USER MOD reduce.3.24.130724 H: found=0, std=0, add=788, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 784 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 38 MET CE :methyl -131:sc= -5.91! (180deg=-9.44!) USER MOD Set 1.2: A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 THR N :NH3+ 134:sc= 0.00256 (180deg=-0.176) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0 USER MOD Single : A 2 SER OG : rot 15:sc= 1.27 USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 HIS : no HD1:sc= -0.0146 X(o=-0.015,f=-0.13) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 ASN : amide:sc=-0.00934 X(o=-0.0093,f=-0.26) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 19 HIS : no HD1:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 39:sc= 1.12 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 MET CE :methyl 172:sc= -1.53 (180deg=-1.6) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot -20:sc= 0.73 USER MOD Single : A 42 SER OG : rot 180:sc= -0.0857 USER MOD Single : A 43 SER OG : rot -53:sc= 0.182 USER MOD Single : A 45 LYS NZ :NH3+ -135:sc= 0 (180deg=-0.218) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 GLN :FLIP amide:sc= -4.42! C(o=-5.5!,f=-4.4!) USER MOD Single : A 68 THR OG1 : rot -26:sc= 0.502 USER MOD Single : A 69 SER OG : rot 58:sc= 1.09 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot -17:sc= 0.787 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot -32:sc=-0.00283 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 TYR OH : rot 120:sc=-0.000929 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 82:sc= 1.2 USER MOD Single : A 104 THR OG1 : rot -41:sc= 0.437 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 27.687 -56.656 -2.168 1.00 0.00 N ATOM 2 CA THR A 1 28.032 -55.243 -2.077 1.00 0.00 C ATOM 3 C THR A 1 26.821 -54.362 -2.360 1.00 0.00 C ATOM 4 O THR A 1 26.016 -54.661 -3.242 1.00 0.00 O ATOM 5 CB THR A 1 29.161 -54.876 -3.058 1.00 0.00 C ATOM 6 OG1 THR A 1 29.542 -53.507 -2.877 1.00 0.00 O ATOM 7 CG2 THR A 1 28.720 -55.098 -4.497 1.00 0.00 C ATOM 0 H1 THR A 1 28.411 -57.155 -2.724 1.00 0.00 H new ATOM 0 H2 THR A 1 27.641 -57.064 -1.213 1.00 0.00 H new ATOM 0 H3 THR A 1 26.762 -56.758 -2.633 1.00 0.00 H new ATOM 0 HA THR A 1 28.375 -55.067 -1.058 1.00 0.00 H new ATOM 0 HB THR A 1 30.015 -55.521 -2.852 1.00 0.00 H new ATOM 0 HG1 THR A 1 30.261 -53.282 -3.503 1.00 0.00 H new ATOM 0 HG21 THR A 1 29.534 -54.832 -5.172 1.00 0.00 H new ATOM 0 HG22 THR A 1 28.458 -56.146 -4.640 1.00 0.00 H new ATOM 0 HG23 THR A 1 27.852 -54.475 -4.712 1.00 0.00 H new ATOM 15 N SER A 2 26.698 -53.273 -1.607 1.00 0.00 N ATOM 16 CA SER A 2 25.582 -52.350 -1.776 1.00 0.00 C ATOM 17 C SER A 2 25.844 -51.041 -1.036 1.00 0.00 C ATOM 18 O SER A 2 26.093 -51.034 0.170 1.00 0.00 O ATOM 19 CB SER A 2 24.285 -52.985 -1.269 1.00 0.00 C ATOM 20 OG SER A 2 23.721 -53.840 -2.247 1.00 0.00 O ATOM 0 H SER A 2 27.357 -53.009 -0.875 1.00 0.00 H new ATOM 0 HA SER A 2 25.480 -52.133 -2.839 1.00 0.00 H new ATOM 0 HB2 SER A 2 24.485 -53.550 -0.359 1.00 0.00 H new ATOM 0 HB3 SER A 2 23.571 -52.204 -1.009 1.00 0.00 H new ATOM 0 HG SER A 2 24.387 -54.028 -2.940 1.00 0.00 H new ATOM 26 N LYS A 3 25.785 -49.934 -1.768 1.00 0.00 N ATOM 27 CA LYS A 3 26.013 -48.617 -1.184 1.00 0.00 C ATOM 28 C LYS A 3 25.592 -47.513 -2.148 1.00 0.00 C ATOM 29 O LYS A 3 25.631 -47.692 -3.365 1.00 0.00 O ATOM 30 CB LYS A 3 27.489 -48.450 -0.814 1.00 0.00 C ATOM 31 CG LYS A 3 28.438 -48.698 -1.974 1.00 0.00 C ATOM 32 CD LYS A 3 28.696 -47.426 -2.765 1.00 0.00 C ATOM 33 CE LYS A 3 29.857 -46.634 -2.184 1.00 0.00 C ATOM 34 NZ LYS A 3 31.172 -47.163 -2.638 1.00 0.00 N ATOM 0 H LYS A 3 25.581 -49.922 -2.767 1.00 0.00 H new ATOM 0 HA LYS A 3 25.406 -48.537 -0.282 1.00 0.00 H new ATOM 0 HB2 LYS A 3 27.648 -47.441 -0.435 1.00 0.00 H new ATOM 0 HB3 LYS A 3 27.732 -49.137 -0.003 1.00 0.00 H new ATOM 0 HG2 LYS A 3 29.382 -49.090 -1.596 1.00 0.00 H new ATOM 0 HG3 LYS A 3 28.018 -49.458 -2.633 1.00 0.00 H new ATOM 0 HD2 LYS A 3 28.910 -47.679 -3.803 1.00 0.00 H new ATOM 0 HD3 LYS A 3 27.798 -46.809 -2.766 1.00 0.00 H new ATOM 0 HE2 LYS A 3 29.766 -45.588 -2.477 1.00 0.00 H new ATOM 0 HE3 LYS A 3 29.809 -46.665 -1.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 31.937 -46.596 -2.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 31.271 -48.153 -2.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 31.228 -47.110 -3.675 1.00 0.00 H new ATOM 48 N GLU A 4 25.190 -46.373 -1.596 1.00 0.00 N ATOM 49 CA GLU A 4 24.762 -45.240 -2.409 1.00 0.00 C ATOM 50 C GLU A 4 24.896 -43.933 -1.634 1.00 0.00 C ATOM 51 O GLU A 4 25.283 -43.927 -0.465 1.00 0.00 O ATOM 52 CB GLU A 4 23.314 -45.430 -2.865 1.00 0.00 C ATOM 53 CG GLU A 4 22.307 -45.382 -1.728 1.00 0.00 C ATOM 54 CD GLU A 4 20.894 -45.687 -2.187 1.00 0.00 C ATOM 55 OE1 GLU A 4 20.740 -46.332 -3.245 1.00 0.00 O ATOM 56 OE2 GLU A 4 19.943 -45.282 -1.487 1.00 0.00 O ATOM 0 H GLU A 4 25.152 -46.209 -0.590 1.00 0.00 H new ATOM 0 HA GLU A 4 25.408 -45.190 -3.286 1.00 0.00 H new ATOM 0 HB2 GLU A 4 23.066 -44.656 -3.592 1.00 0.00 H new ATOM 0 HB3 GLU A 4 23.226 -46.388 -3.377 1.00 0.00 H new ATOM 0 HG2 GLU A 4 22.598 -46.098 -0.959 1.00 0.00 H new ATOM 0 HG3 GLU A 4 22.330 -44.394 -1.268 1.00 0.00 H new ATOM 63 N THR A 5 24.574 -42.825 -2.295 1.00 0.00 N ATOM 64 CA THR A 5 24.660 -41.511 -1.670 1.00 0.00 C ATOM 65 C THR A 5 23.447 -40.656 -2.020 1.00 0.00 C ATOM 66 O THR A 5 23.199 -40.362 -3.189 1.00 0.00 O ATOM 67 CB THR A 5 25.939 -40.767 -2.099 1.00 0.00 C ATOM 68 OG1 THR A 5 26.974 -41.708 -2.402 1.00 0.00 O ATOM 69 CG2 THR A 5 26.409 -39.823 -1.003 1.00 0.00 C ATOM 0 H THR A 5 24.251 -42.812 -3.263 1.00 0.00 H new ATOM 0 HA THR A 5 24.688 -41.675 -0.593 1.00 0.00 H new ATOM 0 HB THR A 5 25.711 -40.180 -2.989 1.00 0.00 H new ATOM 0 HG1 THR A 5 27.783 -41.228 -2.675 1.00 0.00 H new ATOM 0 HG21 THR A 5 27.313 -39.309 -1.329 1.00 0.00 H new ATOM 0 HG22 THR A 5 25.630 -39.090 -0.795 1.00 0.00 H new ATOM 0 HG23 THR A 5 26.621 -40.393 -0.098 1.00 0.00 H new ATOM 77 N PHE A 6 22.694 -40.259 -0.999 1.00 0.00 N ATOM 78 CA PHE A 6 21.506 -39.437 -1.199 1.00 0.00 C ATOM 79 C PHE A 6 21.047 -38.815 0.116 1.00 0.00 C ATOM 80 O PHE A 6 20.481 -39.494 0.974 1.00 0.00 O ATOM 81 CB PHE A 6 20.377 -40.274 -1.802 1.00 0.00 C ATOM 82 CG PHE A 6 19.054 -39.564 -1.831 1.00 0.00 C ATOM 83 CD1 PHE A 6 18.875 -38.436 -2.617 1.00 0.00 C ATOM 84 CD2 PHE A 6 17.989 -40.024 -1.074 1.00 0.00 C ATOM 85 CE1 PHE A 6 17.659 -37.780 -2.644 1.00 0.00 C ATOM 86 CE2 PHE A 6 16.770 -39.372 -1.098 1.00 0.00 C ATOM 87 CZ PHE A 6 16.605 -38.250 -1.885 1.00 0.00 C ATOM 0 H PHE A 6 22.886 -40.493 -0.025 1.00 0.00 H new ATOM 0 HA PHE A 6 21.762 -38.634 -1.890 1.00 0.00 H new ATOM 0 HB2 PHE A 6 20.650 -40.559 -2.818 1.00 0.00 H new ATOM 0 HB3 PHE A 6 20.273 -41.196 -1.229 1.00 0.00 H new ATOM 0 HD1 PHE A 6 19.695 -38.066 -3.215 1.00 0.00 H new ATOM 0 HD2 PHE A 6 18.112 -40.902 -0.458 1.00 0.00 H new ATOM 0 HE1 PHE A 6 17.533 -36.901 -3.258 1.00 0.00 H new ATOM 0 HE2 PHE A 6 15.948 -39.740 -0.502 1.00 0.00 H new ATOM 0 HZ PHE A 6 15.653 -37.740 -1.907 1.00 0.00 H new ATOM 97 N THR A 7 21.296 -37.518 0.270 1.00 0.00 N ATOM 98 CA THR A 7 20.911 -36.804 1.480 1.00 0.00 C ATOM 99 C THR A 7 20.342 -35.429 1.150 1.00 0.00 C ATOM 100 O THR A 7 20.821 -34.750 0.241 1.00 0.00 O ATOM 101 CB THR A 7 22.106 -36.636 2.438 1.00 0.00 C ATOM 102 OG1 THR A 7 21.708 -35.886 3.591 1.00 0.00 O ATOM 103 CG2 THR A 7 23.262 -35.933 1.743 1.00 0.00 C ATOM 0 H THR A 7 21.763 -36.941 -0.429 1.00 0.00 H new ATOM 0 HA THR A 7 20.144 -37.404 1.970 1.00 0.00 H new ATOM 0 HB THR A 7 22.438 -37.627 2.747 1.00 0.00 H new ATOM 0 HG1 THR A 7 22.473 -35.785 4.196 1.00 0.00 H new ATOM 0 HG21 THR A 7 24.094 -35.826 2.439 1.00 0.00 H new ATOM 0 HG22 THR A 7 23.582 -36.522 0.883 1.00 0.00 H new ATOM 0 HG23 THR A 7 22.940 -34.947 1.408 1.00 0.00 H new ATOM 111 N HIS A 8 19.318 -35.023 1.894 1.00 0.00 N ATOM 112 CA HIS A 8 18.684 -33.727 1.680 1.00 0.00 C ATOM 113 C HIS A 8 19.319 -32.659 2.566 1.00 0.00 C ATOM 114 O HIS A 8 19.395 -32.814 3.785 1.00 0.00 O ATOM 115 CB HIS A 8 17.184 -33.816 1.964 1.00 0.00 C ATOM 116 CG HIS A 8 16.385 -34.331 0.807 1.00 0.00 C ATOM 117 ND1 HIS A 8 16.409 -33.748 -0.443 1.00 0.00 N ATOM 118 CD2 HIS A 8 15.537 -35.381 0.714 1.00 0.00 C ATOM 119 CE1 HIS A 8 15.609 -34.417 -1.254 1.00 0.00 C ATOM 120 NE2 HIS A 8 15.068 -35.414 -0.576 1.00 0.00 N ATOM 0 H HIS A 8 18.910 -35.573 2.650 1.00 0.00 H new ATOM 0 HA HIS A 8 18.833 -33.445 0.638 1.00 0.00 H new ATOM 0 HB2 HIS A 8 17.023 -34.466 2.824 1.00 0.00 H new ATOM 0 HB3 HIS A 8 16.815 -32.828 2.238 1.00 0.00 H new ATOM 0 HD2 HIS A 8 15.277 -36.066 1.507 1.00 0.00 H new ATOM 0 HE1 HIS A 8 15.428 -34.188 -2.294 1.00 0.00 H new ATOM 0 HE2 HIS A 8 14.409 -36.097 -0.950 1.00 0.00 H new ATOM 128 N TYR A 9 19.774 -31.576 1.945 1.00 0.00 N ATOM 129 CA TYR A 9 20.405 -30.484 2.677 1.00 0.00 C ATOM 130 C TYR A 9 20.095 -29.141 2.025 1.00 0.00 C ATOM 131 O TYR A 9 19.426 -29.079 0.993 1.00 0.00 O ATOM 132 CB TYR A 9 21.919 -30.695 2.742 1.00 0.00 C ATOM 133 CG TYR A 9 22.570 -30.041 3.940 1.00 0.00 C ATOM 134 CD1 TYR A 9 22.289 -30.473 5.230 1.00 0.00 C ATOM 135 CD2 TYR A 9 23.467 -28.991 3.781 1.00 0.00 C ATOM 136 CE1 TYR A 9 22.881 -29.877 6.327 1.00 0.00 C ATOM 137 CE2 TYR A 9 24.065 -28.391 4.872 1.00 0.00 C ATOM 138 CZ TYR A 9 23.768 -28.837 6.143 1.00 0.00 C ATOM 139 OH TYR A 9 24.361 -28.243 7.233 1.00 0.00 O ATOM 0 H TYR A 9 19.718 -31.431 0.937 1.00 0.00 H new ATOM 0 HA TYR A 9 20.002 -30.477 3.690 1.00 0.00 H new ATOM 0 HB2 TYR A 9 22.128 -31.765 2.764 1.00 0.00 H new ATOM 0 HB3 TYR A 9 22.372 -30.301 1.832 1.00 0.00 H new ATOM 0 HD1 TYR A 9 21.596 -31.288 5.378 1.00 0.00 H new ATOM 0 HD2 TYR A 9 23.700 -28.638 2.787 1.00 0.00 H new ATOM 0 HE1 TYR A 9 22.650 -30.224 7.323 1.00 0.00 H new ATOM 0 HE2 TYR A 9 24.761 -27.577 4.731 1.00 0.00 H new ATOM 0 HH TYR A 9 24.959 -27.528 6.931 1.00 0.00 H new ATOM 149 N GLN A 10 20.587 -28.067 2.634 1.00 0.00 N ATOM 150 CA GLN A 10 20.362 -26.723 2.114 1.00 0.00 C ATOM 151 C GLN A 10 18.958 -26.592 1.533 1.00 0.00 C ATOM 152 O GLN A 10 18.769 -26.175 0.391 1.00 0.00 O ATOM 153 CB GLN A 10 21.402 -26.388 1.043 1.00 0.00 C ATOM 154 CG GLN A 10 21.735 -24.907 0.961 1.00 0.00 C ATOM 155 CD GLN A 10 22.630 -24.574 -0.217 1.00 0.00 C ATOM 156 OE1 GLN A 10 23.577 -25.301 -0.516 1.00 0.00 O ATOM 157 NE2 GLN A 10 22.333 -23.471 -0.893 1.00 0.00 N ATOM 0 H GLN A 10 21.144 -28.101 3.488 1.00 0.00 H new ATOM 0 HA GLN A 10 20.461 -26.019 2.941 1.00 0.00 H new ATOM 0 HB2 GLN A 10 22.315 -26.947 1.248 1.00 0.00 H new ATOM 0 HB3 GLN A 10 21.034 -26.723 0.073 1.00 0.00 H new ATOM 0 HG2 GLN A 10 20.811 -24.334 0.883 1.00 0.00 H new ATOM 0 HG3 GLN A 10 22.225 -24.597 1.884 1.00 0.00 H new ATOM 0 HE21 GLN A 10 21.538 -22.898 -0.610 1.00 0.00 H new ATOM 0 HE22 GLN A 10 22.899 -23.197 -1.696 1.00 0.00 H new ATOM 166 N PRO A 11 17.948 -26.956 2.338 1.00 0.00 N ATOM 167 CA PRO A 11 16.543 -26.887 1.926 1.00 0.00 C ATOM 168 C PRO A 11 16.048 -25.451 1.791 1.00 0.00 C ATOM 169 O PRO A 11 16.571 -24.542 2.435 1.00 0.00 O ATOM 170 CB PRO A 11 15.805 -27.603 3.060 1.00 0.00 C ATOM 171 CG PRO A 11 16.694 -27.451 4.245 1.00 0.00 C ATOM 172 CD PRO A 11 18.101 -27.461 3.713 1.00 0.00 C ATOM 0 HA PRO A 11 16.384 -27.335 0.945 1.00 0.00 H new ATOM 0 HB2 PRO A 11 14.827 -27.157 3.239 1.00 0.00 H new ATOM 0 HB3 PRO A 11 15.638 -28.654 2.822 1.00 0.00 H new ATOM 0 HG2 PRO A 11 16.484 -26.521 4.774 1.00 0.00 H new ATOM 0 HG3 PRO A 11 16.540 -28.263 4.955 1.00 0.00 H new ATOM 0 HD2 PRO A 11 18.759 -26.824 4.304 1.00 0.00 H new ATOM 0 HD3 PRO A 11 18.529 -28.463 3.728 1.00 0.00 H new ATOM 180 N GLN A 12 15.037 -25.255 0.950 1.00 0.00 N ATOM 181 CA GLN A 12 14.473 -23.929 0.732 1.00 0.00 C ATOM 182 C GLN A 12 13.727 -23.443 1.971 1.00 0.00 C ATOM 183 O GLN A 12 13.607 -24.167 2.959 1.00 0.00 O ATOM 184 CB GLN A 12 13.528 -23.945 -0.471 1.00 0.00 C ATOM 185 CG GLN A 12 12.396 -24.951 -0.343 1.00 0.00 C ATOM 186 CD GLN A 12 11.367 -24.816 -1.447 1.00 0.00 C ATOM 187 OE1 GLN A 12 11.644 -25.110 -2.610 1.00 0.00 O ATOM 188 NE2 GLN A 12 10.169 -24.368 -1.088 1.00 0.00 N ATOM 0 H GLN A 12 14.593 -25.997 0.409 1.00 0.00 H new ATOM 0 HA GLN A 12 15.295 -23.242 0.532 1.00 0.00 H new ATOM 0 HB2 GLN A 12 13.105 -22.949 -0.603 1.00 0.00 H new ATOM 0 HB3 GLN A 12 14.102 -24.169 -1.370 1.00 0.00 H new ATOM 0 HG2 GLN A 12 12.808 -25.960 -0.358 1.00 0.00 H new ATOM 0 HG3 GLN A 12 11.907 -24.821 0.622 1.00 0.00 H new ATOM 0 HE21 GLN A 12 9.983 -24.136 -0.112 1.00 0.00 H new ATOM 0 HE22 GLN A 12 9.436 -24.256 -1.788 1.00 0.00 H new ATOM 197 N GLY A 13 13.229 -22.212 1.912 1.00 0.00 N ATOM 198 CA GLY A 13 12.502 -21.651 3.036 1.00 0.00 C ATOM 199 C GLY A 13 11.776 -20.370 2.676 1.00 0.00 C ATOM 200 O GLY A 13 12.239 -19.603 1.833 1.00 0.00 O ATOM 0 H GLY A 13 13.316 -21.593 1.106 1.00 0.00 H new ATOM 0 HA2 GLY A 13 11.781 -22.383 3.400 1.00 0.00 H new ATOM 0 HA3 GLY A 13 13.197 -21.454 3.852 1.00 0.00 H new ATOM 204 N ASN A 14 10.634 -20.140 3.314 1.00 0.00 N ATOM 205 CA ASN A 14 9.841 -18.943 3.055 1.00 0.00 C ATOM 206 C ASN A 14 9.121 -18.483 4.319 1.00 0.00 C ATOM 207 O ASN A 14 9.031 -19.223 5.299 1.00 0.00 O ATOM 208 CB ASN A 14 8.823 -19.212 1.944 1.00 0.00 C ATOM 209 CG ASN A 14 8.205 -20.593 2.048 1.00 0.00 C ATOM 210 OD1 ASN A 14 8.806 -21.587 1.639 1.00 0.00 O ATOM 211 ND2 ASN A 14 6.998 -20.661 2.597 1.00 0.00 N ATOM 0 H ASN A 14 10.236 -20.766 4.014 1.00 0.00 H new ATOM 0 HA ASN A 14 10.518 -18.151 2.735 1.00 0.00 H new ATOM 0 HB2 ASN A 14 8.035 -18.460 1.987 1.00 0.00 H new ATOM 0 HB3 ASN A 14 9.311 -19.107 0.975 1.00 0.00 H new ATOM 0 HD21 ASN A 14 6.532 -21.563 2.694 1.00 0.00 H new ATOM 0 HD22 ASN A 14 6.537 -19.811 2.922 1.00 0.00 H new ATOM 218 N SER A 15 8.609 -17.257 4.288 1.00 0.00 N ATOM 219 CA SER A 15 7.900 -16.696 5.432 1.00 0.00 C ATOM 220 C SER A 15 6.691 -15.885 4.977 1.00 0.00 C ATOM 221 O SER A 15 6.721 -15.239 3.929 1.00 0.00 O ATOM 222 CB SER A 15 8.838 -15.813 6.258 1.00 0.00 C ATOM 223 OG SER A 15 8.289 -15.540 7.536 1.00 0.00 O ATOM 0 H SER A 15 8.672 -16.633 3.483 1.00 0.00 H new ATOM 0 HA SER A 15 7.550 -17.522 6.052 1.00 0.00 H new ATOM 0 HB2 SER A 15 9.802 -16.308 6.371 1.00 0.00 H new ATOM 0 HB3 SER A 15 9.020 -14.877 5.730 1.00 0.00 H new ATOM 0 HG SER A 15 8.908 -14.976 8.044 1.00 0.00 H new ATOM 229 N ASP A 16 5.628 -15.923 5.773 1.00 0.00 N ATOM 230 CA ASP A 16 4.407 -15.192 5.454 1.00 0.00 C ATOM 231 C ASP A 16 3.937 -14.370 6.651 1.00 0.00 C ATOM 232 O ASP A 16 3.764 -14.882 7.757 1.00 0.00 O ATOM 233 CB ASP A 16 3.305 -16.160 5.020 1.00 0.00 C ATOM 234 CG ASP A 16 3.631 -16.860 3.716 1.00 0.00 C ATOM 235 OD1 ASP A 16 4.488 -17.768 3.728 1.00 0.00 O ATOM 236 OD2 ASP A 16 3.029 -16.500 2.682 1.00 0.00 O ATOM 0 H ASP A 16 5.587 -16.452 6.644 1.00 0.00 H new ATOM 0 HA ASP A 16 4.626 -14.511 4.631 1.00 0.00 H new ATOM 0 HB2 ASP A 16 3.152 -16.905 5.801 1.00 0.00 H new ATOM 0 HB3 ASP A 16 2.368 -15.614 4.912 1.00 0.00 H new ATOM 241 N PRO A 17 3.727 -13.064 6.427 1.00 0.00 N ATOM 242 CA PRO A 17 3.276 -12.144 7.475 1.00 0.00 C ATOM 243 C PRO A 17 1.833 -12.405 7.893 1.00 0.00 C ATOM 244 O PRO A 17 1.304 -11.739 8.783 1.00 0.00 O ATOM 245 CB PRO A 17 3.401 -10.768 6.816 1.00 0.00 C ATOM 246 CG PRO A 17 3.291 -11.036 5.355 1.00 0.00 C ATOM 247 CD PRO A 17 3.914 -12.386 5.133 1.00 0.00 C ATOM 0 HA PRO A 17 3.860 -12.249 8.389 1.00 0.00 H new ATOM 0 HB2 PRO A 17 2.614 -10.094 7.155 1.00 0.00 H new ATOM 0 HB3 PRO A 17 4.353 -10.297 7.061 1.00 0.00 H new ATOM 0 HG2 PRO A 17 2.249 -11.030 5.035 1.00 0.00 H new ATOM 0 HG3 PRO A 17 3.807 -10.269 4.778 1.00 0.00 H new ATOM 0 HD2 PRO A 17 3.425 -12.926 4.322 1.00 0.00 H new ATOM 0 HD3 PRO A 17 4.969 -12.304 4.871 1.00 0.00 H new ATOM 255 N ALA A 18 1.200 -13.378 7.245 1.00 0.00 N ATOM 256 CA ALA A 18 -0.181 -13.728 7.552 1.00 0.00 C ATOM 257 C ALA A 18 -0.267 -15.105 8.203 1.00 0.00 C ATOM 258 O ALA A 18 0.399 -16.048 7.775 1.00 0.00 O ATOM 259 CB ALA A 18 -1.029 -13.686 6.289 1.00 0.00 C ATOM 0 H ALA A 18 1.622 -13.938 6.504 1.00 0.00 H new ATOM 0 HA ALA A 18 -0.567 -12.995 8.261 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -2.058 -13.950 6.533 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -1.002 -12.682 5.866 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -0.635 -14.397 5.562 1.00 0.00 H new ATOM 265 N HIS A 19 -1.090 -15.213 9.241 1.00 0.00 N ATOM 266 CA HIS A 19 -1.263 -16.475 9.952 1.00 0.00 C ATOM 267 C HIS A 19 -2.374 -17.307 9.319 1.00 0.00 C ATOM 268 O HIS A 19 -3.204 -17.889 10.019 1.00 0.00 O ATOM 269 CB HIS A 19 -1.579 -16.215 11.425 1.00 0.00 C ATOM 270 CG HIS A 19 -0.458 -15.559 12.172 1.00 0.00 C ATOM 271 ND1 HIS A 19 -0.142 -14.224 12.033 1.00 0.00 N ATOM 272 CD2 HIS A 19 0.421 -16.061 13.070 1.00 0.00 C ATOM 273 CE1 HIS A 19 0.885 -13.934 12.812 1.00 0.00 C ATOM 274 NE2 HIS A 19 1.245 -15.032 13.452 1.00 0.00 N ATOM 0 H HIS A 19 -1.648 -14.442 9.609 1.00 0.00 H new ATOM 0 HA HIS A 19 -0.330 -17.035 9.882 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -2.466 -15.586 11.492 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -1.822 -17.161 11.908 1.00 0.00 H new ATOM 0 HD2 HIS A 19 0.466 -17.081 13.421 1.00 0.00 H new ATOM 0 HE1 HIS A 19 1.351 -12.964 12.909 1.00 0.00 H new ATOM 0 HE2 HIS A 19 2.011 -15.104 14.122 1.00 0.00 H new ATOM 282 N THR A 20 -2.386 -17.358 7.991 1.00 0.00 N ATOM 283 CA THR A 20 -3.397 -18.116 7.264 1.00 0.00 C ATOM 284 C THR A 20 -2.772 -18.916 6.127 1.00 0.00 C ATOM 285 O THR A 20 -1.572 -18.817 5.873 1.00 0.00 O ATOM 286 CB THR A 20 -4.486 -17.192 6.689 1.00 0.00 C ATOM 287 OG1 THR A 20 -3.882 -16.102 5.984 1.00 0.00 O ATOM 288 CG2 THR A 20 -5.380 -16.654 7.796 1.00 0.00 C ATOM 0 H THR A 20 -1.707 -16.883 7.397 1.00 0.00 H new ATOM 0 HA THR A 20 -3.853 -18.801 7.979 1.00 0.00 H new ATOM 0 HB THR A 20 -5.098 -17.774 6.000 1.00 0.00 H new ATOM 0 HG1 THR A 20 -4.582 -15.520 5.620 1.00 0.00 H new ATOM 0 HG21 THR A 20 -6.141 -16.004 7.365 1.00 0.00 H new ATOM 0 HG22 THR A 20 -5.862 -17.485 8.311 1.00 0.00 H new ATOM 0 HG23 THR A 20 -4.778 -16.087 8.506 1.00 0.00 H new ATOM 296 N ALA A 21 -3.593 -19.708 5.446 1.00 0.00 N ATOM 297 CA ALA A 21 -3.121 -20.522 4.333 1.00 0.00 C ATOM 298 C ALA A 21 -3.717 -20.048 3.013 1.00 0.00 C ATOM 299 O ALA A 21 -4.821 -19.503 2.978 1.00 0.00 O ATOM 300 CB ALA A 21 -3.458 -21.987 4.571 1.00 0.00 C ATOM 0 H ALA A 21 -4.589 -19.803 5.646 1.00 0.00 H new ATOM 0 HA ALA A 21 -2.038 -20.414 4.271 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -3.100 -22.584 3.732 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -2.978 -22.326 5.489 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -4.538 -22.102 4.663 1.00 0.00 H new ATOM 306 N THR A 22 -2.980 -20.256 1.926 1.00 0.00 N ATOM 307 CA THR A 22 -3.435 -19.848 0.603 1.00 0.00 C ATOM 308 C THR A 22 -3.373 -21.009 -0.382 1.00 0.00 C ATOM 309 O THR A 22 -2.310 -21.329 -0.913 1.00 0.00 O ATOM 310 CB THR A 22 -2.594 -18.679 0.056 1.00 0.00 C ATOM 311 OG1 THR A 22 -1.227 -19.081 -0.080 1.00 0.00 O ATOM 312 CG2 THR A 22 -2.685 -17.471 0.975 1.00 0.00 C ATOM 0 H THR A 22 -2.064 -20.705 1.936 1.00 0.00 H new ATOM 0 HA THR A 22 -4.470 -19.522 0.711 1.00 0.00 H new ATOM 0 HB THR A 22 -2.989 -18.402 -0.921 1.00 0.00 H new ATOM 0 HG1 THR A 22 -1.188 -20.007 -0.400 1.00 0.00 H new ATOM 0 HG21 THR A 22 -2.083 -16.658 0.568 1.00 0.00 H new ATOM 0 HG22 THR A 22 -3.724 -17.150 1.052 1.00 0.00 H new ATOM 0 HG23 THR A 22 -2.313 -17.738 1.964 1.00 0.00 H new ATOM 320 N ALA A 23 -4.519 -21.637 -0.623 1.00 0.00 N ATOM 321 CA ALA A 23 -4.595 -22.761 -1.548 1.00 0.00 C ATOM 322 C ALA A 23 -4.878 -22.286 -2.968 1.00 0.00 C ATOM 323 O ALA A 23 -5.303 -21.153 -3.196 1.00 0.00 O ATOM 324 CB ALA A 23 -5.663 -23.746 -1.095 1.00 0.00 C ATOM 0 H ALA A 23 -5.408 -21.386 -0.190 1.00 0.00 H new ATOM 0 HA ALA A 23 -3.628 -23.265 -1.548 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -5.709 -24.580 -1.795 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -5.416 -24.119 -0.101 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -6.630 -23.245 -1.064 1.00 0.00 H new ATOM 330 N PRO A 24 -4.638 -23.170 -3.948 1.00 0.00 N ATOM 331 CA PRO A 24 -4.861 -22.862 -5.364 1.00 0.00 C ATOM 332 C PRO A 24 -6.342 -22.738 -5.704 1.00 0.00 C ATOM 333 O PRO A 24 -6.706 -22.464 -6.847 1.00 0.00 O ATOM 334 CB PRO A 24 -4.244 -24.061 -6.089 1.00 0.00 C ATOM 335 CG PRO A 24 -4.306 -25.174 -5.101 1.00 0.00 C ATOM 336 CD PRO A 24 -4.132 -24.538 -3.749 1.00 0.00 C ATOM 0 HA PRO A 24 -4.424 -21.904 -5.647 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -4.799 -24.304 -6.995 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -3.217 -23.856 -6.390 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -5.258 -25.700 -5.165 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -3.523 -25.908 -5.291 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -4.696 -25.067 -2.981 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -3.088 -24.539 -3.436 1.00 0.00 H new ATOM 344 N GLY A 25 -7.194 -22.942 -4.704 1.00 0.00 N ATOM 345 CA GLY A 25 -8.626 -22.849 -4.918 1.00 0.00 C ATOM 346 C GLY A 25 -9.153 -23.958 -5.807 1.00 0.00 C ATOM 347 O GLY A 25 -8.719 -24.108 -6.948 1.00 0.00 O ATOM 0 H GLY A 25 -6.918 -23.170 -3.749 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -9.137 -22.885 -3.956 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -8.861 -21.884 -5.368 1.00 0.00 H new ATOM 351 N GLY A 26 -10.091 -24.741 -5.281 1.00 0.00 N ATOM 352 CA GLY A 26 -10.661 -25.833 -6.048 1.00 0.00 C ATOM 353 C GLY A 26 -12.099 -26.122 -5.666 1.00 0.00 C ATOM 354 O GLY A 26 -12.664 -27.140 -6.066 1.00 0.00 O ATOM 0 H GLY A 26 -10.466 -24.638 -4.338 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -10.612 -25.591 -7.110 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -10.061 -26.730 -5.897 1.00 0.00 H new ATOM 358 N LEU A 27 -12.694 -25.224 -4.888 1.00 0.00 N ATOM 359 CA LEU A 27 -14.076 -25.387 -4.449 1.00 0.00 C ATOM 360 C LEU A 27 -14.959 -25.863 -5.598 1.00 0.00 C ATOM 361 O LEU A 27 -14.617 -25.694 -6.768 1.00 0.00 O ATOM 362 CB LEU A 27 -14.613 -24.069 -3.890 1.00 0.00 C ATOM 363 CG LEU A 27 -15.439 -24.171 -2.607 1.00 0.00 C ATOM 364 CD1 LEU A 27 -15.323 -22.891 -1.794 1.00 0.00 C ATOM 365 CD2 LEU A 27 -16.896 -24.468 -2.933 1.00 0.00 C ATOM 0 H LEU A 27 -12.241 -24.376 -4.548 1.00 0.00 H new ATOM 0 HA LEU A 27 -14.095 -26.142 -3.663 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -13.768 -23.406 -3.703 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -15.226 -23.595 -4.657 1.00 0.00 H new ATOM 0 HG LEU A 27 -15.046 -24.993 -2.009 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -15.917 -22.982 -0.885 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -14.279 -22.721 -1.530 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -15.689 -22.051 -2.384 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -17.469 -24.537 -2.008 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -17.301 -23.667 -3.552 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -16.963 -25.413 -3.473 1.00 0.00 H new ATOM 377 N SER A 28 -16.098 -26.457 -5.256 1.00 0.00 N ATOM 378 CA SER A 28 -17.030 -26.958 -6.259 1.00 0.00 C ATOM 379 C SER A 28 -17.924 -25.836 -6.779 1.00 0.00 C ATOM 380 O SER A 28 -18.045 -25.634 -7.987 1.00 0.00 O ATOM 381 CB SER A 28 -17.890 -28.079 -5.671 1.00 0.00 C ATOM 382 OG SER A 28 -18.808 -28.573 -6.630 1.00 0.00 O ATOM 0 H SER A 28 -16.397 -26.603 -4.292 1.00 0.00 H new ATOM 0 HA SER A 28 -16.450 -27.353 -7.093 1.00 0.00 H new ATOM 0 HB2 SER A 28 -17.249 -28.890 -5.325 1.00 0.00 H new ATOM 0 HB3 SER A 28 -18.432 -27.708 -4.801 1.00 0.00 H new ATOM 0 HG SER A 28 -19.345 -29.289 -6.231 1.00 0.00 H new ATOM 388 N ALA A 29 -18.548 -25.110 -5.858 1.00 0.00 N ATOM 389 CA ALA A 29 -19.428 -24.007 -6.222 1.00 0.00 C ATOM 390 C ALA A 29 -19.292 -22.848 -5.240 1.00 0.00 C ATOM 391 O ALA A 29 -18.554 -22.935 -4.259 1.00 0.00 O ATOM 392 CB ALA A 29 -20.872 -24.483 -6.283 1.00 0.00 C ATOM 0 H ALA A 29 -18.460 -25.266 -4.854 1.00 0.00 H new ATOM 0 HA ALA A 29 -19.132 -23.649 -7.208 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -21.519 -23.649 -6.556 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -20.964 -25.273 -7.029 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -21.169 -24.869 -5.308 1.00 0.00 H new ATOM 398 N LYS A 30 -20.008 -21.762 -5.511 1.00 0.00 N ATOM 399 CA LYS A 30 -19.968 -20.585 -4.652 1.00 0.00 C ATOM 400 C LYS A 30 -20.236 -20.962 -3.199 1.00 0.00 C ATOM 401 O LYS A 30 -21.076 -21.815 -2.915 1.00 0.00 O ATOM 402 CB LYS A 30 -20.995 -19.551 -5.120 1.00 0.00 C ATOM 403 CG LYS A 30 -22.418 -20.080 -5.152 1.00 0.00 C ATOM 404 CD LYS A 30 -22.754 -20.695 -6.501 1.00 0.00 C ATOM 405 CE LYS A 30 -24.235 -20.558 -6.822 1.00 0.00 C ATOM 406 NZ LYS A 30 -24.508 -20.762 -8.272 1.00 0.00 N ATOM 0 H LYS A 30 -20.623 -21.673 -6.320 1.00 0.00 H new ATOM 0 HA LYS A 30 -18.970 -20.152 -4.718 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -20.953 -18.685 -4.460 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -20.722 -19.205 -6.117 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -22.547 -20.827 -4.368 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -23.114 -19.269 -4.937 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -22.165 -20.210 -7.280 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -22.476 -21.749 -6.501 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -24.802 -21.284 -6.240 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -24.582 -19.569 -6.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -25.527 -20.661 -8.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -23.987 -20.053 -8.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -24.200 -21.715 -8.552 1.00 0.00 H new ATOM 420 N ALA A 31 -19.518 -20.320 -2.283 1.00 0.00 N ATOM 421 CA ALA A 31 -19.682 -20.587 -0.859 1.00 0.00 C ATOM 422 C ALA A 31 -19.235 -19.393 -0.023 1.00 0.00 C ATOM 423 O ALA A 31 -18.183 -18.799 -0.257 1.00 0.00 O ATOM 424 CB ALA A 31 -18.904 -21.833 -0.463 1.00 0.00 C ATOM 0 H ALA A 31 -18.817 -19.612 -2.502 1.00 0.00 H new ATOM 0 HA ALA A 31 -20.741 -20.757 -0.665 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -19.035 -22.021 0.603 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -19.273 -22.688 -1.030 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -17.846 -21.685 -0.678 1.00 0.00 H new ATOM 430 N PRO A 32 -20.053 -19.031 0.977 1.00 0.00 N ATOM 431 CA PRO A 32 -19.762 -17.904 1.869 1.00 0.00 C ATOM 432 C PRO A 32 -18.589 -18.190 2.801 1.00 0.00 C ATOM 433 O PRO A 32 -18.188 -19.341 2.974 1.00 0.00 O ATOM 434 CB PRO A 32 -21.055 -17.745 2.672 1.00 0.00 C ATOM 435 CG PRO A 32 -21.688 -19.093 2.644 1.00 0.00 C ATOM 436 CD PRO A 32 -21.323 -19.694 1.315 1.00 0.00 C ATOM 0 HA PRO A 32 -19.474 -17.010 1.316 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -20.849 -17.426 3.694 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -21.707 -16.993 2.228 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -21.325 -19.712 3.465 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -22.770 -19.019 2.755 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -21.206 -20.776 1.382 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -22.089 -19.502 0.563 1.00 0.00 H new ATOM 444 N ALA A 33 -18.043 -17.136 3.398 1.00 0.00 N ATOM 445 CA ALA A 33 -16.918 -17.275 4.314 1.00 0.00 C ATOM 446 C ALA A 33 -17.387 -17.707 5.699 1.00 0.00 C ATOM 447 O ALA A 33 -18.567 -17.991 5.904 1.00 0.00 O ATOM 448 CB ALA A 33 -16.144 -15.968 4.401 1.00 0.00 C ATOM 0 H ALA A 33 -18.362 -16.176 3.264 1.00 0.00 H new ATOM 0 HA ALA A 33 -16.258 -18.050 3.925 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -15.307 -16.086 5.089 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -15.768 -15.702 3.413 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -16.802 -15.179 4.764 1.00 0.00 H new ATOM 454 N MET A 34 -16.455 -17.757 6.645 1.00 0.00 N ATOM 455 CA MET A 34 -16.775 -18.155 8.012 1.00 0.00 C ATOM 456 C MET A 34 -17.358 -19.564 8.045 1.00 0.00 C ATOM 457 O MET A 34 -18.430 -19.790 8.607 1.00 0.00 O ATOM 458 CB MET A 34 -17.762 -17.166 8.636 1.00 0.00 C ATOM 459 CG MET A 34 -17.104 -15.902 9.164 1.00 0.00 C ATOM 460 SD MET A 34 -15.792 -16.246 10.352 1.00 0.00 S ATOM 461 CE MET A 34 -16.697 -17.157 11.601 1.00 0.00 C ATOM 0 H MET A 34 -15.473 -17.527 6.491 1.00 0.00 H new ATOM 0 HA MET A 34 -15.852 -18.150 8.592 1.00 0.00 H new ATOM 0 HB2 MET A 34 -18.510 -16.893 7.891 1.00 0.00 H new ATOM 0 HB3 MET A 34 -18.290 -17.659 9.452 1.00 0.00 H new ATOM 0 HG2 MET A 34 -16.693 -15.335 8.329 1.00 0.00 H new ATOM 0 HG3 MET A 34 -17.860 -15.273 9.635 1.00 0.00 H new ATOM 0 HE1 MET A 34 -15.999 -17.563 12.333 1.00 0.00 H new ATOM 0 HE2 MET A 34 -17.399 -16.490 12.100 1.00 0.00 H new ATOM 0 HE3 MET A 34 -17.244 -17.974 11.130 1.00 0.00 H new ATOM 471 N THR A 35 -16.646 -20.509 7.439 1.00 0.00 N ATOM 472 CA THR A 35 -17.094 -21.895 7.398 1.00 0.00 C ATOM 473 C THR A 35 -15.919 -22.847 7.205 1.00 0.00 C ATOM 474 O THR A 35 -14.924 -22.520 6.558 1.00 0.00 O ATOM 475 CB THR A 35 -18.116 -22.122 6.268 1.00 0.00 C ATOM 476 OG1 THR A 35 -17.495 -21.907 4.996 1.00 0.00 O ATOM 477 CG2 THR A 35 -19.308 -21.190 6.421 1.00 0.00 C ATOM 0 H THR A 35 -15.756 -20.339 6.970 1.00 0.00 H new ATOM 0 HA THR A 35 -17.571 -22.101 8.356 1.00 0.00 H new ATOM 0 HB THR A 35 -18.470 -23.151 6.329 1.00 0.00 H new ATOM 0 HG1 THR A 35 -18.151 -22.055 4.283 1.00 0.00 H new ATOM 0 HG21 THR A 35 -20.016 -21.369 5.612 1.00 0.00 H new ATOM 0 HG22 THR A 35 -19.796 -21.377 7.378 1.00 0.00 H new ATOM 0 HG23 THR A 35 -18.968 -20.155 6.383 1.00 0.00 H new ATOM 485 N PRO A 36 -16.035 -24.055 7.776 1.00 0.00 N ATOM 486 CA PRO A 36 -14.992 -25.080 7.679 1.00 0.00 C ATOM 487 C PRO A 36 -14.868 -25.650 6.270 1.00 0.00 C ATOM 488 O PRO A 36 -15.863 -25.794 5.558 1.00 0.00 O ATOM 489 CB PRO A 36 -15.464 -26.161 8.654 1.00 0.00 C ATOM 490 CG PRO A 36 -16.942 -25.987 8.725 1.00 0.00 C ATOM 491 CD PRO A 36 -17.194 -24.513 8.561 1.00 0.00 C ATOM 0 HA PRO A 36 -14.005 -24.680 7.911 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -15.199 -27.157 8.299 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -15.003 -26.039 9.634 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -17.440 -26.558 7.941 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -17.332 -26.346 9.677 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -18.133 -24.321 8.041 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -17.253 -24.006 9.524 1.00 0.00 H new ATOM 499 N LEU A 37 -13.643 -25.973 5.873 1.00 0.00 N ATOM 500 CA LEU A 37 -13.389 -26.529 4.548 1.00 0.00 C ATOM 501 C LEU A 37 -12.566 -27.810 4.643 1.00 0.00 C ATOM 502 O LEU A 37 -12.037 -28.142 5.703 1.00 0.00 O ATOM 503 CB LEU A 37 -12.662 -25.505 3.675 1.00 0.00 C ATOM 504 CG LEU A 37 -13.167 -24.065 3.766 1.00 0.00 C ATOM 505 CD1 LEU A 37 -12.098 -23.093 3.293 1.00 0.00 C ATOM 506 CD2 LEU A 37 -14.443 -23.894 2.954 1.00 0.00 C ATOM 0 H LEU A 37 -12.809 -25.860 6.449 1.00 0.00 H new ATOM 0 HA LEU A 37 -14.349 -26.770 4.092 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -11.605 -25.516 3.942 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -12.732 -25.828 2.636 1.00 0.00 H new ATOM 0 HG LEU A 37 -13.392 -23.845 4.810 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -12.476 -22.073 3.365 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -11.211 -23.196 3.917 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -11.840 -23.312 2.257 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -14.788 -22.863 3.031 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -14.244 -24.133 1.909 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -15.212 -24.563 3.340 1.00 0.00 H new ATOM 518 N MET A 38 -12.461 -28.523 3.527 1.00 0.00 N ATOM 519 CA MET A 38 -11.699 -29.766 3.484 1.00 0.00 C ATOM 520 C MET A 38 -10.761 -29.787 2.281 1.00 0.00 C ATOM 521 O MET A 38 -11.030 -29.152 1.260 1.00 0.00 O ATOM 522 CB MET A 38 -12.645 -30.967 3.429 1.00 0.00 C ATOM 523 CG MET A 38 -13.340 -31.133 2.087 1.00 0.00 C ATOM 524 SD MET A 38 -13.696 -32.857 1.698 1.00 0.00 S ATOM 525 CE MET A 38 -14.501 -33.386 3.207 1.00 0.00 C ATOM 0 H MET A 38 -12.893 -28.262 2.641 1.00 0.00 H new ATOM 0 HA MET A 38 -11.099 -29.827 4.392 1.00 0.00 H new ATOM 0 HB2 MET A 38 -12.082 -31.873 3.652 1.00 0.00 H new ATOM 0 HB3 MET A 38 -13.399 -30.861 4.209 1.00 0.00 H new ATOM 0 HG2 MET A 38 -14.271 -30.566 2.092 1.00 0.00 H new ATOM 0 HG3 MET A 38 -12.713 -30.710 1.303 1.00 0.00 H new ATOM 0 HE1 MET A 38 -14.055 -34.320 3.549 1.00 0.00 H new ATOM 0 HE2 MET A 38 -14.376 -32.621 3.974 1.00 0.00 H new ATOM 0 HE3 MET A 38 -15.563 -33.540 3.018 1.00 0.00 H new ATOM 535 N LEU A 39 -9.661 -30.520 2.407 1.00 0.00 N ATOM 536 CA LEU A 39 -8.682 -30.624 1.330 1.00 0.00 C ATOM 537 C LEU A 39 -9.231 -31.454 0.174 1.00 0.00 C ATOM 538 O LEU A 39 -10.266 -32.109 0.303 1.00 0.00 O ATOM 539 CB LEU A 39 -7.386 -31.246 1.850 1.00 0.00 C ATOM 540 CG LEU A 39 -6.340 -30.269 2.388 1.00 0.00 C ATOM 541 CD1 LEU A 39 -5.482 -30.936 3.452 1.00 0.00 C ATOM 542 CD2 LEU A 39 -5.472 -29.740 1.255 1.00 0.00 C ATOM 0 H LEU A 39 -9.424 -31.052 3.245 1.00 0.00 H new ATOM 0 HA LEU A 39 -8.473 -29.619 0.964 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -7.637 -31.950 2.643 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.934 -31.823 1.043 1.00 0.00 H new ATOM 0 HG LEU A 39 -6.859 -29.427 2.845 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -4.744 -30.225 3.823 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -6.115 -31.265 4.276 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -4.972 -31.797 3.021 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -4.733 -29.046 1.656 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -4.962 -30.572 0.768 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -6.098 -29.223 0.528 1.00 0.00 H new ATOM 554 N ASP A 40 -8.529 -31.425 -0.953 1.00 0.00 N ATOM 555 CA ASP A 40 -8.944 -32.178 -2.131 1.00 0.00 C ATOM 556 C ASP A 40 -8.714 -33.673 -1.930 1.00 0.00 C ATOM 557 O ASP A 40 -8.138 -34.094 -0.926 1.00 0.00 O ATOM 558 CB ASP A 40 -8.182 -31.695 -3.366 1.00 0.00 C ATOM 559 CG ASP A 40 -8.751 -32.256 -4.654 1.00 0.00 C ATOM 560 OD1 ASP A 40 -9.934 -31.984 -4.948 1.00 0.00 O ATOM 561 OD2 ASP A 40 -8.014 -32.968 -5.368 1.00 0.00 O ATOM 0 H ASP A 40 -7.670 -30.889 -1.076 1.00 0.00 H new ATOM 0 HA ASP A 40 -10.010 -32.009 -2.282 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -8.210 -30.606 -3.404 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -7.135 -31.984 -3.279 1.00 0.00 H new ATOM 566 N THR A 41 -9.169 -34.471 -2.890 1.00 0.00 N ATOM 567 CA THR A 41 -9.015 -35.919 -2.817 1.00 0.00 C ATOM 568 C THR A 41 -7.545 -36.319 -2.858 1.00 0.00 C ATOM 569 O THR A 41 -7.206 -37.492 -2.703 1.00 0.00 O ATOM 570 CB THR A 41 -9.758 -36.621 -3.970 1.00 0.00 C ATOM 571 OG1 THR A 41 -9.612 -38.041 -3.853 1.00 0.00 O ATOM 572 CG2 THR A 41 -9.225 -36.160 -5.318 1.00 0.00 C ATOM 0 H THR A 41 -9.647 -34.139 -3.728 1.00 0.00 H new ATOM 0 HA THR A 41 -9.448 -36.235 -1.868 1.00 0.00 H new ATOM 0 HB THR A 41 -10.814 -36.358 -3.906 1.00 0.00 H new ATOM 0 HG1 THR A 41 -8.835 -38.245 -3.292 1.00 0.00 H new ATOM 0 HG21 THR A 41 -9.765 -36.669 -6.116 1.00 0.00 H new ATOM 0 HG22 THR A 41 -9.364 -35.083 -5.415 1.00 0.00 H new ATOM 0 HG23 THR A 41 -8.163 -36.397 -5.390 1.00 0.00 H new ATOM 580 N SER A 42 -6.675 -35.335 -3.065 1.00 0.00 N ATOM 581 CA SER A 42 -5.239 -35.586 -3.128 1.00 0.00 C ATOM 582 C SER A 42 -4.471 -34.553 -2.309 1.00 0.00 C ATOM 583 O SER A 42 -3.287 -34.314 -2.545 1.00 0.00 O ATOM 584 CB SER A 42 -4.760 -35.561 -4.581 1.00 0.00 C ATOM 585 OG SER A 42 -4.872 -34.261 -5.133 1.00 0.00 O ATOM 0 H SER A 42 -6.939 -34.358 -3.192 1.00 0.00 H new ATOM 0 HA SER A 42 -5.048 -36.573 -2.707 1.00 0.00 H new ATOM 0 HB2 SER A 42 -3.723 -35.892 -4.631 1.00 0.00 H new ATOM 0 HB3 SER A 42 -5.348 -36.263 -5.173 1.00 0.00 H new ATOM 0 HG SER A 42 -4.558 -34.272 -6.061 1.00 0.00 H new ATOM 591 N SER A 43 -5.155 -33.944 -1.346 1.00 0.00 N ATOM 592 CA SER A 43 -4.539 -32.933 -0.494 1.00 0.00 C ATOM 593 C SER A 43 -3.732 -31.941 -1.324 1.00 0.00 C ATOM 594 O SER A 43 -2.647 -31.517 -0.924 1.00 0.00 O ATOM 595 CB SER A 43 -3.637 -33.596 0.549 1.00 0.00 C ATOM 596 OG SER A 43 -3.232 -32.665 1.538 1.00 0.00 O ATOM 0 H SER A 43 -6.135 -34.133 -1.136 1.00 0.00 H new ATOM 0 HA SER A 43 -5.334 -32.390 0.016 1.00 0.00 H new ATOM 0 HB2 SER A 43 -4.167 -34.424 1.020 1.00 0.00 H new ATOM 0 HB3 SER A 43 -2.759 -34.017 0.060 1.00 0.00 H new ATOM 0 HG SER A 43 -2.841 -31.878 1.105 1.00 0.00 H new ATOM 602 N ARG A 44 -4.268 -31.574 -2.484 1.00 0.00 N ATOM 603 CA ARG A 44 -3.598 -30.633 -3.372 1.00 0.00 C ATOM 604 C ARG A 44 -4.336 -29.298 -3.408 1.00 0.00 C ATOM 605 O ARG A 44 -3.733 -28.238 -3.241 1.00 0.00 O ATOM 606 CB ARG A 44 -3.501 -31.212 -4.785 1.00 0.00 C ATOM 607 CG ARG A 44 -2.237 -32.021 -5.027 1.00 0.00 C ATOM 608 CD ARG A 44 -1.047 -31.120 -5.316 1.00 0.00 C ATOM 609 NE ARG A 44 0.124 -31.882 -5.743 1.00 0.00 N ATOM 610 CZ ARG A 44 1.347 -31.368 -5.820 1.00 0.00 C ATOM 611 NH1 ARG A 44 1.557 -30.098 -5.500 1.00 0.00 N ATOM 612 NH2 ARG A 44 2.362 -32.124 -6.217 1.00 0.00 N ATOM 0 H ARG A 44 -5.165 -31.915 -2.830 1.00 0.00 H new ATOM 0 HA ARG A 44 -2.593 -30.462 -2.986 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -4.369 -31.846 -4.969 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -3.544 -30.396 -5.506 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -2.025 -32.637 -4.153 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -2.393 -32.700 -5.865 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -1.315 -30.402 -6.091 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -0.801 -30.547 -4.422 1.00 0.00 H new ATOM 0 HE ARG A 44 -0.004 -32.862 -5.996 1.00 0.00 H new ATOM 0 HH11 ARG A 44 0.779 -29.514 -5.194 1.00 0.00 H new ATOM 0 HH12 ARG A 44 2.497 -29.706 -5.560 1.00 0.00 H new ATOM 0 HH21 ARG A 44 2.204 -33.101 -6.464 1.00 0.00 H new ATOM 0 HH22 ARG A 44 3.300 -31.728 -6.276 1.00 0.00 H new ATOM 626 N LYS A 45 -5.645 -29.358 -3.627 1.00 0.00 N ATOM 627 CA LYS A 45 -6.468 -28.156 -3.684 1.00 0.00 C ATOM 628 C LYS A 45 -7.295 -28.001 -2.411 1.00 0.00 C ATOM 629 O LYS A 45 -7.218 -28.831 -1.504 1.00 0.00 O ATOM 630 CB LYS A 45 -7.392 -28.202 -4.903 1.00 0.00 C ATOM 631 CG LYS A 45 -6.662 -28.053 -6.226 1.00 0.00 C ATOM 632 CD LYS A 45 -6.068 -29.374 -6.686 1.00 0.00 C ATOM 633 CE LYS A 45 -5.257 -29.205 -7.962 1.00 0.00 C ATOM 634 NZ LYS A 45 -3.948 -28.543 -7.704 1.00 0.00 N ATOM 0 H LYS A 45 -6.159 -30.228 -3.768 1.00 0.00 H new ATOM 0 HA LYS A 45 -5.804 -27.296 -3.772 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -7.935 -29.147 -4.902 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -8.134 -27.408 -4.816 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -7.351 -27.680 -6.983 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -5.869 -27.312 -6.124 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -5.432 -29.782 -5.900 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -6.868 -30.095 -6.855 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -5.087 -30.181 -8.416 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -5.827 -28.615 -8.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -3.782 -27.810 -8.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -3.960 -28.106 -6.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -3.187 -29.250 -7.749 1.00 0.00 H new ATOM 648 N LEU A 46 -8.086 -26.936 -2.351 1.00 0.00 N ATOM 649 CA LEU A 46 -8.929 -26.673 -1.190 1.00 0.00 C ATOM 650 C LEU A 46 -10.385 -26.486 -1.604 1.00 0.00 C ATOM 651 O LEU A 46 -10.689 -25.700 -2.502 1.00 0.00 O ATOM 652 CB LEU A 46 -8.435 -25.431 -0.446 1.00 0.00 C ATOM 653 CG LEU A 46 -8.689 -25.406 1.061 1.00 0.00 C ATOM 654 CD1 LEU A 46 -9.939 -26.201 1.405 1.00 0.00 C ATOM 655 CD2 LEU A 46 -7.484 -25.949 1.815 1.00 0.00 C ATOM 0 H LEU A 46 -8.161 -26.240 -3.093 1.00 0.00 H new ATOM 0 HA LEU A 46 -8.868 -27.535 -0.526 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -7.363 -25.333 -0.615 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -8.909 -24.555 -0.889 1.00 0.00 H new ATOM 0 HG LEU A 46 -8.846 -24.371 1.366 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -10.104 -26.172 2.482 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -10.798 -25.766 0.895 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -9.812 -27.235 1.085 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -7.683 -25.923 2.886 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -7.294 -26.977 1.506 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.610 -25.336 1.594 1.00 0.00 H new ATOM 667 N VAL A 47 -11.281 -27.212 -0.944 1.00 0.00 N ATOM 668 CA VAL A 47 -12.706 -27.124 -1.241 1.00 0.00 C ATOM 669 C VAL A 47 -13.534 -27.107 0.038 1.00 0.00 C ATOM 670 O VAL A 47 -13.024 -27.381 1.124 1.00 0.00 O ATOM 671 CB VAL A 47 -13.168 -28.297 -2.125 1.00 0.00 C ATOM 672 CG1 VAL A 47 -12.303 -28.401 -3.371 1.00 0.00 C ATOM 673 CG2 VAL A 47 -13.142 -29.599 -1.337 1.00 0.00 C ATOM 0 H VAL A 47 -11.045 -27.868 -0.200 1.00 0.00 H new ATOM 0 HA VAL A 47 -12.860 -26.190 -1.781 1.00 0.00 H new ATOM 0 HB VAL A 47 -14.194 -28.109 -2.440 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -12.645 -29.236 -3.983 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -12.378 -27.477 -3.944 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -11.265 -28.565 -3.081 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -13.471 -30.418 -1.976 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -12.127 -29.795 -0.991 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -13.809 -29.518 -0.479 1.00 0.00 H new ATOM 683 N ALA A 48 -14.816 -26.785 -0.098 1.00 0.00 N ATOM 684 CA ALA A 48 -15.717 -26.735 1.047 1.00 0.00 C ATOM 685 C ALA A 48 -15.856 -28.108 1.696 1.00 0.00 C ATOM 686 O ALA A 48 -15.555 -29.130 1.079 1.00 0.00 O ATOM 687 CB ALA A 48 -17.081 -26.209 0.623 1.00 0.00 C ATOM 0 H ALA A 48 -15.254 -26.555 -0.990 1.00 0.00 H new ATOM 0 HA ALA A 48 -15.291 -26.055 1.784 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -17.744 -26.177 1.488 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -16.972 -25.205 0.212 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -17.505 -26.867 -0.135 1.00 0.00 H new ATOM 693 N TRP A 49 -16.312 -28.123 2.943 1.00 0.00 N ATOM 694 CA TRP A 49 -16.489 -29.372 3.676 1.00 0.00 C ATOM 695 C TRP A 49 -17.792 -30.057 3.278 1.00 0.00 C ATOM 696 O TRP A 49 -18.790 -29.394 2.994 1.00 0.00 O ATOM 697 CB TRP A 49 -16.477 -29.109 5.183 1.00 0.00 C ATOM 698 CG TRP A 49 -16.749 -30.334 6.002 1.00 0.00 C ATOM 699 CD1 TRP A 49 -16.300 -31.600 5.756 1.00 0.00 C ATOM 700 CD2 TRP A 49 -17.532 -30.409 7.199 1.00 0.00 C ATOM 701 NE1 TRP A 49 -16.758 -32.458 6.727 1.00 0.00 N ATOM 702 CE2 TRP A 49 -17.514 -31.752 7.624 1.00 0.00 C ATOM 703 CE3 TRP A 49 -18.244 -29.473 7.953 1.00 0.00 C ATOM 704 CZ2 TRP A 49 -18.183 -32.178 8.769 1.00 0.00 C ATOM 705 CZ3 TRP A 49 -18.907 -29.898 9.088 1.00 0.00 C ATOM 706 CH2 TRP A 49 -18.872 -31.240 9.488 1.00 0.00 C ATOM 0 H TRP A 49 -16.566 -27.286 3.468 1.00 0.00 H new ATOM 0 HA TRP A 49 -15.660 -30.033 3.423 1.00 0.00 H new ATOM 0 HB2 TRP A 49 -15.507 -28.700 5.465 1.00 0.00 H new ATOM 0 HB3 TRP A 49 -17.224 -28.350 5.418 1.00 0.00 H new ATOM 0 HD1 TRP A 49 -15.677 -31.885 4.921 1.00 0.00 H new ATOM 0 HE1 TRP A 49 -16.566 -33.459 6.772 1.00 0.00 H new ATOM 0 HE3 TRP A 49 -18.276 -28.436 7.654 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 -18.159 -33.212 9.078 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 -19.462 -29.183 9.677 1.00 0.00 H new ATOM 0 HH2 TRP A 49 -19.399 -31.540 10.382 1.00 0.00 H new ATOM 717 N ASP A 50 -17.776 -31.385 3.259 1.00 0.00 N ATOM 718 CA ASP A 50 -18.957 -32.159 2.896 1.00 0.00 C ATOM 719 C ASP A 50 -20.025 -32.061 3.981 1.00 0.00 C ATOM 720 O ASP A 50 -21.204 -31.861 3.690 1.00 0.00 O ATOM 721 CB ASP A 50 -18.582 -33.623 2.664 1.00 0.00 C ATOM 722 CG ASP A 50 -19.589 -34.348 1.794 1.00 0.00 C ATOM 723 OD1 ASP A 50 -20.309 -33.671 1.031 1.00 0.00 O ATOM 724 OD2 ASP A 50 -19.659 -35.593 1.877 1.00 0.00 O ATOM 0 H ASP A 50 -16.958 -31.948 3.491 1.00 0.00 H new ATOM 0 HA ASP A 50 -19.363 -31.745 1.973 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -17.599 -33.673 2.196 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -18.504 -34.132 3.625 1.00 0.00 H new ATOM 729 N GLY A 51 -19.604 -32.204 5.234 1.00 0.00 N ATOM 730 CA GLY A 51 -20.537 -32.129 6.343 1.00 0.00 C ATOM 731 C GLY A 51 -20.693 -33.456 7.060 1.00 0.00 C ATOM 732 O GLY A 51 -21.103 -33.500 8.220 1.00 0.00 O ATOM 0 H GLY A 51 -18.634 -32.370 5.501 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -20.195 -31.375 7.051 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -21.509 -31.802 5.974 1.00 0.00 H new ATOM 736 N THR A 52 -20.368 -34.543 6.367 1.00 0.00 N ATOM 737 CA THR A 52 -20.477 -35.878 6.942 1.00 0.00 C ATOM 738 C THR A 52 -19.105 -36.433 7.306 1.00 0.00 C ATOM 739 O THR A 52 -18.908 -36.968 8.397 1.00 0.00 O ATOM 740 CB THR A 52 -21.173 -36.852 5.974 1.00 0.00 C ATOM 741 OG1 THR A 52 -20.529 -36.816 4.695 1.00 0.00 O ATOM 742 CG2 THR A 52 -22.644 -36.500 5.816 1.00 0.00 C ATOM 0 H THR A 52 -20.027 -34.525 5.406 1.00 0.00 H new ATOM 0 HA THR A 52 -21.079 -35.785 7.846 1.00 0.00 H new ATOM 0 HB THR A 52 -21.099 -37.857 6.390 1.00 0.00 H new ATOM 0 HG1 THR A 52 -20.977 -37.439 4.086 1.00 0.00 H new ATOM 0 HG21 THR A 52 -23.114 -37.202 5.127 1.00 0.00 H new ATOM 0 HG22 THR A 52 -23.138 -36.557 6.786 1.00 0.00 H new ATOM 0 HG23 THR A 52 -22.736 -35.488 5.421 1.00 0.00 H new ATOM 750 N THR A 53 -18.155 -36.303 6.384 1.00 0.00 N ATOM 751 CA THR A 53 -16.801 -36.792 6.607 1.00 0.00 C ATOM 752 C THR A 53 -16.265 -36.330 7.957 1.00 0.00 C ATOM 753 O THR A 53 -16.107 -35.133 8.196 1.00 0.00 O ATOM 754 CB THR A 53 -15.843 -36.319 5.498 1.00 0.00 C ATOM 755 OG1 THR A 53 -16.357 -36.692 4.214 1.00 0.00 O ATOM 756 CG2 THR A 53 -14.457 -36.918 5.688 1.00 0.00 C ATOM 0 H THR A 53 -18.300 -35.863 5.475 1.00 0.00 H new ATOM 0 HA THR A 53 -16.852 -37.881 6.593 1.00 0.00 H new ATOM 0 HB THR A 53 -15.764 -35.233 5.556 1.00 0.00 H new ATOM 0 HG1 THR A 53 -15.743 -36.386 3.514 1.00 0.00 H new ATOM 0 HG21 THR A 53 -13.798 -36.570 4.893 1.00 0.00 H new ATOM 0 HG22 THR A 53 -14.056 -36.609 6.653 1.00 0.00 H new ATOM 0 HG23 THR A 53 -14.523 -38.005 5.654 1.00 0.00 H new ATOM 764 N ASP A 54 -15.985 -37.286 8.836 1.00 0.00 N ATOM 765 CA ASP A 54 -15.464 -36.977 10.163 1.00 0.00 C ATOM 766 C ASP A 54 -13.976 -36.650 10.099 1.00 0.00 C ATOM 767 O ASP A 54 -13.181 -37.426 9.570 1.00 0.00 O ATOM 768 CB ASP A 54 -15.701 -38.152 11.113 1.00 0.00 C ATOM 769 CG ASP A 54 -15.396 -39.489 10.468 1.00 0.00 C ATOM 770 OD1 ASP A 54 -14.353 -39.597 9.789 1.00 0.00 O ATOM 771 OD2 ASP A 54 -16.199 -40.429 10.643 1.00 0.00 O ATOM 0 H ASP A 54 -16.110 -38.282 8.654 1.00 0.00 H new ATOM 0 HA ASP A 54 -15.994 -36.102 10.541 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -15.079 -38.030 12.000 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -16.738 -38.142 11.447 1.00 0.00 H new ATOM 776 N GLY A 55 -13.605 -35.494 10.642 1.00 0.00 N ATOM 777 CA GLY A 55 -12.213 -35.084 10.636 1.00 0.00 C ATOM 778 C GLY A 55 -11.768 -34.567 9.282 1.00 0.00 C ATOM 779 O GLY A 55 -10.582 -34.607 8.955 1.00 0.00 O ATOM 0 H GLY A 55 -14.244 -34.834 11.086 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -12.063 -34.307 11.386 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -11.587 -35.929 10.923 1.00 0.00 H new ATOM 783 N ALA A 56 -12.720 -34.081 8.493 1.00 0.00 N ATOM 784 CA ALA A 56 -12.419 -33.554 7.168 1.00 0.00 C ATOM 785 C ALA A 56 -12.089 -32.066 7.231 1.00 0.00 C ATOM 786 O ALA A 56 -11.240 -31.577 6.487 1.00 0.00 O ATOM 787 CB ALA A 56 -13.588 -33.798 6.225 1.00 0.00 C ATOM 0 H ALA A 56 -13.707 -34.041 8.749 1.00 0.00 H new ATOM 0 HA ALA A 56 -11.543 -34.078 6.786 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -13.349 -33.399 5.239 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -13.776 -34.869 6.148 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -14.477 -33.301 6.612 1.00 0.00 H new ATOM 793 N ALA A 57 -12.767 -31.352 8.123 1.00 0.00 N ATOM 794 CA ALA A 57 -12.545 -29.920 8.284 1.00 0.00 C ATOM 795 C ALA A 57 -11.110 -29.632 8.712 1.00 0.00 C ATOM 796 O ALA A 57 -10.650 -30.118 9.746 1.00 0.00 O ATOM 797 CB ALA A 57 -13.525 -29.344 9.295 1.00 0.00 C ATOM 0 H ALA A 57 -13.475 -31.742 8.746 1.00 0.00 H new ATOM 0 HA ALA A 57 -12.712 -29.441 7.319 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -13.348 -28.274 9.405 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -14.545 -29.509 8.948 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -13.386 -29.836 10.258 1.00 0.00 H new ATOM 803 N VAL A 58 -10.405 -28.840 7.910 1.00 0.00 N ATOM 804 CA VAL A 58 -9.022 -28.487 8.206 1.00 0.00 C ATOM 805 C VAL A 58 -8.903 -27.021 8.609 1.00 0.00 C ATOM 806 O VAL A 58 -8.109 -26.668 9.480 1.00 0.00 O ATOM 807 CB VAL A 58 -8.104 -28.752 6.998 1.00 0.00 C ATOM 808 CG1 VAL A 58 -8.209 -30.203 6.556 1.00 0.00 C ATOM 809 CG2 VAL A 58 -8.447 -27.811 5.853 1.00 0.00 C ATOM 0 H VAL A 58 -10.770 -28.431 7.050 1.00 0.00 H new ATOM 0 HA VAL A 58 -8.706 -29.116 9.038 1.00 0.00 H new ATOM 0 HB VAL A 58 -7.073 -28.563 7.298 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -7.554 -30.371 5.702 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -7.911 -30.856 7.376 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -9.238 -30.423 6.273 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -7.789 -28.012 5.008 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -9.483 -27.967 5.552 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -8.315 -26.779 6.178 1.00 0.00 H new ATOM 819 N GLY A 59 -9.699 -26.170 7.968 1.00 0.00 N ATOM 820 CA GLY A 59 -9.668 -24.752 8.274 1.00 0.00 C ATOM 821 C GLY A 59 -10.986 -24.065 7.975 1.00 0.00 C ATOM 822 O GLY A 59 -11.910 -24.685 7.447 1.00 0.00 O ATOM 0 H GLY A 59 -10.364 -26.438 7.243 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -9.422 -24.616 9.327 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -8.875 -24.276 7.697 1.00 0.00 H new ATOM 826 N ILE A 60 -11.074 -22.784 8.315 1.00 0.00 N ATOM 827 CA ILE A 60 -12.289 -22.014 8.081 1.00 0.00 C ATOM 828 C ILE A 60 -12.029 -20.853 7.127 1.00 0.00 C ATOM 829 O ILE A 60 -11.147 -20.027 7.364 1.00 0.00 O ATOM 830 CB ILE A 60 -12.869 -21.463 9.397 1.00 0.00 C ATOM 831 CG1 ILE A 60 -13.043 -22.591 10.415 1.00 0.00 C ATOM 832 CG2 ILE A 60 -14.196 -20.765 9.140 1.00 0.00 C ATOM 833 CD1 ILE A 60 -13.114 -22.108 11.847 1.00 0.00 C ATOM 0 H ILE A 60 -10.318 -22.257 8.753 1.00 0.00 H new ATOM 0 HA ILE A 60 -13.012 -22.695 7.632 1.00 0.00 H new ATOM 0 HB ILE A 60 -12.171 -20.734 9.807 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -13.953 -23.143 10.181 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -12.212 -23.290 10.317 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -14.593 -20.381 10.080 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -14.044 -19.939 8.446 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -14.903 -21.475 8.710 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -13.238 -22.962 12.513 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -12.194 -21.581 12.099 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -13.962 -21.433 11.962 1.00 0.00 H new ATOM 845 N LEU A 61 -12.803 -20.795 6.050 1.00 0.00 N ATOM 846 CA LEU A 61 -12.658 -19.733 5.060 1.00 0.00 C ATOM 847 C LEU A 61 -12.811 -18.360 5.707 1.00 0.00 C ATOM 848 O LEU A 61 -13.817 -18.079 6.359 1.00 0.00 O ATOM 849 CB LEU A 61 -13.693 -19.902 3.946 1.00 0.00 C ATOM 850 CG LEU A 61 -13.268 -19.425 2.557 1.00 0.00 C ATOM 851 CD1 LEU A 61 -14.488 -19.123 1.700 1.00 0.00 C ATOM 852 CD2 LEU A 61 -12.373 -18.199 2.665 1.00 0.00 C ATOM 0 H LEU A 61 -13.538 -21.470 5.839 1.00 0.00 H new ATOM 0 HA LEU A 61 -11.658 -19.803 4.632 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -13.958 -20.957 3.881 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -14.597 -19.364 4.232 1.00 0.00 H new ATOM 0 HG LEU A 61 -12.701 -20.223 2.077 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -14.166 -18.785 0.715 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -15.091 -20.025 1.595 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -15.082 -18.343 2.175 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -12.080 -17.873 1.667 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -12.915 -17.396 3.164 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -11.482 -18.449 3.241 1.00 0.00 H new ATOM 864 N ALA A 62 -11.808 -17.509 5.521 1.00 0.00 N ATOM 865 CA ALA A 62 -11.833 -16.164 6.083 1.00 0.00 C ATOM 866 C ALA A 62 -12.744 -15.247 5.273 1.00 0.00 C ATOM 867 O ALA A 62 -13.582 -14.538 5.830 1.00 0.00 O ATOM 868 CB ALA A 62 -10.425 -15.592 6.146 1.00 0.00 C ATOM 0 H ALA A 62 -10.968 -17.727 4.985 1.00 0.00 H new ATOM 0 HA ALA A 62 -12.233 -16.227 7.095 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -10.459 -14.587 6.568 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -9.802 -16.228 6.774 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -10.004 -15.550 5.141 1.00 0.00 H new ATOM 874 N VAL A 63 -12.573 -15.266 3.955 1.00 0.00 N ATOM 875 CA VAL A 63 -13.379 -14.436 3.068 1.00 0.00 C ATOM 876 C VAL A 63 -14.170 -15.291 2.085 1.00 0.00 C ATOM 877 O VAL A 63 -13.647 -16.251 1.520 1.00 0.00 O ATOM 878 CB VAL A 63 -12.505 -13.442 2.280 1.00 0.00 C ATOM 879 CG1 VAL A 63 -13.368 -12.565 1.385 1.00 0.00 C ATOM 880 CG2 VAL A 63 -11.674 -12.594 3.231 1.00 0.00 C ATOM 0 H VAL A 63 -11.884 -15.847 3.478 1.00 0.00 H new ATOM 0 HA VAL A 63 -14.071 -13.878 3.699 1.00 0.00 H new ATOM 0 HB VAL A 63 -11.824 -14.008 1.645 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -12.733 -11.869 0.836 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -13.914 -13.191 0.680 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -14.075 -12.005 1.997 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -11.063 -11.897 2.658 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -12.336 -12.036 3.893 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -11.028 -13.240 3.825 1.00 0.00 H new ATOM 890 N ALA A 64 -15.435 -14.936 1.884 1.00 0.00 N ATOM 891 CA ALA A 64 -16.299 -15.669 0.967 1.00 0.00 C ATOM 892 C ALA A 64 -15.645 -15.816 -0.403 1.00 0.00 C ATOM 893 O ALA A 64 -15.214 -14.833 -1.005 1.00 0.00 O ATOM 894 CB ALA A 64 -17.645 -14.972 0.839 1.00 0.00 C ATOM 0 H ALA A 64 -15.884 -14.145 2.344 1.00 0.00 H new ATOM 0 HA ALA A 64 -16.457 -16.667 1.375 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -18.280 -15.530 0.151 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -18.124 -14.924 1.817 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -17.497 -13.962 0.457 1.00 0.00 H new ATOM 900 N ALA A 65 -15.574 -17.051 -0.890 1.00 0.00 N ATOM 901 CA ALA A 65 -14.973 -17.326 -2.189 1.00 0.00 C ATOM 902 C ALA A 65 -15.905 -18.165 -3.058 1.00 0.00 C ATOM 903 O ALA A 65 -16.980 -18.572 -2.618 1.00 0.00 O ATOM 904 CB ALA A 65 -13.636 -18.029 -2.014 1.00 0.00 C ATOM 0 H ALA A 65 -15.925 -17.876 -0.404 1.00 0.00 H new ATOM 0 HA ALA A 65 -14.807 -16.374 -2.694 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -13.199 -18.228 -2.992 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -12.963 -17.393 -1.438 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -13.786 -18.970 -1.485 1.00 0.00 H new ATOM 910 N ASP A 66 -15.485 -18.419 -4.292 1.00 0.00 N ATOM 911 CA ASP A 66 -16.282 -19.210 -5.222 1.00 0.00 C ATOM 912 C ASP A 66 -15.419 -20.253 -5.927 1.00 0.00 C ATOM 913 O ASP A 66 -14.193 -20.153 -5.935 1.00 0.00 O ATOM 914 CB ASP A 66 -16.951 -18.302 -6.255 1.00 0.00 C ATOM 915 CG ASP A 66 -16.150 -17.043 -6.524 1.00 0.00 C ATOM 916 OD1 ASP A 66 -14.905 -17.105 -6.448 1.00 0.00 O ATOM 917 OD2 ASP A 66 -16.767 -15.996 -6.811 1.00 0.00 O ATOM 0 H ASP A 66 -14.598 -18.089 -4.672 1.00 0.00 H new ATOM 0 HA ASP A 66 -17.053 -19.728 -4.651 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -17.082 -18.852 -7.187 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -17.946 -18.028 -5.904 1.00 0.00 H new ATOM 922 N GLN A 67 -16.069 -21.252 -6.515 1.00 0.00 N ATOM 923 CA GLN A 67 -15.361 -22.313 -7.221 1.00 0.00 C ATOM 924 C GLN A 67 -14.552 -21.748 -8.383 1.00 0.00 C ATOM 925 O GLN A 67 -13.686 -22.425 -8.939 1.00 0.00 O ATOM 926 CB GLN A 67 -16.349 -23.362 -7.733 1.00 0.00 C ATOM 927 CG GLN A 67 -17.343 -22.817 -8.747 1.00 0.00 C ATOM 928 CD GLN A 67 -16.698 -22.488 -10.078 1.00 0.00 C ATOM 929 OE1 GLN A 67 -16.990 -21.302 -10.601 1.00 0.00 O flip ATOM 930 NE2 GLN A 67 -15.945 -23.289 -10.632 1.00 0.00 N flip ATOM 0 H GLN A 67 -17.084 -21.349 -6.516 1.00 0.00 H new ATOM 0 HA GLN A 67 -14.673 -22.785 -6.520 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -15.793 -24.182 -8.186 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -16.896 -23.777 -6.887 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -18.135 -23.549 -8.903 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -17.813 -21.920 -8.344 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -15.748 -24.189 -10.195 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -15.518 -23.052 -11.528 1.00 0.00 H new ATOM 939 N THR A 68 -14.839 -20.502 -8.748 1.00 0.00 N ATOM 940 CA THR A 68 -14.139 -19.846 -9.845 1.00 0.00 C ATOM 941 C THR A 68 -12.887 -19.131 -9.351 1.00 0.00 C ATOM 942 O THR A 68 -12.099 -18.619 -10.145 1.00 0.00 O ATOM 943 CB THR A 68 -15.048 -18.830 -10.563 1.00 0.00 C ATOM 944 OG1 THR A 68 -14.390 -18.323 -11.729 1.00 0.00 O ATOM 945 CG2 THR A 68 -15.408 -17.678 -9.636 1.00 0.00 C ATOM 0 H THR A 68 -15.552 -19.927 -8.299 1.00 0.00 H new ATOM 0 HA THR A 68 -13.852 -20.627 -10.549 1.00 0.00 H new ATOM 0 HB THR A 68 -15.965 -19.340 -10.857 1.00 0.00 H new ATOM 0 HG1 THR A 68 -13.419 -18.383 -11.609 1.00 0.00 H new ATOM 0 HG21 THR A 68 -16.050 -16.973 -10.164 1.00 0.00 H new ATOM 0 HG22 THR A 68 -15.934 -18.064 -8.763 1.00 0.00 H new ATOM 0 HG23 THR A 68 -14.498 -17.170 -9.316 1.00 0.00 H new ATOM 953 N SER A 69 -12.710 -19.101 -8.034 1.00 0.00 N ATOM 954 CA SER A 69 -11.555 -18.445 -7.433 1.00 0.00 C ATOM 955 C SER A 69 -10.281 -19.245 -7.691 1.00 0.00 C ATOM 956 O SER A 69 -10.269 -20.471 -7.576 1.00 0.00 O ATOM 957 CB SER A 69 -11.766 -18.273 -5.927 1.00 0.00 C ATOM 958 OG SER A 69 -12.533 -17.114 -5.649 1.00 0.00 O ATOM 0 H SER A 69 -13.352 -19.523 -7.363 1.00 0.00 H new ATOM 0 HA SER A 69 -11.446 -17.462 -7.892 1.00 0.00 H new ATOM 0 HB2 SER A 69 -12.270 -19.152 -5.524 1.00 0.00 H new ATOM 0 HB3 SER A 69 -10.800 -18.202 -5.427 1.00 0.00 H new ATOM 0 HG SER A 69 -13.399 -17.178 -6.104 1.00 0.00 H new ATOM 964 N THR A 70 -9.209 -18.542 -8.041 1.00 0.00 N ATOM 965 CA THR A 70 -7.930 -19.184 -8.317 1.00 0.00 C ATOM 966 C THR A 70 -7.162 -19.457 -7.029 1.00 0.00 C ATOM 967 O THR A 70 -6.143 -20.148 -7.035 1.00 0.00 O ATOM 968 CB THR A 70 -7.058 -18.322 -9.249 1.00 0.00 C ATOM 969 OG1 THR A 70 -7.849 -17.812 -10.328 1.00 0.00 O ATOM 970 CG2 THR A 70 -5.895 -19.131 -9.804 1.00 0.00 C ATOM 0 H THR A 70 -9.201 -17.527 -8.140 1.00 0.00 H new ATOM 0 HA THR A 70 -8.152 -20.130 -8.811 1.00 0.00 H new ATOM 0 HB THR A 70 -6.657 -17.491 -8.669 1.00 0.00 H new ATOM 0 HG1 THR A 70 -7.287 -17.264 -10.915 1.00 0.00 H new ATOM 0 HG21 THR A 70 -5.294 -18.501 -10.459 1.00 0.00 H new ATOM 0 HG22 THR A 70 -5.278 -19.492 -8.981 1.00 0.00 H new ATOM 0 HG23 THR A 70 -6.279 -19.980 -10.369 1.00 0.00 H new ATOM 978 N THR A 71 -7.658 -18.910 -5.923 1.00 0.00 N ATOM 979 CA THR A 71 -7.018 -19.094 -4.627 1.00 0.00 C ATOM 980 C THR A 71 -8.001 -18.844 -3.488 1.00 0.00 C ATOM 981 O THR A 71 -8.820 -17.927 -3.552 1.00 0.00 O ATOM 982 CB THR A 71 -5.808 -18.157 -4.460 1.00 0.00 C ATOM 983 OG1 THR A 71 -4.860 -18.389 -5.508 1.00 0.00 O ATOM 984 CG2 THR A 71 -5.140 -18.370 -3.109 1.00 0.00 C ATOM 0 H THR A 71 -8.501 -18.336 -5.900 1.00 0.00 H new ATOM 0 HA THR A 71 -6.675 -20.128 -4.588 1.00 0.00 H new ATOM 0 HB THR A 71 -6.164 -17.128 -4.513 1.00 0.00 H new ATOM 0 HG1 THR A 71 -5.047 -19.252 -5.933 1.00 0.00 H new ATOM 0 HG21 THR A 71 -4.288 -17.697 -3.014 1.00 0.00 H new ATOM 0 HG22 THR A 71 -5.855 -18.164 -2.313 1.00 0.00 H new ATOM 0 HG23 THR A 71 -4.798 -19.402 -3.031 1.00 0.00 H new ATOM 992 N LEU A 72 -7.914 -19.665 -2.447 1.00 0.00 N ATOM 993 CA LEU A 72 -8.795 -19.532 -1.292 1.00 0.00 C ATOM 994 C LEU A 72 -8.006 -19.142 -0.047 1.00 0.00 C ATOM 995 O LEU A 72 -6.993 -19.761 0.280 1.00 0.00 O ATOM 996 CB LEU A 72 -9.545 -20.843 -1.045 1.00 0.00 C ATOM 997 CG LEU A 72 -10.450 -21.322 -2.180 1.00 0.00 C ATOM 998 CD1 LEU A 72 -10.824 -22.783 -1.983 1.00 0.00 C ATOM 999 CD2 LEU A 72 -11.699 -20.457 -2.268 1.00 0.00 C ATOM 0 H LEU A 72 -7.242 -20.430 -2.379 1.00 0.00 H new ATOM 0 HA LEU A 72 -9.516 -18.742 -1.504 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -8.813 -21.623 -0.837 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -10.152 -20.727 -0.147 1.00 0.00 H new ATOM 0 HG LEU A 72 -9.903 -21.231 -3.118 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -11.468 -23.107 -2.800 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -9.920 -23.392 -1.971 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -11.352 -22.899 -1.037 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -12.331 -20.813 -3.081 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -12.249 -20.515 -1.329 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -11.413 -19.422 -2.457 1.00 0.00 H new ATOM 1011 N THR A 73 -8.478 -18.111 0.647 1.00 0.00 N ATOM 1012 CA THR A 73 -7.818 -17.638 1.858 1.00 0.00 C ATOM 1013 C THR A 73 -8.580 -18.072 3.105 1.00 0.00 C ATOM 1014 O THR A 73 -9.541 -17.421 3.515 1.00 0.00 O ATOM 1015 CB THR A 73 -7.682 -16.104 1.861 1.00 0.00 C ATOM 1016 OG1 THR A 73 -6.930 -15.676 0.720 1.00 0.00 O ATOM 1017 CG2 THR A 73 -7.001 -15.623 3.133 1.00 0.00 C ATOM 0 H THR A 73 -9.315 -17.587 0.391 1.00 0.00 H new ATOM 0 HA THR A 73 -6.823 -18.083 1.870 1.00 0.00 H new ATOM 0 HB THR A 73 -8.682 -15.673 1.818 1.00 0.00 H new ATOM 0 HG1 THR A 73 -6.850 -14.699 0.729 1.00 0.00 H new ATOM 0 HG21 THR A 73 -6.916 -14.536 3.112 1.00 0.00 H new ATOM 0 HG22 THR A 73 -7.592 -15.924 3.998 1.00 0.00 H new ATOM 0 HG23 THR A 73 -6.006 -16.063 3.202 1.00 0.00 H new ATOM 1025 N PHE A 74 -8.144 -19.175 3.705 1.00 0.00 N ATOM 1026 CA PHE A 74 -8.786 -19.696 4.906 1.00 0.00 C ATOM 1027 C PHE A 74 -7.821 -19.682 6.088 1.00 0.00 C ATOM 1028 O PHE A 74 -6.604 -19.635 5.909 1.00 0.00 O ATOM 1029 CB PHE A 74 -9.292 -21.119 4.663 1.00 0.00 C ATOM 1030 CG PHE A 74 -8.196 -22.103 4.369 1.00 0.00 C ATOM 1031 CD1 PHE A 74 -7.593 -22.138 3.121 1.00 0.00 C ATOM 1032 CD2 PHE A 74 -7.768 -22.994 5.340 1.00 0.00 C ATOM 1033 CE1 PHE A 74 -6.584 -23.041 2.848 1.00 0.00 C ATOM 1034 CE2 PHE A 74 -6.759 -23.900 5.072 1.00 0.00 C ATOM 1035 CZ PHE A 74 -6.167 -23.924 3.824 1.00 0.00 C ATOM 0 H PHE A 74 -7.349 -19.725 3.379 1.00 0.00 H new ATOM 0 HA PHE A 74 -9.633 -19.052 5.143 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -9.845 -21.454 5.541 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -9.994 -21.109 3.829 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -7.916 -21.451 2.353 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -8.228 -22.980 6.317 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -6.122 -23.056 1.872 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -6.434 -24.589 5.838 1.00 0.00 H new ATOM 0 HZ PHE A 74 -5.380 -24.632 3.612 1.00 0.00 H new ATOM 1045 N TYR A 75 -8.373 -19.723 7.295 1.00 0.00 N ATOM 1046 CA TYR A 75 -7.563 -19.712 8.507 1.00 0.00 C ATOM 1047 C TYR A 75 -6.925 -21.076 8.748 1.00 0.00 C ATOM 1048 O TYR A 75 -7.277 -22.063 8.102 1.00 0.00 O ATOM 1049 CB TYR A 75 -8.416 -19.315 9.713 1.00 0.00 C ATOM 1050 CG TYR A 75 -8.584 -17.821 9.870 1.00 0.00 C ATOM 1051 CD1 TYR A 75 -7.610 -17.055 10.500 1.00 0.00 C ATOM 1052 CD2 TYR A 75 -9.717 -17.175 9.391 1.00 0.00 C ATOM 1053 CE1 TYR A 75 -7.760 -15.690 10.647 1.00 0.00 C ATOM 1054 CE2 TYR A 75 -9.874 -15.810 9.532 1.00 0.00 C ATOM 1055 CZ TYR A 75 -8.893 -15.072 10.161 1.00 0.00 C ATOM 1056 OH TYR A 75 -9.046 -13.712 10.305 1.00 0.00 O ATOM 0 H TYR A 75 -9.379 -19.764 7.460 1.00 0.00 H new ATOM 0 HA TYR A 75 -6.768 -18.977 8.375 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -9.400 -19.775 9.619 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -7.961 -19.718 10.618 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -6.721 -17.535 10.881 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -10.488 -17.750 8.900 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -6.994 -15.110 11.140 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -10.760 -15.323 9.152 1.00 0.00 H new ATOM 0 HH TYR A 75 -9.898 -13.435 9.908 1.00 0.00 H new ATOM 1066 N LYS A 76 -5.983 -21.125 9.684 1.00 0.00 N ATOM 1067 CA LYS A 76 -5.295 -22.367 10.015 1.00 0.00 C ATOM 1068 C LYS A 76 -5.505 -22.732 11.481 1.00 0.00 C ATOM 1069 O LYS A 76 -5.538 -23.909 11.839 1.00 0.00 O ATOM 1070 CB LYS A 76 -3.799 -22.240 9.720 1.00 0.00 C ATOM 1071 CG LYS A 76 -3.134 -21.077 10.435 1.00 0.00 C ATOM 1072 CD LYS A 76 -2.559 -21.502 11.776 1.00 0.00 C ATOM 1073 CE LYS A 76 -1.803 -20.364 12.444 1.00 0.00 C ATOM 1074 NZ LYS A 76 -0.796 -20.865 13.420 1.00 0.00 N ATOM 0 H LYS A 76 -5.678 -20.317 10.227 1.00 0.00 H new ATOM 0 HA LYS A 76 -5.715 -23.161 9.397 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -3.301 -23.166 10.008 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -3.658 -22.123 8.645 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -2.339 -20.671 9.810 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -3.860 -20.278 10.586 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -3.365 -21.837 12.429 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -1.890 -22.351 11.634 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -1.304 -19.764 11.683 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -2.509 -19.709 12.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -0.302 -20.059 13.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -1.275 -21.417 14.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -0.107 -21.469 12.929 1.00 0.00 H new ATOM 1088 N SER A 77 -5.649 -21.715 12.324 1.00 0.00 N ATOM 1089 CA SER A 77 -5.854 -21.929 13.752 1.00 0.00 C ATOM 1090 C SER A 77 -6.358 -20.656 14.426 1.00 0.00 C ATOM 1091 O SER A 77 -6.351 -19.581 13.829 1.00 0.00 O ATOM 1092 CB SER A 77 -4.553 -22.389 14.413 1.00 0.00 C ATOM 1093 OG SER A 77 -4.030 -23.535 13.765 1.00 0.00 O ATOM 0 H SER A 77 -5.628 -20.735 12.043 1.00 0.00 H new ATOM 0 HA SER A 77 -6.609 -22.706 13.872 1.00 0.00 H new ATOM 0 HB2 SER A 77 -3.820 -21.583 14.381 1.00 0.00 H new ATOM 0 HB3 SER A 77 -4.735 -22.613 15.464 1.00 0.00 H new ATOM 0 HG SER A 77 -4.767 -24.077 13.413 1.00 0.00 H new ATOM 1099 N GLY A 78 -6.794 -20.788 15.675 1.00 0.00 N ATOM 1100 CA GLY A 78 -7.295 -19.642 16.410 1.00 0.00 C ATOM 1101 C GLY A 78 -8.698 -19.862 16.941 1.00 0.00 C ATOM 1102 O GLY A 78 -9.376 -20.813 16.552 1.00 0.00 O ATOM 0 H GLY A 78 -6.809 -21.668 16.191 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -6.625 -19.426 17.242 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -7.289 -18.767 15.761 1.00 0.00 H new ATOM 1106 N THR A 79 -9.136 -18.980 17.834 1.00 0.00 N ATOM 1107 CA THR A 79 -10.466 -19.083 18.422 1.00 0.00 C ATOM 1108 C THR A 79 -11.539 -18.634 17.437 1.00 0.00 C ATOM 1109 O THR A 79 -11.564 -17.478 17.016 1.00 0.00 O ATOM 1110 CB THR A 79 -10.580 -18.241 19.707 1.00 0.00 C ATOM 1111 OG1 THR A 79 -9.441 -18.469 20.545 1.00 0.00 O ATOM 1112 CG2 THR A 79 -11.852 -18.583 20.467 1.00 0.00 C ATOM 0 H THR A 79 -8.589 -18.186 18.166 1.00 0.00 H new ATOM 0 HA THR A 79 -10.621 -20.133 18.670 1.00 0.00 H new ATOM 0 HB THR A 79 -10.617 -17.189 19.424 1.00 0.00 H new ATOM 0 HG1 THR A 79 -9.520 -17.929 21.359 1.00 0.00 H new ATOM 0 HG21 THR A 79 -11.910 -17.976 21.370 1.00 0.00 H new ATOM 0 HG22 THR A 79 -12.718 -18.380 19.837 1.00 0.00 H new ATOM 0 HG23 THR A 79 -11.841 -19.638 20.739 1.00 0.00 H new ATOM 1120 N PHE A 80 -12.424 -19.556 17.073 1.00 0.00 N ATOM 1121 CA PHE A 80 -13.501 -19.254 16.136 1.00 0.00 C ATOM 1122 C PHE A 80 -14.862 -19.553 16.758 1.00 0.00 C ATOM 1123 O PHE A 80 -15.060 -20.603 17.369 1.00 0.00 O ATOM 1124 CB PHE A 80 -13.327 -20.063 14.849 1.00 0.00 C ATOM 1125 CG PHE A 80 -12.100 -19.689 14.067 1.00 0.00 C ATOM 1126 CD1 PHE A 80 -12.128 -18.627 13.177 1.00 0.00 C ATOM 1127 CD2 PHE A 80 -10.920 -20.398 14.222 1.00 0.00 C ATOM 1128 CE1 PHE A 80 -11.001 -18.281 12.456 1.00 0.00 C ATOM 1129 CE2 PHE A 80 -9.790 -20.056 13.503 1.00 0.00 C ATOM 1130 CZ PHE A 80 -9.830 -18.995 12.620 1.00 0.00 C ATOM 0 H PHE A 80 -12.417 -20.518 17.412 1.00 0.00 H new ATOM 0 HA PHE A 80 -13.455 -18.191 15.898 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -13.280 -21.123 15.099 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -14.206 -19.923 14.220 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -13.040 -18.064 13.046 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -10.882 -21.228 14.913 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -11.036 -17.452 11.764 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -8.877 -20.618 13.632 1.00 0.00 H new ATOM 0 HZ PHE A 80 -8.948 -18.724 12.059 1.00 0.00 H new ATOM 1140 N ARG A 81 -15.796 -18.621 16.597 1.00 0.00 N ATOM 1141 CA ARG A 81 -17.138 -18.782 17.143 1.00 0.00 C ATOM 1142 C ARG A 81 -17.988 -19.673 16.241 1.00 0.00 C ATOM 1143 O ARG A 81 -18.203 -19.363 15.069 1.00 0.00 O ATOM 1144 CB ARG A 81 -17.811 -17.419 17.311 1.00 0.00 C ATOM 1145 CG ARG A 81 -17.325 -16.646 18.527 1.00 0.00 C ATOM 1146 CD ARG A 81 -18.059 -15.323 18.675 1.00 0.00 C ATOM 1147 NE ARG A 81 -19.399 -15.499 19.228 1.00 0.00 N ATOM 1148 CZ ARG A 81 -20.155 -14.494 19.657 1.00 0.00 C ATOM 1149 NH1 ARG A 81 -19.705 -13.249 19.596 1.00 0.00 N ATOM 1150 NH2 ARG A 81 -21.365 -14.735 20.147 1.00 0.00 N ATOM 0 H ARG A 81 -15.648 -17.747 16.093 1.00 0.00 H new ATOM 0 HA ARG A 81 -17.051 -19.259 18.119 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -17.633 -16.822 16.416 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -18.889 -17.562 17.389 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -17.472 -17.247 19.424 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -16.254 -16.462 18.438 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -17.484 -14.660 19.322 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -18.129 -14.837 17.702 1.00 0.00 H new ATOM 0 HE ARG A 81 -19.775 -16.445 19.288 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -18.776 -13.060 19.219 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -20.287 -12.479 19.926 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -21.715 -15.692 20.194 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -21.945 -13.963 20.476 1.00 0.00 H new ATOM 1164 N TYR A 82 -18.469 -20.780 16.796 1.00 0.00 N ATOM 1165 CA TYR A 82 -19.293 -21.717 16.042 1.00 0.00 C ATOM 1166 C TYR A 82 -20.681 -21.137 15.784 1.00 0.00 C ATOM 1167 O TYR A 82 -21.322 -21.456 14.783 1.00 0.00 O ATOM 1168 CB TYR A 82 -19.415 -23.043 16.796 1.00 0.00 C ATOM 1169 CG TYR A 82 -20.656 -23.830 16.440 1.00 0.00 C ATOM 1170 CD1 TYR A 82 -21.912 -23.411 16.860 1.00 0.00 C ATOM 1171 CD2 TYR A 82 -20.572 -24.992 15.683 1.00 0.00 C ATOM 1172 CE1 TYR A 82 -23.049 -24.128 16.538 1.00 0.00 C ATOM 1173 CE2 TYR A 82 -21.703 -25.714 15.356 1.00 0.00 C ATOM 1174 CZ TYR A 82 -22.939 -25.278 15.786 1.00 0.00 C ATOM 1175 OH TYR A 82 -24.069 -25.994 15.462 1.00 0.00 O ATOM 0 H TYR A 82 -18.302 -21.050 17.765 1.00 0.00 H new ATOM 0 HA TYR A 82 -18.809 -21.895 15.082 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -18.536 -23.653 16.587 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -19.417 -22.843 17.868 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -22.002 -22.510 17.448 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -19.606 -25.336 15.345 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -24.018 -23.789 16.874 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -21.620 -26.615 14.767 1.00 0.00 H new ATOM 0 HH TYR A 82 -24.159 -26.040 14.487 1.00 0.00 H new ATOM 1185 N GLU A 83 -21.136 -20.282 16.694 1.00 0.00 N ATOM 1186 CA GLU A 83 -22.448 -19.657 16.566 1.00 0.00 C ATOM 1187 C GLU A 83 -22.562 -18.899 15.246 1.00 0.00 C ATOM 1188 O GLU A 83 -23.634 -18.839 14.644 1.00 0.00 O ATOM 1189 CB GLU A 83 -22.701 -18.706 17.737 1.00 0.00 C ATOM 1190 CG GLU A 83 -22.266 -19.265 19.081 1.00 0.00 C ATOM 1191 CD GLU A 83 -23.101 -18.737 20.231 1.00 0.00 C ATOM 1192 OE1 GLU A 83 -24.216 -19.256 20.442 1.00 0.00 O ATOM 1193 OE2 GLU A 83 -22.638 -17.804 20.920 1.00 0.00 O ATOM 0 H GLU A 83 -20.616 -20.006 17.527 1.00 0.00 H new ATOM 0 HA GLU A 83 -23.201 -20.445 16.579 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -22.173 -17.770 17.554 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -23.764 -18.469 17.779 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -22.334 -20.353 19.057 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -21.219 -19.015 19.252 1.00 0.00 H new ATOM 1200 N ASP A 84 -21.450 -18.323 14.804 1.00 0.00 N ATOM 1201 CA ASP A 84 -21.424 -17.569 13.556 1.00 0.00 C ATOM 1202 C ASP A 84 -21.090 -18.479 12.378 1.00 0.00 C ATOM 1203 O ASP A 84 -21.745 -18.431 11.337 1.00 0.00 O ATOM 1204 CB ASP A 84 -20.405 -16.432 13.643 1.00 0.00 C ATOM 1205 CG ASP A 84 -20.451 -15.518 12.434 1.00 0.00 C ATOM 1206 OD1 ASP A 84 -21.540 -14.986 12.135 1.00 0.00 O ATOM 1207 OD2 ASP A 84 -19.399 -15.337 11.786 1.00 0.00 O ATOM 0 H ASP A 84 -20.555 -18.364 15.291 1.00 0.00 H new ATOM 0 HA ASP A 84 -22.416 -17.146 13.395 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -20.593 -15.848 14.544 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -19.404 -16.852 13.739 1.00 0.00 H new ATOM 1212 N VAL A 85 -20.065 -19.308 12.550 1.00 0.00 N ATOM 1213 CA VAL A 85 -19.643 -20.229 11.501 1.00 0.00 C ATOM 1214 C VAL A 85 -20.843 -20.911 10.854 1.00 0.00 C ATOM 1215 O VAL A 85 -21.614 -21.601 11.522 1.00 0.00 O ATOM 1216 CB VAL A 85 -18.689 -21.306 12.051 1.00 0.00 C ATOM 1217 CG1 VAL A 85 -18.175 -22.190 10.925 1.00 0.00 C ATOM 1218 CG2 VAL A 85 -17.535 -20.662 12.804 1.00 0.00 C ATOM 0 H VAL A 85 -19.512 -19.361 13.405 1.00 0.00 H new ATOM 0 HA VAL A 85 -19.117 -19.637 10.752 1.00 0.00 H new ATOM 0 HB VAL A 85 -19.242 -21.934 12.749 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -17.503 -22.945 11.333 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -19.016 -22.680 10.435 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -17.638 -21.579 10.199 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -16.871 -21.438 13.185 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -16.980 -20.009 12.130 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -17.925 -20.077 13.637 1.00 0.00 H new ATOM 1228 N LEU A 86 -20.995 -20.714 9.549 1.00 0.00 N ATOM 1229 CA LEU A 86 -22.102 -21.311 8.809 1.00 0.00 C ATOM 1230 C LEU A 86 -21.795 -22.760 8.445 1.00 0.00 C ATOM 1231 O LEU A 86 -21.420 -23.059 7.311 1.00 0.00 O ATOM 1232 CB LEU A 86 -22.387 -20.504 7.541 1.00 0.00 C ATOM 1233 CG LEU A 86 -23.809 -20.603 6.988 1.00 0.00 C ATOM 1234 CD1 LEU A 86 -24.087 -19.461 6.023 1.00 0.00 C ATOM 1235 CD2 LEU A 86 -24.023 -21.946 6.305 1.00 0.00 C ATOM 0 H LEU A 86 -20.366 -20.146 8.981 1.00 0.00 H new ATOM 0 HA LEU A 86 -22.985 -21.296 9.448 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -22.170 -19.455 7.745 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -21.693 -20.828 6.765 1.00 0.00 H new ATOM 0 HG LEU A 86 -24.509 -20.526 7.820 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -25.104 -19.548 5.640 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -23.976 -18.510 6.543 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -23.381 -19.506 5.193 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -25.040 -21.999 5.917 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -23.315 -22.053 5.483 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -23.867 -22.749 7.025 1.00 0.00 H new ATOM 1247 N TRP A 87 -21.959 -23.655 9.412 1.00 0.00 N ATOM 1248 CA TRP A 87 -21.702 -25.073 9.193 1.00 0.00 C ATOM 1249 C TRP A 87 -22.722 -25.668 8.228 1.00 0.00 C ATOM 1250 O TRP A 87 -23.871 -25.234 8.156 1.00 0.00 O ATOM 1251 CB TRP A 87 -21.737 -25.831 10.521 1.00 0.00 C ATOM 1252 CG TRP A 87 -20.979 -25.143 11.617 1.00 0.00 C ATOM 1253 CD1 TRP A 87 -21.432 -24.133 12.417 1.00 0.00 C ATOM 1254 CD2 TRP A 87 -19.635 -25.414 12.030 1.00 0.00 C ATOM 1255 NE1 TRP A 87 -20.450 -23.760 13.303 1.00 0.00 N ATOM 1256 CE2 TRP A 87 -19.338 -24.531 13.087 1.00 0.00 C ATOM 1257 CE3 TRP A 87 -18.654 -26.317 11.611 1.00 0.00 C ATOM 1258 CZ2 TRP A 87 -18.102 -24.526 13.727 1.00 0.00 C ATOM 1259 CZ3 TRP A 87 -17.428 -26.311 12.248 1.00 0.00 C ATOM 1260 CH2 TRP A 87 -17.161 -25.421 13.297 1.00 0.00 C ATOM 0 H TRP A 87 -22.269 -23.424 10.356 1.00 0.00 H new ATOM 0 HA TRP A 87 -20.710 -25.172 8.752 1.00 0.00 H new ATOM 0 HB2 TRP A 87 -22.774 -25.959 10.831 1.00 0.00 H new ATOM 0 HB3 TRP A 87 -21.323 -26.828 10.373 1.00 0.00 H new ATOM 0 HD1 TRP A 87 -22.417 -23.693 12.361 1.00 0.00 H new ATOM 0 HE1 TRP A 87 -20.535 -23.027 14.008 1.00 0.00 H new ATOM 0 HE3 TRP A 87 -18.851 -27.007 10.804 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 -17.893 -23.840 14.534 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 -16.662 -27.004 11.932 1.00 0.00 H new ATOM 0 HH2 TRP A 87 -16.193 -25.442 13.776 1.00 0.00 H new ATOM 1271 N PRO A 88 -22.294 -26.687 7.467 1.00 0.00 N ATOM 1272 CA PRO A 88 -23.156 -27.364 6.493 1.00 0.00 C ATOM 1273 C PRO A 88 -24.247 -28.193 7.162 1.00 0.00 C ATOM 1274 O PRO A 88 -24.021 -28.807 8.204 1.00 0.00 O ATOM 1275 CB PRO A 88 -22.186 -28.271 5.732 1.00 0.00 C ATOM 1276 CG PRO A 88 -21.067 -28.514 6.685 1.00 0.00 C ATOM 1277 CD PRO A 88 -20.937 -27.257 7.500 1.00 0.00 C ATOM 0 HA PRO A 88 -23.687 -26.656 5.857 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -22.665 -29.205 5.438 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -21.831 -27.793 4.819 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -21.277 -29.373 7.323 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -20.141 -28.731 6.152 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -20.616 -27.471 8.519 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -20.204 -26.574 7.071 1.00 0.00 H new ATOM 1285 N GLU A 89 -25.430 -28.206 6.555 1.00 0.00 N ATOM 1286 CA GLU A 89 -26.556 -28.960 7.094 1.00 0.00 C ATOM 1287 C GLU A 89 -26.226 -30.448 7.174 1.00 0.00 C ATOM 1288 O GLU A 89 -26.652 -31.140 8.097 1.00 0.00 O ATOM 1289 CB GLU A 89 -27.800 -28.748 6.229 1.00 0.00 C ATOM 1290 CG GLU A 89 -27.703 -29.390 4.855 1.00 0.00 C ATOM 1291 CD GLU A 89 -28.842 -28.985 3.940 1.00 0.00 C ATOM 1292 OE1 GLU A 89 -29.059 -27.767 3.767 1.00 0.00 O ATOM 1293 OE2 GLU A 89 -29.517 -29.884 3.397 1.00 0.00 O ATOM 0 H GLU A 89 -25.633 -27.704 5.691 1.00 0.00 H new ATOM 0 HA GLU A 89 -26.756 -28.595 8.102 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -28.668 -29.153 6.750 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -27.971 -27.678 6.110 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -26.755 -29.112 4.394 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -27.698 -30.474 4.964 1.00 0.00 H new ATOM 1300 N ALA A 90 -25.464 -30.932 6.199 1.00 0.00 N ATOM 1301 CA ALA A 90 -25.075 -32.336 6.159 1.00 0.00 C ATOM 1302 C ALA A 90 -24.827 -32.878 7.563 1.00 0.00 C ATOM 1303 O ALA A 90 -25.297 -33.960 7.913 1.00 0.00 O ATOM 1304 CB ALA A 90 -23.835 -32.516 5.295 1.00 0.00 C ATOM 0 H ALA A 90 -25.104 -30.372 5.426 1.00 0.00 H new ATOM 0 HA ALA A 90 -25.896 -32.902 5.719 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -23.556 -33.569 5.274 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -24.046 -32.176 4.281 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -23.014 -31.931 5.710 1.00 0.00 H new ATOM 1310 N ALA A 91 -24.087 -32.118 8.363 1.00 0.00 N ATOM 1311 CA ALA A 91 -23.778 -32.521 9.729 1.00 0.00 C ATOM 1312 C ALA A 91 -25.019 -32.458 10.613 1.00 0.00 C ATOM 1313 O ALA A 91 -25.563 -31.382 10.861 1.00 0.00 O ATOM 1314 CB ALA A 91 -22.674 -31.644 10.302 1.00 0.00 C ATOM 0 H ALA A 91 -23.690 -31.219 8.088 1.00 0.00 H new ATOM 0 HA ALA A 91 -23.431 -33.554 9.707 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -22.454 -31.957 11.323 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -21.777 -31.743 9.691 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -23.000 -30.604 10.303 1.00 0.00 H new ATOM 1320 N SER A 92 -25.462 -33.618 11.087 1.00 0.00 N ATOM 1321 CA SER A 92 -26.642 -33.695 11.940 1.00 0.00 C ATOM 1322 C SER A 92 -26.257 -33.567 13.411 1.00 0.00 C ATOM 1323 O SER A 92 -26.967 -32.939 14.198 1.00 0.00 O ATOM 1324 CB SER A 92 -27.381 -35.014 11.708 1.00 0.00 C ATOM 1325 OG SER A 92 -28.732 -34.922 12.124 1.00 0.00 O ATOM 0 H SER A 92 -25.021 -34.518 10.895 1.00 0.00 H new ATOM 0 HA SER A 92 -27.302 -32.867 11.681 1.00 0.00 H new ATOM 0 HB2 SER A 92 -27.340 -35.276 10.651 1.00 0.00 H new ATOM 0 HB3 SER A 92 -26.883 -35.815 12.255 1.00 0.00 H new ATOM 0 HG SER A 92 -29.183 -35.777 11.964 1.00 0.00 H new ATOM 1331 N ASP A 93 -25.129 -34.166 13.776 1.00 0.00 N ATOM 1332 CA ASP A 93 -24.648 -34.120 15.152 1.00 0.00 C ATOM 1333 C ASP A 93 -23.786 -32.883 15.384 1.00 0.00 C ATOM 1334 O ASP A 93 -22.851 -32.617 14.630 1.00 0.00 O ATOM 1335 CB ASP A 93 -23.850 -35.382 15.478 1.00 0.00 C ATOM 1336 CG ASP A 93 -23.023 -35.234 16.740 1.00 0.00 C ATOM 1337 OD1 ASP A 93 -23.452 -34.489 17.646 1.00 0.00 O ATOM 1338 OD2 ASP A 93 -21.946 -35.862 16.822 1.00 0.00 O ATOM 0 H ASP A 93 -24.530 -34.690 13.138 1.00 0.00 H new ATOM 0 HA ASP A 93 -25.513 -34.067 15.813 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -24.535 -36.222 15.592 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -23.192 -35.619 14.642 1.00 0.00 H new ATOM 1343 N GLU A 94 -24.108 -32.131 16.432 1.00 0.00 N ATOM 1344 CA GLU A 94 -23.364 -30.921 16.761 1.00 0.00 C ATOM 1345 C GLU A 94 -21.932 -31.258 17.168 1.00 0.00 C ATOM 1346 O GLU A 94 -20.995 -30.522 16.854 1.00 0.00 O ATOM 1347 CB GLU A 94 -24.060 -30.158 17.889 1.00 0.00 C ATOM 1348 CG GLU A 94 -23.957 -30.843 19.242 1.00 0.00 C ATOM 1349 CD GLU A 94 -24.747 -30.128 20.320 1.00 0.00 C ATOM 1350 OE1 GLU A 94 -25.945 -30.440 20.483 1.00 0.00 O ATOM 1351 OE2 GLU A 94 -24.168 -29.255 21.000 1.00 0.00 O ATOM 0 H GLU A 94 -24.879 -32.338 17.067 1.00 0.00 H new ATOM 0 HA GLU A 94 -23.333 -30.291 15.872 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -23.627 -29.160 17.962 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -25.112 -30.031 17.635 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -24.316 -31.869 19.154 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -22.910 -30.896 19.539 1.00 0.00 H new ATOM 1358 N THR A 95 -21.769 -32.375 17.870 1.00 0.00 N ATOM 1359 CA THR A 95 -20.453 -32.809 18.322 1.00 0.00 C ATOM 1360 C THR A 95 -19.572 -33.208 17.145 1.00 0.00 C ATOM 1361 O THR A 95 -18.345 -33.132 17.220 1.00 0.00 O ATOM 1362 CB THR A 95 -20.558 -33.997 19.297 1.00 0.00 C ATOM 1363 OG1 THR A 95 -21.415 -33.657 20.393 1.00 0.00 O ATOM 1364 CG2 THR A 95 -19.185 -34.388 19.822 1.00 0.00 C ATOM 0 H THR A 95 -22.533 -32.996 18.138 1.00 0.00 H new ATOM 0 HA THR A 95 -20.001 -31.963 18.840 1.00 0.00 H new ATOM 0 HB THR A 95 -20.979 -34.846 18.758 1.00 0.00 H new ATOM 0 HG1 THR A 95 -21.478 -34.418 21.007 1.00 0.00 H new ATOM 0 HG21 THR A 95 -19.284 -35.229 20.509 1.00 0.00 H new ATOM 0 HG22 THR A 95 -18.544 -34.674 18.988 1.00 0.00 H new ATOM 0 HG23 THR A 95 -18.741 -33.542 20.346 1.00 0.00 H new ATOM 1372 N LYS A 96 -20.204 -33.634 16.056 1.00 0.00 N ATOM 1373 CA LYS A 96 -19.477 -34.044 14.860 1.00 0.00 C ATOM 1374 C LYS A 96 -18.906 -32.834 14.129 1.00 0.00 C ATOM 1375 O LYS A 96 -17.754 -32.844 13.695 1.00 0.00 O ATOM 1376 CB LYS A 96 -20.397 -34.832 13.925 1.00 0.00 C ATOM 1377 CG LYS A 96 -20.343 -36.334 14.142 1.00 0.00 C ATOM 1378 CD LYS A 96 -20.792 -37.093 12.904 1.00 0.00 C ATOM 1379 CE LYS A 96 -21.323 -38.474 13.259 1.00 0.00 C ATOM 1380 NZ LYS A 96 -21.486 -39.332 12.053 1.00 0.00 N ATOM 0 H LYS A 96 -21.219 -33.704 15.977 1.00 0.00 H new ATOM 0 HA LYS A 96 -18.649 -34.683 15.169 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -21.422 -34.490 14.065 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -20.126 -34.613 12.892 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -19.326 -36.629 14.402 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -20.978 -36.604 14.986 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -21.567 -36.525 12.389 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -19.955 -37.190 12.212 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -20.641 -38.957 13.959 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -22.282 -38.375 13.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -21.850 -40.264 12.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -22.157 -38.884 11.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -20.566 -39.448 11.582 1.00 0.00 H new ATOM 1394 N LYS A 97 -19.719 -31.791 13.995 1.00 0.00 N ATOM 1395 CA LYS A 97 -19.295 -30.571 13.318 1.00 0.00 C ATOM 1396 C LYS A 97 -18.395 -29.733 14.221 1.00 0.00 C ATOM 1397 O LYS A 97 -17.349 -29.247 13.791 1.00 0.00 O ATOM 1398 CB LYS A 97 -20.514 -29.750 12.892 1.00 0.00 C ATOM 1399 CG LYS A 97 -21.437 -29.389 14.042 1.00 0.00 C ATOM 1400 CD LYS A 97 -22.702 -28.707 13.549 1.00 0.00 C ATOM 1401 CE LYS A 97 -23.741 -29.721 13.095 1.00 0.00 C ATOM 1402 NZ LYS A 97 -25.127 -29.194 13.231 1.00 0.00 N ATOM 0 H LYS A 97 -20.676 -31.766 14.347 1.00 0.00 H new ATOM 0 HA LYS A 97 -18.728 -30.855 12.432 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -20.174 -28.834 12.409 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -21.078 -30.312 12.148 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -21.701 -30.291 14.595 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -20.915 -28.731 14.736 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -23.118 -28.090 14.345 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -22.458 -28.039 12.723 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -23.555 -29.990 12.055 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -23.640 -30.633 13.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -25.805 -29.915 12.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -25.313 -28.961 14.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -25.232 -28.338 12.649 1.00 0.00 H new ATOM 1416 N ARG A 98 -18.808 -29.571 15.474 1.00 0.00 N ATOM 1417 CA ARG A 98 -18.038 -28.792 16.436 1.00 0.00 C ATOM 1418 C ARG A 98 -16.693 -29.453 16.720 1.00 0.00 C ATOM 1419 O ARG A 98 -15.763 -28.811 17.209 1.00 0.00 O ATOM 1420 CB ARG A 98 -18.824 -28.631 17.739 1.00 0.00 C ATOM 1421 CG ARG A 98 -20.065 -27.765 17.599 1.00 0.00 C ATOM 1422 CD ARG A 98 -20.669 -27.433 18.954 1.00 0.00 C ATOM 1423 NE ARG A 98 -20.980 -28.634 19.724 1.00 0.00 N ATOM 1424 CZ ARG A 98 -21.337 -28.615 21.003 1.00 0.00 C ATOM 1425 NH1 ARG A 98 -21.430 -27.463 21.652 1.00 0.00 N ATOM 1426 NH2 ARG A 98 -21.604 -29.751 21.636 1.00 0.00 N ATOM 0 H ARG A 98 -19.671 -29.968 15.846 1.00 0.00 H new ATOM 0 HA ARG A 98 -17.855 -27.808 16.005 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -19.118 -29.617 18.100 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -18.171 -28.196 18.496 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -19.809 -26.843 17.078 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -20.804 -28.283 16.987 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -19.974 -26.811 19.518 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -21.578 -26.848 18.812 1.00 0.00 H new ATOM 0 HE ARG A 98 -20.920 -29.537 19.254 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -21.227 -26.588 21.169 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -21.704 -27.452 22.634 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -21.535 -30.640 21.140 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -21.878 -29.735 22.618 1.00 0.00 H new ATOM 1440 N THR A 99 -16.596 -30.742 16.409 1.00 0.00 N ATOM 1441 CA THR A 99 -15.366 -31.492 16.631 1.00 0.00 C ATOM 1442 C THR A 99 -14.711 -31.879 15.310 1.00 0.00 C ATOM 1443 O THR A 99 -13.707 -32.591 15.289 1.00 0.00 O ATOM 1444 CB THR A 99 -15.626 -32.767 17.455 1.00 0.00 C ATOM 1445 OG1 THR A 99 -16.406 -32.451 18.614 1.00 0.00 O ATOM 1446 CG2 THR A 99 -14.316 -33.414 17.880 1.00 0.00 C ATOM 0 H THR A 99 -17.355 -31.288 16.002 1.00 0.00 H new ATOM 0 HA THR A 99 -14.695 -30.839 17.188 1.00 0.00 H new ATOM 0 HB THR A 99 -16.174 -33.471 16.829 1.00 0.00 H new ATOM 0 HG1 THR A 99 -17.354 -32.412 18.369 1.00 0.00 H new ATOM 0 HG21 THR A 99 -14.525 -34.312 18.461 1.00 0.00 H new ATOM 0 HG22 THR A 99 -13.738 -33.680 16.995 1.00 0.00 H new ATOM 0 HG23 THR A 99 -13.745 -32.713 18.489 1.00 0.00 H new ATOM 1454 N ALA A 100 -15.286 -31.405 14.209 1.00 0.00 N ATOM 1455 CA ALA A 100 -14.756 -31.700 12.884 1.00 0.00 C ATOM 1456 C ALA A 100 -13.301 -31.260 12.764 1.00 0.00 C ATOM 1457 O ALA A 100 -12.582 -31.696 11.864 1.00 0.00 O ATOM 1458 CB ALA A 100 -15.603 -31.025 11.815 1.00 0.00 C ATOM 0 H ALA A 100 -16.118 -30.815 14.209 1.00 0.00 H new ATOM 0 HA ALA A 100 -14.795 -32.779 12.736 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -15.196 -31.254 10.830 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -16.628 -31.391 11.878 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -15.593 -29.946 11.970 1.00 0.00 H new ATOM 1464 N PHE A 101 -12.872 -30.394 13.676 1.00 0.00 N ATOM 1465 CA PHE A 101 -11.502 -29.894 13.672 1.00 0.00 C ATOM 1466 C PHE A 101 -10.611 -30.742 14.574 1.00 0.00 C ATOM 1467 O PHE A 101 -9.604 -30.264 15.097 1.00 0.00 O ATOM 1468 CB PHE A 101 -11.468 -28.434 14.128 1.00 0.00 C ATOM 1469 CG PHE A 101 -11.968 -27.470 13.091 1.00 0.00 C ATOM 1470 CD1 PHE A 101 -11.194 -27.160 11.985 1.00 0.00 C ATOM 1471 CD2 PHE A 101 -13.211 -26.873 13.223 1.00 0.00 C ATOM 1472 CE1 PHE A 101 -11.651 -26.273 11.028 1.00 0.00 C ATOM 1473 CE2 PHE A 101 -13.673 -25.986 12.269 1.00 0.00 C ATOM 1474 CZ PHE A 101 -12.892 -25.684 11.171 1.00 0.00 C ATOM 0 H PHE A 101 -13.454 -30.024 14.428 1.00 0.00 H new ATOM 0 HA PHE A 101 -11.121 -29.957 12.653 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -12.071 -28.329 15.030 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -10.445 -28.169 14.396 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -10.222 -27.616 11.869 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -13.826 -27.103 14.081 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -11.038 -26.041 10.170 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -14.645 -25.529 12.382 1.00 0.00 H new ATOM 0 HZ PHE A 101 -13.251 -24.989 10.426 1.00 0.00 H new ATOM 1484 N ALA A 102 -10.989 -32.004 14.752 1.00 0.00 N ATOM 1485 CA ALA A 102 -10.224 -32.919 15.590 1.00 0.00 C ATOM 1486 C ALA A 102 -8.856 -33.208 14.981 1.00 0.00 C ATOM 1487 O ALA A 102 -8.756 -33.779 13.896 1.00 0.00 O ATOM 1488 CB ALA A 102 -10.995 -34.215 15.797 1.00 0.00 C ATOM 0 H ALA A 102 -11.820 -32.416 14.327 1.00 0.00 H new ATOM 0 HA ALA A 102 -10.069 -32.442 16.558 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -10.412 -34.889 16.425 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -11.946 -33.999 16.283 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -11.180 -34.687 14.832 1.00 0.00 H new ATOM 1494 N GLY A 103 -7.803 -32.807 15.687 1.00 0.00 N ATOM 1495 CA GLY A 103 -6.454 -33.031 15.199 1.00 0.00 C ATOM 1496 C GLY A 103 -5.731 -31.738 14.882 1.00 0.00 C ATOM 1497 O GLY A 103 -4.504 -31.668 14.960 1.00 0.00 O ATOM 0 H GLY A 103 -7.860 -32.331 16.588 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -5.888 -33.586 15.947 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -6.493 -33.651 14.303 1.00 0.00 H new ATOM 1501 N THR A 104 -6.491 -30.709 14.521 1.00 0.00 N ATOM 1502 CA THR A 104 -5.915 -29.412 14.188 1.00 0.00 C ATOM 1503 C THR A 104 -5.770 -28.540 15.429 1.00 0.00 C ATOM 1504 O THR A 104 -6.361 -28.823 16.471 1.00 0.00 O ATOM 1505 CB THR A 104 -6.773 -28.667 13.148 1.00 0.00 C ATOM 1506 OG1 THR A 104 -8.107 -28.502 13.641 1.00 0.00 O ATOM 1507 CG2 THR A 104 -6.805 -29.425 11.829 1.00 0.00 C ATOM 0 H THR A 104 -7.508 -30.749 14.452 1.00 0.00 H new ATOM 0 HA THR A 104 -4.929 -29.603 13.765 1.00 0.00 H new ATOM 0 HB THR A 104 -6.326 -27.688 12.976 1.00 0.00 H new ATOM 0 HG1 THR A 104 -8.395 -29.326 14.087 1.00 0.00 H new ATOM 0 HG21 THR A 104 -7.417 -28.879 11.111 1.00 0.00 H new ATOM 0 HG22 THR A 104 -5.791 -29.523 11.441 1.00 0.00 H new ATOM 0 HG23 THR A 104 -7.230 -30.416 11.989 1.00 0.00 H new ATOM 1515 N ALA A 105 -4.980 -27.477 15.311 1.00 0.00 N ATOM 1516 CA ALA A 105 -4.760 -26.562 16.423 1.00 0.00 C ATOM 1517 C ALA A 105 -5.847 -25.494 16.480 1.00 0.00 C ATOM 1518 O ALA A 105 -5.689 -24.468 17.142 1.00 0.00 O ATOM 1519 CB ALA A 105 -3.387 -25.914 16.310 1.00 0.00 C ATOM 0 H ALA A 105 -4.482 -27.229 14.456 1.00 0.00 H new ATOM 0 HA ALA A 105 -4.804 -27.137 17.348 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -3.236 -25.233 17.147 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -2.618 -26.686 16.327 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -3.323 -25.359 15.374 1.00 0.00 H new ATOM 1525 N ILE A 106 -6.950 -25.742 15.781 1.00 0.00 N ATOM 1526 CA ILE A 106 -8.063 -24.802 15.753 1.00 0.00 C ATOM 1527 C ILE A 106 -8.952 -24.965 16.981 1.00 0.00 C ATOM 1528 O ILE A 106 -9.179 -26.079 17.452 1.00 0.00 O ATOM 1529 CB ILE A 106 -8.920 -24.982 14.486 1.00 0.00 C ATOM 1530 CG1 ILE A 106 -8.193 -24.410 13.267 1.00 0.00 C ATOM 1531 CG2 ILE A 106 -10.275 -24.313 14.663 1.00 0.00 C ATOM 1532 CD1 ILE A 106 -8.634 -25.026 11.957 1.00 0.00 C ATOM 0 H ILE A 106 -7.096 -26.586 15.227 1.00 0.00 H new ATOM 0 HA ILE A 106 -7.630 -23.801 15.751 1.00 0.00 H new ATOM 0 HB ILE A 106 -9.081 -26.048 14.323 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -8.359 -23.333 13.227 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -7.121 -24.563 13.389 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -10.869 -24.449 13.759 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -10.795 -24.762 15.510 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -10.134 -23.248 14.847 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -8.077 -24.573 11.136 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -8.443 -26.099 11.977 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -9.700 -24.850 11.813 1.00 0.00 H new ATOM 1544 N SER A 107 -9.453 -23.846 17.495 1.00 0.00 N ATOM 1545 CA SER A 107 -10.316 -23.864 18.670 1.00 0.00 C ATOM 1546 C SER A 107 -11.673 -23.239 18.358 1.00 0.00 C ATOM 1547 O SER A 107 -11.762 -22.057 18.027 1.00 0.00 O ATOM 1548 CB SER A 107 -9.652 -23.117 19.828 1.00 0.00 C ATOM 1549 OG SER A 107 -8.749 -23.957 20.526 1.00 0.00 O ATOM 0 H SER A 107 -9.276 -22.916 17.116 1.00 0.00 H new ATOM 0 HA SER A 107 -10.472 -24.903 18.959 1.00 0.00 H new ATOM 0 HB2 SER A 107 -9.121 -22.245 19.446 1.00 0.00 H new ATOM 0 HB3 SER A 107 -10.416 -22.750 20.513 1.00 0.00 H new ATOM 0 HG SER A 107 -8.337 -23.456 21.260 1.00 0.00 H new ATOM 1555 N ILE A 108 -12.726 -24.043 18.465 1.00 0.00 N ATOM 1556 CA ILE A 108 -14.078 -23.569 18.196 1.00 0.00 C ATOM 1557 C ILE A 108 -14.893 -23.475 19.481 1.00 0.00 C ATOM 1558 O ILE A 108 -14.730 -24.285 20.394 1.00 0.00 O ATOM 1559 CB ILE A 108 -14.810 -24.491 17.203 1.00 0.00 C ATOM 1560 CG1 ILE A 108 -16.154 -23.880 16.802 1.00 0.00 C ATOM 1561 CG2 ILE A 108 -15.009 -25.872 17.811 1.00 0.00 C ATOM 1562 CD1 ILE A 108 -16.043 -22.838 15.712 1.00 0.00 C ATOM 0 H ILE A 108 -12.669 -25.025 18.736 1.00 0.00 H new ATOM 0 HA ILE A 108 -13.983 -22.576 17.756 1.00 0.00 H new ATOM 0 HB ILE A 108 -14.198 -24.595 16.307 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -16.820 -24.675 16.467 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -16.615 -23.428 17.680 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -15.528 -26.512 17.098 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -14.039 -26.307 18.051 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -15.603 -25.787 18.721 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -17.034 -22.448 15.479 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -15.403 -22.023 16.051 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -15.612 -23.290 14.819 1.00 0.00 H new ATOM 1574 N VAL A 109 -15.774 -22.481 19.545 1.00 0.00 N ATOM 1575 CA VAL A 109 -16.618 -22.281 20.717 1.00 0.00 C ATOM 1576 C VAL A 109 -18.075 -22.604 20.405 1.00 0.00 C ATOM 1577 O VAL A 109 -18.663 -23.506 21.002 1.00 0.00 O ATOM 1578 CB VAL A 109 -16.523 -20.835 21.237 1.00 0.00 C ATOM 1579 CG1 VAL A 109 -17.461 -20.629 22.417 1.00 0.00 C ATOM 1580 CG2 VAL A 109 -15.090 -20.500 21.620 1.00 0.00 C ATOM 0 H VAL A 109 -15.922 -21.802 18.799 1.00 0.00 H new ATOM 0 HA VAL A 109 -16.255 -22.960 21.489 1.00 0.00 H new ATOM 0 HB VAL A 109 -16.829 -20.159 20.438 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -17.380 -19.601 22.771 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -18.487 -20.826 22.105 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -17.189 -21.312 23.222 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -15.041 -19.474 21.985 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -14.754 -21.180 22.403 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -14.446 -20.605 20.747 1.00 0.00 H new TER 1590 VAL A 109