.656 1.00 0.00 H new ATOM 0 HD3 ARG A 78 12.506 6.398 6.232 1.00 0.00 H new ATOM 0 HE ARG A 78 12.927 5.463 8.491 1.00 0.00 H new ATOM 0 HH11 ARG A 78 13.911 8.835 7.933 1.00 0.00 H new ATOM 0 HH12 ARG A 78 13.700 9.305 9.622 1.00 0.00 H new ATOM 0 HH21 ARG A 78 12.587 6.112 10.663 1.00 0.00 H new ATOM 0 HH22 ARG A 78 12.953 7.768 11.161 1.00 0.00 H new ATOM 1294 N ALA A 79 13.124 1.379 5.469 1.00 0.00 N ATOM 1295 CA ALA A 79 12.551 0.234 4.817 1.00 0.00 C ATOM 1296 C ALA A 79 11.554 -0.302 5.836 1.00 0.00 C ATOM 1297 O ALA A 79 11.885 -0.406 7.038 1.00 0.00 O ATOM 1298 CB ALA A 79 13.626 -0.804 4.536 1.00 0.00 C ATOM 0 H ALA A 79 13.768 1.145 6.224 1.00 0.00 H new ATOM 0 HA ALA A 79 12.090 0.477 3.859 1.00 0.00 H new ATOM 0 HB1 ALA A 79 13.179 -1.666 4.042 1.00 0.00 H new ATOM 0 HB2 ALA A 79 14.390 -0.371 3.890 1.00 0.00 H new ATOM 0 HB3 ALA A 79 14.081 -1.119 5.475 1.00 0.00 H new ATOM 1304 N TRP A 80 10.372 -0.634 5.402 1.00 0.00 N ATOM 1305 CA TRP A 80 9.295 -0.819 6.267 1.00 0.00 C ATOM 1306 C TRP A 80 8.422 -1.963 5.838 1.00 0.00 C ATOM 1307 O TRP A 80 8.482 -2.408 4.685 1.00 0.00 O ATOM 1308 CB TRP A 80 8.505 0.497 6.455 1.00 0.00 C ATOM 1309 CG TRP A 80 7.828 1.160 5.245 1.00 0.00 C ATOM 1310 CD1 TRP A 80 6.610 1.715 5.283 1.00 0.00 C ATOM 1311 CD2 TRP A 80 8.296 1.362 3.870 1.00 0.00 C ATOM 1312 NE1 TRP A 80 6.256 2.234 4.067 1.00 0.00 N ATOM 1313 CE2 TRP A 80 7.269 2.029 3.186 1.00 0.00 C ATOM 1314 CE3 TRP A 80 9.449 1.050 3.159 1.00 0.00 C ATOM 1315 CZ2 TRP A 80 7.368 2.382 1.849 1.00 0.00 C ATOM 1316 CZ3 TRP A 80 9.547 1.400 1.836 1.00 0.00 C ATOM 1317 CH2 TRP A 80 8.511 2.057 1.193 1.00 0.00 C ATOM 0 H TRP A 80 10.149 -0.781 4.417 1.00 0.00 H new ATOM 0 HA TRP A 80 9.693 -1.095 7.244 1.00 0.00 H new ATOM 0 HB2 TRP A 80 7.730 0.308 7.198 1.00 0.00 H new ATOM 0 HB3 TRP A 80 9.189 1.228 6.886 1.00 0.00 H new ATOM 0 HD1 TRP A 80 5.985 1.749 6.163 1.00 0.00 H new ATOM 0 HE1 TRP A 80 5.373 2.700 3.856 1.00 0.00 H new ATOM 0 HE3 TRP A 80 10.264 0.535 3.646 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 6.563 2.898 1.347 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 10.446 1.160 1.288 1.00 0.00 H new ATOM 0 HH2 TRP A 80 8.615 2.316 0.150 1.00 0.00 H new ATOM 1328 N MET A 81 7.626 -2.423 6.759 1.00 0.00 N ATOM 1329 CA MET A 81 6.817 -3.537 6.608 1.00 0.00 C ATOM 1330 C MET A 81 5.487 -3.191 7.058 1.00 0.00 C ATOM 1331 O MET A 81 5.299 -2.366 7.972 1.00 0.00 O ATOM 1332 CB MET A 81 7.321 -4.763 7.355 1.00 0.00 C ATOM 1333 CG MET A 81 7.592 -4.595 8.840 1.00 0.00 C ATOM 1334 SD MET A 81 8.204 -6.114 9.598 1.00 0.00 S ATOM 1335 CE MET A 81 8.464 -5.570 11.283 1.00 0.00 C ATOM 0 H MET A 81 7.539 -1.987 7.677 1.00 0.00 H new ATOM 0 HA MET A 81 6.822 -3.812 5.553 1.00 0.00 H new ATOM 0 HB2 MET A 81 6.589 -5.561 7.231 1.00 0.00 H new ATOM 0 HB3 MET A 81 8.242 -5.098 6.877 1.00 0.00 H new ATOM 0 HG2 MET A 81 8.322 -3.798 8.987 1.00 0.00 H new ATOM 0 HG3 MET A 81 6.676 -4.284 9.342 1.00 0.00 H new ATOM 0 HE1 MET A 81 9.180 -6.230 11.772 1.00 0.00 H new ATOM 0 HE2 MET A 81 8.852 -4.552 11.281 1.00 0.00 H new ATOM 0 HE3 MET A 81 7.518 -5.596 11.824 1.00 0.00 H new ATOM 1345 N TRP A 82 4.590 -3.801 6.463 1.00 0.00 N ATOM 1346 CA TRP A 82 3.244 -3.532 6.648 1.00 0.00 C ATOM 1347 C TRP A 82 2.612 -4.872 6.814 1.00 0.00 C ATOM 1348 O TRP A 82 3.135 -5.855 6.269 1.00 0.00 O ATOM 1349 CB TRP A 82 2.638 -2.900 5.400 1.00 0.00 C ATOM 1350 CG TRP A 82 3.548 -2.049 4.563 1.00 0.00 C ATOM 1351 CD1 TRP A 82 3.990 -0.802 4.826 1.00 0.00 C ATOM 1352 CD2 TRP A 82 4.088 -2.402 3.292 1.00 0.00 C ATOM 1353 NE1 TRP A 82 4.796 -0.368 3.811 1.00 0.00 N ATOM 1354 CE2 TRP A 82 4.871 -1.329 2.859 1.00 0.00 C ATOM 1355 CE3 TRP A 82 3.993 -3.531 2.489 1.00 0.00 C ATOM 1356 CZ2 TRP A 82 5.550 -1.345 1.655 1.00 0.00 C ATOM 1357 CZ3 TRP A 82 4.663 -3.551 1.293 1.00 0.00 C ATOM 1358 CH2 TRP A 82 5.434 -2.465 0.888 1.00 0.00 C ATOM 0 H TRP A 82 4.771 -4.547 5.792 1.00 0.00 H new ATOM 0 HA TRP A 82 3.094 -2.854 7.488 1.00 0.00 H new ATOM 0 HB2 TRP A 82 2.246 -3.699 4.771 1.00 0.00 H new ATOM 0 HB3 TRP A 82 1.789 -2.290 5.706 1.00 0.00 H new ATOM 0 HD1 TRP A 82 3.743 -0.231 5.709 1.00 0.00 H new ATOM 0 HE1 TRP A 82 5.267 0.536 3.776 1.00 0.00 H new ATOM 0 HE3 TRP A 82 3.401 -4.379 2.801 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 6.148 -0.504 1.335 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 4.592 -4.421 0.657 1.00 0.00 H new ATOM 0 HH2 TRP A 82 5.953 -2.511 -0.058 1.00 0.00 H new ATOM 1369 N LEU A 83 1.556 -4.980 7.529 1.00 0.00 N ATOM 1370 CA LEU A 83 0.966 -6.270 7.601 1.00 0.00 C ATOM 1371 C LEU A 83 -0.282 -6.345 6.728 1.00 0.00 C ATOM 1372 O LEU A 83 -1.148 -5.468 6.784 1.00 0.00 O ATOM 1373 CB LEU A 83 0.718 -6.701 9.045 1.00 0.00 C ATOM 1374 CG LEU A 83 -0.256 -5.853 9.897 1.00 0.00 C ATOM 1375 CD1 LEU A 83 -1.707 -6.308 9.737 1.00 0.00 C ATOM 1376 CD2 LEU A 83 0.169 -5.860 11.360 1.00 0.00 C ATOM 0 H LEU A 83 1.097 -4.234 8.051 1.00 0.00 H new ATOM 0 HA LEU A 83 1.675 -6.993 7.197 1.00 0.00 H new ATOM 0 HB2 LEU A 83 0.344 -7.725 9.029 1.00 0.00 H new ATOM 0 HB3 LEU A 83 1.680 -6.721 9.558 1.00 0.00 H new ATOM 0 HG LEU A 83 -0.207 -4.828 9.529 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -2.354 -5.684 10.353 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -2.004 -6.217 8.692 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -1.799 -7.348 10.051 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -0.528 -5.259 11.944 1.00 0.00 H new ATOM 0 HD22 LEU A 83 0.167 -6.884 11.735 1.00 0.00 H new ATOM 0 HD23 LEU A 83 1.172 -5.443 11.450 1.00 0.00 H new ATOM 1388 N ALA A 84 -0.326 -7.326 5.889 1.00 0.00 N ATOM 1389 CA ALA A 84 -1.451 -7.543 5.005 1.00 0.00 C ATOM 1390 C ALA A 84 -1.653 -8.991 4.770 1.00 0.00 C ATOM 1391 O ALA A 84 -0.776 -9.790 5.042 1.00 0.00 O ATOM 1392 CB ALA A 84 -1.262 -6.868 3.668 1.00 0.00 C ATOM 0 H ALA A 84 0.420 -8.014 5.787 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.322 -7.110 5.498 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -2.131 -7.058 3.038 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -1.149 -5.794 3.815 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -0.369 -7.264 3.184 1.00 0.00 H new ATOM 1398 N SER A 85 -2.795 -9.348 4.318 1.00 0.00 N ATOM 1399 CA SER A 85 -2.961 -10.584 3.761 1.00 0.00 C ATOM 1400 C SER A 85 -2.644 -10.524 2.341 1.00 0.00 C ATOM 1401 O SER A 85 -3.405 -10.028 1.508 1.00 0.00 O ATOM 1402 CB SER A 85 -4.270 -11.096 4.059 1.00 0.00 C ATOM 1403 OG SER A 85 -5.131 -10.049 4.529 1.00 0.00 O ATOM 0 H SER A 85 -3.633 -8.767 4.336 1.00 0.00 H new ATOM 0 HA SER A 85 -2.266 -11.301 4.198 1.00 0.00 H new ATOM 0 HB2 SER A 85 -4.699 -11.553 3.167 1.00 0.00 H new ATOM 0 HB3 SER A 85 -4.196 -11.879 4.814 1.00 0.00 H new ATOM 0 HG SER A 85 -6.018 -10.418 4.725 1.00 0.00 H new ATOM 1409 N ASP A 86 -1.511 -11.010 2.080 1.00 0.00 N ATOM 1410 CA ASP A 86 -0.957 -10.891 0.857 1.00 0.00 C ATOM 1411 C ASP A 86 -0.707 -12.241 0.201 1.00 0.00 C ATOM 1412 O ASP A 86 -0.338 -13.205 0.887 1.00 0.00 O ATOM 1413 CB ASP A 86 0.329 -10.083 0.937 1.00 0.00 C ATOM 1414 CG ASP A 86 1.602 -10.904 1.209 1.00 0.00 C ATOM 1415 OD1 ASP A 86 1.742 -11.499 2.283 1.00 0.00 O ATOM 1416 OD2 ASP A 86 2.470 -10.975 0.317 1.00 0.00 O ATOM 0 H ASP A 86 -0.939 -11.518 2.755 1.00 0.00 H new ATOM 0 HA ASP A 86 -1.671 -10.361 0.226 1.00 0.00 H new ATOM 0 HB2 ASP A 86 0.458 -9.542 -0.000 1.00 0.00 H new ATOM 0 HB3 ASP A 86 0.222 -9.337 1.724 1.00 0.00 H new ATOM 1421 N PHE A 87 -1.115 -12.319 -1.085 1.00 0.00 N ATOM 1422 CA PHE A 87 -0.764 -13.334 -2.048 1.00 0.00 C ATOM 1423 C PHE A 87 -1.830 -13.325 -3.156 1.00 0.00 C ATOM 1424 O PHE A 87 -2.925 -13.782 -2.984 1.00 0.00 O ATOM 1425 CB PHE A 87 -0.697 -14.688 -1.467 1.00 0.00 C ATOM 1426 CG PHE A 87 0.577 -15.442 -1.728 1.00 0.00 C ATOM 1427 CD1 PHE A 87 1.219 -15.370 -2.953 1.00 0.00 C ATOM 1428 CD2 PHE A 87 1.140 -16.214 -0.730 1.00 0.00 C ATOM 1429 CE1 PHE A 87 2.393 -16.054 -3.176 1.00 0.00 C ATOM 1430 CE2 PHE A 87 2.313 -16.901 -0.947 1.00 0.00 C ATOM 1431 CZ PHE A 87 2.941 -16.821 -2.173 1.00 0.00 C ATOM 0 H PHE A 87 -1.739 -11.618 -1.484 1.00 0.00 H new ATOM 0 HA PHE A 87 0.231 -13.101 -2.428 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -0.838 -14.609 -0.389 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -1.531 -15.273 -1.855 1.00 0.00 H new ATOM 0 HD1 PHE A 87 0.793 -14.770 -3.743 1.00 0.00 H new ATOM 0 HD2 PHE A 87 0.654 -16.279 0.232 1.00 0.00 H new ATOM 0 HE1 PHE A 87 2.883 -15.989 -4.136 1.00 0.00 H new ATOM 0 HE2 PHE A 87 2.741 -17.502 -0.158 1.00 0.00 H new ATOM 0 HZ PHE A 87 3.861 -17.359 -2.345 1.00 0.00 H new ATOM 1441 N SER A 88 -1.502 -12.711 -4.222 1.00 0.00 N ATOM 1442 CA SER A 88 -2.334 -12.538 -5.373 1.00 0.00 C ATOM 1443 C SER A 88 -2.475 -13.836 -6.076 1.00 0.00 C ATOM 1444 O SER A 88 -3.548 -14.226 -6.517 1.00 0.00 O ATOM 1445 CB SER A 88 -1.655 -11.554 -6.306 1.00 0.00 C ATOM 1446 OG SER A 88 -1.368 -10.355 -5.654 1.00 0.00 O ATOM 0 H SER A 88 -0.584 -12.281 -4.335 1.00 0.00 H new ATOM 0 HA SER A 88 -3.316 -12.173 -5.074 1.00 0.00 H new ATOM 0 HB2 SER A 88 -0.734 -11.991 -6.691 1.00 0.00 H new ATOM 0 HB3 SER A 88 -2.298 -11.359 -7.164 1.00 0.00 H new ATOM 0 HG SER A 88 -1.360 -9.622 -6.305 1.00 0.00 H new ATOM 1452 N ASP A 89 -1.365 -14.553 -6.063 1.00 0.00 N ATOM 1453 CA ASP A 89 -1.184 -15.665 -6.917 1.00 0.00 C ATOM 1454 C ASP A 89 -1.219 -16.899 -6.104 1.00 0.00 C ATOM 1455 O ASP A 89 -1.335 -18.007 -6.600 1.00 0.00 O ATOM 1456 CB ASP A 89 0.165 -15.504 -7.640 1.00 0.00 C ATOM 1457 CG ASP A 89 0.557 -16.653 -8.545 1.00 0.00 C ATOM 1458 OD1 ASP A 89 0.094 -16.708 -9.702 1.00 0.00 O ATOM 1459 OD2 ASP A 89 1.398 -17.483 -8.145 1.00 0.00 O ATOM 0 H ASP A 89 -0.573 -14.362 -5.449 1.00 0.00 H new ATOM 0 HA ASP A 89 -1.975 -15.727 -7.664 1.00 0.00 H new ATOM 0 HB2 ASP A 89 0.133 -14.590 -8.234 1.00 0.00 H new ATOM 0 HB3 ASP A 89 0.946 -15.371 -6.891 1.00 0.00 H new ATOM 1464 N GLY A 90 -1.177 -16.679 -4.836 1.00 0.00 N ATOM 1465 CA GLY A 90 -1.105 -17.703 -3.938 1.00 0.00 C ATOM 1466 C GLY A 90 -2.176 -17.630 -2.944 1.00 0.00 C ATOM 1467 O GLY A 90 -2.230 -18.456 -2.019 1.00 0.00 O ATOM 0 H GLY A 90 -1.194 -15.749 -4.417 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -1.164 -18.655 -4.466 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -0.139 -17.677 -3.434 1.00 0.00 H new ATOM 1471 N ASP A 91 -3.004 -16.579 -3.086 1.00 0.00 N ATOM 1472 CA ASP A 91 -4.199 -16.386 -2.232 1.00 0.00 C ATOM 1473 C ASP A 91 -3.783 -15.850 -0.883 1.00 0.00 C ATOM 1474 O ASP A 91 -2.829 -16.330 -0.289 1.00 0.00 O ATOM 1475 CB ASP A 91 -5.020 -17.665 -2.146 1.00 0.00 C ATOM 1476 CG ASP A 91 -5.968 -17.732 -0.965 1.00 0.00 C ATOM 1477 OD1 ASP A 91 -6.983 -17.031 -0.948 1.00 0.00 O ATOM 1478 OD2 ASP A 91 -5.726 -18.525 -0.041 1.00 0.00 O ATOM 0 H ASP A 91 -2.870 -15.847 -3.784 1.00 0.00 H new ATOM 0 HA ASP A 91 -4.855 -15.642 -2.683 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -5.597 -17.772 -3.064 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -4.339 -18.515 -2.096 1.00 0.00 H new ATOM 1483 N ALA A 92 -4.516 -14.926 -0.376 1.00 0.00 N ATOM 1484 CA ALA A 92 -4.028 -14.104 0.696 1.00 0.00 C ATOM 1485 C ALA A 92 -3.929 -14.790 2.058 1.00 0.00 C ATOM 1486 O ALA A 92 -4.909 -15.318 2.595 1.00 0.00 O ATOM 1487 CB ALA A 92 -4.863 -12.848 0.775 1.00 0.00 C ATOM 0 H ALA A 92 -5.465 -14.711 -0.682 1.00 0.00 H new ATOM 0 HA ALA A 92 -2.993 -13.867 0.449 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -4.498 -12.219 1.587 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -4.791 -12.303 -0.166 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -5.903 -13.114 0.962 1.00 0.00 H new ATOM 1493 N LYS A 93 -2.697 -14.821 2.555 1.00 0.00 N ATOM 1494 CA LYS A 93 -2.329 -15.249 3.870 1.00 0.00 C ATOM 1495 C LYS A 93 -1.902 -13.982 4.581 1.00 0.00 C ATOM 1496 O LYS A 93 -1.400 -13.097 3.919 1.00 0.00 O ATOM 1497 CB LYS A 93 -1.092 -16.147 3.792 1.00 0.00 C ATOM 1498 CG LYS A 93 -1.274 -17.674 3.791 1.00 0.00 C ATOM 1499 CD LYS A 93 -1.574 -18.285 2.425 1.00 0.00 C ATOM 1500 CE LYS A 93 -3.035 -18.266 2.064 1.00 0.00 C ATOM 1501 NZ LYS A 93 -3.261 -18.937 0.770 1.00 0.00 N ATOM 0 H LYS A 93 -1.890 -14.527 2.004 1.00 0.00 H new ATOM 0 HA LYS A 93 -3.143 -15.785 4.359 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -0.549 -15.880 2.885 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -0.449 -15.894 4.635 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -0.368 -18.133 4.187 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -2.085 -17.929 4.473 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -1.013 -17.744 1.663 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -1.218 -19.315 2.411 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -3.614 -18.763 2.843 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -3.389 -17.236 2.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -4.283 -19.049 0.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -2.852 -18.363 0.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -2.808 -19.873 0.780 1.00 0.00 H new ATOM 1515 N LEU A 94 -2.071 -13.853 5.877 1.00 0.00 N ATOM 1516 CA LEU A 94 -1.637 -12.612 6.486 1.00 0.00 C ATOM 1517 C LEU A 94 -0.225 -12.728 6.936 1.00 0.00 C ATOM 1518 O LEU A 94 0.132 -13.585 7.744 1.00 0.00 O ATOM 1519 CB LEU A 94 -2.564 -12.033 7.580 1.00 0.00 C ATOM 1520 CG LEU A 94 -2.681 -12.781 8.934 1.00 0.00 C ATOM 1521 CD1 LEU A 94 -3.391 -11.902 9.949 1.00 0.00 C ATOM 1522 CD2 LEU A 94 -3.445 -14.090 8.786 1.00 0.00 C ATOM 0 H LEU A 94 -2.481 -14.547 6.502 1.00 0.00 H new ATOM 0 HA LEU A 94 -1.705 -11.863 5.697 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.230 -11.017 7.792 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -3.566 -11.957 7.157 1.00 0.00 H new ATOM 0 HG LEU A 94 -1.671 -13.009 9.275 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -3.470 -12.433 10.898 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -2.824 -10.982 10.094 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -4.389 -11.659 9.585 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -3.507 -14.586 9.754 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.450 -13.885 8.418 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -2.925 -14.737 8.079 1.00 0.00 H new ATOM 1534 N GLU A 95 0.545 -11.848 6.433 1.00 0.00 N ATOM 1535 CA GLU A 95 1.902 -11.820 6.517 1.00 0.00 C ATOM 1536 C GLU A 95 2.282 -10.422 6.675 1.00 0.00 C ATOM 1537 O GLU A 95 1.498 -9.490 6.481 1.00 0.00 O ATOM 1538 CB GLU A 95 2.523 -12.429 5.252 1.00 0.00 C ATOM 1539 CG GLU A 95 2.321 -13.942 5.065 1.00 0.00 C ATOM 1540 CD GLU A 95 3.261 -14.805 5.885 1.00 0.00 C ATOM 1541 OE1 GLU A 95 3.240 -14.752 7.132 1.00 0.00 O ATOM 1542 OE2 GLU A 95 4.063 -15.559 5.286 1.00 0.00 O ATOM 0 H GLU A 95 0.177 -11.059 5.902 1.00 0.00 H new ATOM 0 HA GLU A 95 2.263 -12.408 7.361 1.00 0.00 H new ATOM 0 HB2 GLU A 95 2.108 -11.917 4.384 1.00 0.00 H new ATOM 0 HB3 GLU A 95 3.593 -12.224 5.261 1.00 0.00 H new ATOM 0 HG2 GLU A 95 1.294 -14.194 5.327 1.00 0.00 H new ATOM 0 HG3 GLU A 95 2.450 -14.186 4.011 1.00 0.00 H new ATOM 1549 N GLN A 96 3.408 -10.285 7.072 1.00 0.00 N ATOM 1550 CA GLN A 96 3.959 -9.089 7.266 1.00 0.00 C ATOM 1551 C GLN A 96 4.958 -8.962 6.175 1.00 0.00 C ATOM 1552 O GLN A 96 5.851 -9.771 6.038 1.00 0.00 O ATOM 1553 CB GLN A 96 4.539 -8.956 8.680 1.00 0.00 C ATOM 1554 CG GLN A 96 3.454 -9.036 9.742 1.00 0.00 C ATOM 1555 CD GLN A 96 3.937 -8.991 11.172 1.00 0.00 C ATOM 1556 OE1 GLN A 96 4.979 -8.412 11.502 1.00 0.00 O ATOM 1557 NE2 GLN A 96 3.162 -9.566 12.043 1.00 0.00 N ATOM 0 H GLN A 96 4.026 -11.066 7.290 1.00 0.00 H new ATOM 0 HA GLN A 96 3.241 -8.270 7.220 1.00 0.00 H new ATOM 0 HB2 GLN A 96 5.272 -9.745 8.848 1.00 0.00 H new ATOM 0 HB3 GLN A 96 5.066 -8.006 8.769 1.00 0.00 H new ATOM 0 HG2 GLN A 96 2.757 -8.213 9.587 1.00 0.00 H new ATOM 0 HG3 GLN A 96 2.894 -9.960 9.595 1.00 0.00 H new ATOM 0 HE21 GLN A 96 2.310 -10.035 11.736 1.00 0.00 H new ATOM 0 HE22 GLN A 96 3.406 -9.548 13.033 1.00 0.00 H new ATOM 1566 N LEU A 97 4.737 -8.060 5.368 1.00 0.00 N ATOM 1567 CA LEU A 97 5.572 -7.851 4.234 1.00 0.00 C ATOM 1568 C LEU A 97 6.262 -6.547 4.261 1.00 0.00 C ATOM 1569 O LEU A 97 5.698 -5.526 4.625 1.00 0.00 O ATOM 1570 CB LEU A 97 4.877 -8.097 2.887 1.00 0.00 C ATOM 1571 CG LEU A 97 3.593 -7.309 2.550 1.00 0.00 C ATOM 1572 CD1 LEU A 97 3.254 -7.500 1.091 1.00 0.00 C ATOM 1573 CD2 LEU A 97 2.405 -7.756 3.389 1.00 0.00 C ATOM 0 H LEU A 97 3.958 -7.406 5.444 1.00 0.00 H new ATOM 0 HA LEU A 97 6.337 -8.623 4.317 1.00 0.00 H new ATOM 0 HB2 LEU A 97 5.604 -7.893 2.100 1.00 0.00 H new ATOM 0 HB3 LEU A 97 4.635 -9.158 2.831 1.00 0.00 H new ATOM 0 HG LEU A 97 3.789 -6.260 2.772 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.347 -6.944 0.852 1.00 0.00 H new ATOM 0 HD12 LEU A 97 4.076 -7.135 0.476 1.00 0.00 H new ATOM 0 HD13 LEU A 97 3.093 -8.559 0.890 1.00 0.00 H new ATOM 0 HD21 LEU A 97 1.526 -7.172 3.115 1.00 0.00 H new ATOM 0 HD22 LEU A 97 2.209 -8.813 3.209 1.00 0.00 H new ATOM 0 HD23 LEU A 97 2.627 -7.603 4.445 1.00 0.00 H new ATOM 1585 N ALA A 98 7.468 -6.602 3.845 1.00 0.00 N ATOM 1586 CA ALA A 98 8.380 -5.498 3.882 1.00 0.00 C ATOM 1587 C ALA A 98 8.878 -5.196 2.522 1.00 0.00 C ATOM 1588 O ALA A 98 9.049 -6.091 1.720 1.00 0.00 O ATOM 1589 CB ALA A 98 9.568 -5.828 4.758 1.00 0.00 C ATOM 0 H ALA A 98 7.877 -7.449 3.450 1.00 0.00 H new ATOM 0 HA ALA A 98 7.847 -4.636 4.284 1.00 0.00 H new ATOM 0 HB1 ALA A 98 10.253 -4.980 4.777 1.00 0.00 H new ATOM 0 HB2 ALA A 98 9.225 -6.040 5.771 1.00 0.00 H new ATOM 0 HB3 ALA A 98 10.083 -6.702 4.359 1.00 0.00 H new ATOM 1595 N ALA A 99 9.118 -3.968 2.265 1.00 0.00 N ATOM 1596 CA ALA A 99 9.685 -3.567 1.026 1.00 0.00 C ATOM 1597 C ALA A 99 10.752 -2.579 1.313 1.00 0.00 C ATOM 1598 O ALA A 99 10.668 -1.837 2.298 1.00 0.00 O ATOM 1599 CB ALA A 99 8.645 -2.965 0.102 1.00 0.00 C ATOM 0 H ALA A 99 8.927 -3.202 2.910 1.00 0.00 H new ATOM 0 HA ALA A 99 10.093 -4.440 0.516 1.00 0.00 H new ATOM 0 HB1 ALA A 99 9.118 -2.671 -0.835 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.867 -3.702 -0.099 1.00 0.00 H new ATOM 0 HB3 ALA A 99 8.201 -2.089 0.575 1.00 0.00 H new ATOM 1605 N LYS A 100 11.761 -2.573 0.512 1.00 0.00 N ATOM 1606 CA LYS A 100 12.772 -1.676 0.656 1.00 0.00 C ATOM 1607 C LYS A 100 13.159 -1.175 -0.649 1.00 0.00 C ATOM 1608 O LYS A 100 13.107 -1.871 -1.677 1.00 0.00 O ATOM 1609 CB LYS A 100 13.982 -2.231 1.367 1.00 0.00 C ATOM 1610 CG LYS A 100 14.677 -3.416 0.701 1.00 0.00 C ATOM 1611 CD LYS A 100 16.021 -3.735 1.368 1.00 0.00 C ATOM 1612 CE LYS A 100 17.009 -2.574 1.213 1.00 0.00 C ATOM 1613 NZ LYS A 100 18.320 -2.846 1.835 1.00 0.00 N ATOM 0 H LYS A 100 11.876 -3.220 -0.268 1.00 0.00 H new ATOM 0 HA LYS A 100 12.390 -0.873 1.286 1.00 0.00 H new ATOM 0 HB2 LYS A 100 14.710 -1.428 1.480 1.00 0.00 H new ATOM 0 HB3 LYS A 100 13.681 -2.532 2.370 1.00 0.00 H new ATOM 0 HG2 LYS A 100 14.030 -4.292 0.750 1.00 0.00 H new ATOM 0 HG3 LYS A 100 14.838 -3.197 -0.355 1.00 0.00 H new ATOM 0 HD2 LYS A 100 15.864 -3.943 2.426 1.00 0.00 H new ATOM 0 HD3 LYS A 100 16.444 -4.637 0.926 1.00 0.00 H new ATOM 0 HE2 LYS A 100 17.152 -2.365 0.153 1.00 0.00 H new ATOM 0 HE3 LYS A 100 16.580 -1.677 1.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 18.946 -2.027 1.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 18.192 -3.018 2.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 18.747 -3.685 1.393 1.00 0.00 H new ATOM 1627 N PHE A 101 13.486 -0.001 -0.605 1.00 0.00 N ATOM 1628 CA PHE A 101 14.005 0.703 -1.717 1.00 0.00 C ATOM 1629 C PHE A 101 15.506 0.714 -1.684 1.00 0.00 C ATOM 1630 O PHE A 101 16.124 0.218 -0.732 1.00 0.00 O ATOM 1631 CB PHE A 101 13.416 2.098 -1.848 1.00 0.00 C ATOM 1632 CG PHE A 101 12.063 2.101 -2.503 1.00 0.00 C ATOM 1633 CD1 PHE A 101 10.904 1.969 -1.764 1.00 0.00 C ATOM 1634 CD2 PHE A 101 11.965 2.231 -3.881 1.00 0.00 C ATOM 1635 CE1 PHE A 101 9.671 1.968 -2.389 1.00 0.00 C ATOM 1636 CE2 PHE A 101 10.740 2.231 -4.507 1.00 0.00 C ATOM 1637 CZ PHE A 101 9.592 2.100 -3.760 1.00 0.00 C ATOM 0 H PHE A 101 13.411 0.567 0.239 1.00 0.00 H new ATOM 0 HA PHE A 101 13.699 0.170 -2.617 1.00 0.00 H new ATOM 0 HB2 PHE A 101 13.336 2.548 -0.858 1.00 0.00 H new ATOM 0 HB3 PHE A 101 14.096 2.722 -2.428 1.00 0.00 H new ATOM 0 HD1 PHE A 101 10.961 1.866 -0.690 1.00 0.00 H new ATOM 0 HD2 PHE A 101 12.864 2.334 -4.471 1.00 0.00 H new ATOM 0 HE1 PHE A 101 8.769 1.864 -1.804 1.00 0.00 H new ATOM 0 HE2 PHE A 101 10.680 2.333 -5.580 1.00 0.00 H new ATOM 0 HZ PHE A 101 8.628 2.101 -4.247 1.00 0.00 H new ATOM 1647 N LYS A 102 16.066 1.190 -2.765 1.00 0.00 N ATOM 1648 CA LYS A 102 17.506 1.300 -3.004 1.00 0.00 C ATOM 1649 C LYS A 102 18.238 1.863 -1.788 1.00 0.00 C ATOM 1650 O LYS A 102 19.118 1.225 -1.216 1.00 0.00 O ATOM 1651 CB LYS A 102 17.696 2.287 -4.143 1.00 0.00 C ATOM 1652 CG LYS A 102 16.929 1.948 -5.406 1.00 0.00 C ATOM 1653 CD LYS A 102 16.623 3.207 -6.197 1.00 0.00 C ATOM 1654 CE LYS A 102 17.888 3.936 -6.650 1.00 0.00 C ATOM 1655 NZ LYS A 102 17.584 5.162 -7.416 1.00 0.00 N ATOM 0 H LYS A 102 15.513 1.533 -3.551 1.00 0.00 H new ATOM 0 HA LYS A 102 17.904 0.310 -3.224 1.00 0.00 H new ATOM 0 HB2 LYS A 102 17.391 3.277 -3.803 1.00 0.00 H new ATOM 0 HB3 LYS A 102 18.758 2.345 -4.383 1.00 0.00 H new ATOM 0 HG2 LYS A 102 17.511 1.259 -6.018 1.00 0.00 H new ATOM 0 HG3 LYS A 102 16.000 1.438 -5.149 1.00 0.00 H new ATOM 0 HD2 LYS A 102 16.025 2.947 -7.070 1.00 0.00 H new ATOM 0 HD3 LYS A 102 16.020 3.878 -5.586 1.00 0.00 H new ATOM 0 HE2 LYS A 102 18.488 4.195 -5.777 1.00 0.00 H new ATOM 0 HE3 LYS A 102 18.490 3.267 -7.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 18.470 5.585 -7.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 16.977 4.924 -8.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 17.091 5.841 -6.802 1.00 0.00 H new ATOM 1669 N THR A 103 17.830 3.035 -1.396 1.00 0.00 N ATOM 1670 CA THR A 103 18.482 3.803 -0.373 1.00 0.00 C ATOM 1671 C THR A 103 17.404 4.405 0.485 1.00 0.00 C ATOM 1672 O THR A 103 16.236 4.411 0.053 1.00 0.00 O ATOM 1673 CB THR A 103 19.236 4.973 -1.054 1.00 0.00 C ATOM 1674 OG1 THR A 103 18.286 5.736 -1.832 1.00 0.00 O ATOM 1675 CG2 THR A 103 20.310 4.466 -1.992 1.00 0.00 C ATOM 0 H THR A 103 17.011 3.497 -1.790 1.00 0.00 H new ATOM 0 HA THR A 103 19.166 3.183 0.207 1.00 0.00 H new ATOM 0 HB THR A 103 19.704 5.580 -0.279 1.00 0.00 H new ATOM 0 HG1 THR A 103 18.765 6.381 -2.393 1.00 0.00 H new ATOM 0 HG21 THR A 103 20.819 5.312 -2.453 1.00 0.00 H new ATOM 0 HG22 THR A 103 21.030 3.870 -1.432 1.00 0.00 H new ATOM 0 HG23 THR A 103 19.855 3.850 -2.768 1.00 0.00 H new ATOM 1683 N PRO A 104 17.728 4.944 1.693 1.00 0.00 N ATOM 1684 CA PRO A 104 16.768 5.691 2.512 1.00 0.00 C ATOM 1685 C PRO A 104 16.228 6.923 1.816 1.00 0.00 C ATOM 1686 O PRO A 104 15.504 7.633 2.367 1.00 0.00 O ATOM 1687 CB PRO A 104 17.561 6.124 3.731 1.00 0.00 C ATOM 1688 CG PRO A 104 18.633 5.107 3.839 1.00 0.00 C ATOM 1689 CD PRO A 104 19.016 4.790 2.411 1.00 0.00 C ATOM 0 HA PRO A 104 15.902 5.069 2.739 1.00 0.00 H new ATOM 0 HB2 PRO A 104 17.972 7.126 3.605 1.00 0.00 H new ATOM 0 HB3 PRO A 104 16.939 6.145 4.626 1.00 0.00 H new ATOM 0 HG2 PRO A 104 19.485 5.490 4.401 1.00 0.00 H new ATOM 0 HG3 PRO A 104 18.282 4.217 4.360 1.00 0.00 H new ATOM 0 HD2 PRO A 104 19.776 5.474 2.033 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.418 3.781 2.313 1.00 0.00 H new ATOM 1697 N GLU A 105 16.679 7.209 0.666 1.00 0.00 N ATOM 1698 CA GLU A 105 16.102 8.271 -0.116 1.00 0.00 C ATOM 1699 C GLU A 105 14.755 7.796 -0.595 1.00 0.00 C ATOM 1700 O GLU A 105 13.719 8.317 -0.223 1.00 0.00 O ATOM 1701 CB GLU A 105 16.992 8.656 -1.299 1.00 0.00 C ATOM 1702 CG GLU A 105 16.413 9.767 -2.156 1.00 0.00 C ATOM 1703 CD GLU A 105 17.228 10.054 -3.387 1.00 0.00 C ATOM 1704 OE1 GLU A 105 18.270 10.731 -3.274 1.00 0.00 O ATOM 1705 OE2 GLU A 105 16.839 9.618 -4.494 1.00 0.00 O ATOM 0 H GLU A 105 17.459 6.727 0.219 1.00 0.00 H new ATOM 0 HA GLU A 105 16.003 9.167 0.497 1.00 0.00 H new ATOM 0 HB2 GLU A 105 17.967 8.968 -0.924 1.00 0.00 H new ATOM 0 HB3 GLU A 105 17.157 7.776 -1.921 1.00 0.00 H new ATOM 0 HG2 GLU A 105 15.400 9.496 -2.454 1.00 0.00 H new ATOM 0 HG3 GLU A 105 16.337 10.676 -1.559 1.00 0.00 H new ATOM 1712 N LEU A 106 14.811 6.670 -1.279 1.00 0.00 N ATOM 1713 CA LEU A 106 13.664 6.074 -1.892 1.00 0.00 C ATOM 1714 C LEU A 106 12.825 5.447 -0.855 1.00 0.00 C ATOM 1715 O LEU A 106 11.614 5.566 -0.843 1.00 0.00 O ATOM 1716 CB LEU A 106 14.066 5.103 -3.016 1.00 0.00 C ATOM 1717 CG LEU A 106 14.410 5.718 -4.384 1.00 0.00 C ATOM 1718 CD1 LEU A 106 13.271 6.584 -4.909 1.00 0.00 C ATOM 1719 CD2 LEU A 106 15.716 6.483 -4.347 1.00 0.00 C ATOM 0 H LEU A 106 15.673 6.144 -1.420 1.00 0.00 H new ATOM 0 HA LEU A 106 13.068 6.847 -2.377 1.00 0.00 H new ATOM 0 HB2 LEU A 106 14.929 4.531 -2.676 1.00 0.00 H new ATOM 0 HB3 LEU A 106 13.250 4.395 -3.159 1.00 0.00 H new ATOM 0 HG LEU A 106 14.543 4.891 -5.082 1.00 0.00 H new ATOM 0 HD11 LEU A 106 13.548 7.002 -5.877 1.00 0.00 H new ATOM 0 HD12 LEU A 106 12.373 5.976 -5.020 1.00 0.00 H new ATOM 0 HD13 LEU A 106 13.076 7.394 -4.206 1.00 0.00 H new ATOM 0 HD21 LEU A 106 15.921 6.901 -5.333 1.00 0.00 H new ATOM 0 HD22 LEU A 106 15.644 7.291 -3.618 1.00 0.00 H new ATOM 0 HD23 LEU A 106 16.524 5.809 -4.063 1.00 0.00 H new ATOM 1731 N ALA A 107 13.499 4.835 0.058 1.00 0.00 N ATOM 1732 CA ALA A 107 12.898 4.209 1.170 1.00 0.00 C ATOM 1733 C ALA A 107 12.253 5.264 2.054 1.00 0.00 C ATOM 1734 O ALA A 107 11.102 5.106 2.462 1.00 0.00 O ATOM 1735 CB ALA A 107 13.967 3.456 1.906 1.00 0.00 C ATOM 0 H ALA A 107 14.516 4.758 0.044 1.00 0.00 H new ATOM 0 HA ALA A 107 12.118 3.514 0.860 1.00 0.00 H new ATOM 0 HB1 ALA A 107 13.531 2.960 2.773 1.00 0.00 H new ATOM 0 HB2 ALA A 107 14.407 2.710 1.245 1.00 0.00 H new ATOM 0 HB3 ALA A 107 14.740 4.150 2.235 1.00 0.00 H new ATOM 1741 N GLU A 108 12.954 6.386 2.317 1.00 0.00 N ATOM 1742 CA GLU A 108 12.338 7.364 3.232 1.00 0.00 C ATOM 1743 C GLU A 108 11.160 8.086 2.613 1.00 0.00 C ATOM 1744 O GLU A 108 10.114 8.215 3.262 1.00 0.00 O ATOM 1745 CB GLU A 108 13.342 8.316 3.862 1.00 0.00 C ATOM 1746 CG GLU A 108 12.767 9.320 4.854 1.00 0.00 C ATOM 1747 CD GLU A 108 13.843 10.154 5.493 1.00 0.00 C ATOM 1748 OE1 GLU A 108 14.452 9.704 6.496 1.00 0.00 O ATOM 1749 OE2 GLU A 108 14.117 11.266 4.985 1.00 0.00 O ATOM 0 H GLU A 108 13.872 6.626 1.944 1.00 0.00 H new ATOM 0 HA GLU A 108 11.936 6.775 4.056 1.00 0.00 H new ATOM 0 HB2 GLU A 108 14.105 7.726 4.371 1.00 0.00 H new ATOM 0 HB3 GLU A 108 13.843 8.866 3.065 1.00 0.00 H new ATOM 0 HG2 GLU A 108 12.058 9.971 4.342 1.00 0.00 H new ATOM 0 HG3 GLU A 108 12.211 8.789 5.627 1.00 0.00 H new ATOM 1756 N GLU A 109 11.305 8.501 1.360 1.00 0.00 N ATOM 1757 CA GLU A 109 10.239 9.227 0.664 1.00 0.00 C ATOM 1758 C GLU A 109 8.963 8.421 0.622 1.00 0.00 C ATOM 1759 O GLU A 109 7.872 8.943 0.902 1.00 0.00 O ATOM 1760 CB GLU A 109 10.627 9.588 -0.768 1.00 0.00 C ATOM 1761 CG GLU A 109 11.723 10.617 -0.900 1.00 0.00 C ATOM 1762 CD GLU A 109 11.971 10.991 -2.339 1.00 0.00 C ATOM 1763 OE1 GLU A 109 11.080 11.627 -2.962 1.00 0.00 O ATOM 1764 OE2 GLU A 109 13.050 10.710 -2.865 1.00 0.00 O ATOM 0 H GLU A 109 12.146 8.350 0.803 1.00 0.00 H new ATOM 0 HA GLU A 109 10.081 10.144 1.232 1.00 0.00 H new ATOM 0 HB2 GLU A 109 10.941 8.679 -1.282 1.00 0.00 H new ATOM 0 HB3 GLU A 109 9.741 9.957 -1.285 1.00 0.00 H new ATOM 0 HG2 GLU A 109 11.454 11.509 -0.334 1.00 0.00 H new ATOM 0 HG3 GLU A 109 12.642 10.227 -0.462 1.00 0.00 H new ATOM 1771 N PHE A 110 9.091 7.156 0.306 1.00 0.00 N ATOM 1772 CA PHE A 110 8.003 6.302 0.217 1.00 0.00 C ATOM 1773 C PHE A 110 7.407 5.940 1.571 1.00 0.00 C ATOM 1774 O PHE A 110 6.216 5.833 1.669 1.00 0.00 O ATOM 1775 CB PHE A 110 8.365 5.101 -0.607 1.00 0.00 C ATOM 1776 CG PHE A 110 8.290 5.332 -2.100 1.00 0.00 C ATOM 1777 CD1 PHE A 110 9.385 5.793 -2.810 1.00 0.00 C ATOM 1778 CD2 PHE A 110 7.116 5.079 -2.790 1.00 0.00 C ATOM 1779 CE1 PHE A 110 9.316 5.999 -4.170 1.00 0.00 C ATOM 1780 CE2 PHE A 110 7.039 5.285 -4.155 1.00 0.00 C ATOM 1781 CZ PHE A 110 8.143 5.743 -4.844 1.00 0.00 C ATOM 0 H PHE A 110 9.987 6.712 0.105 1.00 0.00 H new ATOM 0 HA PHE A 110 7.201 6.835 -0.294 1.00 0.00 H new ATOM 0 HB2 PHE A 110 9.377 4.788 -0.349 1.00 0.00 H new ATOM 0 HB3 PHE A 110 7.700 4.279 -0.343 1.00 0.00 H new ATOM 0 HD1 PHE A 110 10.309 5.995 -2.289 1.00 0.00 H new ATOM 0 HD2 PHE A 110 6.250 4.716 -2.255 1.00 0.00 H new ATOM 0 HE1 PHE A 110 10.180 6.361 -4.707 1.00 0.00 H new ATOM 0 HE2 PHE A 110 6.116 5.088 -4.681 1.00 0.00 H new ATOM 0 HZ PHE A 110 8.087 5.901 -5.911 1.00 0.00 H new ATOM 1791 N LYS A 111 8.230 5.796 2.616 1.00 0.00 N ATOM 1792 CA LYS A 111 7.718 5.443 3.966 1.00 0.00 C ATOM 1793 C LYS A 111 6.703 6.462 4.424 1.00 0.00 C ATOM 1794 O LYS A 111 5.571 6.134 4.807 1.00 0.00 O ATOM 1795 CB LYS A 111 8.842 5.455 4.988 1.00 0.00 C ATOM 1796 CG LYS A 111 8.411 4.922 6.358 1.00 0.00 C ATOM 1797 CD LYS A 111 9.533 4.972 7.377 1.00 0.00 C ATOM 1798 CE LYS A 111 9.050 4.517 8.754 1.00 0.00 C ATOM 1799 NZ LYS A 111 8.020 5.424 9.328 1.00 0.00 N ATOM 0 H LYS A 111 9.242 5.914 2.566 1.00 0.00 H new ATOM 0 HA LYS A 111 7.274 4.450 3.893 1.00 0.00 H new ATOM 0 HB2 LYS A 111 9.671 4.854 4.615 1.00 0.00 H new ATOM 0 HB3 LYS A 111 9.212 6.474 5.101 1.00 0.00 H new ATOM 0 HG2 LYS A 111 7.566 5.506 6.723 1.00 0.00 H new ATOM 0 HG3 LYS A 111 8.065 3.894 6.252 1.00 0.00 H new ATOM 0 HD2 LYS A 111 10.355 4.336 7.048 1.00 0.00 H new ATOM 0 HD3 LYS A 111 9.923 5.988 7.443 1.00 0.00 H new ATOM 0 HE2 LYS A 111 8.640 3.510 8.676 1.00 0.00 H new ATOM 0 HE3 LYS A 111 9.900 4.463 9.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 7.887 5.205 10.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 8.331 6.411 9.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 7.120 5.291 8.823 1.00 0.00 H new ATOM 1813 N GLN A 112 7.144 7.687 4.367 1.00 0.00 N ATOM 1814 CA GLN A 112 6.352 8.875 4.753 1.00 0.00 C ATOM 1815 C GLN A 112 5.076 8.930 3.973 1.00 0.00 C ATOM 1816 O GLN A 112 3.981 9.138 4.517 1.00 0.00 O ATOM 1817 CB GLN A 112 7.077 10.100 4.331 1.00 0.00 C ATOM 1818 CG GLN A 112 8.496 10.242 4.834 1.00 0.00 C ATOM 1819 CD GLN A 112 8.616 10.245 6.334 1.00 0.00 C ATOM 1820 OE1 GLN A 112 7.718 10.677 7.061 1.00 0.00 O ATOM 1821 NE2 GLN A 112 9.723 9.767 6.814 1.00 0.00 N ATOM 0 H GLN A 112 8.084 7.918 4.046 1.00 0.00 H new ATOM 0 HA GLN A 112 6.180 8.816 5.828 1.00 0.00 H new ATOM 0 HB2 GLN A 112 7.095 10.129 3.242 1.00 0.00 H new ATOM 0 HB3 GLN A 112 6.507 10.967 4.664 1.00 0.00 H new ATOM 0 HG2 GLN A 112 9.096 9.425 4.433 1.00 0.00 H new ATOM 0 HG3 GLN A 112 8.918 11.168 4.444 1.00 0.00 H new ATOM 0 HE21 GLN A 112 10.444 9.418 6.183 1.00 0.00 H new ATOM 0 HE22 GLN A 112 9.872 9.740 7.823 1.00 0.00 H new ATOM 1830 N LYS A 113 5.255 8.785 2.674 1.00 0.00 N ATOM 1831 CA LYS A 113 4.207 8.874 1.711 1.00 0.00 C ATOM 1832 C LYS A 113 3.219 7.812 2.008 1.00 0.00 C ATOM 1833 O LYS A 113 2.044 8.049 2.022 1.00 0.00 O ATOM 1834 CB LYS A 113 4.814 8.647 0.338 1.00 0.00 C ATOM 1835 CG LYS A 113 3.959 9.104 -0.838 1.00 0.00 C ATOM 1836 CD LYS A 113 4.738 9.059 -2.163 1.00 0.00 C ATOM 1837 CE LYS A 113 5.926 10.036 -2.164 1.00 0.00 C ATOM 1838 NZ LYS A 113 6.639 10.057 -3.460 1.00 0.00 N ATOM 0 H LYS A 113 6.168 8.596 2.260 1.00 0.00 H new ATOM 0 HA LYS A 113 3.717 9.847 1.741 1.00 0.00 H new ATOM 0 HB2 LYS A 113 5.772 9.166 0.292 1.00 0.00 H new ATOM 0 HB3 LYS A 113 5.022 7.583 0.223 1.00 0.00 H new ATOM 0 HG2 LYS A 113 3.076 8.469 -0.914 1.00 0.00 H new ATOM 0 HG3 LYS A 113 3.607 10.120 -0.658 1.00 0.00 H new ATOM 0 HD2 LYS A 113 5.101 8.046 -2.336 1.00 0.00 H new ATOM 0 HD3 LYS A 113 4.067 9.302 -2.987 1.00 0.00 H new ATOM 0 HE2 LYS A 113 5.568 11.039 -1.933 1.00 0.00 H new ATOM 0 HE3 LYS A 113 6.623 9.757 -1.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 7.430 10.730 -3.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 7.005 9.107 -3.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 5.983 10.349 -4.212 1.00 0.00 H new ATOM 1852 N PHE A 114 3.739 6.673 2.329 1.00 0.00 N ATOM 1853 CA PHE A 114 2.918 5.476 2.603 1.00 0.00 C ATOM 1854 C PHE A 114 1.983 5.646 3.785 1.00 0.00 C ATOM 1855 O PHE A 114 0.794 5.429 3.644 1.00 0.00 O ATOM 1856 CB PHE A 114 3.753 4.199 2.751 1.00 0.00 C ATOM 1857 CG PHE A 114 3.757 3.315 1.527 1.00 0.00 C ATOM 1858 CD1 PHE A 114 4.462 3.665 0.385 1.00 0.00 C ATOM 1859 CD2 PHE A 114 3.053 2.121 1.530 1.00 0.00 C ATOM 1860 CE1 PHE A 114 4.462 2.843 -0.726 1.00 0.00 C ATOM 1861 CE2 PHE A 114 3.048 1.297 0.421 1.00 0.00 C ATOM 1862 CZ PHE A 114 3.754 1.658 -0.708 1.00 0.00 C ATOM 0 H PHE A 114 4.743 6.517 2.416 1.00 0.00 H new ATOM 0 HA PHE A 114 2.296 5.361 1.715 1.00 0.00 H new ATOM 0 HB2 PHE A 114 4.780 4.476 2.988 1.00 0.00 H new ATOM 0 HB3 PHE A 114 3.373 3.626 3.597 1.00 0.00 H new ATOM 0 HD1 PHE A 114 5.018 4.591 0.364 1.00 0.00 H new ATOM 0 HD2 PHE A 114 2.501 1.831 2.412 1.00 0.00 H new ATOM 0 HE1 PHE A 114 5.016 3.128 -1.608 1.00 0.00 H new ATOM 0 HE2 PHE A 114 2.492 0.371 0.438 1.00 0.00 H new ATOM 0 HZ PHE A 114 3.753 1.015 -1.576 1.00 0.00 H new ATOM 1872 N GLU A 115 2.500 6.050 4.937 1.00 0.00 N ATOM 1873 CA GLU A 115 1.639 6.315 6.090 1.00 0.00 C ATOM 1874 C GLU A 115 0.654 7.468 5.812 1.00 0.00 C ATOM 1875 O GLU A 115 -0.476 7.438 6.288 1.00 0.00 O ATOM 1876 CB GLU A 115 2.471 6.527 7.365 1.00 0.00 C ATOM 1877 CG GLU A 115 3.612 7.510 7.210 1.00 0.00 C ATOM 1878 CD GLU A 115 4.454 7.623 8.443 1.00 0.00 C ATOM 1879 OE1 GLU A 115 5.295 6.729 8.703 1.00 0.00 O ATOM 1880 OE2 GLU A 115 4.323 8.622 9.168 1.00 0.00 O ATOM 0 H GLU A 115 3.495 6.201 5.101 1.00 0.00 H new ATOM 0 HA GLU A 115 1.024 5.432 6.264 1.00 0.00 H new ATOM 0 HB2 GLU A 115 1.812 6.876 8.160 1.00 0.00 H new ATOM 0 HB3 GLU A 115 2.876 5.567 7.684 1.00 0.00 H new ATOM 0 HG2 GLU A 115 4.240 7.201 6.374 1.00 0.00 H new ATOM 0 HG3 GLU A 115 3.208 8.491 6.960 1.00 0.00 H new ATOM 1887 N GLU A 116 1.063 8.452 4.999 1.00 0.00 N ATOM 1888 CA GLU A 116 0.171 9.514 4.599 1.00 0.00 C ATOM 1889 C GLU A 116 -0.955 8.942 3.747 1.00 0.00 C ATOM 1890 O GLU A 116 -2.139 9.168 4.015 1.00 0.00 O ATOM 1891 CB GLU A 116 0.889 10.625 3.824 1.00 0.00 C ATOM 1892 CG GLU A 116 -0.019 11.813 3.490 1.00 0.00 C ATOM 1893 CD GLU A 116 -0.461 12.560 4.732 1.00 0.00 C ATOM 1894 OE1 GLU A 116 -1.222 12.004 5.553 1.00 0.00 O ATOM 1895 OE2 GLU A 116 -0.041 13.711 4.924 1.00 0.00 O ATOM 0 H GLU A 116 2.005 8.522 4.614 1.00 0.00 H new ATOM 0 HA GLU A 116 -0.230 9.961 5.509 1.00 0.00 H new ATOM 0 HB2 GLU A 116 1.737 10.978 4.410 1.00 0.00 H new ATOM 0 HB3 GLU A 116 1.291 10.212 2.899 1.00 0.00 H new ATOM 0 HG2 GLU A 116 0.509 12.497 2.825 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -0.896 11.457 2.950 1.00 0.00 H new ATOM 1902 N CYS A 117 -0.567 8.148 2.758 1.00 0.00 N ATOM 1903 CA CYS A 117 -1.415 7.489 1.878 1.00 0.00 C ATOM 1904 C CYS A 117 -2.356 6.576 2.598 1.00 0.00 C ATOM 1905 O CYS A 117 -3.472 6.370 2.147 1.00 0.00 O ATOM 1906 CB CYS A 117 -0.614 6.760 0.894 1.00 0.00 C ATOM 1907 SG CYS A 117 0.352 7.808 -0.226 1.00 0.00 S ATOM 0 H CYS A 117 0.418 7.960 2.569 1.00 0.00 H new ATOM 0 HA CYS A 117 -2.031 8.227 1.363 1.00 0.00 H new ATOM 0 HB2 CYS A 117 0.067 6.093 1.423 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -1.278 6.132 0.300 1.00 0.00 H new ATOM 0 HG CYS A 117 1.345 8.339 0.424 1.00 0.00 H new ATOM 1913 N GLN A 118 -1.899 6.009 3.707 1.00 0.00 N ATOM 1914 CA GLN A 118 -2.731 5.162 4.512 1.00 0.00 C ATOM 1915 C GLN A 118 -3.980 5.908 4.880 1.00 0.00 C ATOM 1916 O GLN A 118 -5.046 5.345 4.826 1.00 0.00 O ATOM 1917 CB GLN A 118 -2.038 4.770 5.798 1.00 0.00 C ATOM 1918 CG GLN A 118 -0.966 3.720 5.693 1.00 0.00 C ATOM 1919 CD GLN A 118 -0.288 3.496 7.027 1.00 0.00 C ATOM 1920 OE1 GLN A 118 -0.175 4.405 7.828 1.00 0.00 O ATOM 1921 NE2 GLN A 118 0.134 2.295 7.294 1.00 0.00 N ATOM 0 H GLN A 118 -0.950 6.129 4.060 1.00 0.00 H new ATOM 0 HA GLN A 118 -2.954 4.265 3.934 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -1.596 5.666 6.233 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -2.794 4.416 6.498 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -1.402 2.785 5.342 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -0.226 4.024 4.953 1.00 0.00 H new ATOM 0 HE21 GLN A 118 0.027 1.552 6.604 1.00 0.00 H new ATOM 0 HE22 GLN A 118 0.572 2.097 8.193 1.00 0.00 H new ATOM 1930 N ARG A 119 -3.849 7.141 5.353 1.00 0.00 N ATOM 1931 CA ARG A 119 -5.047 7.945 5.579 1.00 0.00 C ATOM 1932 C ARG A 119 -5.686 8.433 4.285 1.00 0.00 C ATOM 1933 O ARG A 119 -6.882 8.295 4.034 1.00 0.00 O ATOM 1934 CB ARG A 119 -4.806 9.171 6.489 1.00 0.00 C ATOM 1935 CG ARG A 119 -4.394 8.913 7.936 1.00 0.00 C ATOM 1936 CD ARG A 119 -2.917 8.573 8.084 1.00 0.00 C ATOM 1937 NE ARG A 119 -2.034 9.687 7.675 1.00 0.00 N ATOM 1938 CZ ARG A 119 -0.836 9.961 8.231 1.00 0.00 C ATOM 1939 NH1 ARG A 119 -0.372 9.213 9.224 1.00 0.00 N ATOM 1940 NH2 ARG A 119 -0.117 10.972 7.779 1.00 0.00 N ATOM 0 H ARG A 119 -2.964 7.594 5.581 1.00 0.00 H new ATOM 0 HA ARG A 119 -5.726 7.259 6.085 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -4.034 9.786 6.026 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -5.721 9.764 6.502 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -4.620 9.795 8.535 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -4.991 8.094 8.337 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -2.710 8.312 9.122 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -2.688 7.693 7.483 1.00 0.00 H new ATOM 0 HE ARG A 119 -2.354 10.291 6.918 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -0.922 8.427 9.570 1.00 0.00 H new ATOM 0 HH12 ARG A 119 0.535 9.424 9.641 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -0.468 11.544 7.011 1.00 0.00 H new ATOM 0 HH22 ARG A 119 0.789 11.181 8.198 1.00 0.00 H new ATOM 1954 N LEU A 120 -4.857 8.975 3.517 1.00 0.00 N ATOM 1955 CA LEU A 120 -5.216 9.746 2.343 1.00 0.00 C ATOM 1956 C LEU A 120 -5.654 9.049 1.098 1.00 0.00 C ATOM 1957 O LEU A 120 -6.733 9.351 0.617 1.00 0.00 O ATOM 1958 CB LEU A 120 -4.243 10.903 2.064 1.00 0.00 C ATOM 1959 CG LEU A 120 -4.554 12.245 2.736 1.00 0.00 C ATOM 1960 CD1 LEU A 120 -4.562 12.116 4.236 1.00 0.00 C ATOM 1961 CD2 LEU A 120 -3.556 13.303 2.296 1.00 0.00 C ATOM 0 H LEU A 120 -3.850 8.913 3.664 1.00 0.00 H new ATOM 0 HA LEU A 120 -6.172 10.147 2.678 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -3.246 10.591 2.374 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -4.206 11.063 0.986 1.00 0.00 H new ATOM 0 HG LEU A 120 -5.551 12.554 2.423 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -4.786 13.085 4.683 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -5.322 11.394 4.535 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -3.584 11.776 4.577 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -3.791 14.250 2.782 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -2.549 12.992 2.575 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -3.611 13.427 1.214 1.00 0.00 H new ATOM 1973 N LEU A 121 -4.924 8.037 0.661 1.00 0.00 N ATOM 1974 CA LEU A 121 -5.152 7.400 -0.658 1.00 0.00 C ATOM 1975 C LEU A 121 -6.519 6.766 -0.762 1.00 0.00 C ATOM 1976 O LEU A 121 -7.069 6.530 -1.849 1.00 0.00 O ATOM 1977 CB LEU A 121 -4.008 6.455 -1.081 1.00 0.00 C ATOM 1978 CG LEU A 121 -2.742 7.103 -1.679 1.00 0.00 C ATOM 1979 CD1 LEU A 121 -1.823 6.038 -2.268 1.00 0.00 C ATOM 1980 CD2 LEU A 121 -3.086 8.134 -2.745 1.00 0.00 C ATOM 0 H LEU A 121 -4.158 7.624 1.194 1.00 0.00 H new ATOM 0 HA LEU A 121 -5.139 8.207 -1.390 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -3.710 5.874 -0.208 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -4.405 5.751 -1.812 1.00 0.00 H new ATOM 0 HG LEU A 121 -2.226 7.616 -0.867 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -0.935 6.514 -2.685 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -1.527 5.340 -1.485 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -2.349 5.498 -3.055 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -2.168 8.568 -3.142 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -3.638 7.653 -3.552 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -3.699 8.921 -2.306 1.00 0.00 H new ATOM 1992 N LEU A 122 -7.023 6.495 0.358 1.00 0.00 N ATOM 1993 CA LEU A 122 -8.318 5.936 0.573 1.00 0.00 C ATOM 1994 C LEU A 122 -9.480 6.855 0.201 1.00 0.00 C ATOM 1995 O LEU A 122 -10.439 6.452 -0.466 1.00 0.00 O ATOM 1996 CB LEU A 122 -8.412 5.948 2.020 1.00 0.00 C ATOM 1997 CG LEU A 122 -7.536 4.986 2.829 1.00 0.00 C ATOM 1998 CD1 LEU A 122 -8.001 4.983 4.276 1.00 0.00 C ATOM 1999 CD2 LEU A 122 -7.573 3.571 2.252 1.00 0.00 C ATOM 0 H LEU A 122 -6.521 6.663 1.230 1.00 0.00 H new ATOM 0 HA LEU A 122 -8.394 5.005 0.012 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -8.186 6.960 2.356 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -9.451 5.748 2.284 1.00 0.00 H new ATOM 0 HG LEU A 122 -6.503 5.329 2.776 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -7.381 4.300 4.856 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -7.916 5.989 4.688 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -9.040 4.658 4.323 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -6.940 2.917 2.852 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -8.597 3.199 2.267 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -7.208 3.587 1.225 1.00 0.00 H new ATOM 2011 N ASP A 123 -9.350 8.096 0.587 1.00 0.00 N ATOM 2012 CA ASP A 123 -10.489 9.011 0.600 1.00 0.00 C ATOM 2013 C ASP A 123 -10.521 9.804 -0.633 1.00 0.00 C ATOM 2014 O ASP A 123 -11.583 10.198 -1.140 1.00 0.00 O ATOM 2015 CB ASP A 123 -10.338 9.956 1.774 1.00 0.00 C ATOM 2016 CG ASP A 123 -11.595 10.726 2.071 1.00 0.00 C ATOM 2017 OD1 ASP A 123 -12.518 10.146 2.674 1.00 0.00 O ATOM 2018 OD2 ASP A 123 -11.683 11.915 1.716 1.00 0.00 O ATOM 0 H ASP A 123 -8.471 8.509 0.899 1.00 0.00 H new ATOM 0 HA ASP A 123 -11.410 8.433 0.680 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -10.050 9.387 2.657 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -9.529 10.657 1.568 1.00 0.00 H new ATOM 2023 N ILE A 124 -9.370 9.999 -1.124 1.00 0.00 N ATOM 2024 CA ILE A 124 -9.132 10.802 -2.245 1.00 0.00 C ATOM 2025 C ILE A 124 -9.658 10.146 -3.534 1.00 0.00 C ATOM 2026 O ILE A 124 -9.424 8.956 -3.782 1.00 0.00 O ATOM 2027 CB ILE A 124 -7.617 11.167 -2.293 1.00 0.00 C ATOM 2028 CG1 ILE A 124 -6.690 9.921 -2.215 1.00 0.00 C ATOM 2029 CG2 ILE A 124 -7.288 12.113 -1.147 1.00 0.00 C ATOM 2030 CD1 ILE A 124 -6.478 9.192 -3.531 1.00 0.00 C ATOM 0 H ILE A 124 -8.524 9.582 -0.736 1.00 0.00 H new ATOM 0 HA ILE A 124 -9.691 11.734 -2.163 1.00 0.00 H new ATOM 0 HB ILE A 124 -7.433 11.645 -3.255 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -5.719 10.233 -1.830 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -7.109 9.220 -1.493 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -6.229 12.369 -1.179 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -7.884 13.021 -1.242 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -7.515 11.628 -0.198 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -5.818 8.339 -3.372 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -7.438 8.842 -3.912 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -6.026 9.871 -4.254 1.00 0.00 H new ATOM 2042 N PRO A 125 -10.511 10.855 -4.277 1.00 0.00 N ATOM 2043 CA PRO A 125 -10.993 10.390 -5.555 1.00 0.00 C ATOM 2044 C PRO A 125 -9.897 10.436 -6.599 1.00 0.00 C ATOM 2045 O PRO A 125 -9.177 11.443 -6.720 1.00 0.00 O ATOM 2046 CB PRO A 125 -12.118 11.364 -5.924 1.00 0.00 C ATOM 2047 CG PRO A 125 -12.371 12.150 -4.689 1.00 0.00 C ATOM 2048 CD PRO A 125 -11.087 12.158 -3.937 1.00 0.00 C ATOM 0 HA PRO A 125 -11.332 9.355 -5.509 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -11.824 12.012 -6.750 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -13.013 10.830 -6.242 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -12.688 13.165 -4.930 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -13.167 11.700 -4.096 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -10.441 12.980 -4.246 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -11.246 12.264 -2.864 1.00 0.00 H new ATOM 2056 N LEU A 126 -9.757 9.386 -7.319 1.00 0.00 N ATOM 2057 CA LEU A 126 -8.850 9.330 -8.402 1.00 0.00 C ATOM 2058 C LEU A 126 -9.613 8.863 -9.590 1.00 0.00 C ATOM 2059 O LEU A 126 -10.548 8.071 -9.445 1.00 0.00 O ATOM 2060 CB LEU A 126 -7.724 8.378 -8.110 1.00 0.00 C ATOM 2061 CG LEU A 126 -6.598 8.381 -9.138 1.00 0.00 C ATOM 2062 CD1 LEU A 126 -5.989 9.777 -9.288 1.00 0.00 C ATOM 2063 CD2 LEU A 126 -5.561 7.440 -8.700 1.00 0.00 C ATOM 0 H LEU A 126 -10.281 8.524 -7.169 1.00 0.00 H new ATOM 0 HA LEU A 126 -8.411 10.312 -8.577 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -7.305 8.622 -7.134 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -8.130 7.369 -8.040 1.00 0.00 H new ATOM 0 HG LEU A 126 -7.003 8.084 -10.105 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -5.189 9.747 -10.028 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -6.759 10.477 -9.614 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -5.585 10.103 -8.329 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -4.748 7.431 -9.426 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -5.176 7.749 -7.728 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -5.987 6.440 -8.620 1.00 0.00 H new ATOM 2075 N GLN A 127 -9.296 9.364 -10.732 1.00 0.00 N ATOM 2076 CA GLN A 127 -9.974 8.946 -11.918 1.00 0.00 C ATOM 2077 C GLN A 127 -8.997 8.218 -12.800 1.00 0.00 C ATOM 2078 O GLN A 127 -7.832 8.060 -12.433 1.00 0.00 O ATOM 2079 CB GLN A 127 -10.584 10.131 -12.657 1.00 0.00 C ATOM 2080 CG GLN A 127 -11.563 10.945 -11.833 1.00 0.00 C ATOM 2081 CD GLN A 127 -12.259 11.995 -12.662 1.00 0.00 C ATOM 2082 OE1 GLN A 127 -12.477 11.809 -13.867 1.00 0.00 O ATOM 2083 NE2 GLN A 127 -12.602 13.097 -12.053 1.00 0.00 N ATOM 0 H GLN A 127 -8.570 10.066 -10.875 1.00 0.00 H new ATOM 0 HA GLN A 127 -10.794 8.282 -11.645 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -9.781 10.785 -12.996 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -11.094 9.765 -13.548 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -12.305 10.281 -11.391 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -11.034 11.425 -11.010 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -12.405 13.213 -11.059 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -13.067 13.843 -12.571 1.00 0.00 H new ATOM 2092 N THR A 128 -9.441 7.792 -13.941 1.00 0.00 N ATOM 2093 CA THR A 128 -8.587 7.103 -14.852 1.00 0.00 C ATOM 2094 C THR A 128 -7.712 8.144 -15.558 1.00 0.00 C ATOM 2095 O THR A 128 -8.228 9.153 -16.051 1.00 0.00 O ATOM 2096 CB THR A 128 -9.433 6.348 -15.881 1.00 0.00 C ATOM 2097 OG1 THR A 128 -10.548 5.753 -15.200 1.00 0.00 O ATOM 2098 CG2 THR A 128 -8.611 5.244 -16.527 1.00 0.00 C ATOM 0 H THR A 128 -10.401 7.912 -14.265 1.00 0.00 H new ATOM 0 HA THR A 128 -7.963 6.384 -14.321 1.00 0.00 H new ATOM 0 HB THR A 128 -9.771 7.040 -16.652 1.00 0.00 H new ATOM 0 HG1 THR A 128 -11.103 5.266 -15.844 1.00 0.00 H new ATOM 0 HG21 THR A 128 -9.223 4.714 -17.257 1.00 0.00 H new ATOM 0 HG22 THR A 128 -7.746 5.680 -17.027 1.00 0.00 H new ATOM 0 HG23 THR A 128 -8.274 4.546 -15.761 1.00 0.00 H new ATOM 2106 N PRO A 129 -6.394 7.963 -15.555 1.00 0.00 N ATOM 2107 CA PRO A 129 -5.471 8.910 -16.163 1.00 0.00 C ATOM 2108 C PRO A 129 -5.540 8.938 -17.692 1.00 0.00 C ATOM 2109 O PRO A 129 -5.930 7.952 -18.342 1.00 0.00 O ATOM 2110 CB PRO A 129 -4.105 8.438 -15.703 1.00 0.00 C ATOM 2111 CG PRO A 129 -4.279 7.000 -15.423 1.00 0.00 C ATOM 2112 CD PRO A 129 -5.685 6.831 -14.938 1.00 0.00 C ATOM 0 HA PRO A 129 -5.710 9.930 -15.863 1.00 0.00 H new ATOM 0 HB2 PRO A 129 -3.350 8.603 -16.471 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -3.778 8.978 -14.814 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -4.103 6.406 -16.320 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -3.566 6.662 -14.672 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -6.106 5.875 -15.249 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -5.742 6.865 -13.850 1.00 0.00 H new ATOM 2120 N LYS A 130 -5.180 10.067 -18.238 1.00 0.00 N ATOM 2121 CA LYS A 130 -5.135 10.303 -19.659 1.00 0.00 C ATOM 2122 C LYS A 130 -3.854 11.069 -19.924 1.00 0.00 C ATOM 2123 O LYS A 130 -2.823 10.436 -20.177 1.00 0.00 O ATOM 2124 CB LYS A 130 -6.364 11.133 -20.115 1.00 0.00 C ATOM 2125 CG LYS A 130 -6.407 11.474 -21.613 1.00 0.00 C ATOM 2126 CD LYS A 130 -6.683 10.262 -22.513 1.00 0.00 C ATOM 2127 CE LYS A 130 -8.184 9.903 -22.634 1.00 0.00 C ATOM 2128 NZ LYS A 130 -8.821 9.469 -21.365 1.00 0.00 N ATOM 2129 OXT LYS A 130 -3.857 12.314 -19.777 1.00 0.00 O ATOM 0 H LYS A 130 -4.899 10.879 -17.688 1.00 0.00 H new ATOM 0 HA LYS A 130 -5.158 9.365 -20.213 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -7.269 10.582 -19.858 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -6.385 12.063 -19.547 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -7.178 12.225 -21.784 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -5.456 11.921 -21.902 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -6.285 10.462 -23.508 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -6.143 9.400 -22.121 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -8.722 10.770 -23.017 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -8.295 9.108 -23.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -9.622 8.840 -21.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -8.125 8.961 -20.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -9.164 10.302 -20.846 1.00 0.00 H new TER 2143 LYS A 130