USER MOD reduce.3.24.130724 H: found=0, std=0, add=1318, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1314 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 143 HIS : no HD1:sc= -0.143 X(o=-0.18,f=0.019) USER MOD Set 1.2: A 144 GLN : amide:sc= -0.0343 X(o=-0.18,f=0.019) USER MOD Set 2.1: A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 100 TYR OH : rot 180:sc= 0 USER MOD Set 2.3: A 110 GLN : amide:sc= -0.824 X(o=-0.82,f=-0.97) USER MOD Set 3.1: A 22 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 62 TYR OH : rot 180:sc= -2.44! USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.258 USER MOD Single : A 9 SER OG : rot 54:sc= 0.145 USER MOD Single : A -1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 154:sc= 0 (180deg=-0.248) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.44 USER MOD Single : A 29 GLN : amide:sc= -0.753 K(o=-0.75,f=-2!) USER MOD Single : A 34 GLN : amide:sc=-0.000633 X(o=-0.00063,f=-0.21) USER MOD Single : A 35 LYS NZ :NH3+ -131:sc= 0 (180deg=-0.276) USER MOD Single : A 37 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.00584) USER MOD Single : A 38 SER OG : rot 60:sc= 0.807 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot -140:sc= -1.01 USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 GLN : amide:sc= -3.57 K(o=-3.6,f=-7!) USER MOD Single : A 53 MET CE :methyl 170:sc= -2.57 (180deg=-2.83) USER MOD Single : A 54 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 56 HIS : no HE2:sc= -2.02! C(o=-2!,f=-4.2!) USER MOD Single : A 57 HIS : no HD1:sc= -4.38! C(o=-4.4!,f=-5.9!) USER MOD Single : A 58 GLN : amide:sc= -0.123 X(o=-0.12,f=-0.44) USER MOD Single : A 60 SER OG : rot -49:sc= 0.972 USER MOD Single : A 64 TYR OH : rot 30:sc= 0 USER MOD Single : A 65 THR OG1 : rot 98:sc= 0.908 USER MOD Single : A 67 TYR OH : rot 165:sc= -0.103 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ -122:sc= -0.023 (180deg=-0.209) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.326) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 TYR OH : rot 159:sc= 0.514 USER MOD Single : A 89 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.157) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0.0659 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 ASN : amide:sc=-0.00916 K(o=-0.0092,f=-0.71) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0.00314 USER MOD Single : A 115 ASN : amide:sc= -0.0998 X(o=-0.1,f=-0.47) USER MOD Single : A 116 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 87:sc= -2.21 USER MOD Single : A 128 GLN : amide:sc= -0.177 K(o=-0.18,f=-1.4!) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 43:sc= 0.0308 USER MOD Single : A 139 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 147 HIS : no HD1:sc= -1.16 K(o=-1.2,f=-0.52) USER MOD Single : A 155 SER OG : rot 180:sc= 0.281 USER MOD Single : A 156 THR OG1 : rot 180:sc= 0.0174 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 -28.257 -5.743 -10.599 1.00 0.00 N ATOM 2 CA GLY A -1 -28.800 -6.954 -9.920 1.00 0.00 C ATOM 3 C GLY A -1 -27.641 -7.838 -9.439 1.00 0.00 C ATOM 4 O GLY A -1 -26.701 -7.353 -8.838 1.00 0.00 O ATOM 0 H1 GLY A -1 -29.044 -5.145 -10.924 1.00 0.00 H new ATOM 0 H2 GLY A -1 -27.667 -5.206 -9.932 1.00 0.00 H new ATOM 0 H3 GLY A -1 -27.681 -6.032 -11.415 1.00 0.00 H new ATOM 0 HA2 GLY A -1 -29.422 -6.661 -9.074 1.00 0.00 H new ATOM 0 HA3 GLY A -1 -29.437 -7.513 -10.606 1.00 0.00 H new ATOM 10 N GLY A 0 -27.696 -9.130 -9.697 1.00 0.00 N ATOM 11 CA GLY A 0 -26.592 -10.029 -9.249 1.00 0.00 C ATOM 12 C GLY A 0 -26.548 -10.061 -7.715 1.00 0.00 C ATOM 13 O GLY A 0 -26.894 -9.094 -7.064 1.00 0.00 O ATOM 0 H GLY A 0 -28.456 -9.592 -10.196 1.00 0.00 H new ATOM 0 HA2 GLY A 0 -26.746 -11.035 -9.640 1.00 0.00 H new ATOM 0 HA3 GLY A 0 -25.639 -9.676 -9.643 1.00 0.00 H new ATOM 17 N SER A 1 -26.125 -11.164 -7.128 1.00 0.00 N ATOM 18 CA SER A 1 -26.065 -11.241 -5.637 1.00 0.00 C ATOM 19 C SER A 1 -24.659 -11.667 -5.183 1.00 0.00 C ATOM 20 O SER A 1 -24.017 -12.454 -5.849 1.00 0.00 O ATOM 21 CB SER A 1 -27.095 -12.302 -5.255 1.00 0.00 C ATOM 22 OG SER A 1 -28.351 -11.678 -5.027 1.00 0.00 O ATOM 0 H SER A 1 -25.822 -12.005 -7.619 1.00 0.00 H new ATOM 0 HA SER A 1 -26.273 -10.281 -5.165 1.00 0.00 H new ATOM 0 HB2 SER A 1 -27.183 -13.042 -6.050 1.00 0.00 H new ATOM 0 HB3 SER A 1 -26.772 -12.833 -4.359 1.00 0.00 H new ATOM 0 HG SER A 1 -29.014 -12.357 -4.783 1.00 0.00 H new ATOM 28 N PRO A 2 -24.215 -11.136 -4.061 1.00 0.00 N ATOM 29 CA PRO A 2 -22.868 -11.490 -3.548 1.00 0.00 C ATOM 30 C PRO A 2 -22.875 -12.913 -2.966 1.00 0.00 C ATOM 31 O PRO A 2 -23.843 -13.637 -3.108 1.00 0.00 O ATOM 32 CB PRO A 2 -22.616 -10.457 -2.453 1.00 0.00 C ATOM 33 CG PRO A 2 -23.974 -10.025 -2.002 1.00 0.00 C ATOM 34 CD PRO A 2 -24.902 -10.176 -3.180 1.00 0.00 C ATOM 0 HA PRO A 2 -22.099 -11.479 -4.320 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -22.046 -10.887 -1.630 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -22.040 -9.613 -2.833 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -24.313 -10.634 -1.164 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -23.954 -8.991 -1.657 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -25.879 -10.547 -2.872 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -25.067 -9.223 -3.682 1.00 0.00 H new ATOM 42 N ARG A 3 -21.807 -13.322 -2.309 1.00 0.00 N ATOM 43 CA ARG A 3 -21.771 -14.699 -1.724 1.00 0.00 C ATOM 44 C ARG A 3 -20.854 -14.739 -0.487 1.00 0.00 C ATOM 45 O ARG A 3 -19.776 -14.174 -0.496 1.00 0.00 O ATOM 46 CB ARG A 3 -21.222 -15.597 -2.841 1.00 0.00 C ATOM 47 CG ARG A 3 -19.808 -15.145 -3.244 1.00 0.00 C ATOM 48 CD ARG A 3 -18.785 -16.202 -2.816 1.00 0.00 C ATOM 49 NE ARG A 3 -17.709 -16.139 -3.853 1.00 0.00 N ATOM 50 CZ ARG A 3 -16.818 -15.160 -3.861 1.00 0.00 C ATOM 51 NH1 ARG A 3 -16.842 -14.203 -2.962 1.00 0.00 N ATOM 52 NH2 ARG A 3 -15.890 -15.140 -4.783 1.00 0.00 N ATOM 0 H ARG A 3 -20.968 -12.763 -2.156 1.00 0.00 H new ATOM 0 HA ARG A 3 -22.755 -15.026 -1.390 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -21.198 -16.633 -2.505 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -21.884 -15.558 -3.706 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -19.758 -14.993 -4.322 1.00 0.00 H new ATOM 0 HG3 ARG A 3 -19.574 -14.189 -2.776 1.00 0.00 H new ATOM 0 HD2 ARG A 3 -18.389 -15.989 -1.823 1.00 0.00 H new ATOM 0 HD3 ARG A 3 -19.236 -17.194 -2.774 1.00 0.00 H new ATOM 0 HE ARG A 3 -17.661 -16.865 -4.568 1.00 0.00 H new ATOM 0 HH11 ARG A 3 -17.559 -14.203 -2.236 1.00 0.00 H new ATOM 0 HH12 ARG A 3 -16.144 -13.460 -2.990 1.00 0.00 H new ATOM 0 HH21 ARG A 3 -15.857 -15.875 -5.489 1.00 0.00 H new ATOM 0 HH22 ARG A 3 -15.200 -14.389 -4.796 1.00 0.00 H new ATOM 66 N ILE A 4 -21.271 -15.398 0.575 1.00 0.00 N ATOM 67 CA ILE A 4 -20.417 -15.465 1.799 1.00 0.00 C ATOM 68 C ILE A 4 -20.022 -16.923 2.088 1.00 0.00 C ATOM 69 O ILE A 4 -20.788 -17.834 1.839 1.00 0.00 O ATOM 70 CB ILE A 4 -21.290 -14.906 2.928 1.00 0.00 C ATOM 71 CG1 ILE A 4 -21.697 -13.466 2.599 1.00 0.00 C ATOM 72 CG2 ILE A 4 -20.505 -14.919 4.243 1.00 0.00 C ATOM 73 CD1 ILE A 4 -22.743 -12.988 3.608 1.00 0.00 C ATOM 0 H ILE A 4 -22.163 -15.889 0.642 1.00 0.00 H new ATOM 0 HA ILE A 4 -19.491 -14.901 1.689 1.00 0.00 H new ATOM 0 HB ILE A 4 -22.182 -15.525 3.029 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -20.824 -12.814 2.628 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -22.101 -13.413 1.588 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -21.129 -14.521 5.043 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -20.215 -15.942 4.484 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -19.611 -14.304 4.139 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -23.033 -11.964 3.374 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -23.620 -13.634 3.557 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -22.323 -13.026 4.613 1.00 0.00 H new ATOM 85 N LYS A 5 -18.833 -17.153 2.610 1.00 0.00 N ATOM 86 CA LYS A 5 -18.404 -18.552 2.907 1.00 0.00 C ATOM 87 C LYS A 5 -17.982 -18.675 4.380 1.00 0.00 C ATOM 88 O LYS A 5 -17.625 -17.697 5.008 1.00 0.00 O ATOM 89 CB LYS A 5 -17.211 -18.806 1.985 1.00 0.00 C ATOM 90 CG LYS A 5 -17.684 -19.531 0.722 1.00 0.00 C ATOM 91 CD LYS A 5 -16.579 -20.466 0.226 1.00 0.00 C ATOM 92 CE LYS A 5 -17.205 -21.646 -0.519 1.00 0.00 C ATOM 93 NZ LYS A 5 -16.194 -22.736 -0.429 1.00 0.00 N ATOM 0 H LYS A 5 -18.149 -16.432 2.840 1.00 0.00 H new ATOM 0 HA LYS A 5 -19.205 -19.273 2.744 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -16.737 -17.861 1.718 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -16.461 -19.405 2.501 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -18.589 -20.101 0.934 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -17.937 -18.807 -0.052 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -15.899 -19.926 -0.433 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -15.988 -20.826 1.068 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -18.149 -21.944 -0.064 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -17.418 -21.390 -1.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -16.551 -23.582 -0.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -15.308 -22.425 -0.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -16.016 -22.963 0.570 1.00 0.00 H new ATOM 107 N THR A 6 -18.017 -19.871 4.943 1.00 0.00 N ATOM 108 CA THR A 6 -17.617 -20.052 6.378 1.00 0.00 C ATOM 109 C THR A 6 -18.395 -19.084 7.287 1.00 0.00 C ATOM 110 O THR A 6 -19.278 -18.381 6.833 1.00 0.00 O ATOM 111 CB THR A 6 -16.112 -19.744 6.426 1.00 0.00 C ATOM 112 OG1 THR A 6 -15.535 -19.896 5.122 1.00 0.00 O ATOM 113 CG2 THR A 6 -15.425 -20.688 7.421 1.00 0.00 C ATOM 0 H THR A 6 -18.306 -20.725 4.467 1.00 0.00 H new ATOM 0 HA THR A 6 -17.837 -21.059 6.732 1.00 0.00 H new ATOM 0 HB THR A 6 -15.968 -18.714 6.752 1.00 0.00 H new ATOM 0 HG1 THR A 6 -14.577 -19.696 5.163 1.00 0.00 H new ATOM 0 HG21 THR A 6 -14.358 -20.468 7.454 1.00 0.00 H new ATOM 0 HG22 THR A 6 -15.855 -20.547 8.413 1.00 0.00 H new ATOM 0 HG23 THR A 6 -15.573 -21.721 7.105 1.00 0.00 H new ATOM 121 N ARG A 7 -18.077 -19.041 8.565 1.00 0.00 N ATOM 122 CA ARG A 7 -18.805 -18.118 9.487 1.00 0.00 C ATOM 123 C ARG A 7 -17.824 -17.482 10.485 1.00 0.00 C ATOM 124 O ARG A 7 -17.668 -17.960 11.593 1.00 0.00 O ATOM 125 CB ARG A 7 -19.814 -19.004 10.219 1.00 0.00 C ATOM 126 CG ARG A 7 -20.883 -19.480 9.234 1.00 0.00 C ATOM 127 CD ARG A 7 -22.186 -19.755 9.988 1.00 0.00 C ATOM 128 NE ARG A 7 -23.272 -19.459 9.003 1.00 0.00 N ATOM 129 CZ ARG A 7 -23.537 -20.286 8.003 1.00 0.00 C ATOM 130 NH1 ARG A 7 -22.860 -21.399 7.836 1.00 0.00 N ATOM 131 NH2 ARG A 7 -24.494 -19.993 7.161 1.00 0.00 N ATOM 0 H ARG A 7 -17.348 -19.604 9.002 1.00 0.00 H new ATOM 0 HA ARG A 7 -19.291 -17.301 8.954 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -19.307 -19.860 10.664 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -20.277 -18.449 11.035 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -21.047 -18.724 8.466 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -20.547 -20.384 8.725 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -22.234 -20.789 10.330 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -22.272 -19.123 10.872 1.00 0.00 H new ATOM 0 HE ARG A 7 -23.819 -18.604 9.103 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -22.111 -21.643 8.484 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -23.083 -22.020 7.058 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -25.030 -19.133 7.277 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -24.704 -20.625 6.388 1.00 0.00 H new ATOM 145 N ARG A 8 -17.161 -16.407 10.106 1.00 0.00 N ATOM 146 CA ARG A 8 -16.197 -15.754 11.042 1.00 0.00 C ATOM 147 C ARG A 8 -16.583 -14.282 11.261 1.00 0.00 C ATOM 148 O ARG A 8 -15.763 -13.394 11.110 1.00 0.00 O ATOM 149 CB ARG A 8 -14.838 -15.857 10.347 1.00 0.00 C ATOM 150 CG ARG A 8 -13.742 -16.049 11.398 1.00 0.00 C ATOM 151 CD ARG A 8 -12.458 -15.360 10.929 1.00 0.00 C ATOM 152 NE ARG A 8 -11.827 -14.831 12.176 1.00 0.00 N ATOM 153 CZ ARG A 8 -12.303 -13.757 12.787 1.00 0.00 C ATOM 154 NH1 ARG A 8 -13.350 -13.113 12.324 1.00 0.00 N ATOM 155 NH2 ARG A 8 -11.723 -13.322 13.876 1.00 0.00 N ATOM 0 H ARG A 8 -17.249 -15.961 9.193 1.00 0.00 H new ATOM 0 HA ARG A 8 -16.189 -16.228 12.024 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -14.837 -16.693 9.648 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -14.645 -14.955 9.765 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -14.062 -15.633 12.353 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -13.559 -17.112 11.558 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -11.797 -16.061 10.419 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -12.675 -14.557 10.225 1.00 0.00 H new ATOM 0 HE ARG A 8 -11.013 -15.307 12.565 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -13.815 -13.438 11.476 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -13.698 -12.288 12.812 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -10.909 -13.810 14.250 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -12.085 -12.495 14.351 1.00 0.00 H new ATOM 169 N SER A 9 -17.823 -14.012 11.617 1.00 0.00 N ATOM 170 CA SER A 9 -18.246 -12.596 11.844 1.00 0.00 C ATOM 171 C SER A 9 -18.634 -12.391 13.317 1.00 0.00 C ATOM 172 O SER A 9 -19.745 -12.685 13.713 1.00 0.00 O ATOM 173 CB SER A 9 -19.459 -12.392 10.937 1.00 0.00 C ATOM 174 OG SER A 9 -20.288 -13.546 10.993 1.00 0.00 O ATOM 0 H SER A 9 -18.553 -14.711 11.758 1.00 0.00 H new ATOM 0 HA SER A 9 -17.449 -11.886 11.622 1.00 0.00 H new ATOM 0 HB2 SER A 9 -20.019 -11.512 11.253 1.00 0.00 H new ATOM 0 HB3 SER A 9 -19.135 -12.213 9.912 1.00 0.00 H new ATOM 0 HG SER A 9 -20.512 -13.743 11.927 1.00 0.00 H new ATOM 180 N LYS A 10 -17.728 -11.890 14.133 1.00 0.00 N ATOM 181 CA LYS A 10 -18.056 -11.674 15.575 1.00 0.00 C ATOM 182 C LYS A 10 -17.606 -10.274 16.021 1.00 0.00 C ATOM 183 O LYS A 10 -16.952 -9.574 15.271 1.00 0.00 O ATOM 184 CB LYS A 10 -17.270 -12.754 16.323 1.00 0.00 C ATOM 185 CG LYS A 10 -18.204 -13.911 16.687 1.00 0.00 C ATOM 186 CD LYS A 10 -17.766 -14.519 18.022 1.00 0.00 C ATOM 187 CE LYS A 10 -18.331 -15.935 18.148 1.00 0.00 C ATOM 188 NZ LYS A 10 -19.619 -15.773 18.879 1.00 0.00 N ATOM 0 H LYS A 10 -16.782 -11.624 13.859 1.00 0.00 H new ATOM 0 HA LYS A 10 -19.127 -11.738 15.769 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -16.450 -13.117 15.703 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -16.825 -12.335 17.226 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -19.232 -13.555 16.757 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -18.182 -14.670 15.905 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -16.678 -14.543 18.083 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -18.118 -13.901 18.848 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -18.487 -16.386 17.168 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -17.647 -16.586 18.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -20.067 -16.703 19.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -19.438 -15.348 19.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -20.252 -15.155 18.333 1.00 0.00 H new ATOM 202 N PRO A 11 -17.966 -9.901 17.231 1.00 0.00 N ATOM 203 CA PRO A 11 -17.579 -8.567 17.754 1.00 0.00 C ATOM 204 C PRO A 11 -16.078 -8.521 18.062 1.00 0.00 C ATOM 205 O PRO A 11 -15.442 -9.547 18.225 1.00 0.00 O ATOM 206 CB PRO A 11 -18.401 -8.426 19.033 1.00 0.00 C ATOM 207 CG PRO A 11 -18.689 -9.827 19.464 1.00 0.00 C ATOM 208 CD PRO A 11 -18.754 -10.665 18.216 1.00 0.00 C ATOM 0 HA PRO A 11 -17.766 -7.762 17.043 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -17.848 -7.883 19.800 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -19.322 -7.872 18.851 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -17.911 -10.192 20.134 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -19.630 -9.877 20.012 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -18.334 -11.658 18.379 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -19.782 -10.805 17.882 1.00 0.00 H new ATOM 216 N ALA A 12 -15.504 -7.339 18.147 1.00 0.00 N ATOM 217 CA ALA A 12 -14.034 -7.242 18.453 1.00 0.00 C ATOM 218 C ALA A 12 -13.813 -7.316 19.975 1.00 0.00 C ATOM 219 O ALA A 12 -14.629 -6.829 20.733 1.00 0.00 O ATOM 220 CB ALA A 12 -13.563 -5.885 17.902 1.00 0.00 C ATOM 0 H ALA A 12 -15.982 -6.447 18.020 1.00 0.00 H new ATOM 0 HA ALA A 12 -13.474 -8.060 17.999 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.498 -5.763 18.098 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -13.741 -5.847 16.827 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -14.116 -5.082 18.390 1.00 0.00 H new ATOM 226 N PRO A 13 -12.721 -7.928 20.381 1.00 0.00 N ATOM 227 CA PRO A 13 -12.425 -8.056 21.832 1.00 0.00 C ATOM 228 C PRO A 13 -12.034 -6.700 22.432 1.00 0.00 C ATOM 229 O PRO A 13 -11.714 -5.768 21.717 1.00 0.00 O ATOM 230 CB PRO A 13 -11.250 -9.029 21.879 1.00 0.00 C ATOM 231 CG PRO A 13 -10.590 -8.903 20.544 1.00 0.00 C ATOM 232 CD PRO A 13 -11.670 -8.550 19.555 1.00 0.00 C ATOM 0 HA PRO A 13 -13.283 -8.402 22.408 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -10.561 -8.777 22.685 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -11.589 -10.049 22.057 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -9.819 -8.133 20.565 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -10.101 -9.836 20.265 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.303 -7.863 18.792 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -12.041 -9.434 19.037 1.00 0.00 H new ATOM 240 N ASP A 14 -12.062 -6.581 23.745 1.00 0.00 N ATOM 241 CA ASP A 14 -11.690 -5.269 24.401 1.00 0.00 C ATOM 242 C ASP A 14 -10.362 -4.716 23.844 1.00 0.00 C ATOM 243 O ASP A 14 -10.174 -3.516 23.771 1.00 0.00 O ATOM 244 CB ASP A 14 -11.543 -5.556 25.904 1.00 0.00 C ATOM 245 CG ASP A 14 -11.513 -4.236 26.676 1.00 0.00 C ATOM 246 OD1 ASP A 14 -12.565 -3.637 26.827 1.00 0.00 O ATOM 247 OD2 ASP A 14 -10.439 -3.848 27.106 1.00 0.00 O ATOM 0 H ASP A 14 -12.324 -7.327 24.389 1.00 0.00 H new ATOM 0 HA ASP A 14 -12.456 -4.519 24.203 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -12.372 -6.173 26.250 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -10.628 -6.119 26.090 1.00 0.00 H new ATOM 252 N GLY A 15 -9.439 -5.574 23.447 1.00 0.00 N ATOM 253 CA GLY A 15 -8.134 -5.085 22.895 1.00 0.00 C ATOM 254 C GLY A 15 -8.373 -4.055 21.772 1.00 0.00 C ATOM 255 O GLY A 15 -7.616 -3.114 21.627 1.00 0.00 O ATOM 0 H GLY A 15 -9.538 -6.589 23.484 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -7.543 -4.633 23.691 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -7.558 -5.926 22.508 1.00 0.00 H new ATOM 259 N PHE A 16 -9.419 -4.217 20.978 1.00 0.00 N ATOM 260 CA PHE A 16 -9.680 -3.218 19.874 1.00 0.00 C ATOM 261 C PHE A 16 -9.773 -1.791 20.445 1.00 0.00 C ATOM 262 O PHE A 16 -9.388 -0.839 19.793 1.00 0.00 O ATOM 263 CB PHE A 16 -11.019 -3.612 19.225 1.00 0.00 C ATOM 264 CG PHE A 16 -11.294 -2.715 18.039 1.00 0.00 C ATOM 265 CD1 PHE A 16 -10.328 -2.557 17.036 1.00 0.00 C ATOM 266 CD2 PHE A 16 -12.518 -2.043 17.942 1.00 0.00 C ATOM 267 CE1 PHE A 16 -10.586 -1.726 15.940 1.00 0.00 C ATOM 268 CE2 PHE A 16 -12.776 -1.212 16.845 1.00 0.00 C ATOM 269 CZ PHE A 16 -11.811 -1.053 15.844 1.00 0.00 C ATOM 0 H PHE A 16 -10.091 -4.982 21.044 1.00 0.00 H new ATOM 0 HA PHE A 16 -8.869 -3.229 19.146 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -10.987 -4.654 18.906 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -11.826 -3.527 19.953 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -9.384 -3.077 17.109 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -13.264 -2.166 18.714 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.841 -1.603 15.168 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -13.720 -0.693 16.771 1.00 0.00 H new ATOM 0 HZ PHE A 16 -12.010 -0.412 14.998 1.00 0.00 H new ATOM 279 N GLU A 17 -10.273 -1.629 21.658 1.00 0.00 N ATOM 280 CA GLU A 17 -10.371 -0.241 22.249 1.00 0.00 C ATOM 281 C GLU A 17 -8.997 0.451 22.213 1.00 0.00 C ATOM 282 O GLU A 17 -8.906 1.638 21.964 1.00 0.00 O ATOM 283 CB GLU A 17 -10.837 -0.409 23.704 1.00 0.00 C ATOM 284 CG GLU A 17 -11.364 0.929 24.230 1.00 0.00 C ATOM 285 CD GLU A 17 -11.228 0.967 25.753 1.00 0.00 C ATOM 286 OE1 GLU A 17 -12.144 0.517 26.421 1.00 0.00 O ATOM 287 OE2 GLU A 17 -10.210 1.447 26.225 1.00 0.00 O ATOM 0 H GLU A 17 -10.612 -2.383 22.256 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.069 0.375 21.682 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -11.618 -1.167 23.762 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.010 -0.755 24.324 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -10.806 1.752 23.784 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -12.408 1.059 23.944 1.00 0.00 H new ATOM 294 N LYS A 18 -7.928 -0.283 22.450 1.00 0.00 N ATOM 295 CA LYS A 18 -6.559 0.355 22.412 1.00 0.00 C ATOM 296 C LYS A 18 -6.314 1.004 21.039 1.00 0.00 C ATOM 297 O LYS A 18 -5.708 2.054 20.949 1.00 0.00 O ATOM 298 CB LYS A 18 -5.538 -0.768 22.655 1.00 0.00 C ATOM 299 CG LYS A 18 -5.424 -1.040 24.156 1.00 0.00 C ATOM 300 CD LYS A 18 -5.167 -2.530 24.389 1.00 0.00 C ATOM 301 CE LYS A 18 -5.513 -2.888 25.836 1.00 0.00 C ATOM 302 NZ LYS A 18 -5.533 -4.377 25.868 1.00 0.00 N ATOM 0 H LYS A 18 -7.939 -1.280 22.665 1.00 0.00 H new ATOM 0 HA LYS A 18 -6.471 1.135 23.169 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -5.847 -1.674 22.133 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -4.566 -0.484 22.252 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -4.613 -0.450 24.582 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -6.340 -0.735 24.662 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -5.769 -3.125 23.702 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -4.123 -2.766 24.185 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -4.774 -2.488 26.530 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -6.479 -2.474 26.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -5.323 -4.706 26.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -6.473 -4.718 25.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -4.817 -4.748 25.211 1.00 0.00 H new ATOM 316 N ILE A 19 -6.788 0.396 19.970 1.00 0.00 N ATOM 317 CA ILE A 19 -6.583 0.997 18.613 1.00 0.00 C ATOM 318 C ILE A 19 -7.941 1.370 17.977 1.00 0.00 C ATOM 319 O ILE A 19 -8.116 1.249 16.779 1.00 0.00 O ATOM 320 CB ILE A 19 -5.860 -0.081 17.784 1.00 0.00 C ATOM 321 CG1 ILE A 19 -6.742 -1.339 17.645 1.00 0.00 C ATOM 322 CG2 ILE A 19 -4.538 -0.461 18.467 1.00 0.00 C ATOM 323 CD1 ILE A 19 -6.674 -1.867 16.207 1.00 0.00 C ATOM 0 H ILE A 19 -7.304 -0.484 19.982 1.00 0.00 H new ATOM 0 HA ILE A 19 -5.999 1.916 18.660 1.00 0.00 H new ATOM 0 HB ILE A 19 -5.660 0.322 16.791 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.406 -2.108 18.340 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -7.773 -1.102 17.906 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.030 -1.224 17.877 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -3.902 0.421 18.545 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -4.742 -0.850 19.464 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.299 -2.755 16.116 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -7.031 -1.100 15.520 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.643 -2.122 15.961 1.00 0.00 H new ATOM 335 N LYS A 20 -8.905 1.807 18.767 1.00 0.00 N ATOM 336 CA LYS A 20 -10.252 2.160 18.185 1.00 0.00 C ATOM 337 C LYS A 20 -10.316 3.605 17.628 1.00 0.00 C ATOM 338 O LYS A 20 -10.889 3.806 16.576 1.00 0.00 O ATOM 339 CB LYS A 20 -11.272 1.984 19.323 1.00 0.00 C ATOM 340 CG LYS A 20 -12.694 2.201 18.788 1.00 0.00 C ATOM 341 CD LYS A 20 -13.255 3.523 19.321 1.00 0.00 C ATOM 342 CE LYS A 20 -14.285 4.078 18.334 1.00 0.00 C ATOM 343 NZ LYS A 20 -15.401 4.580 19.184 1.00 0.00 N ATOM 0 H LYS A 20 -8.820 1.933 19.776 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.461 1.511 17.334 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -11.184 0.986 19.751 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -11.063 2.694 20.123 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -12.684 2.213 17.698 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -13.336 1.374 19.092 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -13.717 3.367 20.296 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -12.448 4.242 19.463 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -13.860 4.878 17.728 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -14.629 3.305 17.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -16.148 4.977 18.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -15.790 3.795 19.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -15.045 5.319 19.823 1.00 0.00 H new ATOM 357 N PRO A 21 -9.769 4.577 18.339 1.00 0.00 N ATOM 358 CA PRO A 21 -9.845 5.980 17.852 1.00 0.00 C ATOM 359 C PRO A 21 -8.850 6.236 16.708 1.00 0.00 C ATOM 360 O PRO A 21 -9.157 6.958 15.778 1.00 0.00 O ATOM 361 CB PRO A 21 -9.491 6.812 19.079 1.00 0.00 C ATOM 362 CG PRO A 21 -8.672 5.911 19.947 1.00 0.00 C ATOM 363 CD PRO A 21 -9.045 4.488 19.616 1.00 0.00 C ATOM 0 HA PRO A 21 -10.825 6.224 17.443 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -8.931 7.705 18.800 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -10.389 7.148 19.598 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -7.609 6.077 19.774 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -8.860 6.120 21.000 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -8.160 3.858 19.526 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -9.670 4.051 20.395 1.00 0.00 H new ATOM 371 N THR A 22 -7.663 5.663 16.761 1.00 0.00 N ATOM 372 CA THR A 22 -6.673 5.910 15.648 1.00 0.00 C ATOM 373 C THR A 22 -7.262 5.442 14.309 1.00 0.00 C ATOM 374 O THR A 22 -7.127 6.116 13.304 1.00 0.00 O ATOM 375 CB THR A 22 -5.403 5.109 15.990 1.00 0.00 C ATOM 376 OG1 THR A 22 -4.901 5.546 17.246 1.00 0.00 O ATOM 377 CG2 THR A 22 -4.343 5.333 14.909 1.00 0.00 C ATOM 0 H THR A 22 -7.340 5.048 17.508 1.00 0.00 H new ATOM 0 HA THR A 22 -6.443 6.971 15.554 1.00 0.00 H new ATOM 0 HB THR A 22 -5.644 4.047 16.039 1.00 0.00 H new ATOM 0 HG1 THR A 22 -4.093 5.038 17.470 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.446 4.764 15.155 1.00 0.00 H new ATOM 0 HG22 THR A 22 -4.730 5.001 13.946 1.00 0.00 H new ATOM 0 HG23 THR A 22 -4.097 6.393 14.855 1.00 0.00 H new ATOM 385 N LEU A 23 -7.924 4.307 14.286 1.00 0.00 N ATOM 386 CA LEU A 23 -8.529 3.828 12.993 1.00 0.00 C ATOM 387 C LEU A 23 -9.632 4.801 12.553 1.00 0.00 C ATOM 388 O LEU A 23 -9.761 5.104 11.381 1.00 0.00 O ATOM 389 CB LEU A 23 -9.115 2.434 13.260 1.00 0.00 C ATOM 390 CG LEU A 23 -7.989 1.398 13.246 1.00 0.00 C ATOM 391 CD1 LEU A 23 -8.310 0.261 14.227 1.00 0.00 C ATOM 392 CD2 LEU A 23 -7.840 0.833 11.829 1.00 0.00 C ATOM 0 H LEU A 23 -8.072 3.698 15.091 1.00 0.00 H new ATOM 0 HA LEU A 23 -7.785 3.781 12.198 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.625 2.420 14.223 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -9.859 2.189 12.502 1.00 0.00 H new ATOM 0 HG LEU A 23 -7.056 1.873 13.550 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -7.503 -0.472 14.211 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -8.411 0.667 15.234 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.243 -0.220 13.934 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -7.039 0.094 11.814 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -8.774 0.361 11.525 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.601 1.642 11.138 1.00 0.00 H new ATOM 404 N THR A 24 -10.427 5.307 13.480 1.00 0.00 N ATOM 405 CA THR A 24 -11.512 6.278 13.085 1.00 0.00 C ATOM 406 C THR A 24 -10.903 7.488 12.352 1.00 0.00 C ATOM 407 O THR A 24 -11.504 8.026 11.442 1.00 0.00 O ATOM 408 CB THR A 24 -12.197 6.737 14.387 1.00 0.00 C ATOM 409 OG1 THR A 24 -12.151 5.689 15.363 1.00 0.00 O ATOM 410 CG2 THR A 24 -13.653 7.123 14.093 1.00 0.00 C ATOM 0 H THR A 24 -10.373 5.094 14.476 1.00 0.00 H new ATOM 0 HA THR A 24 -12.228 5.808 12.411 1.00 0.00 H new ATOM 0 HB THR A 24 -11.670 7.605 14.783 1.00 0.00 H new ATOM 0 HG1 THR A 24 -12.587 5.990 16.187 1.00 0.00 H new ATOM 0 HG21 THR A 24 -14.137 7.447 15.014 1.00 0.00 H new ATOM 0 HG22 THR A 24 -13.674 7.935 13.366 1.00 0.00 H new ATOM 0 HG23 THR A 24 -14.184 6.261 13.689 1.00 0.00 H new ATOM 418 N ASP A 25 -9.715 7.920 12.735 1.00 0.00 N ATOM 419 CA ASP A 25 -9.088 9.102 12.034 1.00 0.00 C ATOM 420 C ASP A 25 -8.978 8.833 10.522 1.00 0.00 C ATOM 421 O ASP A 25 -9.137 9.735 9.720 1.00 0.00 O ATOM 422 CB ASP A 25 -7.684 9.281 12.638 1.00 0.00 C ATOM 423 CG ASP A 25 -7.026 10.526 12.042 1.00 0.00 C ATOM 424 OD1 ASP A 25 -6.510 10.430 10.940 1.00 0.00 O ATOM 425 OD2 ASP A 25 -7.048 11.555 12.697 1.00 0.00 O ATOM 0 H ASP A 25 -9.160 7.514 13.489 1.00 0.00 H new ATOM 0 HA ASP A 25 -9.694 9.998 12.168 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -7.752 9.377 13.722 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.074 8.401 12.433 1.00 0.00 H new ATOM 430 N PHE A 26 -8.709 7.604 10.121 1.00 0.00 N ATOM 431 CA PHE A 26 -8.593 7.305 8.646 1.00 0.00 C ATOM 432 C PHE A 26 -9.884 7.699 7.909 1.00 0.00 C ATOM 433 O PHE A 26 -9.838 8.157 6.782 1.00 0.00 O ATOM 434 CB PHE A 26 -8.382 5.790 8.519 1.00 0.00 C ATOM 435 CG PHE A 26 -6.910 5.475 8.587 1.00 0.00 C ATOM 436 CD1 PHE A 26 -6.284 5.319 9.829 1.00 0.00 C ATOM 437 CD2 PHE A 26 -6.170 5.333 7.409 1.00 0.00 C ATOM 438 CE1 PHE A 26 -4.919 5.022 9.889 1.00 0.00 C ATOM 439 CE2 PHE A 26 -4.808 5.036 7.472 1.00 0.00 C ATOM 440 CZ PHE A 26 -4.183 4.881 8.708 1.00 0.00 C ATOM 0 H PHE A 26 -8.567 6.806 10.740 1.00 0.00 H new ATOM 0 HA PHE A 26 -7.770 7.868 8.207 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -8.912 5.271 9.318 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -8.797 5.433 7.576 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -6.854 5.428 10.740 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -6.653 5.453 6.450 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -4.434 4.902 10.846 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.237 4.926 6.562 1.00 0.00 H new ATOM 0 HZ PHE A 26 -3.129 4.652 8.754 1.00 0.00 H new ATOM 450 N GLU A 27 -11.036 7.508 8.521 1.00 0.00 N ATOM 451 CA GLU A 27 -12.319 7.862 7.814 1.00 0.00 C ATOM 452 C GLU A 27 -12.355 9.352 7.461 1.00 0.00 C ATOM 453 O GLU A 27 -12.835 9.718 6.404 1.00 0.00 O ATOM 454 CB GLU A 27 -13.470 7.515 8.772 1.00 0.00 C ATOM 455 CG GLU A 27 -13.641 5.996 8.835 1.00 0.00 C ATOM 456 CD GLU A 27 -14.587 5.542 7.723 1.00 0.00 C ATOM 457 OE1 GLU A 27 -14.386 5.959 6.594 1.00 0.00 O ATOM 458 OE2 GLU A 27 -15.498 4.785 8.019 1.00 0.00 O ATOM 0 H GLU A 27 -11.144 7.129 9.462 1.00 0.00 H new ATOM 0 HA GLU A 27 -12.405 7.307 6.880 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -13.261 7.910 9.766 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -14.394 7.982 8.431 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -12.674 5.506 8.726 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -14.039 5.704 9.807 1.00 0.00 H new ATOM 465 N ILE A 28 -11.855 10.219 8.316 1.00 0.00 N ATOM 466 CA ILE A 28 -11.884 11.687 7.970 1.00 0.00 C ATOM 467 C ILE A 28 -11.020 11.923 6.717 1.00 0.00 C ATOM 468 O ILE A 28 -11.401 12.677 5.839 1.00 0.00 O ATOM 469 CB ILE A 28 -11.347 12.457 9.200 1.00 0.00 C ATOM 470 CG1 ILE A 28 -12.393 12.402 10.325 1.00 0.00 C ATOM 471 CG2 ILE A 28 -11.088 13.926 8.835 1.00 0.00 C ATOM 472 CD1 ILE A 28 -12.008 11.326 11.338 1.00 0.00 C ATOM 0 H ILE A 28 -11.438 9.985 9.217 1.00 0.00 H new ATOM 0 HA ILE A 28 -12.891 12.037 7.741 1.00 0.00 H new ATOM 0 HB ILE A 28 -10.414 11.997 9.527 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -12.461 13.371 10.819 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -13.377 12.187 9.909 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -10.710 14.457 9.709 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -10.352 13.977 8.033 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -12.018 14.388 8.504 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -12.753 11.292 12.133 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -11.963 10.357 10.840 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -11.033 11.560 11.765 1.00 0.00 H new ATOM 484 N GLN A 29 -9.878 11.270 6.608 1.00 0.00 N ATOM 485 CA GLN A 29 -9.037 11.466 5.375 1.00 0.00 C ATOM 486 C GLN A 29 -9.752 10.810 4.191 1.00 0.00 C ATOM 487 O GLN A 29 -10.044 11.462 3.206 1.00 0.00 O ATOM 488 CB GLN A 29 -7.684 10.788 5.637 1.00 0.00 C ATOM 489 CG GLN A 29 -6.643 11.326 4.653 1.00 0.00 C ATOM 490 CD GLN A 29 -6.307 12.780 5.006 1.00 0.00 C ATOM 491 OE1 GLN A 29 -7.024 13.686 4.627 1.00 0.00 O ATOM 492 NE2 GLN A 29 -5.241 13.051 5.721 1.00 0.00 N ATOM 0 H GLN A 29 -9.500 10.625 7.302 1.00 0.00 H new ATOM 0 HA GLN A 29 -8.884 12.521 5.147 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.363 10.977 6.661 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -7.779 9.708 5.527 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -5.742 10.714 4.690 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.026 11.267 3.634 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -4.636 12.295 6.042 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -5.017 14.018 5.956 1.00 0.00 H new ATOM 501 N LEU A 30 -10.070 9.530 4.283 1.00 0.00 N ATOM 502 CA LEU A 30 -10.808 8.870 3.144 1.00 0.00 C ATOM 503 C LEU A 30 -12.120 9.632 2.862 1.00 0.00 C ATOM 504 O LEU A 30 -12.574 9.682 1.739 1.00 0.00 O ATOM 505 CB LEU A 30 -11.127 7.419 3.570 1.00 0.00 C ATOM 506 CG LEU A 30 -10.733 6.469 2.442 1.00 0.00 C ATOM 507 CD1 LEU A 30 -9.219 6.274 2.464 1.00 0.00 C ATOM 508 CD2 LEU A 30 -11.432 5.119 2.630 1.00 0.00 C ATOM 0 H LEU A 30 -9.857 8.927 5.077 1.00 0.00 H new ATOM 0 HA LEU A 30 -10.202 8.878 2.238 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -10.584 7.167 4.481 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -12.189 7.318 3.793 1.00 0.00 H new ATOM 0 HG LEU A 30 -11.036 6.892 1.484 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -8.928 5.596 1.661 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.726 7.236 2.324 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -8.921 5.850 3.423 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -11.147 4.446 1.822 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -11.135 4.686 3.585 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -12.512 5.264 2.617 1.00 0.00 H new ATOM 520 N ARG A 31 -12.736 10.229 3.874 1.00 0.00 N ATOM 521 CA ARG A 31 -14.019 10.984 3.631 1.00 0.00 C ATOM 522 C ARG A 31 -13.795 12.087 2.588 1.00 0.00 C ATOM 523 O ARG A 31 -14.650 12.332 1.757 1.00 0.00 O ATOM 524 CB ARG A 31 -14.427 11.617 4.973 1.00 0.00 C ATOM 525 CG ARG A 31 -15.322 10.653 5.753 1.00 0.00 C ATOM 526 CD ARG A 31 -15.280 11.010 7.243 1.00 0.00 C ATOM 527 NE ARG A 31 -16.690 10.861 7.715 1.00 0.00 N ATOM 528 CZ ARG A 31 -17.627 11.731 7.371 1.00 0.00 C ATOM 529 NH1 ARG A 31 -17.355 12.762 6.601 1.00 0.00 N ATOM 530 NH2 ARG A 31 -18.851 11.567 7.801 1.00 0.00 N ATOM 0 H ARG A 31 -12.409 10.225 4.840 1.00 0.00 H new ATOM 0 HA ARG A 31 -14.795 10.316 3.256 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -13.538 11.855 5.558 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -14.954 12.555 4.797 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -16.346 10.710 5.383 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -14.986 9.627 5.604 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -14.609 10.347 7.789 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -14.918 12.027 7.395 1.00 0.00 H new ATOM 0 HE ARG A 31 -16.936 10.073 8.314 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -16.406 12.904 6.256 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -18.093 13.419 6.349 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -19.080 10.772 8.398 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -19.577 12.234 7.539 1.00 0.00 H new ATOM 544 N ASP A 32 -12.660 12.763 2.619 1.00 0.00 N ATOM 545 CA ASP A 32 -12.427 13.850 1.603 1.00 0.00 C ATOM 546 C ASP A 32 -12.369 13.241 0.198 1.00 0.00 C ATOM 547 O ASP A 32 -13.053 13.693 -0.702 1.00 0.00 O ATOM 548 CB ASP A 32 -11.088 14.517 1.956 1.00 0.00 C ATOM 549 CG ASP A 32 -11.329 15.651 2.955 1.00 0.00 C ATOM 550 OD1 ASP A 32 -12.303 16.364 2.787 1.00 0.00 O ATOM 551 OD2 ASP A 32 -10.536 15.784 3.872 1.00 0.00 O ATOM 0 H ASP A 32 -11.903 12.614 3.287 1.00 0.00 H new ATOM 0 HA ASP A 32 -13.234 14.583 1.616 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -10.405 13.782 2.382 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -10.615 14.907 1.055 1.00 0.00 H new ATOM 556 N ALA A 33 -11.575 12.209 0.000 1.00 0.00 N ATOM 557 CA ALA A 33 -11.511 11.578 -1.365 1.00 0.00 C ATOM 558 C ALA A 33 -12.825 10.835 -1.649 1.00 0.00 C ATOM 559 O ALA A 33 -13.318 10.850 -2.762 1.00 0.00 O ATOM 560 CB ALA A 33 -10.334 10.591 -1.346 1.00 0.00 C ATOM 0 H ALA A 33 -10.979 11.783 0.709 1.00 0.00 H new ATOM 0 HA ALA A 33 -11.371 12.328 -2.144 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -10.249 10.108 -2.319 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -9.412 11.129 -1.126 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -10.505 9.835 -0.579 1.00 0.00 H new ATOM 566 N GLN A 34 -13.408 10.195 -0.652 1.00 0.00 N ATOM 567 CA GLN A 34 -14.703 9.470 -0.892 1.00 0.00 C ATOM 568 C GLN A 34 -15.849 10.480 -1.093 1.00 0.00 C ATOM 569 O GLN A 34 -16.789 10.207 -1.816 1.00 0.00 O ATOM 570 CB GLN A 34 -14.969 8.611 0.356 1.00 0.00 C ATOM 571 CG GLN A 34 -13.849 7.581 0.515 1.00 0.00 C ATOM 572 CD GLN A 34 -14.246 6.278 -0.189 1.00 0.00 C ATOM 573 OE1 GLN A 34 -14.027 6.130 -1.375 1.00 0.00 O ATOM 574 NE2 GLN A 34 -14.826 5.319 0.489 1.00 0.00 N ATOM 0 H GLN A 34 -13.048 10.145 0.301 1.00 0.00 H new ATOM 0 HA GLN A 34 -14.644 8.852 -1.788 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -15.023 9.244 1.241 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -15.931 8.107 0.265 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -12.922 7.968 0.091 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -13.662 7.393 1.572 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -15.012 5.439 1.485 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -15.092 4.452 0.021 1.00 0.00 H new ATOM 583 N LYS A 35 -15.787 11.647 -0.469 1.00 0.00 N ATOM 584 CA LYS A 35 -16.893 12.647 -0.657 1.00 0.00 C ATOM 585 C LYS A 35 -16.569 13.597 -1.819 1.00 0.00 C ATOM 586 O LYS A 35 -17.456 14.003 -2.547 1.00 0.00 O ATOM 587 CB LYS A 35 -17.002 13.425 0.662 1.00 0.00 C ATOM 588 CG LYS A 35 -17.415 12.472 1.785 1.00 0.00 C ATOM 589 CD LYS A 35 -17.248 13.171 3.136 1.00 0.00 C ATOM 590 CE LYS A 35 -18.526 13.943 3.474 1.00 0.00 C ATOM 591 NZ LYS A 35 -19.456 12.922 4.032 1.00 0.00 N ATOM 0 H LYS A 35 -15.031 11.941 0.150 1.00 0.00 H new ATOM 0 HA LYS A 35 -17.833 12.153 -0.901 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -16.047 13.893 0.901 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -17.734 14.227 0.564 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -18.451 12.161 1.650 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -16.805 11.569 1.753 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -17.038 12.437 3.914 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -16.398 13.852 3.102 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -18.329 14.735 4.197 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -18.947 14.418 2.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -20.382 13.004 3.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -19.068 11.971 3.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -19.569 13.077 5.054 1.00 0.00 H new ATOM 605 N ASP A 36 -15.313 13.950 -2.013 1.00 0.00 N ATOM 606 CA ASP A 36 -14.976 14.870 -3.157 1.00 0.00 C ATOM 607 C ASP A 36 -15.180 14.126 -4.486 1.00 0.00 C ATOM 608 O ASP A 36 -15.685 14.688 -5.441 1.00 0.00 O ATOM 609 CB ASP A 36 -13.503 15.274 -2.988 1.00 0.00 C ATOM 610 CG ASP A 36 -13.363 16.199 -1.778 1.00 0.00 C ATOM 611 OD1 ASP A 36 -14.079 15.991 -0.812 1.00 0.00 O ATOM 612 OD2 ASP A 36 -12.543 17.101 -1.837 1.00 0.00 O ATOM 0 H ASP A 36 -14.523 13.649 -1.443 1.00 0.00 H new ATOM 0 HA ASP A 36 -15.615 15.753 -3.162 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -12.885 14.386 -2.854 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -13.148 15.777 -3.887 1.00 0.00 H new ATOM 617 N LYS A 37 -14.802 12.863 -4.558 1.00 0.00 N ATOM 618 CA LYS A 37 -14.997 12.098 -5.843 1.00 0.00 C ATOM 619 C LYS A 37 -16.490 12.060 -6.215 1.00 0.00 C ATOM 620 O LYS A 37 -16.839 12.138 -7.378 1.00 0.00 O ATOM 621 CB LYS A 37 -14.478 10.672 -5.595 1.00 0.00 C ATOM 622 CG LYS A 37 -14.564 9.861 -6.891 1.00 0.00 C ATOM 623 CD LYS A 37 -15.850 9.030 -6.894 1.00 0.00 C ATOM 624 CE LYS A 37 -15.600 7.698 -6.184 1.00 0.00 C ATOM 625 NZ LYS A 37 -15.048 6.800 -7.235 1.00 0.00 N ATOM 0 H LYS A 37 -14.374 12.336 -3.797 1.00 0.00 H new ATOM 0 HA LYS A 37 -14.461 12.572 -6.665 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -13.447 10.706 -5.243 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -15.066 10.191 -4.813 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -14.549 10.530 -7.752 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -13.697 9.207 -6.981 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -16.649 9.576 -6.394 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -16.178 8.852 -7.918 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -14.899 7.816 -5.358 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -16.522 7.295 -5.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -14.588 5.982 -6.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -15.819 6.470 -7.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -14.350 7.320 -7.805 1.00 0.00 H new ATOM 639 N SER A 38 -17.377 11.947 -5.243 1.00 0.00 N ATOM 640 CA SER A 38 -18.840 11.913 -5.570 1.00 0.00 C ATOM 641 C SER A 38 -19.490 13.266 -5.236 1.00 0.00 C ATOM 642 O SER A 38 -20.599 13.317 -4.740 1.00 0.00 O ATOM 643 CB SER A 38 -19.434 10.801 -4.699 1.00 0.00 C ATOM 644 OG SER A 38 -19.706 11.316 -3.402 1.00 0.00 O ATOM 0 H SER A 38 -17.150 11.878 -4.251 1.00 0.00 H new ATOM 0 HA SER A 38 -19.015 11.726 -6.630 1.00 0.00 H new ATOM 0 HB2 SER A 38 -20.350 10.419 -5.151 1.00 0.00 H new ATOM 0 HB3 SER A 38 -18.738 9.964 -4.632 1.00 0.00 H new ATOM 0 HG SER A 38 -20.344 12.057 -3.471 1.00 0.00 H new ATOM 650 N SER A 39 -18.810 14.364 -5.505 1.00 0.00 N ATOM 651 CA SER A 39 -19.401 15.706 -5.200 1.00 0.00 C ATOM 652 C SER A 39 -18.787 16.782 -6.113 1.00 0.00 C ATOM 653 O SER A 39 -19.491 17.455 -6.841 1.00 0.00 O ATOM 654 CB SER A 39 -19.038 15.973 -3.739 1.00 0.00 C ATOM 655 OG SER A 39 -19.541 17.246 -3.357 1.00 0.00 O ATOM 0 H SER A 39 -17.878 14.384 -5.920 1.00 0.00 H new ATOM 0 HA SER A 39 -20.478 15.729 -5.366 1.00 0.00 H new ATOM 0 HB2 SER A 39 -19.458 15.196 -3.100 1.00 0.00 H new ATOM 0 HB3 SER A 39 -17.956 15.942 -3.609 1.00 0.00 H new ATOM 0 HG SER A 39 -19.312 17.421 -2.420 1.00 0.00 H new ATOM 661 N LYS A 40 -17.479 16.946 -6.083 1.00 0.00 N ATOM 662 CA LYS A 40 -16.831 17.972 -6.953 1.00 0.00 C ATOM 663 C LYS A 40 -15.598 17.367 -7.644 1.00 0.00 C ATOM 664 O LYS A 40 -14.561 17.204 -7.029 1.00 0.00 O ATOM 665 CB LYS A 40 -16.418 19.095 -6.001 1.00 0.00 C ATOM 666 CG LYS A 40 -17.528 20.146 -5.942 1.00 0.00 C ATOM 667 CD LYS A 40 -17.554 20.938 -7.253 1.00 0.00 C ATOM 668 CE LYS A 40 -18.999 21.290 -7.610 1.00 0.00 C ATOM 669 NZ LYS A 40 -19.260 22.587 -6.924 1.00 0.00 N ATOM 0 H LYS A 40 -16.840 16.412 -5.494 1.00 0.00 H new ATOM 0 HA LYS A 40 -17.495 18.332 -7.739 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -16.230 18.692 -5.006 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -15.488 19.551 -6.341 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -18.491 19.664 -5.777 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -17.361 20.820 -5.101 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -16.962 21.847 -7.152 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -17.103 20.351 -8.053 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -19.128 21.381 -8.688 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -19.689 20.518 -7.270 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -20.234 22.895 -7.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -19.136 22.468 -5.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -18.593 23.305 -7.273 1.00 0.00 H new ATOM 683 N LEU A 41 -15.701 17.029 -8.914 1.00 0.00 N ATOM 684 CA LEU A 41 -14.529 16.435 -9.626 1.00 0.00 C ATOM 685 C LEU A 41 -14.194 17.258 -10.879 1.00 0.00 C ATOM 686 O LEU A 41 -14.435 16.827 -11.992 1.00 0.00 O ATOM 687 CB LEU A 41 -14.976 15.022 -10.010 1.00 0.00 C ATOM 688 CG LEU A 41 -13.746 14.128 -10.180 1.00 0.00 C ATOM 689 CD1 LEU A 41 -13.183 13.767 -8.804 1.00 0.00 C ATOM 690 CD2 LEU A 41 -14.146 12.849 -10.919 1.00 0.00 C ATOM 0 H LEU A 41 -16.542 17.140 -9.480 1.00 0.00 H new ATOM 0 HA LEU A 41 -13.631 16.424 -9.008 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -15.632 14.615 -9.241 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -15.550 15.049 -10.936 1.00 0.00 H new ATOM 0 HG LEU A 41 -12.987 14.659 -10.754 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -12.307 13.130 -8.925 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -12.900 14.678 -8.277 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -13.941 13.236 -8.229 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -13.271 12.211 -11.041 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -14.905 12.319 -10.344 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -14.548 13.106 -11.899 1.00 0.00 H new ATOM 702 N ALA A 42 -13.635 18.439 -10.712 1.00 0.00 N ATOM 703 CA ALA A 42 -13.283 19.277 -11.902 1.00 0.00 C ATOM 704 C ALA A 42 -11.758 19.324 -12.082 1.00 0.00 C ATOM 705 O ALA A 42 -11.249 19.024 -13.147 1.00 0.00 O ATOM 706 CB ALA A 42 -13.832 20.673 -11.596 1.00 0.00 C ATOM 0 H ALA A 42 -13.410 18.853 -9.808 1.00 0.00 H new ATOM 0 HA ALA A 42 -13.702 18.875 -12.824 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -13.610 21.342 -12.428 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -14.911 20.617 -11.454 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -13.366 21.056 -10.688 1.00 0.00 H new ATOM 712 N ALA A 43 -11.021 19.691 -11.053 1.00 0.00 N ATOM 713 CA ALA A 43 -9.533 19.748 -11.179 1.00 0.00 C ATOM 714 C ALA A 43 -8.884 18.729 -10.230 1.00 0.00 C ATOM 715 O ALA A 43 -9.384 18.480 -9.149 1.00 0.00 O ATOM 716 CB ALA A 43 -9.153 21.174 -10.778 1.00 0.00 C ATOM 0 H ALA A 43 -11.389 19.951 -10.138 1.00 0.00 H new ATOM 0 HA ALA A 43 -9.194 19.507 -12.186 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -8.072 21.295 -10.845 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -9.640 21.882 -11.448 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -9.476 21.362 -9.754 1.00 0.00 H new ATOM 722 N LYS A 44 -7.771 18.130 -10.619 1.00 0.00 N ATOM 723 CA LYS A 44 -7.094 17.124 -9.733 1.00 0.00 C ATOM 724 C LYS A 44 -8.083 16.025 -9.305 1.00 0.00 C ATOM 725 O LYS A 44 -8.733 16.139 -8.283 1.00 0.00 O ATOM 726 CB LYS A 44 -6.609 17.915 -8.514 1.00 0.00 C ATOM 727 CG LYS A 44 -5.519 17.120 -7.791 1.00 0.00 C ATOM 728 CD LYS A 44 -4.614 18.082 -7.018 1.00 0.00 C ATOM 729 CE LYS A 44 -3.932 17.332 -5.872 1.00 0.00 C ATOM 730 NZ LYS A 44 -2.825 18.226 -5.433 1.00 0.00 N ATOM 0 H LYS A 44 -7.307 18.298 -11.512 1.00 0.00 H new ATOM 0 HA LYS A 44 -6.272 16.624 -10.245 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -6.220 18.884 -8.827 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -7.442 18.109 -7.838 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -5.971 16.401 -7.108 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -4.931 16.550 -8.511 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -3.864 18.508 -7.685 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -5.200 18.913 -6.625 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -4.629 17.137 -5.057 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -3.552 16.366 -6.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -2.309 17.780 -4.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -2.174 18.388 -6.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -3.218 19.135 -5.117 1.00 0.00 H new ATOM 744 N SER A 45 -8.203 14.962 -10.076 1.00 0.00 N ATOM 745 CA SER A 45 -9.152 13.868 -9.702 1.00 0.00 C ATOM 746 C SER A 45 -8.387 12.570 -9.408 1.00 0.00 C ATOM 747 O SER A 45 -8.521 12.000 -8.341 1.00 0.00 O ATOM 748 CB SER A 45 -10.059 13.693 -10.919 1.00 0.00 C ATOM 749 OG SER A 45 -10.947 12.607 -10.690 1.00 0.00 O ATOM 0 H SER A 45 -7.686 14.810 -10.942 1.00 0.00 H new ATOM 0 HA SER A 45 -9.719 14.109 -8.803 1.00 0.00 H new ATOM 0 HB2 SER A 45 -10.624 14.607 -11.101 1.00 0.00 H new ATOM 0 HB3 SER A 45 -9.460 13.506 -11.810 1.00 0.00 H new ATOM 0 HG SER A 45 -11.049 12.088 -11.515 1.00 0.00 H new ATOM 755 N ASN A 46 -7.584 12.097 -10.338 1.00 0.00 N ATOM 756 CA ASN A 46 -6.810 10.823 -10.086 1.00 0.00 C ATOM 757 C ASN A 46 -5.970 10.965 -8.805 1.00 0.00 C ATOM 758 O ASN A 46 -5.862 10.035 -8.028 1.00 0.00 O ATOM 759 CB ASN A 46 -5.890 10.615 -11.299 1.00 0.00 C ATOM 760 CG ASN A 46 -6.726 10.165 -12.504 1.00 0.00 C ATOM 761 OD1 ASN A 46 -7.079 9.008 -12.610 1.00 0.00 O ATOM 762 ND2 ASN A 46 -7.062 11.034 -13.428 1.00 0.00 N ATOM 0 H ASN A 46 -7.429 12.528 -11.250 1.00 0.00 H new ATOM 0 HA ASN A 46 -7.482 9.974 -9.955 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -5.364 11.541 -11.533 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -5.131 9.867 -11.069 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -7.617 10.736 -14.230 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -6.768 12.007 -13.344 1.00 0.00 H new ATOM 769 N GLU A 47 -5.382 12.123 -8.573 1.00 0.00 N ATOM 770 CA GLU A 47 -4.559 12.302 -7.321 1.00 0.00 C ATOM 771 C GLU A 47 -5.434 12.067 -6.077 1.00 0.00 C ATOM 772 O GLU A 47 -4.976 11.514 -5.095 1.00 0.00 O ATOM 773 CB GLU A 47 -4.037 13.749 -7.334 1.00 0.00 C ATOM 774 CG GLU A 47 -3.139 13.958 -8.555 1.00 0.00 C ATOM 775 CD GLU A 47 -2.033 14.957 -8.212 1.00 0.00 C ATOM 776 OE1 GLU A 47 -2.313 16.145 -8.216 1.00 0.00 O ATOM 777 OE2 GLU A 47 -0.925 14.519 -7.952 1.00 0.00 O ATOM 0 H GLU A 47 -5.434 12.939 -9.183 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.735 11.590 -7.289 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -4.873 14.448 -7.361 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -3.479 13.954 -6.420 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -2.702 13.009 -8.865 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.729 14.327 -9.394 1.00 0.00 H new ATOM 784 N GLN A 48 -6.690 12.478 -6.105 1.00 0.00 N ATOM 785 CA GLN A 48 -7.570 12.257 -4.898 1.00 0.00 C ATOM 786 C GLN A 48 -7.716 10.752 -4.632 1.00 0.00 C ATOM 787 O GLN A 48 -7.566 10.302 -3.512 1.00 0.00 O ATOM 788 CB GLN A 48 -8.944 12.866 -5.221 1.00 0.00 C ATOM 789 CG GLN A 48 -9.529 13.506 -3.962 1.00 0.00 C ATOM 790 CD GLN A 48 -10.825 14.237 -4.325 1.00 0.00 C ATOM 791 OE1 GLN A 48 -10.970 15.409 -4.039 1.00 0.00 O ATOM 792 NE2 GLN A 48 -11.782 13.596 -4.952 1.00 0.00 N ATOM 0 H GLN A 48 -7.136 12.947 -6.893 1.00 0.00 H new ATOM 0 HA GLN A 48 -7.139 12.721 -4.011 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -8.846 13.613 -6.009 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -9.617 12.094 -5.595 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -9.726 12.743 -3.210 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -8.813 14.204 -3.528 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -11.664 12.612 -5.194 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -12.645 14.081 -5.198 1.00 0.00 H new ATOM 801 N LEU A 49 -8.006 9.965 -5.652 1.00 0.00 N ATOM 802 CA LEU A 49 -8.155 8.480 -5.428 1.00 0.00 C ATOM 803 C LEU A 49 -6.858 7.901 -4.839 1.00 0.00 C ATOM 804 O LEU A 49 -6.899 7.037 -3.983 1.00 0.00 O ATOM 805 CB LEU A 49 -8.441 7.846 -6.798 1.00 0.00 C ATOM 806 CG LEU A 49 -9.952 7.809 -7.038 1.00 0.00 C ATOM 807 CD1 LEU A 49 -10.232 7.291 -8.450 1.00 0.00 C ATOM 808 CD2 LEU A 49 -10.609 6.877 -6.015 1.00 0.00 C ATOM 0 H LEU A 49 -8.144 10.279 -6.613 1.00 0.00 H new ATOM 0 HA LEU A 49 -8.963 8.272 -4.726 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -7.951 8.419 -7.585 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -8.031 6.837 -6.836 1.00 0.00 H new ATOM 0 HG LEU A 49 -10.361 8.814 -6.931 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -11.308 7.265 -8.621 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -9.765 7.952 -9.180 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -9.823 6.286 -8.557 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -11.685 6.850 -6.186 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -10.200 5.873 -6.122 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -10.410 7.244 -5.008 1.00 0.00 H new ATOM 820 N TRP A 50 -5.705 8.374 -5.277 1.00 0.00 N ATOM 821 CA TRP A 50 -4.416 7.833 -4.708 1.00 0.00 C ATOM 822 C TRP A 50 -4.373 8.063 -3.190 1.00 0.00 C ATOM 823 O TRP A 50 -3.852 7.242 -2.458 1.00 0.00 O ATOM 824 CB TRP A 50 -3.262 8.572 -5.421 1.00 0.00 C ATOM 825 CG TRP A 50 -3.333 8.356 -6.916 1.00 0.00 C ATOM 826 CD1 TRP A 50 -4.119 7.445 -7.555 1.00 0.00 C ATOM 827 CD2 TRP A 50 -2.599 9.052 -7.967 1.00 0.00 C ATOM 828 NE1 TRP A 50 -3.916 7.552 -8.916 1.00 0.00 N ATOM 829 CE2 TRP A 50 -2.992 8.524 -9.220 1.00 0.00 C ATOM 830 CE3 TRP A 50 -1.642 10.084 -7.957 1.00 0.00 C ATOM 831 CZ2 TRP A 50 -2.460 8.999 -10.414 1.00 0.00 C ATOM 832 CZ3 TRP A 50 -1.100 10.562 -9.164 1.00 0.00 C ATOM 833 CH2 TRP A 50 -1.513 10.019 -10.390 1.00 0.00 C ATOM 0 H TRP A 50 -5.601 9.097 -5.989 1.00 0.00 H new ATOM 0 HA TRP A 50 -4.330 6.759 -4.871 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -3.314 9.638 -5.200 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -2.305 8.214 -5.042 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -4.792 6.751 -7.074 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -4.394 6.979 -9.612 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -1.322 10.511 -7.018 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -2.780 8.578 -11.356 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -0.362 11.351 -9.147 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -1.097 10.392 -11.314 1.00 0.00 H new ATOM 844 N GLU A 51 -4.935 9.152 -2.701 1.00 0.00 N ATOM 845 CA GLU A 51 -4.928 9.376 -1.214 1.00 0.00 C ATOM 846 C GLU A 51 -5.722 8.260 -0.511 1.00 0.00 C ATOM 847 O GLU A 51 -5.404 7.894 0.605 1.00 0.00 O ATOM 848 CB GLU A 51 -5.593 10.740 -0.963 1.00 0.00 C ATOM 849 CG GLU A 51 -4.536 11.845 -1.038 1.00 0.00 C ATOM 850 CD GLU A 51 -4.210 12.142 -2.503 1.00 0.00 C ATOM 851 OE1 GLU A 51 -3.402 11.423 -3.066 1.00 0.00 O ATOM 852 OE2 GLU A 51 -4.776 13.082 -3.037 1.00 0.00 O ATOM 0 H GLU A 51 -5.388 9.879 -3.254 1.00 0.00 H new ATOM 0 HA GLU A 51 -3.912 9.362 -0.820 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -6.373 10.918 -1.703 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -6.074 10.748 0.015 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -4.902 12.746 -0.546 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -3.634 11.537 -0.509 1.00 0.00 H new ATOM 859 N ILE A 52 -6.745 7.702 -1.146 1.00 0.00 N ATOM 860 CA ILE A 52 -7.518 6.604 -0.468 1.00 0.00 C ATOM 861 C ILE A 52 -6.659 5.338 -0.415 1.00 0.00 C ATOM 862 O ILE A 52 -6.372 4.841 0.660 1.00 0.00 O ATOM 863 CB ILE A 52 -8.808 6.384 -1.278 1.00 0.00 C ATOM 864 CG1 ILE A 52 -9.596 7.712 -1.289 1.00 0.00 C ATOM 865 CG2 ILE A 52 -9.637 5.267 -0.619 1.00 0.00 C ATOM 866 CD1 ILE A 52 -11.074 7.499 -1.660 1.00 0.00 C ATOM 0 H ILE A 52 -7.067 7.955 -2.080 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.776 6.865 0.558 1.00 0.00 H new ATOM 0 HB ILE A 52 -8.580 6.085 -2.301 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.532 8.180 -0.307 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -9.139 8.400 -2.000 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -10.552 5.108 -1.190 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -9.056 4.345 -0.601 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -9.891 5.556 0.401 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -11.592 8.458 -1.656 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -11.139 7.055 -2.653 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -11.539 6.832 -0.934 1.00 0.00 H new ATOM 878 N MET A 53 -6.219 4.810 -1.547 1.00 0.00 N ATOM 879 CA MET A 53 -5.349 3.574 -1.472 1.00 0.00 C ATOM 880 C MET A 53 -4.099 3.857 -0.610 1.00 0.00 C ATOM 881 O MET A 53 -3.550 2.948 -0.015 1.00 0.00 O ATOM 882 CB MET A 53 -4.950 3.133 -2.903 1.00 0.00 C ATOM 883 CG MET A 53 -4.444 4.307 -3.759 1.00 0.00 C ATOM 884 SD MET A 53 -5.477 4.458 -5.247 1.00 0.00 S ATOM 885 CE MET A 53 -4.980 2.907 -6.032 1.00 0.00 C ATOM 0 H MET A 53 -6.414 5.163 -2.484 1.00 0.00 H new ATOM 0 HA MET A 53 -5.906 2.764 -1.002 1.00 0.00 H new ATOM 0 HB2 MET A 53 -4.174 2.370 -2.842 1.00 0.00 H new ATOM 0 HB3 MET A 53 -5.810 2.674 -3.392 1.00 0.00 H new ATOM 0 HG2 MET A 53 -4.478 5.232 -3.184 1.00 0.00 H new ATOM 0 HG3 MET A 53 -3.403 4.145 -4.040 1.00 0.00 H new ATOM 0 HE1 MET A 53 -5.629 2.707 -6.885 1.00 0.00 H new ATOM 0 HE2 MET A 53 -3.947 2.986 -6.372 1.00 0.00 H new ATOM 0 HE3 MET A 53 -5.064 2.092 -5.313 1.00 0.00 H new ATOM 895 N GLN A 54 -3.654 5.103 -0.505 1.00 0.00 N ATOM 896 CA GLN A 54 -2.455 5.387 0.362 1.00 0.00 C ATOM 897 C GLN A 54 -2.795 5.062 1.827 1.00 0.00 C ATOM 898 O GLN A 54 -1.983 4.500 2.539 1.00 0.00 O ATOM 899 CB GLN A 54 -2.134 6.884 0.209 1.00 0.00 C ATOM 900 CG GLN A 54 -1.306 7.100 -1.059 1.00 0.00 C ATOM 901 CD GLN A 54 0.187 7.064 -0.709 1.00 0.00 C ATOM 902 OE1 GLN A 54 0.714 6.020 -0.377 1.00 0.00 O ATOM 903 NE2 GLN A 54 0.900 8.163 -0.767 1.00 0.00 N ATOM 0 H GLN A 54 -4.061 5.914 -0.972 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.599 4.780 0.068 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -3.057 7.461 0.156 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -1.584 7.240 1.080 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -1.537 6.328 -1.793 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -1.561 8.057 -1.513 1.00 0.00 H new ATOM 0 HE21 GLN A 54 0.462 9.041 -1.045 1.00 0.00 H new ATOM 0 HE22 GLN A 54 1.893 8.140 -0.534 1.00 0.00 H new ATOM 912 N LEU A 55 -3.996 5.387 2.287 1.00 0.00 N ATOM 913 CA LEU A 55 -4.362 5.059 3.718 1.00 0.00 C ATOM 914 C LEU A 55 -4.156 3.552 3.980 1.00 0.00 C ATOM 915 O LEU A 55 -3.793 3.158 5.072 1.00 0.00 O ATOM 916 CB LEU A 55 -5.870 5.396 3.909 1.00 0.00 C ATOM 917 CG LEU A 55 -6.160 6.856 4.386 1.00 0.00 C ATOM 918 CD1 LEU A 55 -4.989 7.491 5.157 1.00 0.00 C ATOM 919 CD2 LEU A 55 -6.517 7.734 3.178 1.00 0.00 C ATOM 0 H LEU A 55 -4.723 5.855 1.746 1.00 0.00 H new ATOM 0 HA LEU A 55 -3.738 5.630 4.405 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -6.388 5.228 2.965 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -6.294 4.701 4.634 1.00 0.00 H new ATOM 0 HG LEU A 55 -6.998 6.797 5.080 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -5.258 8.503 5.458 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -4.771 6.895 6.043 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -4.108 7.525 4.517 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -6.719 8.751 3.514 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.684 7.743 2.475 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -7.403 7.333 2.685 1.00 0.00 H new ATOM 931 N HIS A 56 -4.389 2.703 2.993 1.00 0.00 N ATOM 932 CA HIS A 56 -4.206 1.223 3.213 1.00 0.00 C ATOM 933 C HIS A 56 -2.784 0.931 3.718 1.00 0.00 C ATOM 934 O HIS A 56 -2.596 0.101 4.588 1.00 0.00 O ATOM 935 CB HIS A 56 -4.433 0.552 1.849 1.00 0.00 C ATOM 936 CG HIS A 56 -4.864 -0.873 2.051 1.00 0.00 C ATOM 937 ND1 HIS A 56 -5.914 -1.217 2.886 1.00 0.00 N ATOM 938 CD2 HIS A 56 -4.404 -2.054 1.523 1.00 0.00 C ATOM 939 CE1 HIS A 56 -6.050 -2.555 2.838 1.00 0.00 C ATOM 940 NE2 HIS A 56 -5.154 -3.113 2.020 1.00 0.00 N ATOM 0 H HIS A 56 -4.694 2.968 2.057 1.00 0.00 H new ATOM 0 HA HIS A 56 -4.903 0.846 3.962 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -5.193 1.096 1.287 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -3.517 0.585 1.260 1.00 0.00 H new ATOM 0 HD1 HIS A 56 -6.481 -0.573 3.437 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -3.583 -2.146 0.827 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -6.792 -3.109 3.393 1.00 0.00 H new ATOM 948 N HIS A 57 -1.783 1.609 3.191 1.00 0.00 N ATOM 949 CA HIS A 57 -0.381 1.349 3.679 1.00 0.00 C ATOM 950 C HIS A 57 -0.263 1.764 5.149 1.00 0.00 C ATOM 951 O HIS A 57 0.188 0.995 5.976 1.00 0.00 O ATOM 952 CB HIS A 57 0.565 2.192 2.811 1.00 0.00 C ATOM 953 CG HIS A 57 0.995 1.387 1.617 1.00 0.00 C ATOM 954 ND1 HIS A 57 2.112 1.718 0.867 1.00 0.00 N ATOM 955 CD2 HIS A 57 0.475 0.256 1.037 1.00 0.00 C ATOM 956 CE1 HIS A 57 2.229 0.802 -0.112 1.00 0.00 C ATOM 957 NE2 HIS A 57 1.256 -0.112 -0.052 1.00 0.00 N ATOM 0 H HIS A 57 -1.871 2.316 2.461 1.00 0.00 H new ATOM 0 HA HIS A 57 -0.128 0.291 3.604 1.00 0.00 H new ATOM 0 HB2 HIS A 57 0.064 3.104 2.487 1.00 0.00 H new ATOM 0 HB3 HIS A 57 1.436 2.496 3.392 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -0.407 -0.268 1.376 1.00 0.00 H new ATOM 0 HE1 HIS A 57 3.013 0.805 -0.855 1.00 0.00 H new ATOM 0 HE2 HIS A 57 1.116 -0.909 -0.673 1.00 0.00 H new ATOM 965 N GLN A 58 -0.676 2.970 5.489 1.00 0.00 N ATOM 966 CA GLN A 58 -0.589 3.404 6.930 1.00 0.00 C ATOM 967 C GLN A 58 -1.367 2.419 7.824 1.00 0.00 C ATOM 968 O GLN A 58 -0.966 2.149 8.941 1.00 0.00 O ATOM 969 CB GLN A 58 -1.212 4.807 7.011 1.00 0.00 C ATOM 970 CG GLN A 58 -0.813 5.469 8.332 1.00 0.00 C ATOM 971 CD GLN A 58 0.652 5.917 8.259 1.00 0.00 C ATOM 972 OE1 GLN A 58 1.046 6.575 7.317 1.00 0.00 O ATOM 973 NE2 GLN A 58 1.485 5.588 9.216 1.00 0.00 N ATOM 0 H GLN A 58 -1.062 3.661 4.845 1.00 0.00 H new ATOM 0 HA GLN A 58 0.445 3.419 7.275 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -0.875 5.415 6.171 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -2.298 4.739 6.940 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -1.457 6.326 8.530 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -0.950 4.770 9.157 1.00 0.00 H new ATOM 0 HE21 GLN A 58 1.158 5.036 10.009 1.00 0.00 H new ATOM 0 HE22 GLN A 58 2.460 5.884 9.168 1.00 0.00 H new ATOM 982 N ARG A 59 -2.470 1.867 7.343 1.00 0.00 N ATOM 983 CA ARG A 59 -3.239 0.890 8.192 1.00 0.00 C ATOM 984 C ARG A 59 -2.385 -0.364 8.435 1.00 0.00 C ATOM 985 O ARG A 59 -2.227 -0.797 9.560 1.00 0.00 O ATOM 986 CB ARG A 59 -4.508 0.516 7.413 1.00 0.00 C ATOM 987 CG ARG A 59 -5.412 1.741 7.286 1.00 0.00 C ATOM 988 CD ARG A 59 -6.071 2.030 8.636 1.00 0.00 C ATOM 989 NE ARG A 59 -7.360 1.271 8.610 1.00 0.00 N ATOM 990 CZ ARG A 59 -8.357 1.635 7.817 1.00 0.00 C ATOM 991 NH1 ARG A 59 -8.253 2.670 7.016 1.00 0.00 N ATOM 992 NH2 ARG A 59 -9.471 0.949 7.826 1.00 0.00 N ATOM 0 H ARG A 59 -2.861 2.048 6.419 1.00 0.00 H new ATOM 0 HA ARG A 59 -3.493 1.325 9.159 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -4.243 0.143 6.424 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -5.037 -0.288 7.925 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -4.830 2.604 6.961 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -6.174 1.567 6.527 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -5.438 1.704 9.462 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -6.245 3.098 8.770 1.00 0.00 H new ATOM 0 HE ARG A 59 -7.473 0.457 9.215 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -7.390 3.214 6.995 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -9.035 2.930 6.415 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -9.567 0.141 8.440 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -10.243 1.223 7.219 1.00 0.00 H new ATOM 1006 N SER A 60 -1.828 -0.952 7.389 1.00 0.00 N ATOM 1007 CA SER A 60 -0.981 -2.180 7.596 1.00 0.00 C ATOM 1008 C SER A 60 0.212 -1.839 8.496 1.00 0.00 C ATOM 1009 O SER A 60 0.574 -2.615 9.355 1.00 0.00 O ATOM 1010 CB SER A 60 -0.491 -2.627 6.209 1.00 0.00 C ATOM 1011 OG SER A 60 0.525 -1.740 5.763 1.00 0.00 O ATOM 0 H SER A 60 -1.922 -0.641 6.422 1.00 0.00 H new ATOM 0 HA SER A 60 -1.550 -2.975 8.078 1.00 0.00 H new ATOM 0 HB2 SER A 60 -0.105 -3.645 6.257 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.321 -2.633 5.502 1.00 0.00 H new ATOM 0 HG SER A 60 0.220 -0.814 5.867 1.00 0.00 H new ATOM 1017 N ARG A 61 0.820 -0.682 8.322 1.00 0.00 N ATOM 1018 CA ARG A 61 1.982 -0.323 9.209 1.00 0.00 C ATOM 1019 C ARG A 61 1.491 -0.200 10.659 1.00 0.00 C ATOM 1020 O ARG A 61 2.150 -0.651 11.577 1.00 0.00 O ATOM 1021 CB ARG A 61 2.526 1.028 8.714 1.00 0.00 C ATOM 1022 CG ARG A 61 3.895 1.289 9.345 1.00 0.00 C ATOM 1023 CD ARG A 61 4.998 0.758 8.417 1.00 0.00 C ATOM 1024 NE ARG A 61 6.268 1.465 8.818 1.00 0.00 N ATOM 1025 CZ ARG A 61 7.457 0.922 8.591 1.00 0.00 C ATOM 1026 NH1 ARG A 61 7.581 -0.231 7.972 1.00 0.00 N ATOM 1027 NH2 ARG A 61 8.537 1.552 8.973 1.00 0.00 N ATOM 0 H ARG A 61 0.569 0.015 7.621 1.00 0.00 H new ATOM 0 HA ARG A 61 2.762 -1.084 9.174 1.00 0.00 H new ATOM 0 HB2 ARG A 61 2.610 1.022 7.627 1.00 0.00 H new ATOM 0 HB3 ARG A 61 1.834 1.829 8.976 1.00 0.00 H new ATOM 0 HG2 ARG A 61 4.031 2.357 9.515 1.00 0.00 H new ATOM 0 HG3 ARG A 61 3.958 0.801 10.318 1.00 0.00 H new ATOM 0 HD2 ARG A 61 5.106 -0.322 8.520 1.00 0.00 H new ATOM 0 HD3 ARG A 61 4.756 0.956 7.373 1.00 0.00 H new ATOM 0 HE ARG A 61 6.212 2.377 9.272 1.00 0.00 H new ATOM 0 HH11 ARG A 61 6.751 -0.731 7.653 1.00 0.00 H new ATOM 0 HH12 ARG A 61 8.507 -0.626 7.810 1.00 0.00 H new ATOM 0 HH21 ARG A 61 8.462 2.455 9.442 1.00 0.00 H new ATOM 0 HH22 ARG A 61 9.455 1.141 8.802 1.00 0.00 H new ATOM 1041 N TYR A 62 0.335 0.397 10.877 1.00 0.00 N ATOM 1042 CA TYR A 62 -0.184 0.526 12.285 1.00 0.00 C ATOM 1043 C TYR A 62 -0.441 -0.871 12.872 1.00 0.00 C ATOM 1044 O TYR A 62 0.007 -1.179 13.962 1.00 0.00 O ATOM 1045 CB TYR A 62 -1.500 1.318 12.196 1.00 0.00 C ATOM 1046 CG TYR A 62 -2.070 1.520 13.580 1.00 0.00 C ATOM 1047 CD1 TYR A 62 -2.804 0.496 14.190 1.00 0.00 C ATOM 1048 CD2 TYR A 62 -1.868 2.731 14.251 1.00 0.00 C ATOM 1049 CE1 TYR A 62 -3.335 0.682 15.471 1.00 0.00 C ATOM 1050 CE2 TYR A 62 -2.398 2.918 15.532 1.00 0.00 C ATOM 1051 CZ TYR A 62 -3.132 1.894 16.142 1.00 0.00 C ATOM 1052 OH TYR A 62 -3.656 2.079 17.404 1.00 0.00 O ATOM 0 H TYR A 62 -0.263 0.795 10.153 1.00 0.00 H new ATOM 0 HA TYR A 62 0.533 1.033 12.931 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -1.323 2.283 11.721 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -2.216 0.783 11.572 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.961 -0.438 13.671 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -1.303 3.522 13.780 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -3.901 -0.108 15.942 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -2.241 3.852 16.050 1.00 0.00 H new ATOM 0 HH TYR A 62 -3.422 2.974 17.727 1.00 0.00 H new ATOM 1062 N ILE A 63 -1.151 -1.725 12.158 1.00 0.00 N ATOM 1063 CA ILE A 63 -1.412 -3.105 12.702 1.00 0.00 C ATOM 1064 C ILE A 63 -0.112 -3.931 12.665 1.00 0.00 C ATOM 1065 O ILE A 63 0.146 -4.713 13.562 1.00 0.00 O ATOM 1066 CB ILE A 63 -2.509 -3.730 11.816 1.00 0.00 C ATOM 1067 CG1 ILE A 63 -3.803 -2.921 11.988 1.00 0.00 C ATOM 1068 CG2 ILE A 63 -2.755 -5.182 12.239 1.00 0.00 C ATOM 1069 CD1 ILE A 63 -4.905 -3.479 11.079 1.00 0.00 C ATOM 0 H ILE A 63 -1.553 -1.531 11.241 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.743 -3.078 13.740 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.193 -3.713 10.773 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -4.127 -2.957 13.028 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -3.620 -1.874 11.748 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -3.531 -5.618 11.610 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -1.834 -5.754 12.128 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -3.076 -5.208 13.280 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.816 -2.896 11.212 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.584 -3.419 10.039 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -5.099 -4.520 11.339 1.00 0.00 H new ATOM 1081 N TYR A 64 0.720 -3.756 11.657 1.00 0.00 N ATOM 1082 CA TYR A 64 2.007 -4.536 11.619 1.00 0.00 C ATOM 1083 C TYR A 64 2.928 -4.028 12.735 1.00 0.00 C ATOM 1084 O TYR A 64 3.567 -4.806 13.415 1.00 0.00 O ATOM 1085 CB TYR A 64 2.647 -4.283 10.242 1.00 0.00 C ATOM 1086 CG TYR A 64 3.765 -5.273 10.010 1.00 0.00 C ATOM 1087 CD1 TYR A 64 4.959 -5.171 10.733 1.00 0.00 C ATOM 1088 CD2 TYR A 64 3.605 -6.293 9.067 1.00 0.00 C ATOM 1089 CE1 TYR A 64 5.991 -6.092 10.513 1.00 0.00 C ATOM 1090 CE2 TYR A 64 4.635 -7.214 8.848 1.00 0.00 C ATOM 1091 CZ TYR A 64 5.828 -7.114 9.570 1.00 0.00 C ATOM 1092 OH TYR A 64 6.844 -8.022 9.353 1.00 0.00 O ATOM 0 H TYR A 64 0.568 -3.120 10.874 1.00 0.00 H new ATOM 0 HA TYR A 64 1.837 -5.602 11.768 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.896 -4.378 9.458 1.00 0.00 H new ATOM 0 HB3 TYR A 64 3.033 -3.265 10.191 1.00 0.00 H new ATOM 0 HD1 TYR A 64 5.085 -4.382 11.460 1.00 0.00 H new ATOM 0 HD2 TYR A 64 2.685 -6.370 8.507 1.00 0.00 H new ATOM 0 HE1 TYR A 64 6.913 -6.014 11.071 1.00 0.00 H new ATOM 0 HE2 TYR A 64 4.509 -8.003 8.121 1.00 0.00 H new ATOM 0 HH TYR A 64 7.358 -8.141 10.179 1.00 0.00 H new ATOM 1102 N THR A 65 2.997 -2.727 12.943 1.00 0.00 N ATOM 1103 CA THR A 65 3.887 -2.201 14.036 1.00 0.00 C ATOM 1104 C THR A 65 3.425 -2.750 15.396 1.00 0.00 C ATOM 1105 O THR A 65 4.238 -3.101 16.229 1.00 0.00 O ATOM 1106 CB THR A 65 3.770 -0.667 14.013 1.00 0.00 C ATOM 1107 OG1 THR A 65 4.166 -0.183 12.737 1.00 0.00 O ATOM 1108 CG2 THR A 65 4.680 -0.064 15.088 1.00 0.00 C ATOM 0 H THR A 65 2.486 -2.020 12.414 1.00 0.00 H new ATOM 0 HA THR A 65 4.921 -2.511 13.883 1.00 0.00 H new ATOM 0 HB THR A 65 2.737 -0.381 14.210 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.371 -0.030 12.184 1.00 0.00 H new ATOM 0 HG21 THR A 65 4.595 1.023 15.069 1.00 0.00 H new ATOM 0 HG22 THR A 65 4.380 -0.435 16.068 1.00 0.00 H new ATOM 0 HG23 THR A 65 5.713 -0.350 14.892 1.00 0.00 H new ATOM 1116 N LEU A 66 2.131 -2.816 15.641 1.00 0.00 N ATOM 1117 CA LEU A 66 1.661 -3.334 16.972 1.00 0.00 C ATOM 1118 C LEU A 66 1.605 -4.879 17.016 1.00 0.00 C ATOM 1119 O LEU A 66 1.882 -5.468 18.046 1.00 0.00 O ATOM 1120 CB LEU A 66 0.280 -2.697 17.244 1.00 0.00 C ATOM 1121 CG LEU A 66 -0.798 -3.262 16.308 1.00 0.00 C ATOM 1122 CD1 LEU A 66 -1.363 -4.564 16.892 1.00 0.00 C ATOM 1123 CD2 LEU A 66 -1.926 -2.233 16.164 1.00 0.00 C ATOM 0 H LEU A 66 1.395 -2.540 14.991 1.00 0.00 H new ATOM 0 HA LEU A 66 2.369 -3.056 17.753 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -0.006 -2.877 18.280 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.345 -1.617 17.114 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.360 -3.470 15.331 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -2.128 -4.961 16.224 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.560 -5.294 16.999 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -1.803 -4.364 17.869 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.696 -2.627 15.500 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.360 -2.030 17.143 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.525 -1.310 15.746 1.00 0.00 H new ATOM 1135 N TYR A 67 1.245 -5.548 15.935 1.00 0.00 N ATOM 1136 CA TYR A 67 1.180 -7.059 15.984 1.00 0.00 C ATOM 1137 C TYR A 67 2.546 -7.702 15.674 1.00 0.00 C ATOM 1138 O TYR A 67 2.871 -8.740 16.221 1.00 0.00 O ATOM 1139 CB TYR A 67 0.135 -7.495 14.939 1.00 0.00 C ATOM 1140 CG TYR A 67 -0.029 -9.004 14.980 1.00 0.00 C ATOM 1141 CD1 TYR A 67 0.776 -9.814 14.171 1.00 0.00 C ATOM 1142 CD2 TYR A 67 -0.979 -9.591 15.831 1.00 0.00 C ATOM 1143 CE1 TYR A 67 0.634 -11.207 14.211 1.00 0.00 C ATOM 1144 CE2 TYR A 67 -1.123 -10.985 15.870 1.00 0.00 C ATOM 1145 CZ TYR A 67 -0.315 -11.792 15.060 1.00 0.00 C ATOM 1146 OH TYR A 67 -0.453 -13.165 15.097 1.00 0.00 O ATOM 0 H TYR A 67 0.998 -5.127 15.039 1.00 0.00 H new ATOM 0 HA TYR A 67 0.904 -7.387 16.986 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.820 -7.010 15.141 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.448 -7.180 13.944 1.00 0.00 H new ATOM 0 HD1 TYR A 67 1.507 -9.365 13.515 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.600 -8.967 16.457 1.00 0.00 H new ATOM 0 HE1 TYR A 67 1.257 -11.831 13.587 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -1.856 -11.435 16.523 1.00 0.00 H new ATOM 0 HH TYR A 67 -0.968 -13.421 15.891 1.00 0.00 H new ATOM 1156 N TYR A 68 3.339 -7.126 14.790 1.00 0.00 N ATOM 1157 CA TYR A 68 4.662 -7.765 14.457 1.00 0.00 C ATOM 1158 C TYR A 68 5.852 -7.136 15.222 1.00 0.00 C ATOM 1159 O TYR A 68 6.965 -7.613 15.096 1.00 0.00 O ATOM 1160 CB TYR A 68 4.842 -7.592 12.940 1.00 0.00 C ATOM 1161 CG TYR A 68 4.246 -8.778 12.217 1.00 0.00 C ATOM 1162 CD1 TYR A 68 4.714 -10.068 12.492 1.00 0.00 C ATOM 1163 CD2 TYR A 68 3.227 -8.591 11.269 1.00 0.00 C ATOM 1164 CE1 TYR A 68 4.166 -11.171 11.824 1.00 0.00 C ATOM 1165 CE2 TYR A 68 2.681 -9.693 10.603 1.00 0.00 C ATOM 1166 CZ TYR A 68 3.150 -10.983 10.880 1.00 0.00 C ATOM 1167 OH TYR A 68 2.611 -12.069 10.221 1.00 0.00 O ATOM 0 H TYR A 68 3.133 -6.259 14.294 1.00 0.00 H new ATOM 0 HA TYR A 68 4.654 -8.812 14.759 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.359 -6.672 12.609 1.00 0.00 H new ATOM 0 HB3 TYR A 68 5.901 -7.501 12.698 1.00 0.00 H new ATOM 0 HD1 TYR A 68 5.498 -10.213 13.220 1.00 0.00 H new ATOM 0 HD2 TYR A 68 2.865 -7.596 11.054 1.00 0.00 H new ATOM 0 HE1 TYR A 68 4.528 -12.166 12.038 1.00 0.00 H new ATOM 0 HE2 TYR A 68 1.897 -9.549 9.874 1.00 0.00 H new ATOM 0 HH TYR A 68 1.916 -11.764 9.601 1.00 0.00 H new ATOM 1177 N LYS A 69 5.657 -6.094 16.013 1.00 0.00 N ATOM 1178 CA LYS A 69 6.818 -5.501 16.756 1.00 0.00 C ATOM 1179 C LYS A 69 6.416 -5.132 18.193 1.00 0.00 C ATOM 1180 O LYS A 69 6.999 -5.625 19.142 1.00 0.00 O ATOM 1181 CB LYS A 69 7.216 -4.250 15.971 1.00 0.00 C ATOM 1182 CG LYS A 69 7.751 -4.652 14.592 1.00 0.00 C ATOM 1183 CD LYS A 69 6.673 -4.414 13.527 1.00 0.00 C ATOM 1184 CE LYS A 69 7.017 -3.161 12.714 1.00 0.00 C ATOM 1185 NZ LYS A 69 8.129 -3.577 11.815 1.00 0.00 N ATOM 0 H LYS A 69 4.758 -5.639 16.171 1.00 0.00 H new ATOM 0 HA LYS A 69 7.644 -6.208 16.834 1.00 0.00 H new ATOM 0 HB2 LYS A 69 6.356 -3.590 15.859 1.00 0.00 H new ATOM 0 HB3 LYS A 69 7.976 -3.693 16.518 1.00 0.00 H new ATOM 0 HG2 LYS A 69 8.643 -4.073 14.355 1.00 0.00 H new ATOM 0 HG3 LYS A 69 8.044 -5.702 14.597 1.00 0.00 H new ATOM 0 HD2 LYS A 69 6.603 -5.279 12.868 1.00 0.00 H new ATOM 0 HD3 LYS A 69 5.699 -4.295 14.002 1.00 0.00 H new ATOM 0 HE2 LYS A 69 6.157 -2.813 12.142 1.00 0.00 H new ATOM 0 HE3 LYS A 69 7.321 -2.340 13.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 8.957 -2.971 11.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 8.380 -4.568 12.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 7.828 -3.483 10.824 1.00 0.00 H new ATOM 1199 N ARG A 70 5.429 -4.274 18.371 1.00 0.00 N ATOM 1200 CA ARG A 70 5.018 -3.899 19.775 1.00 0.00 C ATOM 1201 C ARG A 70 4.488 -5.131 20.532 1.00 0.00 C ATOM 1202 O ARG A 70 4.592 -5.202 21.742 1.00 0.00 O ATOM 1203 CB ARG A 70 3.909 -2.846 19.649 1.00 0.00 C ATOM 1204 CG ARG A 70 3.938 -1.924 20.869 1.00 0.00 C ATOM 1205 CD ARG A 70 5.159 -0.994 20.782 1.00 0.00 C ATOM 1206 NE ARG A 70 5.039 -0.025 21.932 1.00 0.00 N ATOM 1207 CZ ARG A 70 6.111 0.555 22.454 1.00 0.00 C ATOM 1208 NH1 ARG A 70 7.314 0.347 21.969 1.00 0.00 N ATOM 1209 NH2 ARG A 70 5.973 1.371 23.467 1.00 0.00 N ATOM 0 H ARG A 70 4.900 -3.825 17.624 1.00 0.00 H new ATOM 0 HA ARG A 70 5.870 -3.511 20.333 1.00 0.00 H new ATOM 0 HB2 ARG A 70 4.047 -2.265 18.737 1.00 0.00 H new ATOM 0 HB3 ARG A 70 2.937 -3.334 19.572 1.00 0.00 H new ATOM 0 HG2 ARG A 70 3.022 -1.335 20.915 1.00 0.00 H new ATOM 0 HG3 ARG A 70 3.983 -2.515 21.784 1.00 0.00 H new ATOM 0 HD2 ARG A 70 6.086 -1.563 20.849 1.00 0.00 H new ATOM 0 HD3 ARG A 70 5.177 -0.465 19.829 1.00 0.00 H new ATOM 0 HE ARG A 70 4.118 0.188 22.314 1.00 0.00 H new ATOM 0 HH11 ARG A 70 7.441 -0.274 21.170 1.00 0.00 H new ATOM 0 HH12 ARG A 70 8.121 0.807 22.391 1.00 0.00 H new ATOM 0 HH21 ARG A 70 5.046 1.557 23.849 1.00 0.00 H new ATOM 0 HH22 ARG A 70 6.793 1.821 23.874 1.00 0.00 H new ATOM 1223 N LYS A 71 3.910 -6.102 19.842 1.00 0.00 N ATOM 1224 CA LYS A 71 3.369 -7.316 20.537 1.00 0.00 C ATOM 1225 C LYS A 71 2.324 -6.905 21.583 1.00 0.00 C ATOM 1226 O LYS A 71 2.303 -7.425 22.682 1.00 0.00 O ATOM 1227 CB LYS A 71 4.568 -8.008 21.202 1.00 0.00 C ATOM 1228 CG LYS A 71 5.110 -9.096 20.271 1.00 0.00 C ATOM 1229 CD LYS A 71 5.617 -10.276 21.104 1.00 0.00 C ATOM 1230 CE LYS A 71 4.508 -11.323 21.236 1.00 0.00 C ATOM 1231 NZ LYS A 71 5.201 -12.635 21.102 1.00 0.00 N ATOM 0 H LYS A 71 3.793 -6.100 18.829 1.00 0.00 H new ATOM 0 HA LYS A 71 2.874 -7.989 19.837 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.348 -7.278 21.419 1.00 0.00 H new ATOM 0 HB3 LYS A 71 4.267 -8.446 22.154 1.00 0.00 H new ATOM 0 HG2 LYS A 71 4.328 -9.428 19.589 1.00 0.00 H new ATOM 0 HG3 LYS A 71 5.918 -8.696 19.659 1.00 0.00 H new ATOM 0 HD2 LYS A 71 6.494 -10.718 20.632 1.00 0.00 H new ATOM 0 HD3 LYS A 71 5.926 -9.932 22.091 1.00 0.00 H new ATOM 0 HE2 LYS A 71 4.000 -11.241 22.197 1.00 0.00 H new ATOM 0 HE3 LYS A 71 3.750 -11.196 20.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 4.506 -13.404 21.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 5.670 -12.687 20.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 5.912 -12.731 21.855 1.00 0.00 H new ATOM 1245 N ALA A 72 1.446 -5.986 21.240 1.00 0.00 N ATOM 1246 CA ALA A 72 0.392 -5.555 22.207 1.00 0.00 C ATOM 1247 C ALA A 72 -0.996 -5.948 21.672 1.00 0.00 C ATOM 1248 O ALA A 72 -1.956 -5.219 21.839 1.00 0.00 O ATOM 1249 CB ALA A 72 0.525 -4.034 22.294 1.00 0.00 C ATOM 0 H ALA A 72 1.418 -5.520 20.333 1.00 0.00 H new ATOM 0 HA ALA A 72 0.506 -6.024 23.184 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -0.219 -3.643 22.988 1.00 0.00 H new ATOM 0 HB2 ALA A 72 1.523 -3.776 22.648 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.366 -3.598 21.308 1.00 0.00 H new ATOM 1255 N ILE A 73 -1.111 -7.093 21.026 1.00 0.00 N ATOM 1256 CA ILE A 73 -2.439 -7.522 20.481 1.00 0.00 C ATOM 1257 C ILE A 73 -2.476 -9.053 20.316 1.00 0.00 C ATOM 1258 O ILE A 73 -1.443 -9.697 20.295 1.00 0.00 O ATOM 1259 CB ILE A 73 -2.554 -6.819 19.117 1.00 0.00 C ATOM 1260 CG1 ILE A 73 -3.883 -7.197 18.450 1.00 0.00 C ATOM 1261 CG2 ILE A 73 -1.392 -7.241 18.208 1.00 0.00 C ATOM 1262 CD1 ILE A 73 -4.063 -6.397 17.158 1.00 0.00 C ATOM 0 H ILE A 73 -0.343 -7.743 20.856 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.265 -7.259 21.142 1.00 0.00 H new ATOM 0 HB ILE A 73 -2.516 -5.741 19.272 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -3.900 -8.265 18.232 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -4.711 -6.997 19.130 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.482 -6.738 17.245 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -0.446 -6.965 18.674 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -1.421 -8.320 18.058 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.009 -6.670 16.690 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -4.066 -5.331 17.387 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -3.243 -6.619 16.475 1.00 0.00 H new ATOM 1274 N SER A 74 -3.647 -9.640 20.191 1.00 0.00 N ATOM 1275 CA SER A 74 -3.717 -11.124 20.020 1.00 0.00 C ATOM 1276 C SER A 74 -4.165 -11.467 18.591 1.00 0.00 C ATOM 1277 O SER A 74 -4.926 -10.733 17.991 1.00 0.00 O ATOM 1278 CB SER A 74 -4.753 -11.603 21.039 1.00 0.00 C ATOM 1279 OG SER A 74 -4.197 -11.530 22.344 1.00 0.00 O ATOM 0 H SER A 74 -4.546 -9.159 20.200 1.00 0.00 H new ATOM 0 HA SER A 74 -2.750 -11.602 20.177 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.651 -10.988 20.979 1.00 0.00 H new ATOM 0 HB3 SER A 74 -5.053 -12.627 20.816 1.00 0.00 H new ATOM 0 HG SER A 74 -4.859 -11.835 22.999 1.00 0.00 H new ATOM 1285 N LYS A 75 -3.694 -12.572 18.038 1.00 0.00 N ATOM 1286 CA LYS A 75 -4.097 -12.962 16.630 1.00 0.00 C ATOM 1287 C LYS A 75 -5.617 -12.806 16.408 1.00 0.00 C ATOM 1288 O LYS A 75 -6.047 -12.483 15.317 1.00 0.00 O ATOM 1289 CB LYS A 75 -3.700 -14.437 16.457 1.00 0.00 C ATOM 1290 CG LYS A 75 -3.513 -14.745 14.970 1.00 0.00 C ATOM 1291 CD LYS A 75 -3.670 -16.250 14.736 1.00 0.00 C ATOM 1292 CE LYS A 75 -2.728 -16.694 13.614 1.00 0.00 C ATOM 1293 NZ LYS A 75 -3.187 -15.949 12.409 1.00 0.00 N ATOM 0 H LYS A 75 -3.052 -13.219 18.496 1.00 0.00 H new ATOM 0 HA LYS A 75 -3.602 -12.315 15.906 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.778 -14.642 17.000 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -4.469 -15.083 16.879 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -4.246 -14.196 14.379 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.527 -14.416 14.641 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -3.445 -16.796 15.652 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -4.702 -16.482 14.472 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -1.691 -16.458 13.853 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -2.782 -17.771 13.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -2.840 -16.426 11.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -4.227 -15.921 12.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -2.815 -14.978 12.439 1.00 0.00 H new ATOM 1307 N ASP A 76 -6.434 -13.021 17.424 1.00 0.00 N ATOM 1308 CA ASP A 76 -7.920 -12.861 17.224 1.00 0.00 C ATOM 1309 C ASP A 76 -8.226 -11.410 16.831 1.00 0.00 C ATOM 1310 O ASP A 76 -8.899 -11.164 15.847 1.00 0.00 O ATOM 1311 CB ASP A 76 -8.595 -13.206 18.561 1.00 0.00 C ATOM 1312 CG ASP A 76 -8.622 -14.725 18.742 1.00 0.00 C ATOM 1313 OD1 ASP A 76 -8.983 -15.408 17.798 1.00 0.00 O ATOM 1314 OD2 ASP A 76 -8.282 -15.179 19.822 1.00 0.00 O ATOM 0 H ASP A 76 -6.144 -13.294 18.363 1.00 0.00 H new ATOM 0 HA ASP A 76 -8.288 -13.514 16.432 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -8.054 -12.741 19.385 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -9.610 -12.809 18.581 1.00 0.00 H new ATOM 1319 N LEU A 77 -7.720 -10.441 17.574 1.00 0.00 N ATOM 1320 CA LEU A 77 -7.985 -9.010 17.192 1.00 0.00 C ATOM 1321 C LEU A 77 -7.266 -8.716 15.870 1.00 0.00 C ATOM 1322 O LEU A 77 -7.827 -8.110 14.976 1.00 0.00 O ATOM 1323 CB LEU A 77 -7.421 -8.124 18.315 1.00 0.00 C ATOM 1324 CG LEU A 77 -7.716 -6.655 18.000 1.00 0.00 C ATOM 1325 CD1 LEU A 77 -9.202 -6.370 18.237 1.00 0.00 C ATOM 1326 CD2 LEU A 77 -6.869 -5.749 18.903 1.00 0.00 C ATOM 0 H LEU A 77 -7.149 -10.576 18.408 1.00 0.00 H new ATOM 0 HA LEU A 77 -9.050 -8.817 17.064 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -7.868 -8.400 19.270 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -6.346 -8.278 18.410 1.00 0.00 H new ATOM 0 HG LEU A 77 -7.468 -6.454 16.958 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -9.412 -5.324 18.013 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -9.803 -7.008 17.589 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -9.450 -6.575 19.278 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -7.083 -4.705 18.674 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -7.110 -5.949 19.947 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -5.812 -5.949 18.730 1.00 0.00 H new ATOM 1338 N TYR A 78 -6.030 -9.160 15.728 1.00 0.00 N ATOM 1339 CA TYR A 78 -5.295 -8.915 14.436 1.00 0.00 C ATOM 1340 C TYR A 78 -6.059 -9.583 13.277 1.00 0.00 C ATOM 1341 O TYR A 78 -6.150 -9.029 12.196 1.00 0.00 O ATOM 1342 CB TYR A 78 -3.888 -9.534 14.605 1.00 0.00 C ATOM 1343 CG TYR A 78 -3.097 -9.424 13.315 1.00 0.00 C ATOM 1344 CD1 TYR A 78 -3.089 -8.226 12.587 1.00 0.00 C ATOM 1345 CD2 TYR A 78 -2.365 -10.525 12.854 1.00 0.00 C ATOM 1346 CE1 TYR A 78 -2.353 -8.132 11.400 1.00 0.00 C ATOM 1347 CE2 TYR A 78 -1.629 -10.430 11.666 1.00 0.00 C ATOM 1348 CZ TYR A 78 -1.623 -9.233 10.940 1.00 0.00 C ATOM 1349 OH TYR A 78 -0.897 -9.139 9.770 1.00 0.00 O ATOM 0 H TYR A 78 -5.507 -9.673 16.438 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.216 -7.852 14.207 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.355 -9.026 15.409 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -3.978 -10.581 14.894 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -3.651 -7.375 12.942 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -2.368 -11.448 13.415 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -2.349 -7.209 10.839 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -1.066 -11.280 11.310 1.00 0.00 H new ATOM 0 HH TYR A 78 -0.448 -9.992 9.594 1.00 0.00 H new ATOM 1359 N ASP A 79 -6.631 -10.756 13.494 1.00 0.00 N ATOM 1360 CA ASP A 79 -7.407 -11.418 12.387 1.00 0.00 C ATOM 1361 C ASP A 79 -8.752 -10.698 12.221 1.00 0.00 C ATOM 1362 O ASP A 79 -9.192 -10.450 11.115 1.00 0.00 O ATOM 1363 CB ASP A 79 -7.625 -12.880 12.806 1.00 0.00 C ATOM 1364 CG ASP A 79 -8.017 -13.710 11.582 1.00 0.00 C ATOM 1365 OD1 ASP A 79 -7.123 -14.177 10.896 1.00 0.00 O ATOM 1366 OD2 ASP A 79 -9.205 -13.865 11.352 1.00 0.00 O ATOM 0 H ASP A 79 -6.594 -11.272 14.373 1.00 0.00 H new ATOM 0 HA ASP A 79 -6.876 -11.373 11.436 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -6.715 -13.280 13.254 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -8.406 -12.939 13.564 1.00 0.00 H new ATOM 1371 N TRP A 80 -9.404 -10.338 13.311 1.00 0.00 N ATOM 1372 CA TRP A 80 -10.717 -9.604 13.187 1.00 0.00 C ATOM 1373 C TRP A 80 -10.494 -8.295 12.408 1.00 0.00 C ATOM 1374 O TRP A 80 -11.316 -7.909 11.598 1.00 0.00 O ATOM 1375 CB TRP A 80 -11.192 -9.307 14.623 1.00 0.00 C ATOM 1376 CG TRP A 80 -12.499 -8.579 14.593 1.00 0.00 C ATOM 1377 CD1 TRP A 80 -13.708 -9.157 14.408 1.00 0.00 C ATOM 1378 CD2 TRP A 80 -12.748 -7.152 14.757 1.00 0.00 C ATOM 1379 NE1 TRP A 80 -14.683 -8.176 14.447 1.00 0.00 N ATOM 1380 CE2 TRP A 80 -14.140 -6.923 14.659 1.00 0.00 C ATOM 1381 CE3 TRP A 80 -11.909 -6.045 14.977 1.00 0.00 C ATOM 1382 CZ2 TRP A 80 -14.681 -5.642 14.776 1.00 0.00 C ATOM 1383 CZ3 TRP A 80 -12.450 -4.754 15.095 1.00 0.00 C ATOM 1384 CH2 TRP A 80 -13.832 -4.553 14.993 1.00 0.00 C ATOM 0 H TRP A 80 -9.091 -10.516 14.265 1.00 0.00 H new ATOM 0 HA TRP A 80 -11.463 -10.191 12.651 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -11.299 -10.239 15.179 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -10.445 -8.708 15.145 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -13.883 -10.212 14.255 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -15.681 -8.356 14.333 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -10.841 -6.188 15.056 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -15.748 -5.493 14.699 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -11.796 -3.911 15.265 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -14.242 -3.558 15.082 1.00 0.00 H new ATOM 1395 N LEU A 81 -9.383 -7.618 12.632 1.00 0.00 N ATOM 1396 CA LEU A 81 -9.125 -6.347 11.874 1.00 0.00 C ATOM 1397 C LEU A 81 -8.940 -6.673 10.387 1.00 0.00 C ATOM 1398 O LEU A 81 -9.630 -6.140 9.542 1.00 0.00 O ATOM 1399 CB LEU A 81 -7.825 -5.744 12.434 1.00 0.00 C ATOM 1400 CG LEU A 81 -8.017 -5.355 13.899 1.00 0.00 C ATOM 1401 CD1 LEU A 81 -6.664 -5.371 14.609 1.00 0.00 C ATOM 1402 CD2 LEU A 81 -8.608 -3.949 13.973 1.00 0.00 C ATOM 0 H LEU A 81 -8.657 -7.887 13.296 1.00 0.00 H new ATOM 0 HA LEU A 81 -9.956 -5.649 11.980 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -7.012 -6.465 12.344 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.540 -4.868 11.851 1.00 0.00 H new ATOM 0 HG LEU A 81 -8.691 -6.063 14.381 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -6.798 -5.094 15.655 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.235 -6.371 14.551 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.992 -4.660 14.128 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -8.747 -3.667 15.017 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -7.929 -3.243 13.494 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -9.570 -3.931 13.461 1.00 0.00 H new ATOM 1414 N ILE A 82 -8.009 -7.549 10.056 1.00 0.00 N ATOM 1415 CA ILE A 82 -7.793 -7.888 8.603 1.00 0.00 C ATOM 1416 C ILE A 82 -9.108 -8.391 7.952 1.00 0.00 C ATOM 1417 O ILE A 82 -9.299 -8.243 6.760 1.00 0.00 O ATOM 1418 CB ILE A 82 -6.654 -8.951 8.561 1.00 0.00 C ATOM 1419 CG1 ILE A 82 -5.886 -8.809 7.242 1.00 0.00 C ATOM 1420 CG2 ILE A 82 -7.195 -10.384 8.687 1.00 0.00 C ATOM 1421 CD1 ILE A 82 -4.662 -7.915 7.460 1.00 0.00 C ATOM 0 H ILE A 82 -7.401 -8.035 10.715 1.00 0.00 H new ATOM 0 HA ILE A 82 -7.501 -7.012 8.023 1.00 0.00 H new ATOM 0 HB ILE A 82 -5.996 -8.773 9.411 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.574 -9.790 6.882 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -6.532 -8.379 6.477 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -6.366 -11.090 8.653 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -7.724 -10.491 9.634 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -7.880 -10.588 7.864 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -4.115 -7.813 6.523 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -4.986 -6.931 7.800 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -4.013 -8.364 8.212 1.00 0.00 H new ATOM 1433 N LYS A 83 -10.016 -8.973 8.720 1.00 0.00 N ATOM 1434 CA LYS A 83 -11.303 -9.460 8.109 1.00 0.00 C ATOM 1435 C LYS A 83 -12.389 -8.360 8.113 1.00 0.00 C ATOM 1436 O LYS A 83 -13.350 -8.453 7.372 1.00 0.00 O ATOM 1437 CB LYS A 83 -11.759 -10.657 8.959 1.00 0.00 C ATOM 1438 CG LYS A 83 -11.135 -11.952 8.412 1.00 0.00 C ATOM 1439 CD LYS A 83 -12.233 -12.983 8.133 1.00 0.00 C ATOM 1440 CE LYS A 83 -13.014 -12.572 6.884 1.00 0.00 C ATOM 1441 NZ LYS A 83 -12.384 -13.332 5.769 1.00 0.00 N ATOM 0 H LYS A 83 -9.922 -9.128 9.724 1.00 0.00 H new ATOM 0 HA LYS A 83 -11.146 -9.738 7.067 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -11.463 -10.511 9.998 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -12.846 -10.732 8.944 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -10.581 -11.741 7.497 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -10.421 -12.354 9.131 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -11.792 -13.970 7.991 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -12.905 -13.054 8.988 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -14.072 -12.817 6.981 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -12.951 -11.497 6.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -12.866 -13.103 4.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -11.379 -13.073 5.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -12.466 -14.352 5.954 1.00 0.00 H new ATOM 1455 N GLU A 84 -12.262 -7.322 8.925 1.00 0.00 N ATOM 1456 CA GLU A 84 -13.317 -6.249 8.931 1.00 0.00 C ATOM 1457 C GLU A 84 -12.849 -4.978 8.181 1.00 0.00 C ATOM 1458 O GLU A 84 -13.330 -3.897 8.451 1.00 0.00 O ATOM 1459 CB GLU A 84 -13.550 -5.927 10.399 1.00 0.00 C ATOM 1460 CG GLU A 84 -14.122 -7.145 11.118 1.00 0.00 C ATOM 1461 CD GLU A 84 -15.513 -7.462 10.565 1.00 0.00 C ATOM 1462 OE1 GLU A 84 -15.587 -8.143 9.554 1.00 0.00 O ATOM 1463 OE2 GLU A 84 -16.481 -7.020 11.161 1.00 0.00 O ATOM 0 H GLU A 84 -11.486 -7.176 9.571 1.00 0.00 H new ATOM 0 HA GLU A 84 -14.220 -6.589 8.424 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -12.613 -5.626 10.867 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -14.237 -5.085 10.490 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -13.462 -8.002 10.983 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -14.181 -6.953 12.189 1.00 0.00 H new ATOM 1470 N LYS A 85 -11.922 -5.104 7.245 1.00 0.00 N ATOM 1471 CA LYS A 85 -11.402 -3.932 6.441 1.00 0.00 C ATOM 1472 C LYS A 85 -10.447 -3.054 7.258 1.00 0.00 C ATOM 1473 O LYS A 85 -10.762 -1.930 7.599 1.00 0.00 O ATOM 1474 CB LYS A 85 -12.608 -3.113 5.936 1.00 0.00 C ATOM 1475 CG LYS A 85 -13.631 -4.036 5.264 1.00 0.00 C ATOM 1476 CD LYS A 85 -13.082 -4.513 3.917 1.00 0.00 C ATOM 1477 CE LYS A 85 -12.405 -5.874 4.093 1.00 0.00 C ATOM 1478 NZ LYS A 85 -12.617 -6.579 2.799 1.00 0.00 N ATOM 0 H LYS A 85 -11.493 -5.996 6.998 1.00 0.00 H new ATOM 0 HA LYS A 85 -10.826 -4.309 5.596 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -13.074 -2.587 6.769 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -12.272 -2.355 5.229 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -13.842 -4.891 5.906 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -14.573 -3.507 5.118 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -13.890 -4.589 3.189 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -12.368 -3.788 3.526 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -11.343 -5.761 4.312 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -12.844 -6.429 4.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -12.180 -7.522 2.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -13.637 -6.678 2.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -12.182 -6.031 2.030 1.00 0.00 H new ATOM 1492 N TYR A 86 -9.266 -3.558 7.559 1.00 0.00 N ATOM 1493 CA TYR A 86 -8.272 -2.758 8.332 1.00 0.00 C ATOM 1494 C TYR A 86 -6.910 -2.834 7.632 1.00 0.00 C ATOM 1495 O TYR A 86 -6.394 -1.842 7.155 1.00 0.00 O ATOM 1496 CB TYR A 86 -8.197 -3.422 9.708 1.00 0.00 C ATOM 1497 CG TYR A 86 -9.421 -3.073 10.518 1.00 0.00 C ATOM 1498 CD1 TYR A 86 -10.675 -3.600 10.175 1.00 0.00 C ATOM 1499 CD2 TYR A 86 -9.296 -2.222 11.622 1.00 0.00 C ATOM 1500 CE1 TYR A 86 -11.799 -3.269 10.945 1.00 0.00 C ATOM 1501 CE2 TYR A 86 -10.420 -1.896 12.387 1.00 0.00 C ATOM 1502 CZ TYR A 86 -11.671 -2.418 12.048 1.00 0.00 C ATOM 1503 OH TYR A 86 -12.781 -2.096 12.804 1.00 0.00 O ATOM 0 H TYR A 86 -8.954 -4.493 7.298 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.551 -1.707 8.409 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -8.122 -4.504 9.595 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -7.299 -3.093 10.231 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -10.774 -4.257 9.323 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -8.330 -1.816 11.883 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -12.767 -3.672 10.686 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -10.321 -1.241 13.240 1.00 0.00 H new ATOM 0 HH TYR A 86 -12.496 -1.793 13.691 1.00 0.00 H new ATOM 1513 N ALA A 87 -6.327 -4.013 7.557 1.00 0.00 N ATOM 1514 CA ALA A 87 -5.006 -4.160 6.878 1.00 0.00 C ATOM 1515 C ALA A 87 -5.070 -5.310 5.863 1.00 0.00 C ATOM 1516 O ALA A 87 -6.107 -5.926 5.692 1.00 0.00 O ATOM 1517 CB ALA A 87 -4.018 -4.487 7.999 1.00 0.00 C ATOM 0 H ALA A 87 -6.714 -4.876 7.939 1.00 0.00 H new ATOM 0 HA ALA A 87 -4.715 -3.263 6.332 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -3.020 -4.611 7.579 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -4.009 -3.674 8.724 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -4.321 -5.410 8.493 1.00 0.00 H new ATOM 1523 N ASP A 88 -3.982 -5.607 5.182 1.00 0.00 N ATOM 1524 CA ASP A 88 -4.009 -6.718 4.183 1.00 0.00 C ATOM 1525 C ASP A 88 -2.817 -7.663 4.393 1.00 0.00 C ATOM 1526 O ASP A 88 -1.676 -7.241 4.373 1.00 0.00 O ATOM 1527 CB ASP A 88 -3.909 -6.025 2.826 1.00 0.00 C ATOM 1528 CG ASP A 88 -4.456 -6.953 1.738 1.00 0.00 C ATOM 1529 OD1 ASP A 88 -3.727 -7.838 1.321 1.00 0.00 O ATOM 1530 OD2 ASP A 88 -5.593 -6.761 1.341 1.00 0.00 O ATOM 0 H ASP A 88 -3.086 -5.129 5.277 1.00 0.00 H new ATOM 0 HA ASP A 88 -4.909 -7.327 4.270 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -4.472 -5.092 2.840 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -2.871 -5.768 2.612 1.00 0.00 H new ATOM 1535 N LYS A 89 -3.070 -8.944 4.581 1.00 0.00 N ATOM 1536 CA LYS A 89 -1.928 -9.906 4.776 1.00 0.00 C ATOM 1537 C LYS A 89 -1.222 -10.159 3.434 1.00 0.00 C ATOM 1538 O LYS A 89 -0.014 -10.299 3.388 1.00 0.00 O ATOM 1539 CB LYS A 89 -2.535 -11.211 5.314 1.00 0.00 C ATOM 1540 CG LYS A 89 -2.675 -11.120 6.835 1.00 0.00 C ATOM 1541 CD LYS A 89 -3.626 -12.213 7.327 1.00 0.00 C ATOM 1542 CE LYS A 89 -3.183 -12.692 8.711 1.00 0.00 C ATOM 1543 NZ LYS A 89 -4.412 -13.259 9.333 1.00 0.00 N ATOM 0 H LYS A 89 -4.001 -9.359 4.608 1.00 0.00 H new ATOM 0 HA LYS A 89 -1.189 -9.507 5.471 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -3.510 -11.386 4.858 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -1.901 -12.057 5.046 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -1.699 -11.232 7.308 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -3.055 -10.138 7.118 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -4.645 -11.829 7.373 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -3.631 -13.048 6.626 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -2.396 -13.443 8.636 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -2.783 -11.870 9.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -4.149 -13.843 10.152 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -5.032 -12.485 9.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -4.915 -13.846 8.637 1.00 0.00 H new ATOM 1557 N LEU A 90 -1.957 -10.219 2.337 1.00 0.00 N ATOM 1558 CA LEU A 90 -1.290 -10.463 1.007 1.00 0.00 C ATOM 1559 C LEU A 90 -0.282 -9.339 0.717 1.00 0.00 C ATOM 1560 O LEU A 90 0.824 -9.601 0.281 1.00 0.00 O ATOM 1561 CB LEU A 90 -2.404 -10.477 -0.055 1.00 0.00 C ATOM 1562 CG LEU A 90 -1.800 -10.776 -1.428 1.00 0.00 C ATOM 1563 CD1 LEU A 90 -1.527 -12.276 -1.551 1.00 0.00 C ATOM 1564 CD2 LEU A 90 -2.784 -10.347 -2.520 1.00 0.00 C ATOM 0 H LEU A 90 -2.971 -10.112 2.305 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.745 -11.407 1.003 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -3.151 -11.230 0.197 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -2.915 -9.514 -0.073 1.00 0.00 H new ATOM 0 HG LEU A 90 -0.865 -10.227 -1.541 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -1.097 -12.488 -2.530 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -0.829 -12.584 -0.773 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -2.461 -12.826 -1.438 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -2.356 -10.559 -3.500 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.718 -10.898 -2.405 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -2.980 -9.278 -2.434 1.00 0.00 H new ATOM 1576 N LEU A 91 -0.640 -8.092 0.969 1.00 0.00 N ATOM 1577 CA LEU A 91 0.343 -6.980 0.712 1.00 0.00 C ATOM 1578 C LEU A 91 1.499 -7.112 1.710 1.00 0.00 C ATOM 1579 O LEU A 91 2.657 -7.090 1.329 1.00 0.00 O ATOM 1580 CB LEU A 91 -0.409 -5.649 0.913 1.00 0.00 C ATOM 1581 CG LEU A 91 0.557 -4.468 0.741 1.00 0.00 C ATOM 1582 CD1 LEU A 91 1.126 -4.456 -0.682 1.00 0.00 C ATOM 1583 CD2 LEU A 91 -0.192 -3.159 0.996 1.00 0.00 C ATOM 0 H LEU A 91 -1.548 -7.802 1.333 1.00 0.00 H new ATOM 0 HA LEU A 91 0.752 -7.021 -0.297 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -1.224 -5.570 0.194 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -0.857 -5.621 1.906 1.00 0.00 H new ATOM 0 HG LEU A 91 1.376 -4.571 1.453 1.00 0.00 H new ATOM 0 HD11 LEU A 91 1.810 -3.615 -0.793 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.663 -5.387 -0.867 1.00 0.00 H new ATOM 0 HD13 LEU A 91 0.311 -4.358 -1.399 1.00 0.00 H new ATOM 0 HD21 LEU A 91 0.492 -2.319 0.874 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -1.013 -3.065 0.285 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -0.590 -3.159 2.011 1.00 0.00 H new ATOM 1595 N ILE A 92 1.203 -7.279 2.989 1.00 0.00 N ATOM 1596 CA ILE A 92 2.318 -7.447 3.991 1.00 0.00 C ATOM 1597 C ILE A 92 3.162 -8.674 3.588 1.00 0.00 C ATOM 1598 O ILE A 92 4.375 -8.644 3.663 1.00 0.00 O ATOM 1599 CB ILE A 92 1.653 -7.647 5.373 1.00 0.00 C ATOM 1600 CG1 ILE A 92 0.966 -6.338 5.794 1.00 0.00 C ATOM 1601 CG2 ILE A 92 2.714 -8.022 6.417 1.00 0.00 C ATOM 1602 CD1 ILE A 92 0.270 -6.514 7.151 1.00 0.00 C ATOM 0 H ILE A 92 0.259 -7.306 3.374 1.00 0.00 H new ATOM 0 HA ILE A 92 2.980 -6.582 4.025 1.00 0.00 H new ATOM 0 HB ILE A 92 0.918 -8.450 5.307 1.00 0.00 H new ATOM 0 HG12 ILE A 92 1.702 -5.537 5.857 1.00 0.00 H new ATOM 0 HG13 ILE A 92 0.237 -6.043 5.039 1.00 0.00 H new ATOM 0 HG21 ILE A 92 2.237 -8.161 7.387 1.00 0.00 H new ATOM 0 HG22 ILE A 92 3.206 -8.948 6.119 1.00 0.00 H new ATOM 0 HG23 ILE A 92 3.453 -7.224 6.487 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -0.212 -5.579 7.437 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -0.480 -7.301 7.076 1.00 0.00 H new ATOM 0 HD13 ILE A 92 1.008 -6.787 7.906 1.00 0.00 H new ATOM 1614 N ALA A 93 2.530 -9.745 3.137 1.00 0.00 N ATOM 1615 CA ALA A 93 3.324 -10.951 2.709 1.00 0.00 C ATOM 1616 C ALA A 93 4.236 -10.572 1.531 1.00 0.00 C ATOM 1617 O ALA A 93 5.370 -11.009 1.462 1.00 0.00 O ATOM 1618 CB ALA A 93 2.311 -12.022 2.274 1.00 0.00 C ATOM 0 H ALA A 93 1.518 -9.834 3.049 1.00 0.00 H new ATOM 0 HA ALA A 93 3.952 -11.322 3.519 1.00 0.00 H new ATOM 0 HB1 ALA A 93 2.843 -12.918 1.954 1.00 0.00 H new ATOM 0 HB2 ALA A 93 1.658 -12.267 3.112 1.00 0.00 H new ATOM 0 HB3 ALA A 93 1.712 -11.641 1.447 1.00 0.00 H new ATOM 1624 N LYS A 94 3.761 -9.756 0.603 1.00 0.00 N ATOM 1625 CA LYS A 94 4.637 -9.358 -0.559 1.00 0.00 C ATOM 1626 C LYS A 94 5.902 -8.664 -0.031 1.00 0.00 C ATOM 1627 O LYS A 94 7.000 -8.959 -0.466 1.00 0.00 O ATOM 1628 CB LYS A 94 3.830 -8.369 -1.422 1.00 0.00 C ATOM 1629 CG LYS A 94 2.919 -9.125 -2.396 1.00 0.00 C ATOM 1630 CD LYS A 94 3.762 -9.984 -3.343 1.00 0.00 C ATOM 1631 CE LYS A 94 3.089 -10.039 -4.721 1.00 0.00 C ATOM 1632 NZ LYS A 94 3.061 -11.484 -5.084 1.00 0.00 N ATOM 0 H LYS A 94 2.823 -9.356 0.600 1.00 0.00 H new ATOM 0 HA LYS A 94 4.933 -10.231 -1.141 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.230 -7.723 -0.781 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.510 -7.723 -1.978 1.00 0.00 H new ATOM 0 HG2 LYS A 94 2.224 -9.756 -1.842 1.00 0.00 H new ATOM 0 HG3 LYS A 94 2.320 -8.418 -2.970 1.00 0.00 H new ATOM 0 HD2 LYS A 94 4.765 -9.567 -3.433 1.00 0.00 H new ATOM 0 HD3 LYS A 94 3.870 -10.991 -2.939 1.00 0.00 H new ATOM 0 HE2 LYS A 94 2.082 -9.622 -4.685 1.00 0.00 H new ATOM 0 HE3 LYS A 94 3.648 -9.459 -5.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 2.614 -11.599 -6.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 4.033 -11.852 -5.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 2.516 -12.010 -4.371 1.00 0.00 H new ATOM 1646 N TRP A 95 5.760 -7.749 0.910 1.00 0.00 N ATOM 1647 CA TRP A 95 6.979 -7.054 1.457 1.00 0.00 C ATOM 1648 C TRP A 95 7.875 -8.071 2.179 1.00 0.00 C ATOM 1649 O TRP A 95 9.082 -8.048 2.038 1.00 0.00 O ATOM 1650 CB TRP A 95 6.482 -5.986 2.450 1.00 0.00 C ATOM 1651 CG TRP A 95 6.083 -4.737 1.719 1.00 0.00 C ATOM 1652 CD1 TRP A 95 6.701 -4.232 0.622 1.00 0.00 C ATOM 1653 CD2 TRP A 95 4.990 -3.821 2.024 1.00 0.00 C ATOM 1654 NE1 TRP A 95 6.055 -3.072 0.238 1.00 0.00 N ATOM 1655 CE2 TRP A 95 4.995 -2.776 1.069 1.00 0.00 C ATOM 1656 CE3 TRP A 95 4.003 -3.797 3.027 1.00 0.00 C ATOM 1657 CZ2 TRP A 95 4.058 -1.745 1.107 1.00 0.00 C ATOM 1658 CZ3 TRP A 95 3.057 -2.758 3.068 1.00 0.00 C ATOM 1659 CH2 TRP A 95 3.085 -1.735 2.108 1.00 0.00 C ATOM 0 H TRP A 95 4.870 -7.458 1.316 1.00 0.00 H new ATOM 0 HA TRP A 95 7.562 -6.596 0.658 1.00 0.00 H new ATOM 0 HB2 TRP A 95 5.633 -6.372 3.014 1.00 0.00 H new ATOM 0 HB3 TRP A 95 7.267 -5.758 3.171 1.00 0.00 H new ATOM 0 HD1 TRP A 95 7.558 -4.666 0.129 1.00 0.00 H new ATOM 0 HE1 TRP A 95 6.329 -2.504 -0.563 1.00 0.00 H new ATOM 0 HE3 TRP A 95 3.972 -4.581 3.769 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.084 -0.959 0.367 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 2.305 -2.747 3.843 1.00 0.00 H new ATOM 0 HH2 TRP A 95 2.354 -0.940 2.143 1.00 0.00 H new ATOM 1670 N ARG A 96 7.292 -8.970 2.946 1.00 0.00 N ATOM 1671 CA ARG A 96 8.135 -9.995 3.667 1.00 0.00 C ATOM 1672 C ARG A 96 8.831 -10.929 2.660 1.00 0.00 C ATOM 1673 O ARG A 96 9.921 -11.403 2.915 1.00 0.00 O ATOM 1674 CB ARG A 96 7.184 -10.799 4.573 1.00 0.00 C ATOM 1675 CG ARG A 96 7.093 -10.128 5.953 1.00 0.00 C ATOM 1676 CD ARG A 96 5.625 -9.978 6.366 1.00 0.00 C ATOM 1677 NE ARG A 96 5.084 -11.372 6.400 1.00 0.00 N ATOM 1678 CZ ARG A 96 5.373 -12.197 7.394 1.00 0.00 C ATOM 1679 NH1 ARG A 96 6.146 -11.828 8.390 1.00 0.00 N ATOM 1680 NH2 ARG A 96 4.881 -13.410 7.390 1.00 0.00 N ATOM 0 H ARG A 96 6.287 -9.041 3.104 1.00 0.00 H new ATOM 0 HA ARG A 96 8.916 -9.510 4.253 1.00 0.00 H new ATOM 0 HB2 ARG A 96 6.195 -10.855 4.119 1.00 0.00 H new ATOM 0 HB3 ARG A 96 7.545 -11.822 4.678 1.00 0.00 H new ATOM 0 HG2 ARG A 96 7.628 -10.724 6.692 1.00 0.00 H new ATOM 0 HG3 ARG A 96 7.573 -9.150 5.923 1.00 0.00 H new ATOM 0 HD2 ARG A 96 5.537 -9.497 7.340 1.00 0.00 H new ATOM 0 HD3 ARG A 96 5.077 -9.360 5.655 1.00 0.00 H new ATOM 0 HE ARG A 96 4.481 -11.693 5.643 1.00 0.00 H new ATOM 0 HH11 ARG A 96 6.539 -10.887 8.409 1.00 0.00 H new ATOM 0 HH12 ARG A 96 6.354 -12.483 9.144 1.00 0.00 H new ATOM 0 HH21 ARG A 96 4.279 -13.714 6.624 1.00 0.00 H new ATOM 0 HH22 ARG A 96 5.099 -14.051 8.152 1.00 0.00 H new ATOM 1694 N LYS A 97 8.219 -11.202 1.520 1.00 0.00 N ATOM 1695 CA LYS A 97 8.879 -12.115 0.511 1.00 0.00 C ATOM 1696 C LYS A 97 10.291 -11.608 0.167 1.00 0.00 C ATOM 1697 O LYS A 97 10.750 -10.624 0.714 1.00 0.00 O ATOM 1698 CB LYS A 97 8.007 -12.076 -0.754 1.00 0.00 C ATOM 1699 CG LYS A 97 6.942 -13.169 -0.693 1.00 0.00 C ATOM 1700 CD LYS A 97 7.604 -14.541 -0.844 1.00 0.00 C ATOM 1701 CE LYS A 97 6.867 -15.562 0.025 1.00 0.00 C ATOM 1702 NZ LYS A 97 5.785 -16.098 -0.846 1.00 0.00 N ATOM 0 H LYS A 97 7.306 -10.839 1.247 1.00 0.00 H new ATOM 0 HA LYS A 97 8.970 -13.125 0.911 1.00 0.00 H new ATOM 0 HB2 LYS A 97 7.532 -11.100 -0.847 1.00 0.00 H new ATOM 0 HB3 LYS A 97 8.629 -12.213 -1.638 1.00 0.00 H new ATOM 0 HG2 LYS A 97 6.405 -13.115 0.254 1.00 0.00 H new ATOM 0 HG3 LYS A 97 6.207 -13.019 -1.484 1.00 0.00 H new ATOM 0 HD2 LYS A 97 7.583 -14.854 -1.888 1.00 0.00 H new ATOM 0 HD3 LYS A 97 8.652 -14.485 -0.549 1.00 0.00 H new ATOM 0 HE2 LYS A 97 7.537 -16.356 0.356 1.00 0.00 H new ATOM 0 HE3 LYS A 97 6.458 -15.096 0.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 5.234 -16.806 -0.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 5.159 -15.321 -1.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 6.205 -16.542 -1.688 1.00 0.00 H new ATOM 1716 N THR A 98 10.980 -12.266 -0.746 1.00 0.00 N ATOM 1717 CA THR A 98 12.351 -11.803 -1.123 1.00 0.00 C ATOM 1718 C THR A 98 12.322 -11.175 -2.523 1.00 0.00 C ATOM 1719 O THR A 98 11.742 -11.727 -3.440 1.00 0.00 O ATOM 1720 CB THR A 98 13.232 -13.058 -1.112 1.00 0.00 C ATOM 1721 OG1 THR A 98 12.419 -14.211 -1.286 1.00 0.00 O ATOM 1722 CG2 THR A 98 13.973 -13.149 0.222 1.00 0.00 C ATOM 0 H THR A 98 10.650 -13.096 -1.239 1.00 0.00 H new ATOM 0 HA THR A 98 12.731 -11.047 -0.436 1.00 0.00 H new ATOM 0 HB THR A 98 13.956 -13.001 -1.925 1.00 0.00 H new ATOM 0 HG1 THR A 98 12.983 -15.013 -1.281 1.00 0.00 H new ATOM 0 HG21 THR A 98 14.599 -14.041 0.230 1.00 0.00 H new ATOM 0 HG22 THR A 98 14.598 -12.266 0.352 1.00 0.00 H new ATOM 0 HG23 THR A 98 13.251 -13.205 1.036 1.00 0.00 H new ATOM 1730 N GLY A 99 12.931 -10.021 -2.697 1.00 0.00 N ATOM 1731 CA GLY A 99 12.922 -9.363 -4.037 1.00 0.00 C ATOM 1732 C GLY A 99 11.860 -8.239 -4.101 1.00 0.00 C ATOM 1733 O GLY A 99 11.671 -7.646 -5.146 1.00 0.00 O ATOM 0 H GLY A 99 13.431 -9.512 -1.968 1.00 0.00 H new ATOM 0 HA2 GLY A 99 13.908 -8.948 -4.248 1.00 0.00 H new ATOM 0 HA3 GLY A 99 12.717 -10.105 -4.808 1.00 0.00 H new ATOM 1737 N TYR A 100 11.168 -7.927 -3.013 1.00 0.00 N ATOM 1738 CA TYR A 100 10.145 -6.835 -3.072 1.00 0.00 C ATOM 1739 C TYR A 100 10.626 -5.619 -2.267 1.00 0.00 C ATOM 1740 O TYR A 100 9.881 -5.056 -1.486 1.00 0.00 O ATOM 1741 CB TYR A 100 8.879 -7.424 -2.443 1.00 0.00 C ATOM 1742 CG TYR A 100 8.230 -8.386 -3.409 1.00 0.00 C ATOM 1743 CD1 TYR A 100 7.705 -7.918 -4.619 1.00 0.00 C ATOM 1744 CD2 TYR A 100 8.150 -9.745 -3.091 1.00 0.00 C ATOM 1745 CE1 TYR A 100 7.100 -8.812 -5.512 1.00 0.00 C ATOM 1746 CE2 TYR A 100 7.546 -10.641 -3.980 1.00 0.00 C ATOM 1747 CZ TYR A 100 7.021 -10.174 -5.192 1.00 0.00 C ATOM 1748 OH TYR A 100 6.425 -11.056 -6.071 1.00 0.00 O ATOM 0 H TYR A 100 11.272 -8.379 -2.105 1.00 0.00 H new ATOM 0 HA TYR A 100 9.967 -6.498 -4.093 1.00 0.00 H new ATOM 0 HB2 TYR A 100 9.128 -7.938 -1.515 1.00 0.00 H new ATOM 0 HB3 TYR A 100 8.183 -6.625 -2.188 1.00 0.00 H new ATOM 0 HD1 TYR A 100 7.766 -6.868 -4.864 1.00 0.00 H new ATOM 0 HD2 TYR A 100 8.555 -10.104 -2.157 1.00 0.00 H new ATOM 0 HE1 TYR A 100 6.695 -8.452 -6.446 1.00 0.00 H new ATOM 0 HE2 TYR A 100 7.485 -11.690 -3.732 1.00 0.00 H new ATOM 0 HH TYR A 100 6.455 -11.961 -5.697 1.00 0.00 H new ATOM 1758 N GLU A 101 11.864 -5.202 -2.451 1.00 0.00 N ATOM 1759 CA GLU A 101 12.370 -4.009 -1.681 1.00 0.00 C ATOM 1760 C GLU A 101 11.524 -2.771 -2.022 1.00 0.00 C ATOM 1761 O GLU A 101 11.211 -1.976 -1.155 1.00 0.00 O ATOM 1762 CB GLU A 101 13.829 -3.787 -2.111 1.00 0.00 C ATOM 1763 CG GLU A 101 14.753 -4.649 -1.249 1.00 0.00 C ATOM 1764 CD GLU A 101 16.084 -4.855 -1.973 1.00 0.00 C ATOM 1765 OE1 GLU A 101 16.141 -5.720 -2.833 1.00 0.00 O ATOM 1766 OE2 GLU A 101 17.024 -4.144 -1.658 1.00 0.00 O ATOM 0 H GLU A 101 12.536 -5.627 -3.090 1.00 0.00 H new ATOM 0 HA GLU A 101 12.303 -4.177 -0.606 1.00 0.00 H new ATOM 0 HB2 GLU A 101 13.952 -4.044 -3.163 1.00 0.00 H new ATOM 0 HB3 GLU A 101 14.094 -2.735 -2.006 1.00 0.00 H new ATOM 0 HG2 GLU A 101 14.922 -4.168 -0.286 1.00 0.00 H new ATOM 0 HG3 GLU A 101 14.285 -5.612 -1.047 1.00 0.00 H new ATOM 1773 N LYS A 102 11.150 -2.601 -3.274 1.00 0.00 N ATOM 1774 CA LYS A 102 10.326 -1.416 -3.655 1.00 0.00 C ATOM 1775 C LYS A 102 8.948 -1.877 -4.160 1.00 0.00 C ATOM 1776 O LYS A 102 8.815 -2.331 -5.281 1.00 0.00 O ATOM 1777 CB LYS A 102 11.118 -0.728 -4.769 1.00 0.00 C ATOM 1778 CG LYS A 102 12.475 -0.252 -4.221 1.00 0.00 C ATOM 1779 CD LYS A 102 12.607 1.270 -4.380 1.00 0.00 C ATOM 1780 CE LYS A 102 13.574 1.592 -5.524 1.00 0.00 C ATOM 1781 NZ LYS A 102 14.295 2.818 -5.083 1.00 0.00 N ATOM 0 H LYS A 102 11.382 -3.232 -4.041 1.00 0.00 H new ATOM 0 HA LYS A 102 10.144 -0.743 -2.817 1.00 0.00 H new ATOM 0 HB2 LYS A 102 11.272 -1.418 -5.599 1.00 0.00 H new ATOM 0 HB3 LYS A 102 10.555 0.120 -5.159 1.00 0.00 H new ATOM 0 HG2 LYS A 102 12.567 -0.524 -3.170 1.00 0.00 H new ATOM 0 HG3 LYS A 102 13.285 -0.752 -4.752 1.00 0.00 H new ATOM 0 HD2 LYS A 102 11.630 1.709 -4.583 1.00 0.00 H new ATOM 0 HD3 LYS A 102 12.968 1.712 -3.451 1.00 0.00 H new ATOM 0 HE2 LYS A 102 14.266 0.768 -5.700 1.00 0.00 H new ATOM 0 HE3 LYS A 102 13.038 1.763 -6.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 14.977 3.102 -5.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 13.611 3.587 -4.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 14.801 2.623 -4.196 1.00 0.00 H new ATOM 1795 N LEU A 103 7.923 -1.776 -3.337 1.00 0.00 N ATOM 1796 CA LEU A 103 6.564 -2.220 -3.765 1.00 0.00 C ATOM 1797 C LEU A 103 5.512 -1.192 -3.287 1.00 0.00 C ATOM 1798 O LEU A 103 5.605 -0.676 -2.189 1.00 0.00 O ATOM 1799 CB LEU A 103 6.409 -3.610 -3.099 1.00 0.00 C ATOM 1800 CG LEU A 103 4.954 -3.905 -2.694 1.00 0.00 C ATOM 1801 CD1 LEU A 103 4.045 -3.842 -3.927 1.00 0.00 C ATOM 1802 CD2 LEU A 103 4.879 -5.298 -2.063 1.00 0.00 C ATOM 0 H LEU A 103 7.976 -1.404 -2.389 1.00 0.00 H new ATOM 0 HA LEU A 103 6.427 -2.288 -4.844 1.00 0.00 H new ATOM 0 HB2 LEU A 103 6.756 -4.381 -3.787 1.00 0.00 H new ATOM 0 HB3 LEU A 103 7.047 -3.661 -2.217 1.00 0.00 H new ATOM 0 HG LEU A 103 4.620 -3.160 -1.972 1.00 0.00 H new ATOM 0 HD11 LEU A 103 3.017 -4.052 -3.632 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.100 -2.847 -4.369 1.00 0.00 H new ATOM 0 HD13 LEU A 103 4.371 -4.582 -4.658 1.00 0.00 H new ATOM 0 HD21 LEU A 103 3.850 -5.512 -1.774 1.00 0.00 H new ATOM 0 HD22 LEU A 103 5.216 -6.043 -2.784 1.00 0.00 H new ATOM 0 HD23 LEU A 103 5.518 -5.333 -1.181 1.00 0.00 H new ATOM 1814 N CYS A 104 4.520 -0.886 -4.104 1.00 0.00 N ATOM 1815 CA CYS A 104 3.489 0.115 -3.676 1.00 0.00 C ATOM 1816 C CYS A 104 2.093 -0.518 -3.460 1.00 0.00 C ATOM 1817 O CYS A 104 1.400 -0.132 -2.542 1.00 0.00 O ATOM 1818 CB CYS A 104 3.479 1.212 -4.755 1.00 0.00 C ATOM 1819 SG CYS A 104 2.992 0.574 -6.384 1.00 0.00 S ATOM 0 H CYS A 104 4.385 -1.282 -5.034 1.00 0.00 H new ATOM 0 HA CYS A 104 3.743 0.533 -2.702 1.00 0.00 H new ATOM 0 HB2 CYS A 104 2.792 2.004 -4.458 1.00 0.00 H new ATOM 0 HB3 CYS A 104 4.471 1.659 -4.824 1.00 0.00 H new ATOM 1824 N CYS A 105 1.662 -1.476 -4.261 1.00 0.00 N ATOM 1825 CA CYS A 105 0.302 -2.086 -4.016 1.00 0.00 C ATOM 1826 C CYS A 105 0.333 -3.600 -4.306 1.00 0.00 C ATOM 1827 O CYS A 105 1.384 -4.175 -4.507 1.00 0.00 O ATOM 1828 CB CYS A 105 -0.688 -1.424 -4.985 1.00 0.00 C ATOM 1829 SG CYS A 105 -0.454 0.375 -5.108 1.00 0.00 S ATOM 0 H CYS A 105 2.178 -1.855 -5.055 1.00 0.00 H new ATOM 0 HA CYS A 105 0.010 -1.930 -2.977 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -0.575 -1.869 -5.973 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -1.706 -1.632 -4.656 1.00 0.00 H new ATOM 1834 N LEU A 106 -0.821 -4.249 -4.348 1.00 0.00 N ATOM 1835 CA LEU A 106 -0.843 -5.723 -4.647 1.00 0.00 C ATOM 1836 C LEU A 106 -1.128 -5.960 -6.140 1.00 0.00 C ATOM 1837 O LEU A 106 -0.528 -6.823 -6.753 1.00 0.00 O ATOM 1838 CB LEU A 106 -1.956 -6.320 -3.779 1.00 0.00 C ATOM 1839 CG LEU A 106 -1.409 -6.613 -2.382 1.00 0.00 C ATOM 1840 CD1 LEU A 106 -2.548 -7.096 -1.482 1.00 0.00 C ATOM 1841 CD2 LEU A 106 -0.329 -7.700 -2.467 1.00 0.00 C ATOM 0 H LEU A 106 -1.735 -3.824 -4.190 1.00 0.00 H new ATOM 0 HA LEU A 106 0.117 -6.190 -4.427 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -2.794 -5.626 -3.715 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -2.334 -7.236 -4.233 1.00 0.00 H new ATOM 0 HG LEU A 106 -0.974 -5.704 -1.966 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.160 -7.306 -0.485 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.314 -6.323 -1.418 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.982 -8.004 -1.901 1.00 0.00 H new ATOM 0 HD21 LEU A 106 0.059 -7.906 -1.469 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -0.761 -8.610 -2.884 1.00 0.00 H new ATOM 0 HD23 LEU A 106 0.483 -7.357 -3.108 1.00 0.00 H new ATOM 1853 N ARG A 107 -2.007 -5.180 -6.748 1.00 0.00 N ATOM 1854 CA ARG A 107 -2.276 -5.356 -8.219 1.00 0.00 C ATOM 1855 C ARG A 107 -1.517 -4.275 -9.026 1.00 0.00 C ATOM 1856 O ARG A 107 -1.950 -3.865 -10.085 1.00 0.00 O ATOM 1857 CB ARG A 107 -3.790 -5.193 -8.389 1.00 0.00 C ATOM 1858 CG ARG A 107 -4.214 -5.750 -9.750 1.00 0.00 C ATOM 1859 CD ARG A 107 -5.722 -5.526 -9.951 1.00 0.00 C ATOM 1860 NE ARG A 107 -6.395 -6.829 -9.603 1.00 0.00 N ATOM 1861 CZ ARG A 107 -7.575 -7.150 -10.116 1.00 0.00 C ATOM 1862 NH1 ARG A 107 -8.227 -6.331 -10.911 1.00 0.00 N ATOM 1863 NH2 ARG A 107 -8.119 -8.299 -9.811 1.00 0.00 N ATOM 0 H ARG A 107 -2.542 -4.440 -6.294 1.00 0.00 H new ATOM 0 HA ARG A 107 -1.940 -6.327 -8.582 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -4.315 -5.717 -7.590 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -4.064 -4.141 -8.314 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -3.654 -5.259 -10.546 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -3.983 -6.814 -9.807 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -6.083 -4.720 -9.313 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -5.938 -5.240 -10.980 1.00 0.00 H new ATOM 0 HE ARG A 107 -5.935 -7.475 -8.962 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -7.827 -5.423 -11.147 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -9.133 -6.603 -11.292 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -7.636 -8.941 -9.183 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -9.026 -8.553 -10.201 1.00 0.00 H new ATOM 1877 N CYS A 108 -0.391 -3.806 -8.524 1.00 0.00 N ATOM 1878 CA CYS A 108 0.404 -2.751 -9.227 1.00 0.00 C ATOM 1879 C CYS A 108 1.875 -3.239 -9.395 1.00 0.00 C ATOM 1880 O CYS A 108 2.751 -2.453 -9.688 1.00 0.00 O ATOM 1881 CB CYS A 108 0.321 -1.599 -8.216 1.00 0.00 C ATOM 1882 SG CYS A 108 0.367 0.057 -8.939 1.00 0.00 S ATOM 0 H CYS A 108 0.013 -4.119 -7.641 1.00 0.00 H new ATOM 0 HA CYS A 108 0.054 -2.489 -10.225 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -0.601 -1.704 -7.644 1.00 0.00 H new ATOM 0 HB3 CYS A 108 1.147 -1.694 -7.511 1.00 0.00 H new ATOM 1887 N ILE A 109 2.153 -4.535 -9.198 1.00 0.00 N ATOM 1888 CA ILE A 109 3.559 -5.062 -9.323 1.00 0.00 C ATOM 1889 C ILE A 109 3.550 -6.594 -9.545 1.00 0.00 C ATOM 1890 O ILE A 109 4.387 -7.295 -9.003 1.00 0.00 O ATOM 1891 CB ILE A 109 4.238 -4.778 -7.962 1.00 0.00 C ATOM 1892 CG1 ILE A 109 3.379 -5.358 -6.813 1.00 0.00 C ATOM 1893 CG2 ILE A 109 4.420 -3.273 -7.755 1.00 0.00 C ATOM 1894 CD1 ILE A 109 4.180 -6.404 -6.026 1.00 0.00 C ATOM 0 H ILE A 109 1.456 -5.239 -8.956 1.00 0.00 H new ATOM 0 HA ILE A 109 4.072 -4.594 -10.163 1.00 0.00 H new ATOM 0 HB ILE A 109 5.218 -5.254 -7.960 1.00 0.00 H new ATOM 0 HG12 ILE A 109 3.061 -4.556 -6.147 1.00 0.00 H new ATOM 0 HG13 ILE A 109 2.475 -5.812 -7.219 1.00 0.00 H new ATOM 0 HG21 ILE A 109 4.899 -3.093 -6.793 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.044 -2.869 -8.552 1.00 0.00 H new ATOM 0 HG23 ILE A 109 3.447 -2.783 -7.773 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.564 -6.804 -5.221 1.00 0.00 H new ATOM 0 HD12 ILE A 109 4.475 -7.214 -6.693 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.071 -5.938 -5.604 1.00 0.00 H new ATOM 1906 N GLN A 110 2.614 -7.129 -10.305 1.00 0.00 N ATOM 1907 CA GLN A 110 2.580 -8.615 -10.498 1.00 0.00 C ATOM 1908 C GLN A 110 2.535 -8.990 -11.988 1.00 0.00 C ATOM 1909 O GLN A 110 1.921 -8.309 -12.785 1.00 0.00 O ATOM 1910 CB GLN A 110 1.299 -9.069 -9.798 1.00 0.00 C ATOM 1911 CG GLN A 110 1.532 -9.116 -8.286 1.00 0.00 C ATOM 1912 CD GLN A 110 0.303 -9.723 -7.598 1.00 0.00 C ATOM 1913 OE1 GLN A 110 0.429 -10.657 -6.830 1.00 0.00 O ATOM 1914 NE2 GLN A 110 -0.889 -9.234 -7.836 1.00 0.00 N ATOM 0 H GLN A 110 1.885 -6.607 -10.791 1.00 0.00 H new ATOM 0 HA GLN A 110 3.473 -9.091 -10.093 1.00 0.00 H new ATOM 0 HB2 GLN A 110 0.483 -8.384 -10.030 1.00 0.00 H new ATOM 0 HB3 GLN A 110 1.002 -10.053 -10.162 1.00 0.00 H new ATOM 0 HG2 GLN A 110 2.418 -9.710 -8.062 1.00 0.00 H new ATOM 0 HG3 GLN A 110 1.717 -8.112 -7.904 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -1.000 -8.450 -8.480 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -1.706 -9.637 -7.378 1.00 0.00 H new ATOM 1923 N LYS A 111 3.174 -10.080 -12.366 1.00 0.00 N ATOM 1924 CA LYS A 111 3.161 -10.501 -13.800 1.00 0.00 C ATOM 1925 C LYS A 111 2.562 -11.912 -13.935 1.00 0.00 C ATOM 1926 O LYS A 111 1.596 -12.109 -14.647 1.00 0.00 O ATOM 1927 CB LYS A 111 4.630 -10.494 -14.228 1.00 0.00 C ATOM 1928 CG LYS A 111 4.717 -10.471 -15.755 1.00 0.00 C ATOM 1929 CD LYS A 111 6.186 -10.435 -16.182 1.00 0.00 C ATOM 1930 CE LYS A 111 6.776 -9.056 -15.872 1.00 0.00 C ATOM 1931 NZ LYS A 111 8.134 -9.333 -15.326 1.00 0.00 N ATOM 0 H LYS A 111 3.701 -10.690 -11.741 1.00 0.00 H new ATOM 0 HA LYS A 111 2.554 -9.841 -14.420 1.00 0.00 H new ATOM 0 HB2 LYS A 111 5.137 -9.624 -13.811 1.00 0.00 H new ATOM 0 HB3 LYS A 111 5.138 -11.376 -13.838 1.00 0.00 H new ATOM 0 HG2 LYS A 111 4.228 -11.352 -16.171 1.00 0.00 H new ATOM 0 HG3 LYS A 111 4.192 -9.600 -16.147 1.00 0.00 H new ATOM 0 HD2 LYS A 111 6.747 -11.208 -15.657 1.00 0.00 H new ATOM 0 HD3 LYS A 111 6.271 -10.647 -17.248 1.00 0.00 H new ATOM 0 HE2 LYS A 111 6.829 -8.439 -16.769 1.00 0.00 H new ATOM 0 HE3 LYS A 111 6.162 -8.517 -15.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 8.603 -8.435 -15.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 8.051 -9.917 -14.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 8.697 -9.841 -16.038 1.00 0.00 H new ATOM 1945 N ASN A 112 3.123 -12.901 -13.258 1.00 0.00 N ATOM 1946 CA ASN A 112 2.576 -14.299 -13.353 1.00 0.00 C ATOM 1947 C ASN A 112 2.443 -14.761 -14.819 1.00 0.00 C ATOM 1948 O ASN A 112 1.598 -15.579 -15.131 1.00 0.00 O ATOM 1949 CB ASN A 112 1.197 -14.225 -12.711 1.00 0.00 C ATOM 1950 CG ASN A 112 0.887 -15.546 -11.995 1.00 0.00 C ATOM 1951 OD1 ASN A 112 1.371 -16.587 -12.391 1.00 0.00 O ATOM 1952 ND2 ASN A 112 0.095 -15.553 -10.950 1.00 0.00 N ATOM 0 H ASN A 112 3.933 -12.797 -12.647 1.00 0.00 H new ATOM 0 HA ASN A 112 3.237 -15.013 -12.863 1.00 0.00 H new ATOM 0 HB2 ASN A 112 1.160 -13.398 -12.001 1.00 0.00 H new ATOM 0 HB3 ASN A 112 0.442 -14.027 -13.471 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -0.112 -16.430 -10.473 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -0.314 -14.681 -10.614 1.00 0.00 H new ATOM 1959 N GLU A 113 3.256 -14.252 -15.718 1.00 0.00 N ATOM 1960 CA GLU A 113 3.152 -14.678 -17.149 1.00 0.00 C ATOM 1961 C GLU A 113 4.522 -14.582 -17.842 1.00 0.00 C ATOM 1962 O GLU A 113 5.528 -14.350 -17.199 1.00 0.00 O ATOM 1963 CB GLU A 113 2.163 -13.696 -17.780 1.00 0.00 C ATOM 1964 CG GLU A 113 1.257 -14.441 -18.763 1.00 0.00 C ATOM 1965 CD GLU A 113 -0.147 -13.833 -18.728 1.00 0.00 C ATOM 1966 OE1 GLU A 113 -0.621 -13.549 -17.640 1.00 0.00 O ATOM 1967 OE2 GLU A 113 -0.724 -13.661 -19.789 1.00 0.00 O ATOM 0 H GLU A 113 3.983 -13.564 -15.522 1.00 0.00 H new ATOM 0 HA GLU A 113 2.824 -15.713 -17.247 1.00 0.00 H new ATOM 0 HB2 GLU A 113 1.562 -13.221 -17.005 1.00 0.00 H new ATOM 0 HB3 GLU A 113 2.703 -12.902 -18.297 1.00 0.00 H new ATOM 0 HG2 GLU A 113 1.667 -14.377 -19.771 1.00 0.00 H new ATOM 0 HG3 GLU A 113 1.213 -15.499 -18.503 1.00 0.00 H new ATOM 1974 N THR A 114 4.571 -14.757 -19.148 1.00 0.00 N ATOM 1975 CA THR A 114 5.879 -14.673 -19.866 1.00 0.00 C ATOM 1976 C THR A 114 5.791 -13.645 -21.004 1.00 0.00 C ATOM 1977 O THR A 114 4.814 -13.600 -21.724 1.00 0.00 O ATOM 1978 CB THR A 114 6.114 -16.077 -20.426 1.00 0.00 C ATOM 1979 OG1 THR A 114 4.871 -16.643 -20.817 1.00 0.00 O ATOM 1980 CG2 THR A 114 6.762 -16.953 -19.352 1.00 0.00 C ATOM 0 H THR A 114 3.763 -14.953 -19.739 1.00 0.00 H new ATOM 0 HA THR A 114 6.691 -14.355 -19.213 1.00 0.00 H new ATOM 0 HB THR A 114 6.774 -16.019 -21.291 1.00 0.00 H new ATOM 0 HG1 THR A 114 5.020 -17.542 -21.178 1.00 0.00 H new ATOM 0 HG21 THR A 114 6.930 -17.953 -19.751 1.00 0.00 H new ATOM 0 HG22 THR A 114 7.715 -16.517 -19.053 1.00 0.00 H new ATOM 0 HG23 THR A 114 6.103 -17.013 -18.486 1.00 0.00 H new ATOM 1988 N ASN A 115 6.809 -12.817 -21.181 1.00 0.00 N ATOM 1989 CA ASN A 115 6.795 -11.782 -22.274 1.00 0.00 C ATOM 1990 C ASN A 115 5.681 -10.746 -22.027 1.00 0.00 C ATOM 1991 O ASN A 115 5.962 -9.608 -21.700 1.00 0.00 O ATOM 1992 CB ASN A 115 6.559 -12.543 -23.595 1.00 0.00 C ATOM 1993 CG ASN A 115 7.724 -12.284 -24.560 1.00 0.00 C ATOM 1994 OD1 ASN A 115 8.868 -12.259 -24.151 1.00 0.00 O ATOM 1995 ND2 ASN A 115 7.486 -12.088 -25.835 1.00 0.00 N ATOM 0 H ASN A 115 7.653 -12.818 -20.608 1.00 0.00 H new ATOM 0 HA ASN A 115 7.735 -11.230 -22.307 1.00 0.00 H new ATOM 0 HB2 ASN A 115 6.468 -13.611 -23.399 1.00 0.00 H new ATOM 0 HB3 ASN A 115 5.621 -12.221 -24.048 1.00 0.00 H new ATOM 0 HD21 ASN A 115 8.259 -11.916 -26.478 1.00 0.00 H new ATOM 0 HD22 ASN A 115 6.528 -12.108 -26.184 1.00 0.00 H new ATOM 2002 N ASN A 116 4.426 -11.119 -22.177 1.00 0.00 N ATOM 2003 CA ASN A 116 3.320 -10.140 -21.946 1.00 0.00 C ATOM 2004 C ASN A 116 2.292 -10.723 -20.963 1.00 0.00 C ATOM 2005 O ASN A 116 1.623 -11.693 -21.268 1.00 0.00 O ATOM 2006 CB ASN A 116 2.686 -9.928 -23.321 1.00 0.00 C ATOM 2007 CG ASN A 116 1.986 -8.564 -23.357 1.00 0.00 C ATOM 2008 OD1 ASN A 116 2.512 -7.617 -23.909 1.00 0.00 O ATOM 2009 ND2 ASN A 116 0.813 -8.415 -22.788 1.00 0.00 N ATOM 0 H ASN A 116 4.126 -12.056 -22.448 1.00 0.00 H new ATOM 0 HA ASN A 116 3.678 -9.206 -21.514 1.00 0.00 H new ATOM 0 HB2 ASN A 116 3.450 -9.977 -24.097 1.00 0.00 H new ATOM 0 HB3 ASN A 116 1.969 -10.722 -23.529 1.00 0.00 H new ATOM 0 HD21 ASN A 116 0.347 -7.508 -22.810 1.00 0.00 H new ATOM 0 HD22 ASN A 116 0.367 -9.206 -22.324 1.00 0.00 H new ATOM 2016 N GLY A 117 2.159 -10.143 -19.787 1.00 0.00 N ATOM 2017 CA GLY A 117 1.174 -10.673 -18.798 1.00 0.00 C ATOM 2018 C GLY A 117 0.332 -9.516 -18.239 1.00 0.00 C ATOM 2019 O GLY A 117 0.018 -8.579 -18.950 1.00 0.00 O ATOM 0 H GLY A 117 2.690 -9.330 -19.476 1.00 0.00 H new ATOM 0 HA2 GLY A 117 0.527 -11.410 -19.273 1.00 0.00 H new ATOM 0 HA3 GLY A 117 1.695 -11.182 -17.987 1.00 0.00 H new ATOM 2023 N SER A 118 -0.036 -9.568 -16.975 1.00 0.00 N ATOM 2024 CA SER A 118 -0.855 -8.466 -16.388 1.00 0.00 C ATOM 2025 C SER A 118 -0.080 -7.774 -15.255 1.00 0.00 C ATOM 2026 O SER A 118 -0.188 -8.157 -14.105 1.00 0.00 O ATOM 2027 CB SER A 118 -2.106 -9.151 -15.839 1.00 0.00 C ATOM 2028 OG SER A 118 -3.036 -9.346 -16.897 1.00 0.00 O ATOM 0 H SER A 118 0.197 -10.325 -16.332 1.00 0.00 H new ATOM 0 HA SER A 118 -1.099 -7.698 -17.122 1.00 0.00 H new ATOM 0 HB2 SER A 118 -1.843 -10.108 -15.389 1.00 0.00 H new ATOM 0 HB3 SER A 118 -2.553 -8.542 -15.053 1.00 0.00 H new ATOM 0 HG SER A 118 -3.839 -9.787 -16.549 1.00 0.00 H new ATOM 2034 N THR A 119 0.702 -6.760 -15.567 1.00 0.00 N ATOM 2035 CA THR A 119 1.475 -6.055 -14.500 1.00 0.00 C ATOM 2036 C THR A 119 1.352 -4.536 -14.671 1.00 0.00 C ATOM 2037 O THR A 119 0.853 -4.061 -15.673 1.00 0.00 O ATOM 2038 CB THR A 119 2.930 -6.488 -14.708 1.00 0.00 C ATOM 2039 OG1 THR A 119 2.966 -7.846 -15.126 1.00 0.00 O ATOM 2040 CG2 THR A 119 3.714 -6.334 -13.398 1.00 0.00 C ATOM 0 H THR A 119 0.834 -6.396 -16.511 1.00 0.00 H new ATOM 0 HA THR A 119 1.110 -6.300 -13.503 1.00 0.00 H new ATOM 0 HB THR A 119 3.385 -5.858 -15.473 1.00 0.00 H new ATOM 0 HG1 THR A 119 2.879 -7.891 -16.101 1.00 0.00 H new ATOM 0 HG21 THR A 119 4.747 -6.644 -13.554 1.00 0.00 H new ATOM 0 HG22 THR A 119 3.692 -5.291 -13.081 1.00 0.00 H new ATOM 0 HG23 THR A 119 3.261 -6.957 -12.627 1.00 0.00 H new ATOM 2048 N CYS A 120 1.821 -3.768 -13.710 1.00 0.00 N ATOM 2049 CA CYS A 120 1.744 -2.279 -13.842 1.00 0.00 C ATOM 2050 C CYS A 120 3.093 -1.750 -14.350 1.00 0.00 C ATOM 2051 O CYS A 120 4.112 -2.395 -14.174 1.00 0.00 O ATOM 2052 CB CYS A 120 1.453 -1.745 -12.441 1.00 0.00 C ATOM 2053 SG CYS A 120 1.186 0.035 -12.543 1.00 0.00 S ATOM 0 H CYS A 120 2.249 -4.107 -12.849 1.00 0.00 H new ATOM 0 HA CYS A 120 0.973 -1.965 -14.546 1.00 0.00 H new ATOM 0 HB2 CYS A 120 0.573 -2.236 -12.025 1.00 0.00 H new ATOM 0 HB3 CYS A 120 2.286 -1.964 -11.773 1.00 0.00 H new ATOM 2058 N ILE A 121 3.121 -0.598 -14.989 1.00 0.00 N ATOM 2059 CA ILE A 121 4.434 -0.076 -15.507 1.00 0.00 C ATOM 2060 C ILE A 121 5.294 0.539 -14.386 1.00 0.00 C ATOM 2061 O ILE A 121 6.508 0.524 -14.480 1.00 0.00 O ATOM 2062 CB ILE A 121 4.119 0.979 -16.586 1.00 0.00 C ATOM 2063 CG1 ILE A 121 5.444 1.453 -17.199 1.00 0.00 C ATOM 2064 CG2 ILE A 121 3.370 2.174 -15.975 1.00 0.00 C ATOM 2065 CD1 ILE A 121 5.177 2.438 -18.333 1.00 0.00 C ATOM 0 H ILE A 121 2.310 -0.007 -15.172 1.00 0.00 H new ATOM 0 HA ILE A 121 5.014 -0.900 -15.923 1.00 0.00 H new ATOM 0 HB ILE A 121 3.482 0.538 -17.352 1.00 0.00 H new ATOM 0 HG12 ILE A 121 6.059 1.926 -16.433 1.00 0.00 H new ATOM 0 HG13 ILE A 121 6.006 0.598 -17.575 1.00 0.00 H new ATOM 0 HG21 ILE A 121 3.157 2.907 -16.753 1.00 0.00 H new ATOM 0 HG22 ILE A 121 2.434 1.830 -15.535 1.00 0.00 H new ATOM 0 HG23 ILE A 121 3.987 2.634 -15.203 1.00 0.00 H new ATOM 0 HD11 ILE A 121 6.124 2.767 -18.760 1.00 0.00 H new ATOM 0 HD12 ILE A 121 4.581 1.951 -19.105 1.00 0.00 H new ATOM 0 HD13 ILE A 121 4.635 3.300 -17.946 1.00 0.00 H new ATOM 2077 N CYS A 122 4.708 1.092 -13.336 1.00 0.00 N ATOM 2078 CA CYS A 122 5.571 1.704 -12.256 1.00 0.00 C ATOM 2079 C CYS A 122 6.591 0.669 -11.739 1.00 0.00 C ATOM 2080 O CYS A 122 7.725 1.007 -11.457 1.00 0.00 O ATOM 2081 CB CYS A 122 4.624 2.232 -11.148 1.00 0.00 C ATOM 2082 SG CYS A 122 3.978 0.894 -10.095 1.00 0.00 S ATOM 0 H CYS A 122 3.701 1.146 -13.182 1.00 0.00 H new ATOM 0 HA CYS A 122 6.161 2.538 -12.637 1.00 0.00 H new ATOM 0 HB2 CYS A 122 5.159 2.952 -10.529 1.00 0.00 H new ATOM 0 HB3 CYS A 122 3.791 2.764 -11.608 1.00 0.00 H new ATOM 2087 N ARG A 123 6.218 -0.597 -11.658 1.00 0.00 N ATOM 2088 CA ARG A 123 7.215 -1.636 -11.210 1.00 0.00 C ATOM 2089 C ARG A 123 8.442 -1.617 -12.155 1.00 0.00 C ATOM 2090 O ARG A 123 9.546 -1.927 -11.748 1.00 0.00 O ATOM 2091 CB ARG A 123 6.508 -2.998 -11.295 1.00 0.00 C ATOM 2092 CG ARG A 123 7.403 -4.079 -10.685 1.00 0.00 C ATOM 2093 CD ARG A 123 8.222 -4.749 -11.790 1.00 0.00 C ATOM 2094 NE ARG A 123 8.261 -6.197 -11.417 1.00 0.00 N ATOM 2095 CZ ARG A 123 9.046 -6.636 -10.446 1.00 0.00 C ATOM 2096 NH1 ARG A 123 9.822 -5.821 -9.769 1.00 0.00 N ATOM 2097 NH2 ARG A 123 9.054 -7.910 -10.148 1.00 0.00 N ATOM 0 H ARG A 123 5.286 -0.949 -11.878 1.00 0.00 H new ATOM 0 HA ARG A 123 7.562 -1.441 -10.195 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.556 -2.959 -10.766 1.00 0.00 H new ATOM 0 HB3 ARG A 123 6.285 -3.240 -12.334 1.00 0.00 H new ATOM 0 HG2 ARG A 123 8.068 -3.639 -9.942 1.00 0.00 H new ATOM 0 HG3 ARG A 123 6.794 -4.821 -10.169 1.00 0.00 H new ATOM 0 HD2 ARG A 123 7.760 -4.605 -12.767 1.00 0.00 H new ATOM 0 HD3 ARG A 123 9.226 -4.329 -11.847 1.00 0.00 H new ATOM 0 HE ARG A 123 7.671 -6.859 -11.921 1.00 0.00 H new ATOM 0 HH11 ARG A 123 9.829 -4.825 -9.987 1.00 0.00 H new ATOM 0 HH12 ARG A 123 10.418 -6.184 -9.025 1.00 0.00 H new ATOM 0 HH21 ARG A 123 8.458 -8.558 -10.663 1.00 0.00 H new ATOM 0 HH22 ARG A 123 9.657 -8.255 -9.401 1.00 0.00 H new ATOM 2111 N VAL A 124 8.255 -1.249 -13.415 1.00 0.00 N ATOM 2112 CA VAL A 124 9.416 -1.208 -14.375 1.00 0.00 C ATOM 2113 C VAL A 124 10.326 -0.003 -14.060 1.00 0.00 C ATOM 2114 O VAL A 124 9.887 1.126 -14.160 1.00 0.00 O ATOM 2115 CB VAL A 124 8.806 -1.029 -15.782 1.00 0.00 C ATOM 2116 CG1 VAL A 124 9.912 -1.034 -16.839 1.00 0.00 C ATOM 2117 CG2 VAL A 124 7.817 -2.163 -16.077 1.00 0.00 C ATOM 0 H VAL A 124 7.356 -0.978 -13.813 1.00 0.00 H new ATOM 0 HA VAL A 124 10.016 -2.115 -14.302 1.00 0.00 H new ATOM 0 HB VAL A 124 8.280 -0.075 -15.813 1.00 0.00 H new ATOM 0 HG11 VAL A 124 9.471 -0.907 -17.828 1.00 0.00 H new ATOM 0 HG12 VAL A 124 10.606 -0.216 -16.644 1.00 0.00 H new ATOM 0 HG13 VAL A 124 10.448 -1.982 -16.800 1.00 0.00 H new ATOM 0 HG21 VAL A 124 7.393 -2.026 -17.072 1.00 0.00 H new ATOM 0 HG22 VAL A 124 8.337 -3.120 -16.032 1.00 0.00 H new ATOM 0 HG23 VAL A 124 7.017 -2.150 -15.337 1.00 0.00 H new ATOM 2127 N PRO A 125 11.571 -0.263 -13.713 1.00 0.00 N ATOM 2128 CA PRO A 125 12.518 0.848 -13.421 1.00 0.00 C ATOM 2129 C PRO A 125 12.778 1.686 -14.684 1.00 0.00 C ATOM 2130 O PRO A 125 12.411 1.293 -15.776 1.00 0.00 O ATOM 2131 CB PRO A 125 13.791 0.131 -12.967 1.00 0.00 C ATOM 2132 CG PRO A 125 13.686 -1.232 -13.566 1.00 0.00 C ATOM 2133 CD PRO A 125 12.221 -1.575 -13.556 1.00 0.00 C ATOM 0 HA PRO A 125 12.139 1.544 -12.673 1.00 0.00 H new ATOM 0 HB2 PRO A 125 14.684 0.650 -13.315 1.00 0.00 H new ATOM 0 HB3 PRO A 125 13.853 0.083 -11.880 1.00 0.00 H new ATOM 0 HG2 PRO A 125 14.083 -1.244 -14.581 1.00 0.00 H new ATOM 0 HG3 PRO A 125 14.261 -1.957 -12.990 1.00 0.00 H new ATOM 0 HD2 PRO A 125 11.960 -2.254 -14.368 1.00 0.00 H new ATOM 0 HD3 PRO A 125 11.927 -2.062 -12.626 1.00 0.00 H new ATOM 2141 N ARG A 126 13.406 2.838 -14.548 1.00 0.00 N ATOM 2142 CA ARG A 126 13.680 3.688 -15.761 1.00 0.00 C ATOM 2143 C ARG A 126 14.833 3.089 -16.584 1.00 0.00 C ATOM 2144 O ARG A 126 14.799 3.106 -17.801 1.00 0.00 O ATOM 2145 CB ARG A 126 14.063 5.085 -15.244 1.00 0.00 C ATOM 2146 CG ARG A 126 14.287 6.029 -16.428 1.00 0.00 C ATOM 2147 CD ARG A 126 12.951 6.301 -17.125 1.00 0.00 C ATOM 2148 NE ARG A 126 13.041 7.721 -17.587 1.00 0.00 N ATOM 2149 CZ ARG A 126 12.905 8.730 -16.740 1.00 0.00 C ATOM 2150 NH1 ARG A 126 12.686 8.526 -15.461 1.00 0.00 N ATOM 2151 NH2 ARG A 126 12.990 9.959 -17.181 1.00 0.00 N ATOM 0 H ARG A 126 13.736 3.222 -13.663 1.00 0.00 H new ATOM 0 HA ARG A 126 12.806 3.737 -16.410 1.00 0.00 H new ATOM 0 HB2 ARG A 126 13.274 5.474 -14.600 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.967 5.024 -14.639 1.00 0.00 H new ATOM 0 HG2 ARG A 126 14.726 6.965 -16.082 1.00 0.00 H new ATOM 0 HG3 ARG A 126 14.993 5.586 -17.131 1.00 0.00 H new ATOM 0 HD2 ARG A 126 12.797 5.622 -17.963 1.00 0.00 H new ATOM 0 HD3 ARG A 126 12.113 6.160 -16.442 1.00 0.00 H new ATOM 0 HE ARG A 126 13.210 7.916 -18.574 1.00 0.00 H new ATOM 0 HH11 ARG A 126 12.617 7.574 -15.101 1.00 0.00 H new ATOM 0 HH12 ARG A 126 12.585 9.319 -14.828 1.00 0.00 H new ATOM 0 HH21 ARG A 126 13.160 10.135 -18.171 1.00 0.00 H new ATOM 0 HH22 ARG A 126 12.886 10.741 -16.535 1.00 0.00 H new ATOM 2165 N ALA A 127 15.858 2.564 -15.938 1.00 0.00 N ATOM 2166 CA ALA A 127 17.007 1.973 -16.719 1.00 0.00 C ATOM 2167 C ALA A 127 16.500 0.847 -17.632 1.00 0.00 C ATOM 2168 O ALA A 127 16.924 0.731 -18.767 1.00 0.00 O ATOM 2169 CB ALA A 127 18.002 1.412 -15.691 1.00 0.00 C ATOM 0 H ALA A 127 15.949 2.519 -14.923 1.00 0.00 H new ATOM 0 HA ALA A 127 17.480 2.726 -17.349 1.00 0.00 H new ATOM 0 HB1 ALA A 127 18.853 0.972 -16.211 1.00 0.00 H new ATOM 0 HB2 ALA A 127 18.349 2.217 -15.043 1.00 0.00 H new ATOM 0 HB3 ALA A 127 17.511 0.648 -15.089 1.00 0.00 H new ATOM 2175 N GLN A 128 15.591 0.019 -17.155 1.00 0.00 N ATOM 2176 CA GLN A 128 15.067 -1.091 -18.030 1.00 0.00 C ATOM 2177 C GLN A 128 14.280 -0.491 -19.203 1.00 0.00 C ATOM 2178 O GLN A 128 14.404 -0.940 -20.328 1.00 0.00 O ATOM 2179 CB GLN A 128 14.146 -1.954 -17.152 1.00 0.00 C ATOM 2180 CG GLN A 128 13.627 -3.141 -17.966 1.00 0.00 C ATOM 2181 CD GLN A 128 13.207 -4.270 -17.016 1.00 0.00 C ATOM 2182 OE1 GLN A 128 13.854 -4.501 -16.015 1.00 0.00 O ATOM 2183 NE2 GLN A 128 12.146 -4.990 -17.286 1.00 0.00 N ATOM 0 H GLN A 128 15.195 0.061 -16.216 1.00 0.00 H new ATOM 0 HA GLN A 128 15.878 -1.692 -18.441 1.00 0.00 H new ATOM 0 HB2 GLN A 128 14.690 -2.310 -16.277 1.00 0.00 H new ATOM 0 HB3 GLN A 128 13.310 -1.357 -16.787 1.00 0.00 H new ATOM 0 HG2 GLN A 128 12.780 -2.833 -18.578 1.00 0.00 H new ATOM 0 HG3 GLN A 128 14.401 -3.494 -18.648 1.00 0.00 H new ATOM 0 HE21 GLN A 128 11.600 -4.799 -18.126 1.00 0.00 H new ATOM 0 HE22 GLN A 128 11.866 -5.742 -16.656 1.00 0.00 H new ATOM 2192 N LEU A 129 13.476 0.525 -18.958 1.00 0.00 N ATOM 2193 CA LEU A 129 12.698 1.144 -20.089 1.00 0.00 C ATOM 2194 C LEU A 129 13.669 1.773 -21.100 1.00 0.00 C ATOM 2195 O LEU A 129 13.468 1.674 -22.297 1.00 0.00 O ATOM 2196 CB LEU A 129 11.798 2.227 -19.472 1.00 0.00 C ATOM 2197 CG LEU A 129 10.660 1.565 -18.700 1.00 0.00 C ATOM 2198 CD1 LEU A 129 9.997 2.593 -17.781 1.00 0.00 C ATOM 2199 CD2 LEU A 129 9.626 1.021 -19.688 1.00 0.00 C ATOM 0 H LEU A 129 13.326 0.946 -18.041 1.00 0.00 H new ATOM 0 HA LEU A 129 12.100 0.398 -20.614 1.00 0.00 H new ATOM 0 HB2 LEU A 129 12.381 2.863 -18.806 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.395 2.869 -20.255 1.00 0.00 H new ATOM 0 HG LEU A 129 11.057 0.747 -18.099 1.00 0.00 H new ATOM 0 HD11 LEU A 129 9.185 2.119 -17.231 1.00 0.00 H new ATOM 0 HD12 LEU A 129 10.734 2.981 -17.078 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.600 3.413 -18.379 1.00 0.00 H new ATOM 0 HD21 LEU A 129 8.812 0.548 -19.139 1.00 0.00 H new ATOM 0 HD22 LEU A 129 9.230 1.840 -20.289 1.00 0.00 H new ATOM 0 HD23 LEU A 129 10.098 0.287 -20.341 1.00 0.00 H new ATOM 2211 N GLU A 130 14.722 2.420 -20.634 1.00 0.00 N ATOM 2212 CA GLU A 130 15.695 3.048 -21.599 1.00 0.00 C ATOM 2213 C GLU A 130 16.307 1.971 -22.509 1.00 0.00 C ATOM 2214 O GLU A 130 16.503 2.196 -23.688 1.00 0.00 O ATOM 2215 CB GLU A 130 16.794 3.712 -20.754 1.00 0.00 C ATOM 2216 CG GLU A 130 16.291 5.059 -20.231 1.00 0.00 C ATOM 2217 CD GLU A 130 16.733 6.175 -21.181 1.00 0.00 C ATOM 2218 OE1 GLU A 130 16.009 6.443 -22.124 1.00 0.00 O ATOM 2219 OE2 GLU A 130 17.788 6.740 -20.947 1.00 0.00 O ATOM 0 H GLU A 130 14.947 2.539 -19.646 1.00 0.00 H new ATOM 0 HA GLU A 130 15.197 3.778 -22.236 1.00 0.00 H new ATOM 0 HB2 GLU A 130 17.067 3.065 -19.920 1.00 0.00 H new ATOM 0 HB3 GLU A 130 17.693 3.855 -21.354 1.00 0.00 H new ATOM 0 HG2 GLU A 130 15.204 5.046 -20.149 1.00 0.00 H new ATOM 0 HG3 GLU A 130 16.684 5.242 -19.231 1.00 0.00 H new ATOM 2226 N GLU A 131 16.612 0.801 -21.979 1.00 0.00 N ATOM 2227 CA GLU A 131 17.212 -0.273 -22.851 1.00 0.00 C ATOM 2228 C GLU A 131 16.212 -0.693 -23.938 1.00 0.00 C ATOM 2229 O GLU A 131 16.591 -0.934 -25.069 1.00 0.00 O ATOM 2230 CB GLU A 131 17.535 -1.468 -21.939 1.00 0.00 C ATOM 2231 CG GLU A 131 18.962 -1.330 -21.400 1.00 0.00 C ATOM 2232 CD GLU A 131 18.979 -0.317 -20.255 1.00 0.00 C ATOM 2233 OE1 GLU A 131 19.041 0.869 -20.538 1.00 0.00 O ATOM 2234 OE2 GLU A 131 18.930 -0.743 -19.112 1.00 0.00 O ATOM 0 H GLU A 131 16.475 0.546 -21.001 1.00 0.00 H new ATOM 0 HA GLU A 131 18.112 0.090 -23.348 1.00 0.00 H new ATOM 0 HB2 GLU A 131 16.826 -1.510 -21.113 1.00 0.00 H new ATOM 0 HB3 GLU A 131 17.433 -2.400 -22.494 1.00 0.00 H new ATOM 0 HG2 GLU A 131 19.325 -2.296 -21.050 1.00 0.00 H new ATOM 0 HG3 GLU A 131 19.633 -1.007 -22.196 1.00 0.00 H new ATOM 2241 N GLU A 132 14.939 -0.782 -23.612 1.00 0.00 N ATOM 2242 CA GLU A 132 13.931 -1.189 -24.656 1.00 0.00 C ATOM 2243 C GLU A 132 13.849 -0.114 -25.750 1.00 0.00 C ATOM 2244 O GLU A 132 13.758 -0.431 -26.921 1.00 0.00 O ATOM 2245 CB GLU A 132 12.577 -1.325 -23.941 1.00 0.00 C ATOM 2246 CG GLU A 132 12.449 -2.731 -23.354 1.00 0.00 C ATOM 2247 CD GLU A 132 11.154 -2.832 -22.545 1.00 0.00 C ATOM 2248 OE1 GLU A 132 10.099 -2.644 -23.128 1.00 0.00 O ATOM 2249 OE2 GLU A 132 11.239 -3.094 -21.357 1.00 0.00 O ATOM 0 H GLU A 132 14.557 -0.594 -22.685 1.00 0.00 H new ATOM 0 HA GLU A 132 14.214 -2.128 -25.131 1.00 0.00 H new ATOM 0 HB2 GLU A 132 12.495 -0.580 -23.149 1.00 0.00 H new ATOM 0 HB3 GLU A 132 11.763 -1.136 -24.641 1.00 0.00 H new ATOM 0 HG2 GLU A 132 12.449 -3.472 -24.154 1.00 0.00 H new ATOM 0 HG3 GLU A 132 13.306 -2.950 -22.717 1.00 0.00 H new ATOM 2256 N ALA A 133 13.885 1.154 -25.387 1.00 0.00 N ATOM 2257 CA ALA A 133 13.813 2.227 -26.441 1.00 0.00 C ATOM 2258 C ALA A 133 15.078 2.182 -27.311 1.00 0.00 C ATOM 2259 O ALA A 133 15.006 2.318 -28.519 1.00 0.00 O ATOM 2260 CB ALA A 133 13.720 3.574 -25.706 1.00 0.00 C ATOM 0 H ALA A 133 13.960 1.487 -24.426 1.00 0.00 H new ATOM 0 HA ALA A 133 12.950 2.084 -27.092 1.00 0.00 H new ATOM 0 HB1 ALA A 133 13.666 4.383 -26.434 1.00 0.00 H new ATOM 0 HB2 ALA A 133 12.826 3.587 -25.082 1.00 0.00 H new ATOM 0 HB3 ALA A 133 14.602 3.708 -25.080 1.00 0.00 H new ATOM 2266 N ARG A 134 16.238 1.981 -26.715 1.00 0.00 N ATOM 2267 CA ARG A 134 17.497 1.920 -27.542 1.00 0.00 C ATOM 2268 C ARG A 134 17.419 0.753 -28.543 1.00 0.00 C ATOM 2269 O ARG A 134 17.944 0.844 -29.638 1.00 0.00 O ATOM 2270 CB ARG A 134 18.665 1.699 -26.563 1.00 0.00 C ATOM 2271 CG ARG A 134 19.940 2.351 -27.120 1.00 0.00 C ATOM 2272 CD ARG A 134 20.319 3.565 -26.265 1.00 0.00 C ATOM 2273 NE ARG A 134 20.954 4.526 -27.219 1.00 0.00 N ATOM 2274 CZ ARG A 134 20.224 5.267 -28.039 1.00 0.00 C ATOM 2275 NH1 ARG A 134 18.913 5.188 -28.052 1.00 0.00 N ATOM 2276 NH2 ARG A 134 20.817 6.098 -28.857 1.00 0.00 N ATOM 0 H ARG A 134 16.367 1.859 -25.711 1.00 0.00 H new ATOM 0 HA ARG A 134 17.633 2.839 -28.112 1.00 0.00 H new ATOM 0 HB2 ARG A 134 18.422 2.126 -25.590 1.00 0.00 H new ATOM 0 HB3 ARG A 134 18.828 0.632 -26.411 1.00 0.00 H new ATOM 0 HG2 ARG A 134 20.756 1.629 -27.124 1.00 0.00 H new ATOM 0 HG3 ARG A 134 19.781 2.658 -28.154 1.00 0.00 H new ATOM 0 HD2 ARG A 134 19.441 4.003 -25.789 1.00 0.00 H new ATOM 0 HD3 ARG A 134 21.008 3.287 -25.468 1.00 0.00 H new ATOM 0 HE ARG A 134 21.970 4.613 -27.239 1.00 0.00 H new ATOM 0 HH11 ARG A 134 18.435 4.545 -27.421 1.00 0.00 H new ATOM 0 HH12 ARG A 134 18.373 5.770 -28.693 1.00 0.00 H new ATOM 0 HH21 ARG A 134 21.834 6.172 -28.860 1.00 0.00 H new ATOM 0 HH22 ARG A 134 20.262 6.672 -29.492 1.00 0.00 H new ATOM 2290 N LYS A 135 16.773 -0.345 -28.189 1.00 0.00 N ATOM 2291 CA LYS A 135 16.682 -1.501 -29.151 1.00 0.00 C ATOM 2292 C LYS A 135 15.593 -1.255 -30.215 1.00 0.00 C ATOM 2293 O LYS A 135 15.701 -1.747 -31.324 1.00 0.00 O ATOM 2294 CB LYS A 135 16.334 -2.741 -28.314 1.00 0.00 C ATOM 2295 CG LYS A 135 17.597 -3.265 -27.627 1.00 0.00 C ATOM 2296 CD LYS A 135 17.209 -4.053 -26.374 1.00 0.00 C ATOM 2297 CE LYS A 135 18.423 -4.176 -25.451 1.00 0.00 C ATOM 2298 NZ LYS A 135 18.334 -5.549 -24.882 1.00 0.00 N ATOM 0 H LYS A 135 16.313 -0.488 -27.290 1.00 0.00 H new ATOM 0 HA LYS A 135 17.624 -1.630 -29.684 1.00 0.00 H new ATOM 0 HB2 LYS A 135 15.580 -2.489 -27.569 1.00 0.00 H new ATOM 0 HB3 LYS A 135 15.906 -3.515 -28.952 1.00 0.00 H new ATOM 0 HG2 LYS A 135 18.158 -3.902 -28.311 1.00 0.00 H new ATOM 0 HG3 LYS A 135 18.249 -2.434 -27.359 1.00 0.00 H new ATOM 0 HD2 LYS A 135 16.393 -3.551 -25.854 1.00 0.00 H new ATOM 0 HD3 LYS A 135 16.848 -5.043 -26.652 1.00 0.00 H new ATOM 0 HE2 LYS A 135 19.353 -4.036 -26.001 1.00 0.00 H new ATOM 0 HE3 LYS A 135 18.400 -3.421 -24.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 19.134 -5.710 -24.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 17.441 -5.651 -24.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 18.365 -6.247 -25.653 1.00 0.00 H new ATOM 2312 N LYS A 136 14.547 -0.508 -29.904 1.00 0.00 N ATOM 2313 CA LYS A 136 13.479 -0.264 -30.936 1.00 0.00 C ATOM 2314 C LYS A 136 13.670 1.092 -31.652 1.00 0.00 C ATOM 2315 O LYS A 136 12.731 1.624 -32.212 1.00 0.00 O ATOM 2316 CB LYS A 136 12.150 -0.276 -30.170 1.00 0.00 C ATOM 2317 CG LYS A 136 11.737 -1.722 -29.887 1.00 0.00 C ATOM 2318 CD LYS A 136 10.326 -1.744 -29.296 1.00 0.00 C ATOM 2319 CE LYS A 136 9.665 -3.090 -29.602 1.00 0.00 C ATOM 2320 NZ LYS A 136 8.204 -2.800 -29.648 1.00 0.00 N ATOM 0 H LYS A 136 14.391 -0.066 -28.998 1.00 0.00 H new ATOM 0 HA LYS A 136 13.515 -1.027 -31.714 1.00 0.00 H new ATOM 0 HB2 LYS A 136 12.252 0.274 -29.234 1.00 0.00 H new ATOM 0 HB3 LYS A 136 11.378 0.227 -30.752 1.00 0.00 H new ATOM 0 HG2 LYS A 136 11.767 -2.306 -30.807 1.00 0.00 H new ATOM 0 HG3 LYS A 136 12.440 -2.183 -29.194 1.00 0.00 H new ATOM 0 HD2 LYS A 136 10.369 -1.585 -28.219 1.00 0.00 H new ATOM 0 HD3 LYS A 136 9.732 -0.932 -29.715 1.00 0.00 H new ATOM 0 HE2 LYS A 136 10.017 -3.496 -30.550 1.00 0.00 H new ATOM 0 HE3 LYS A 136 9.897 -3.828 -28.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 7.682 -3.676 -29.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 7.896 -2.421 -28.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 8.012 -2.100 -30.393 1.00 0.00 H new ATOM 2334 N GLY A 137 14.867 1.656 -31.658 1.00 0.00 N ATOM 2335 CA GLY A 137 15.085 2.964 -32.358 1.00 0.00 C ATOM 2336 C GLY A 137 14.058 4.011 -31.892 1.00 0.00 C ATOM 2337 O GLY A 137 13.469 4.702 -32.701 1.00 0.00 O ATOM 0 H GLY A 137 15.695 1.264 -31.209 1.00 0.00 H new ATOM 0 HA2 GLY A 137 16.094 3.324 -32.159 1.00 0.00 H new ATOM 0 HA3 GLY A 137 15.004 2.823 -33.436 1.00 0.00 H new ATOM 2341 N THR A 138 13.838 4.136 -30.599 1.00 0.00 N ATOM 2342 CA THR A 138 12.846 5.144 -30.104 1.00 0.00 C ATOM 2343 C THR A 138 13.257 5.664 -28.716 1.00 0.00 C ATOM 2344 O THR A 138 14.383 5.480 -28.294 1.00 0.00 O ATOM 2345 CB THR A 138 11.510 4.394 -30.037 1.00 0.00 C ATOM 2346 OG1 THR A 138 10.503 5.274 -29.556 1.00 0.00 O ATOM 2347 CG2 THR A 138 11.623 3.189 -29.095 1.00 0.00 C ATOM 0 H THR A 138 14.300 3.587 -29.873 1.00 0.00 H new ATOM 0 HA THR A 138 12.785 6.016 -30.756 1.00 0.00 H new ATOM 0 HB THR A 138 11.251 4.040 -31.035 1.00 0.00 H new ATOM 0 HG1 THR A 138 10.600 6.149 -29.987 1.00 0.00 H new ATOM 0 HG21 THR A 138 10.667 2.666 -29.057 1.00 0.00 H new ATOM 0 HG22 THR A 138 12.393 2.511 -29.462 1.00 0.00 H new ATOM 0 HG23 THR A 138 11.889 3.532 -28.095 1.00 0.00 H new ATOM 2355 N GLN A 139 12.359 6.314 -28.001 1.00 0.00 N ATOM 2356 CA GLN A 139 12.716 6.838 -26.649 1.00 0.00 C ATOM 2357 C GLN A 139 11.607 6.506 -25.637 1.00 0.00 C ATOM 2358 O GLN A 139 10.497 6.184 -26.016 1.00 0.00 O ATOM 2359 CB GLN A 139 12.841 8.351 -26.831 1.00 0.00 C ATOM 2360 CG GLN A 139 14.218 8.681 -27.409 1.00 0.00 C ATOM 2361 CD GLN A 139 14.423 10.202 -27.411 1.00 0.00 C ATOM 2362 OE1 GLN A 139 14.663 10.790 -26.376 1.00 0.00 O ATOM 2363 NE2 GLN A 139 14.337 10.871 -28.536 1.00 0.00 N ATOM 0 H GLN A 139 11.401 6.500 -28.299 1.00 0.00 H new ATOM 0 HA GLN A 139 13.635 6.396 -26.266 1.00 0.00 H new ATOM 0 HB2 GLN A 139 12.058 8.714 -27.497 1.00 0.00 H new ATOM 0 HB3 GLN A 139 12.705 8.856 -25.875 1.00 0.00 H new ATOM 0 HG2 GLN A 139 14.997 8.199 -26.818 1.00 0.00 H new ATOM 0 HG3 GLN A 139 14.301 8.291 -28.424 1.00 0.00 H new ATOM 0 HE21 GLN A 139 14.136 10.380 -29.407 1.00 0.00 H new ATOM 0 HE22 GLN A 139 14.472 11.882 -28.540 1.00 0.00 H new ATOM 2372 N VAL A 140 11.897 6.579 -24.353 1.00 0.00 N ATOM 2373 CA VAL A 140 10.852 6.262 -23.329 1.00 0.00 C ATOM 2374 C VAL A 140 11.112 7.052 -22.032 1.00 0.00 C ATOM 2375 O VAL A 140 12.208 7.530 -21.807 1.00 0.00 O ATOM 2376 CB VAL A 140 10.989 4.754 -23.081 1.00 0.00 C ATOM 2377 CG1 VAL A 140 12.404 4.430 -22.577 1.00 0.00 C ATOM 2378 CG2 VAL A 140 9.955 4.314 -22.038 1.00 0.00 C ATOM 0 H VAL A 140 12.807 6.843 -23.976 1.00 0.00 H new ATOM 0 HA VAL A 140 9.851 6.533 -23.664 1.00 0.00 H new ATOM 0 HB VAL A 140 10.816 4.219 -24.015 1.00 0.00 H new ATOM 0 HG11 VAL A 140 12.492 3.357 -22.404 1.00 0.00 H new ATOM 0 HG12 VAL A 140 13.136 4.738 -23.324 1.00 0.00 H new ATOM 0 HG13 VAL A 140 12.590 4.964 -21.645 1.00 0.00 H new ATOM 0 HG21 VAL A 140 10.051 3.243 -21.860 1.00 0.00 H new ATOM 0 HG22 VAL A 140 10.126 4.853 -21.106 1.00 0.00 H new ATOM 0 HG23 VAL A 140 8.952 4.533 -22.405 1.00 0.00 H new ATOM 2388 N SER A 141 10.117 7.190 -21.175 1.00 0.00 N ATOM 2389 CA SER A 141 10.330 7.948 -19.898 1.00 0.00 C ATOM 2390 C SER A 141 9.129 7.786 -18.947 1.00 0.00 C ATOM 2391 O SER A 141 8.059 8.304 -19.206 1.00 0.00 O ATOM 2392 CB SER A 141 10.476 9.405 -20.330 1.00 0.00 C ATOM 2393 OG SER A 141 10.661 10.222 -19.182 1.00 0.00 O ATOM 0 H SER A 141 9.178 6.813 -21.306 1.00 0.00 H new ATOM 0 HA SER A 141 11.201 7.585 -19.353 1.00 0.00 H new ATOM 0 HB2 SER A 141 11.324 9.512 -21.006 1.00 0.00 H new ATOM 0 HB3 SER A 141 9.589 9.724 -20.878 1.00 0.00 H new ATOM 0 HG SER A 141 10.756 11.157 -19.458 1.00 0.00 H new ATOM 2399 N PHE A 142 9.297 7.077 -17.848 1.00 0.00 N ATOM 2400 CA PHE A 142 8.159 6.898 -16.892 1.00 0.00 C ATOM 2401 C PHE A 142 8.367 7.762 -15.634 1.00 0.00 C ATOM 2402 O PHE A 142 9.476 8.139 -15.305 1.00 0.00 O ATOM 2403 CB PHE A 142 8.160 5.411 -16.515 1.00 0.00 C ATOM 2404 CG PHE A 142 7.045 5.144 -15.525 1.00 0.00 C ATOM 2405 CD1 PHE A 142 5.739 4.932 -15.977 1.00 0.00 C ATOM 2406 CD2 PHE A 142 7.319 5.127 -14.154 1.00 0.00 C ATOM 2407 CE1 PHE A 142 4.711 4.697 -15.055 1.00 0.00 C ATOM 2408 CE2 PHE A 142 6.292 4.895 -13.237 1.00 0.00 C ATOM 2409 CZ PHE A 142 4.991 4.678 -13.682 1.00 0.00 C ATOM 0 H PHE A 142 10.168 6.620 -17.577 1.00 0.00 H new ATOM 0 HA PHE A 142 7.213 7.203 -17.340 1.00 0.00 H new ATOM 0 HB2 PHE A 142 8.025 4.798 -17.406 1.00 0.00 H new ATOM 0 HB3 PHE A 142 9.121 5.135 -16.081 1.00 0.00 H new ATOM 0 HD1 PHE A 142 5.523 4.949 -17.035 1.00 0.00 H new ATOM 0 HD2 PHE A 142 8.327 5.294 -13.804 1.00 0.00 H new ATOM 0 HE1 PHE A 142 3.702 4.530 -15.402 1.00 0.00 H new ATOM 0 HE2 PHE A 142 6.508 4.884 -12.179 1.00 0.00 H new ATOM 0 HZ PHE A 142 4.199 4.495 -12.971 1.00 0.00 H new ATOM 2419 N HIS A 143 7.303 8.051 -14.918 1.00 0.00 N ATOM 2420 CA HIS A 143 7.421 8.859 -13.667 1.00 0.00 C ATOM 2421 C HIS A 143 6.507 8.245 -12.591 1.00 0.00 C ATOM 2422 O HIS A 143 6.965 7.813 -11.551 1.00 0.00 O ATOM 2423 CB HIS A 143 6.964 10.269 -14.050 1.00 0.00 C ATOM 2424 CG HIS A 143 7.063 11.176 -12.853 1.00 0.00 C ATOM 2425 ND1 HIS A 143 6.350 12.360 -12.761 1.00 0.00 N ATOM 2426 CD2 HIS A 143 7.790 11.084 -11.691 1.00 0.00 C ATOM 2427 CE1 HIS A 143 6.658 12.929 -11.582 1.00 0.00 C ATOM 2428 NE2 HIS A 143 7.532 12.193 -10.889 1.00 0.00 N ATOM 0 H HIS A 143 6.354 7.758 -15.151 1.00 0.00 H new ATOM 0 HA HIS A 143 8.433 8.878 -13.262 1.00 0.00 H new ATOM 0 HB2 HIS A 143 7.581 10.654 -14.862 1.00 0.00 H new ATOM 0 HB3 HIS A 143 5.937 10.243 -14.415 1.00 0.00 H new ATOM 0 HD2 HIS A 143 8.459 10.275 -11.438 1.00 0.00 H new ATOM 0 HE1 HIS A 143 6.249 13.867 -11.237 1.00 0.00 H new ATOM 0 HE2 HIS A 143 7.925 12.399 -9.971 1.00 0.00 H new ATOM 2436 N GLN A 144 5.220 8.181 -12.852 1.00 0.00 N ATOM 2437 CA GLN A 144 4.272 7.570 -11.868 1.00 0.00 C ATOM 2438 C GLN A 144 3.112 6.904 -12.630 1.00 0.00 C ATOM 2439 O GLN A 144 2.748 7.349 -13.704 1.00 0.00 O ATOM 2440 CB GLN A 144 3.768 8.736 -11.006 1.00 0.00 C ATOM 2441 CG GLN A 144 3.082 9.787 -11.885 1.00 0.00 C ATOM 2442 CD GLN A 144 2.767 11.030 -11.044 1.00 0.00 C ATOM 2443 OE1 GLN A 144 1.617 11.393 -10.891 1.00 0.00 O ATOM 2444 NE2 GLN A 144 3.741 11.707 -10.486 1.00 0.00 N ATOM 0 H GLN A 144 4.786 8.528 -13.708 1.00 0.00 H new ATOM 0 HA GLN A 144 4.740 6.803 -11.251 1.00 0.00 H new ATOM 0 HB2 GLN A 144 3.069 8.367 -10.255 1.00 0.00 H new ATOM 0 HB3 GLN A 144 4.602 9.188 -10.470 1.00 0.00 H new ATOM 0 HG2 GLN A 144 3.728 10.055 -12.721 1.00 0.00 H new ATOM 0 HG3 GLN A 144 2.164 9.379 -12.309 1.00 0.00 H new ATOM 0 HE21 GLN A 144 4.708 11.407 -10.611 1.00 0.00 H new ATOM 0 HE22 GLN A 144 3.532 12.534 -9.927 1.00 0.00 H new ATOM 2453 N CYS A 145 2.537 5.843 -12.106 1.00 0.00 N ATOM 2454 CA CYS A 145 1.412 5.175 -12.854 1.00 0.00 C ATOM 2455 C CYS A 145 0.045 5.714 -12.396 1.00 0.00 C ATOM 2456 O CYS A 145 -0.090 6.225 -11.300 1.00 0.00 O ATOM 2457 CB CYS A 145 1.545 3.658 -12.605 1.00 0.00 C ATOM 2458 SG CYS A 145 1.212 3.238 -10.862 1.00 0.00 S ATOM 0 H CYS A 145 2.788 5.417 -11.214 1.00 0.00 H new ATOM 0 HA CYS A 145 1.474 5.387 -13.921 1.00 0.00 H new ATOM 0 HB2 CYS A 145 0.850 3.120 -13.250 1.00 0.00 H new ATOM 0 HB3 CYS A 145 2.549 3.330 -12.874 1.00 0.00 H new ATOM 2463 N VAL A 146 -0.966 5.613 -13.237 1.00 0.00 N ATOM 2464 CA VAL A 146 -2.323 6.141 -12.845 1.00 0.00 C ATOM 2465 C VAL A 146 -3.007 5.235 -11.798 1.00 0.00 C ATOM 2466 O VAL A 146 -3.842 5.701 -11.047 1.00 0.00 O ATOM 2467 CB VAL A 146 -3.167 6.214 -14.136 1.00 0.00 C ATOM 2468 CG1 VAL A 146 -3.375 4.812 -14.726 1.00 0.00 C ATOM 2469 CG2 VAL A 146 -4.531 6.833 -13.816 1.00 0.00 C ATOM 0 H VAL A 146 -0.913 5.194 -14.165 1.00 0.00 H new ATOM 0 HA VAL A 146 -2.224 7.123 -12.383 1.00 0.00 H new ATOM 0 HB VAL A 146 -2.638 6.828 -14.865 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -3.972 4.885 -15.635 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -2.407 4.369 -14.962 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -3.894 4.185 -14.001 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -5.129 6.886 -14.726 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -5.046 6.217 -13.078 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -4.390 7.837 -13.416 1.00 0.00 H new ATOM 2479 N HIS A 147 -2.681 3.949 -11.739 1.00 0.00 N ATOM 2480 CA HIS A 147 -3.348 3.045 -10.721 1.00 0.00 C ATOM 2481 C HIS A 147 -3.307 3.690 -9.320 1.00 0.00 C ATOM 2482 O HIS A 147 -4.324 3.820 -8.665 1.00 0.00 O ATOM 2483 CB HIS A 147 -2.558 1.721 -10.717 1.00 0.00 C ATOM 2484 CG HIS A 147 -2.675 1.013 -12.053 1.00 0.00 C ATOM 2485 ND1 HIS A 147 -3.527 1.437 -13.073 1.00 0.00 N ATOM 2486 CD2 HIS A 147 -2.042 -0.109 -12.548 1.00 0.00 C ATOM 2487 CE1 HIS A 147 -3.379 0.586 -14.105 1.00 0.00 C ATOM 2488 NE2 HIS A 147 -2.490 -0.371 -13.838 1.00 0.00 N ATOM 0 H HIS A 147 -1.994 3.494 -12.341 1.00 0.00 H new ATOM 0 HA HIS A 147 -4.394 2.879 -10.977 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -1.509 1.920 -10.498 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -2.932 1.073 -9.924 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -1.309 -0.695 -12.014 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -3.916 0.668 -15.038 1.00 0.00 H new ATOM 0 HE2 HIS A 147 -2.200 -1.134 -14.450 1.00 0.00 H new ATOM 2496 N CYS A 148 -2.143 4.098 -8.861 1.00 0.00 N ATOM 2497 CA CYS A 148 -2.041 4.734 -7.518 1.00 0.00 C ATOM 2498 C CYS A 148 -1.143 5.987 -7.583 1.00 0.00 C ATOM 2499 O CYS A 148 -0.828 6.470 -8.654 1.00 0.00 O ATOM 2500 CB CYS A 148 -1.414 3.641 -6.643 1.00 0.00 C ATOM 2501 SG CYS A 148 0.294 3.296 -7.169 1.00 0.00 S ATOM 0 H CYS A 148 -1.261 4.014 -9.366 1.00 0.00 H new ATOM 0 HA CYS A 148 -3.001 5.075 -7.129 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -1.422 3.955 -5.599 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -2.010 2.731 -6.707 1.00 0.00 H new ATOM 2506 N GLY A 149 -0.704 6.492 -6.449 1.00 0.00 N ATOM 2507 CA GLY A 149 0.198 7.680 -6.456 1.00 0.00 C ATOM 2508 C GLY A 149 1.636 7.181 -6.252 1.00 0.00 C ATOM 2509 O GLY A 149 2.279 7.511 -5.274 1.00 0.00 O ATOM 0 H GLY A 149 -0.934 6.129 -5.524 1.00 0.00 H new ATOM 0 HA2 GLY A 149 0.111 8.219 -7.399 1.00 0.00 H new ATOM 0 HA3 GLY A 149 -0.081 8.375 -5.664 1.00 0.00 H new ATOM 2513 N CYS A 150 2.139 6.370 -7.163 1.00 0.00 N ATOM 2514 CA CYS A 150 3.528 5.831 -7.010 1.00 0.00 C ATOM 2515 C CYS A 150 4.485 6.583 -7.946 1.00 0.00 C ATOM 2516 O CYS A 150 4.166 6.829 -9.091 1.00 0.00 O ATOM 2517 CB CYS A 150 3.403 4.345 -7.395 1.00 0.00 C ATOM 2518 SG CYS A 150 5.021 3.538 -7.496 1.00 0.00 S ATOM 0 H CYS A 150 1.646 6.062 -8.001 1.00 0.00 H new ATOM 0 HA CYS A 150 3.931 5.951 -6.004 1.00 0.00 H new ATOM 0 HB2 CYS A 150 2.785 3.830 -6.660 1.00 0.00 H new ATOM 0 HB3 CYS A 150 2.894 4.260 -8.355 1.00 0.00 H new ATOM 2523 N ARG A 151 5.665 6.935 -7.475 1.00 0.00 N ATOM 2524 CA ARG A 151 6.636 7.657 -8.360 1.00 0.00 C ATOM 2525 C ARG A 151 7.618 6.649 -8.979 1.00 0.00 C ATOM 2526 O ARG A 151 8.821 6.813 -8.890 1.00 0.00 O ATOM 2527 CB ARG A 151 7.379 8.651 -7.458 1.00 0.00 C ATOM 2528 CG ARG A 151 6.393 9.695 -6.930 1.00 0.00 C ATOM 2529 CD ARG A 151 7.003 10.408 -5.721 1.00 0.00 C ATOM 2530 NE ARG A 151 7.665 11.625 -6.284 1.00 0.00 N ATOM 2531 CZ ARG A 151 6.953 12.646 -6.738 1.00 0.00 C ATOM 2532 NH1 ARG A 151 5.640 12.631 -6.713 1.00 0.00 N ATOM 2533 NH2 ARG A 151 7.566 13.694 -7.223 1.00 0.00 N ATOM 0 H ARG A 151 5.992 6.754 -6.526 1.00 0.00 H new ATOM 0 HA ARG A 151 6.134 8.173 -9.178 1.00 0.00 H new ATOM 0 HB2 ARG A 151 7.847 8.124 -6.627 1.00 0.00 H new ATOM 0 HB3 ARG A 151 8.178 9.139 -8.017 1.00 0.00 H new ATOM 0 HG2 ARG A 151 6.159 10.418 -7.712 1.00 0.00 H new ATOM 0 HG3 ARG A 151 5.456 9.216 -6.648 1.00 0.00 H new ATOM 0 HD2 ARG A 151 6.237 10.676 -4.993 1.00 0.00 H new ATOM 0 HD3 ARG A 151 7.722 9.770 -5.207 1.00 0.00 H new ATOM 0 HE ARG A 151 8.683 11.670 -6.319 1.00 0.00 H new ATOM 0 HH11 ARG A 151 5.146 11.821 -6.338 1.00 0.00 H new ATOM 0 HH12 ARG A 151 5.114 13.429 -7.068 1.00 0.00 H new ATOM 0 HH21 ARG A 151 8.585 13.722 -7.250 1.00 0.00 H new ATOM 0 HH22 ARG A 151 7.025 14.484 -7.574 1.00 0.00 H new ATOM 2547 N GLY A 152 7.115 5.606 -9.608 1.00 0.00 N ATOM 2548 CA GLY A 152 8.016 4.597 -10.229 1.00 0.00 C ATOM 2549 C GLY A 152 8.726 3.787 -9.137 1.00 0.00 C ATOM 2550 O GLY A 152 9.729 4.217 -8.596 1.00 0.00 O ATOM 0 H GLY A 152 6.118 5.418 -9.713 1.00 0.00 H new ATOM 0 HA2 GLY A 152 7.441 3.931 -10.872 1.00 0.00 H new ATOM 0 HA3 GLY A 152 8.752 5.094 -10.861 1.00 0.00 H new ATOM 2554 N CYS A 153 8.223 2.612 -8.811 1.00 0.00 N ATOM 2555 CA CYS A 153 8.887 1.781 -7.761 1.00 0.00 C ATOM 2556 C CYS A 153 9.589 0.571 -8.410 1.00 0.00 C ATOM 2557 O CYS A 153 8.984 -0.176 -9.151 1.00 0.00 O ATOM 2558 CB CYS A 153 7.770 1.353 -6.782 1.00 0.00 C ATOM 2559 SG CYS A 153 6.585 0.211 -7.561 1.00 0.00 S ATOM 0 H CYS A 153 7.387 2.201 -9.227 1.00 0.00 H new ATOM 0 HA CYS A 153 9.662 2.331 -7.227 1.00 0.00 H new ATOM 0 HB2 CYS A 153 8.215 0.875 -5.910 1.00 0.00 H new ATOM 0 HB3 CYS A 153 7.241 2.237 -6.425 1.00 0.00 H new ATOM 2564 N ALA A 154 10.866 0.383 -8.151 1.00 0.00 N ATOM 2565 CA ALA A 154 11.598 -0.766 -8.765 1.00 0.00 C ATOM 2566 C ALA A 154 12.544 -1.395 -7.733 1.00 0.00 C ATOM 2567 O ALA A 154 13.210 -0.692 -6.998 1.00 0.00 O ATOM 2568 CB ALA A 154 12.395 -0.152 -9.912 1.00 0.00 C ATOM 0 H ALA A 154 11.428 0.977 -7.541 1.00 0.00 H new ATOM 0 HA ALA A 154 10.927 -1.554 -9.108 1.00 0.00 H new ATOM 0 HB1 ALA A 154 12.964 -0.932 -10.418 1.00 0.00 H new ATOM 0 HB2 ALA A 154 11.711 0.316 -10.620 1.00 0.00 H new ATOM 0 HB3 ALA A 154 13.080 0.599 -9.518 1.00 0.00 H new ATOM 2574 N SER A 155 12.614 -2.710 -7.666 1.00 0.00 N ATOM 2575 CA SER A 155 13.525 -3.355 -6.668 1.00 0.00 C ATOM 2576 C SER A 155 14.742 -3.976 -7.373 1.00 0.00 C ATOM 2577 O SER A 155 15.871 -3.728 -6.991 1.00 0.00 O ATOM 2578 CB SER A 155 12.685 -4.439 -5.991 1.00 0.00 C ATOM 2579 OG SER A 155 11.322 -4.037 -5.978 1.00 0.00 O ATOM 0 H SER A 155 12.085 -3.354 -8.254 1.00 0.00 H new ATOM 0 HA SER A 155 13.912 -2.635 -5.947 1.00 0.00 H new ATOM 0 HB2 SER A 155 12.792 -5.384 -6.523 1.00 0.00 H new ATOM 0 HB3 SER A 155 13.037 -4.605 -4.973 1.00 0.00 H new ATOM 0 HG SER A 155 10.781 -4.730 -5.546 1.00 0.00 H new ATOM 2585 N THR A 156 14.531 -4.782 -8.397 1.00 0.00 N ATOM 2586 CA THR A 156 15.707 -5.409 -9.108 1.00 0.00 C ATOM 2587 C THR A 156 16.642 -4.319 -9.654 1.00 0.00 C ATOM 2588 O THR A 156 17.851 -4.448 -9.590 1.00 0.00 O ATOM 2589 CB THR A 156 15.135 -6.241 -10.268 1.00 0.00 C ATOM 2590 OG1 THR A 156 14.131 -5.490 -10.936 1.00 0.00 O ATOM 2591 CG2 THR A 156 14.528 -7.533 -9.721 1.00 0.00 C ATOM 0 H THR A 156 13.613 -5.030 -8.767 1.00 0.00 H new ATOM 0 HA THR A 156 16.286 -6.032 -8.426 1.00 0.00 H new ATOM 0 HB THR A 156 15.933 -6.486 -10.968 1.00 0.00 H new ATOM 0 HG1 THR A 156 13.766 -6.018 -11.677 1.00 0.00 H new ATOM 0 HG21 THR A 156 14.123 -8.122 -10.544 1.00 0.00 H new ATOM 0 HG22 THR A 156 15.299 -8.108 -9.208 1.00 0.00 H new ATOM 0 HG23 THR A 156 13.729 -7.291 -9.020 1.00 0.00 H new ATOM 2599 N ASP A 157 16.097 -3.248 -10.188 1.00 0.00 N ATOM 2600 CA ASP A 157 16.964 -2.158 -10.734 1.00 0.00 C ATOM 2601 C ASP A 157 16.304 -0.793 -10.522 1.00 0.00 C ATOM 2602 O ASP A 157 15.156 -0.770 -10.109 1.00 0.00 O ATOM 2603 CB ASP A 157 17.091 -2.465 -12.227 1.00 0.00 C ATOM 2604 CG ASP A 157 18.245 -3.445 -12.450 1.00 0.00 C ATOM 2605 OD1 ASP A 157 19.337 -3.161 -11.985 1.00 0.00 O ATOM 2606 OD2 ASP A 157 18.017 -4.463 -13.083 1.00 0.00 O ATOM 2607 OXT ASP A 157 16.957 0.205 -10.774 1.00 0.00 O ATOM 0 H ASP A 157 15.093 -3.085 -10.268 1.00 0.00 H new ATOM 0 HA ASP A 157 17.935 -2.119 -10.239 1.00 0.00 H new ATOM 0 HB2 ASP A 157 16.160 -2.891 -12.602 1.00 0.00 H new ATOM 0 HB3 ASP A 157 17.268 -1.545 -12.785 1.00 0.00 H new TER 2612 ASP A 157 HETATM 2613 ZN ZN A1000 0.806 1.073 -6.919 1.00 0.00 ZN HETATM 2614 ZN ZN A1001 4.584 1.307 -7.900 1.00 0.00 ZN HETATM 2615 ZN ZN A1002 1.720 1.008 -10.542 1.00 0.00 ZN