USER MOD reduce.3.24.130724 H: found=0, std=0, add=866, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 864 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 94 TYR OH : rot 180:sc= -0.0659 USER MOD Set 1.2: A 110 LYS NZ :NH3+ -121:sc= 0.0425 (180deg=-0.217) USER MOD Set 2.1: A 97 TYR OH : rot 180:sc= 0.556 USER MOD Set 2.2: A 102 LYS NZ :NH3+ -126:sc= 1.12 (180deg=-0.448) USER MOD Single : A 1 GLY N :NH3+ -106:sc= 0.0563 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 14 ASN : amide:sc= -0.225 K(o=-0.22,f=-1.7) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 ASN : amide:sc= -0.0649 K(o=-0.065,f=-1.1!) USER MOD Single : A 31 TYR OH : rot 180:sc= -0.984 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot -80:sc= 1.17 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 38:sc= 0.441 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ -156:sc= -0.136 (180deg=-0.658) USER MOD Single : A 61 HIS : no HD1:sc= -6.71! C(o=-6.7!,f=-9!) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 ASN :FLIP amide:sc= -4.55! C(o=-7.5!,f=-4.5!) USER MOD Single : A 69 GLN : amide:sc= -0.0126 K(o=-0.013,f=-0.56) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 SER OG : rot 180:sc= 0.00273 USER MOD Single : A 79 GLN : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 THR OG1 : rot -95:sc= 1.14 USER MOD Single : A 90 CYS SG : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ -141:sc= -0.0227 (180deg=-1.17) USER MOD Single : A 101 HIS : no HD1:sc= -1.12 X(o=-1.1,f=-1) USER MOD Single : A 103 MET CE :methyl 167:sc= 0 (180deg=-0.252) USER MOD Single : A 105 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 114 HIS :FLIP no HE2:sc= -0.279 F(o=-1.4,f=-0.28) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 THR OG1 : rot 180:sc= 0.0728 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -9.739 24.603 -24.946 1.00 0.00 N ATOM 2 CA GLY A 1 -9.370 23.548 -24.021 1.00 0.00 C ATOM 3 C GLY A 1 -7.875 23.299 -23.991 1.00 0.00 C ATOM 4 O GLY A 1 -7.163 23.639 -24.937 1.00 0.00 O ATOM 0 H1 GLY A 1 -9.995 25.458 -24.413 1.00 0.00 H new ATOM 0 H2 GLY A 1 -8.935 24.813 -25.572 1.00 0.00 H new ATOM 0 H3 GLY A 1 -10.552 24.295 -25.517 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -9.711 23.811 -23.020 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -9.883 22.628 -24.301 1.00 0.00 H new ATOM 8 N SER A 2 -7.396 22.707 -22.902 1.00 0.00 N ATOM 9 CA SER A 2 -5.974 22.419 -22.751 1.00 0.00 C ATOM 10 C SER A 2 -5.761 21.156 -21.921 1.00 0.00 C ATOM 11 O SER A 2 -6.648 20.729 -21.181 1.00 0.00 O ATOM 12 CB SER A 2 -5.260 23.601 -22.094 1.00 0.00 C ATOM 13 OG SER A 2 -5.873 23.949 -20.865 1.00 0.00 O ATOM 0 H SER A 2 -7.971 22.417 -22.111 1.00 0.00 H new ATOM 0 HA SER A 2 -5.554 22.256 -23.743 1.00 0.00 H new ATOM 0 HB2 SER A 2 -4.214 23.348 -21.923 1.00 0.00 H new ATOM 0 HB3 SER A 2 -5.275 24.458 -22.767 1.00 0.00 H new ATOM 0 HG SER A 2 -5.397 24.706 -20.465 1.00 0.00 H new ATOM 19 N SER A 3 -4.579 20.563 -22.050 1.00 0.00 N ATOM 20 CA SER A 3 -4.249 19.347 -21.316 1.00 0.00 C ATOM 21 C SER A 3 -2.842 19.430 -20.733 1.00 0.00 C ATOM 22 O SER A 3 -2.080 20.344 -21.046 1.00 0.00 O ATOM 23 CB SER A 3 -4.363 18.127 -22.232 1.00 0.00 C ATOM 24 OG SER A 3 -4.630 16.953 -21.485 1.00 0.00 O ATOM 0 H SER A 3 -3.833 20.905 -22.656 1.00 0.00 H new ATOM 0 HA SER A 3 -4.958 19.243 -20.495 1.00 0.00 H new ATOM 0 HB2 SER A 3 -5.158 18.288 -22.960 1.00 0.00 H new ATOM 0 HB3 SER A 3 -3.437 18.002 -22.794 1.00 0.00 H new ATOM 0 HG SER A 3 -4.700 16.187 -22.093 1.00 0.00 H new ATOM 30 N GLY A 4 -2.504 18.467 -19.881 1.00 0.00 N ATOM 31 CA GLY A 4 -1.189 18.448 -19.266 1.00 0.00 C ATOM 32 C GLY A 4 -0.072 18.374 -20.288 1.00 0.00 C ATOM 33 O GLY A 4 -0.225 18.835 -21.419 1.00 0.00 O ATOM 0 H GLY A 4 -3.117 17.700 -19.606 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -1.063 19.344 -18.658 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -1.118 17.594 -18.593 1.00 0.00 H new ATOM 37 N SER A 5 1.055 17.794 -19.889 1.00 0.00 N ATOM 38 CA SER A 5 2.205 17.667 -20.777 1.00 0.00 C ATOM 39 C SER A 5 3.178 16.613 -20.258 1.00 0.00 C ATOM 40 O SER A 5 3.442 16.533 -19.058 1.00 0.00 O ATOM 41 CB SER A 5 2.919 19.012 -20.917 1.00 0.00 C ATOM 42 OG SER A 5 4.158 18.864 -21.589 1.00 0.00 O ATOM 0 H SER A 5 1.197 17.405 -18.957 1.00 0.00 H new ATOM 0 HA SER A 5 1.844 17.352 -21.756 1.00 0.00 H new ATOM 0 HB2 SER A 5 2.285 19.708 -21.466 1.00 0.00 H new ATOM 0 HB3 SER A 5 3.086 19.443 -19.930 1.00 0.00 H new ATOM 0 HG SER A 5 4.594 19.738 -21.667 1.00 0.00 H new ATOM 48 N SER A 6 3.709 15.806 -21.171 1.00 0.00 N ATOM 49 CA SER A 6 4.651 14.754 -20.806 1.00 0.00 C ATOM 50 C SER A 6 6.027 15.024 -21.407 1.00 0.00 C ATOM 51 O SER A 6 6.162 15.792 -22.358 1.00 0.00 O ATOM 52 CB SER A 6 4.135 13.393 -21.278 1.00 0.00 C ATOM 53 OG SER A 6 4.662 12.345 -20.483 1.00 0.00 O ATOM 0 H SER A 6 3.503 15.860 -22.169 1.00 0.00 H new ATOM 0 HA SER A 6 4.744 14.744 -19.720 1.00 0.00 H new ATOM 0 HB2 SER A 6 3.046 13.377 -21.231 1.00 0.00 H new ATOM 0 HB3 SER A 6 4.412 13.237 -22.321 1.00 0.00 H new ATOM 0 HG SER A 6 4.316 11.486 -20.803 1.00 0.00 H new ATOM 59 N GLY A 7 7.048 14.386 -20.842 1.00 0.00 N ATOM 60 CA GLY A 7 8.401 14.570 -21.334 1.00 0.00 C ATOM 61 C GLY A 7 9.381 13.594 -20.714 1.00 0.00 C ATOM 62 O GLY A 7 8.980 12.654 -20.026 1.00 0.00 O ATOM 0 H GLY A 7 6.962 13.745 -20.053 1.00 0.00 H new ATOM 0 HA2 GLY A 7 8.410 14.450 -22.417 1.00 0.00 H new ATOM 0 HA3 GLY A 7 8.725 15.589 -21.123 1.00 0.00 H new ATOM 66 N ARG A 8 10.668 13.814 -20.959 1.00 0.00 N ATOM 67 CA ARG A 8 11.708 12.944 -20.422 1.00 0.00 C ATOM 68 C ARG A 8 12.658 13.726 -19.520 1.00 0.00 C ATOM 69 O ARG A 8 12.936 14.901 -19.762 1.00 0.00 O ATOM 70 CB ARG A 8 12.492 12.289 -21.560 1.00 0.00 C ATOM 71 CG ARG A 8 11.662 11.330 -22.398 1.00 0.00 C ATOM 72 CD ARG A 8 10.978 12.047 -23.552 1.00 0.00 C ATOM 73 NE ARG A 8 9.989 11.200 -24.213 1.00 0.00 N ATOM 74 CZ ARG A 8 9.485 11.459 -25.414 1.00 0.00 C ATOM 75 NH1 ARG A 8 9.875 12.536 -26.082 1.00 0.00 N ATOM 76 NH2 ARG A 8 8.588 10.641 -25.950 1.00 0.00 N ATOM 0 H ARG A 8 11.016 14.587 -21.526 1.00 0.00 H new ATOM 0 HA ARG A 8 11.226 12.168 -19.828 1.00 0.00 H new ATOM 0 HB2 ARG A 8 12.896 13.068 -22.207 1.00 0.00 H new ATOM 0 HB3 ARG A 8 13.342 11.750 -21.141 1.00 0.00 H new ATOM 0 HG2 ARG A 8 12.302 10.539 -22.788 1.00 0.00 H new ATOM 0 HG3 ARG A 8 10.911 10.852 -21.769 1.00 0.00 H new ATOM 0 HD2 ARG A 8 10.492 12.950 -23.181 1.00 0.00 H new ATOM 0 HD3 ARG A 8 11.727 12.363 -24.278 1.00 0.00 H new ATOM 0 HE ARG A 8 9.668 10.364 -23.726 1.00 0.00 H new ATOM 0 HH11 ARG A 8 10.564 13.168 -25.674 1.00 0.00 H new ATOM 0 HH12 ARG A 8 9.486 12.733 -27.004 1.00 0.00 H new ATOM 0 HH21 ARG A 8 8.285 9.812 -25.439 1.00 0.00 H new ATOM 0 HH22 ARG A 8 8.202 10.842 -26.873 1.00 0.00 H new ATOM 90 N LEU A 9 13.153 13.066 -18.478 1.00 0.00 N ATOM 91 CA LEU A 9 14.072 13.699 -17.538 1.00 0.00 C ATOM 92 C LEU A 9 14.954 12.658 -16.855 1.00 0.00 C ATOM 93 O LEU A 9 14.471 11.832 -16.079 1.00 0.00 O ATOM 94 CB LEU A 9 13.293 14.492 -16.488 1.00 0.00 C ATOM 95 CG LEU A 9 14.029 15.675 -15.857 1.00 0.00 C ATOM 96 CD1 LEU A 9 14.249 16.775 -16.884 1.00 0.00 C ATOM 97 CD2 LEU A 9 13.256 16.207 -14.660 1.00 0.00 C ATOM 0 H LEU A 9 12.933 12.093 -18.263 1.00 0.00 H new ATOM 0 HA LEU A 9 14.713 14.381 -18.097 1.00 0.00 H new ATOM 0 HB2 LEU A 9 12.377 14.863 -16.948 1.00 0.00 H new ATOM 0 HB3 LEU A 9 12.996 13.809 -15.692 1.00 0.00 H new ATOM 0 HG LEU A 9 15.003 15.330 -15.510 1.00 0.00 H new ATOM 0 HD11 LEU A 9 14.774 17.609 -16.417 1.00 0.00 H new ATOM 0 HD12 LEU A 9 14.845 16.387 -17.710 1.00 0.00 H new ATOM 0 HD13 LEU A 9 13.286 17.118 -17.261 1.00 0.00 H new ATOM 0 HD21 LEU A 9 13.795 17.048 -14.224 1.00 0.00 H new ATOM 0 HD22 LEU A 9 12.268 16.536 -14.982 1.00 0.00 H new ATOM 0 HD23 LEU A 9 13.151 15.418 -13.915 1.00 0.00 H new ATOM 109 N LEU A 10 16.249 12.705 -17.147 1.00 0.00 N ATOM 110 CA LEU A 10 17.200 11.768 -16.559 1.00 0.00 C ATOM 111 C LEU A 10 16.933 11.583 -15.069 1.00 0.00 C ATOM 112 O LEU A 10 16.533 12.521 -14.379 1.00 0.00 O ATOM 113 CB LEU A 10 18.632 12.261 -16.775 1.00 0.00 C ATOM 114 CG LEU A 10 19.217 13.131 -15.662 1.00 0.00 C ATOM 115 CD1 LEU A 10 19.643 12.272 -14.482 1.00 0.00 C ATOM 116 CD2 LEU A 10 20.392 13.945 -16.183 1.00 0.00 C ATOM 0 H LEU A 10 16.665 13.382 -17.787 1.00 0.00 H new ATOM 0 HA LEU A 10 17.075 10.805 -17.053 1.00 0.00 H new ATOM 0 HB2 LEU A 10 19.278 11.393 -16.908 1.00 0.00 H new ATOM 0 HB3 LEU A 10 18.664 12.827 -17.706 1.00 0.00 H new ATOM 0 HG LEU A 10 18.445 13.821 -15.323 1.00 0.00 H new ATOM 0 HD11 LEU A 10 20.057 12.908 -13.700 1.00 0.00 H new ATOM 0 HD12 LEU A 10 18.779 11.734 -14.093 1.00 0.00 H new ATOM 0 HD13 LEU A 10 20.399 11.557 -14.807 1.00 0.00 H new ATOM 0 HD21 LEU A 10 20.796 14.558 -15.377 1.00 0.00 H new ATOM 0 HD22 LEU A 10 21.167 13.272 -16.550 1.00 0.00 H new ATOM 0 HD23 LEU A 10 20.056 14.589 -16.996 1.00 0.00 H new ATOM 128 N ASP A 11 17.158 10.369 -14.579 1.00 0.00 N ATOM 129 CA ASP A 11 16.945 10.062 -13.169 1.00 0.00 C ATOM 130 C ASP A 11 17.447 8.661 -12.837 1.00 0.00 C ATOM 131 O ASP A 11 16.877 7.663 -13.282 1.00 0.00 O ATOM 132 CB ASP A 11 15.461 10.183 -12.818 1.00 0.00 C ATOM 133 CG ASP A 11 14.561 9.912 -14.007 1.00 0.00 C ATOM 134 OD1 ASP A 11 14.896 9.020 -14.815 1.00 0.00 O ATOM 135 OD2 ASP A 11 13.520 10.591 -14.130 1.00 0.00 O ATOM 0 H ASP A 11 17.488 9.581 -15.137 1.00 0.00 H new ATOM 0 HA ASP A 11 17.510 10.781 -12.576 1.00 0.00 H new ATOM 0 HB2 ASP A 11 15.222 9.483 -12.018 1.00 0.00 H new ATOM 0 HB3 ASP A 11 15.262 11.184 -12.436 1.00 0.00 H new ATOM 140 N LEU A 12 18.516 8.592 -12.052 1.00 0.00 N ATOM 141 CA LEU A 12 19.097 7.312 -11.660 1.00 0.00 C ATOM 142 C LEU A 12 18.011 6.259 -11.465 1.00 0.00 C ATOM 143 O LEU A 12 18.054 5.190 -12.072 1.00 0.00 O ATOM 144 CB LEU A 12 19.907 7.470 -10.372 1.00 0.00 C ATOM 145 CG LEU A 12 21.004 6.431 -10.137 1.00 0.00 C ATOM 146 CD1 LEU A 12 22.012 6.940 -9.118 1.00 0.00 C ATOM 147 CD2 LEU A 12 20.400 5.112 -9.680 1.00 0.00 C ATOM 0 H LEU A 12 18.999 9.407 -11.674 1.00 0.00 H new ATOM 0 HA LEU A 12 19.759 6.981 -12.460 1.00 0.00 H new ATOM 0 HB2 LEU A 12 20.365 8.459 -10.374 1.00 0.00 H new ATOM 0 HB3 LEU A 12 19.219 7.439 -9.528 1.00 0.00 H new ATOM 0 HG LEU A 12 21.525 6.261 -11.079 1.00 0.00 H new ATOM 0 HD11 LEU A 12 22.785 6.187 -8.964 1.00 0.00 H new ATOM 0 HD12 LEU A 12 22.469 7.859 -9.486 1.00 0.00 H new ATOM 0 HD13 LEU A 12 21.506 7.139 -8.173 1.00 0.00 H new ATOM 0 HD21 LEU A 12 21.195 4.385 -9.518 1.00 0.00 H new ATOM 0 HD22 LEU A 12 19.853 5.265 -8.750 1.00 0.00 H new ATOM 0 HD23 LEU A 12 19.718 4.740 -10.445 1.00 0.00 H new ATOM 159 N GLU A 13 17.037 6.570 -10.614 1.00 0.00 N ATOM 160 CA GLU A 13 15.940 5.650 -10.341 1.00 0.00 C ATOM 161 C GLU A 13 14.670 6.088 -11.065 1.00 0.00 C ATOM 162 O GLU A 13 14.436 7.279 -11.266 1.00 0.00 O ATOM 163 CB GLU A 13 15.678 5.566 -8.836 1.00 0.00 C ATOM 164 CG GLU A 13 14.436 4.768 -8.477 1.00 0.00 C ATOM 165 CD GLU A 13 14.154 4.765 -6.987 1.00 0.00 C ATOM 166 OE1 GLU A 13 13.899 5.852 -6.428 1.00 0.00 O ATOM 167 OE2 GLU A 13 14.190 3.674 -6.380 1.00 0.00 O ATOM 0 H GLU A 13 16.986 7.451 -10.103 1.00 0.00 H new ATOM 0 HA GLU A 13 16.226 4.665 -10.709 1.00 0.00 H new ATOM 0 HB2 GLU A 13 16.543 5.114 -8.350 1.00 0.00 H new ATOM 0 HB3 GLU A 13 15.579 6.575 -8.436 1.00 0.00 H new ATOM 0 HG2 GLU A 13 13.577 5.183 -9.005 1.00 0.00 H new ATOM 0 HG3 GLU A 13 14.556 3.741 -8.822 1.00 0.00 H new ATOM 174 N ASN A 14 13.853 5.115 -11.455 1.00 0.00 N ATOM 175 CA ASN A 14 12.607 5.398 -12.159 1.00 0.00 C ATOM 176 C ASN A 14 11.498 5.761 -11.176 1.00 0.00 C ATOM 177 O ASN A 14 10.766 6.730 -11.380 1.00 0.00 O ATOM 178 CB ASN A 14 12.185 4.191 -12.999 1.00 0.00 C ATOM 179 CG ASN A 14 13.331 3.628 -13.818 1.00 0.00 C ATOM 180 OD1 ASN A 14 14.352 4.287 -14.012 1.00 0.00 O ATOM 181 ND2 ASN A 14 13.164 2.403 -14.303 1.00 0.00 N ATOM 0 H ASN A 14 14.031 4.123 -11.296 1.00 0.00 H new ATOM 0 HA ASN A 14 12.777 6.249 -12.819 1.00 0.00 H new ATOM 0 HB2 ASN A 14 11.795 3.413 -12.342 1.00 0.00 H new ATOM 0 HB3 ASN A 14 11.374 4.482 -13.666 1.00 0.00 H new ATOM 0 HD21 ASN A 14 13.900 1.971 -14.862 1.00 0.00 H new ATOM 0 HD22 ASN A 14 12.300 1.894 -14.116 1.00 0.00 H new ATOM 188 N ILE A 15 11.381 4.977 -10.109 1.00 0.00 N ATOM 189 CA ILE A 15 10.363 5.217 -9.094 1.00 0.00 C ATOM 190 C ILE A 15 10.723 6.418 -8.226 1.00 0.00 C ATOM 191 O ILE A 15 11.888 6.620 -7.883 1.00 0.00 O ATOM 192 CB ILE A 15 10.168 3.985 -8.191 1.00 0.00 C ATOM 193 CG1 ILE A 15 9.551 2.833 -8.988 1.00 0.00 C ATOM 194 CG2 ILE A 15 9.294 4.337 -6.996 1.00 0.00 C ATOM 195 CD1 ILE A 15 10.574 1.966 -9.687 1.00 0.00 C ATOM 0 H ILE A 15 11.978 4.171 -9.925 1.00 0.00 H new ATOM 0 HA ILE A 15 9.432 5.421 -9.623 1.00 0.00 H new ATOM 0 HB ILE A 15 11.143 3.666 -7.822 1.00 0.00 H new ATOM 0 HG12 ILE A 15 8.960 2.212 -8.315 1.00 0.00 H new ATOM 0 HG13 ILE A 15 8.865 3.242 -9.730 1.00 0.00 H new ATOM 0 HG21 ILE A 15 9.165 3.456 -6.367 1.00 0.00 H new ATOM 0 HG22 ILE A 15 9.770 5.129 -6.418 1.00 0.00 H new ATOM 0 HG23 ILE A 15 8.320 4.678 -7.346 1.00 0.00 H new ATOM 0 HD11 ILE A 15 10.065 1.171 -10.232 1.00 0.00 H new ATOM 0 HD12 ILE A 15 11.150 2.574 -10.385 1.00 0.00 H new ATOM 0 HD13 ILE A 15 11.245 1.528 -8.948 1.00 0.00 H new ATOM 207 N GLN A 16 9.716 7.210 -7.874 1.00 0.00 N ATOM 208 CA GLN A 16 9.928 8.391 -7.045 1.00 0.00 C ATOM 209 C GLN A 16 8.929 8.433 -5.893 1.00 0.00 C ATOM 210 O GLN A 16 7.829 8.968 -6.031 1.00 0.00 O ATOM 211 CB GLN A 16 9.805 9.661 -7.888 1.00 0.00 C ATOM 212 CG GLN A 16 8.468 9.791 -8.600 1.00 0.00 C ATOM 213 CD GLN A 16 8.528 10.732 -9.788 1.00 0.00 C ATOM 214 OE1 GLN A 16 8.555 11.952 -9.627 1.00 0.00 O ATOM 215 NE2 GLN A 16 8.550 10.167 -10.990 1.00 0.00 N ATOM 0 H GLN A 16 8.746 7.056 -8.149 1.00 0.00 H new ATOM 0 HA GLN A 16 10.934 8.336 -6.629 1.00 0.00 H new ATOM 0 HB2 GLN A 16 9.951 10.529 -7.245 1.00 0.00 H new ATOM 0 HB3 GLN A 16 10.605 9.674 -8.629 1.00 0.00 H new ATOM 0 HG2 GLN A 16 8.143 8.807 -8.937 1.00 0.00 H new ATOM 0 HG3 GLN A 16 7.718 10.150 -7.895 1.00 0.00 H new ATOM 0 HE21 GLN A 16 8.526 9.151 -11.076 1.00 0.00 H new ATOM 0 HE22 GLN A 16 8.591 10.749 -11.827 1.00 0.00 H new ATOM 224 N ILE A 17 9.320 7.864 -4.757 1.00 0.00 N ATOM 225 CA ILE A 17 8.460 7.838 -3.581 1.00 0.00 C ATOM 226 C ILE A 17 8.822 8.955 -2.609 1.00 0.00 C ATOM 227 O ILE A 17 9.993 9.221 -2.338 1.00 0.00 O ATOM 228 CB ILE A 17 8.550 6.486 -2.848 1.00 0.00 C ATOM 229 CG1 ILE A 17 8.128 5.347 -3.779 1.00 0.00 C ATOM 230 CG2 ILE A 17 7.684 6.503 -1.597 1.00 0.00 C ATOM 231 CD1 ILE A 17 8.371 3.971 -3.198 1.00 0.00 C ATOM 0 H ILE A 17 10.227 7.415 -4.627 1.00 0.00 H new ATOM 0 HA ILE A 17 7.439 7.984 -3.934 1.00 0.00 H new ATOM 0 HB ILE A 17 9.585 6.320 -2.548 1.00 0.00 H new ATOM 0 HG12 ILE A 17 7.068 5.452 -4.012 1.00 0.00 H new ATOM 0 HG13 ILE A 17 8.672 5.437 -4.720 1.00 0.00 H new ATOM 0 HG21 ILE A 17 7.758 5.541 -1.090 1.00 0.00 H new ATOM 0 HG22 ILE A 17 8.026 7.293 -0.928 1.00 0.00 H new ATOM 0 HG23 ILE A 17 6.646 6.688 -1.875 1.00 0.00 H new ATOM 0 HD11 ILE A 17 8.049 3.213 -3.912 1.00 0.00 H new ATOM 0 HD12 ILE A 17 9.434 3.846 -2.991 1.00 0.00 H new ATOM 0 HD13 ILE A 17 7.806 3.862 -2.272 1.00 0.00 H new ATOM 243 N PRO A 18 7.794 9.627 -2.070 1.00 0.00 N ATOM 244 CA PRO A 18 7.978 10.726 -1.117 1.00 0.00 C ATOM 245 C PRO A 18 8.498 10.242 0.232 1.00 0.00 C ATOM 246 O PRO A 18 8.745 9.051 0.422 1.00 0.00 O ATOM 247 CB PRO A 18 6.570 11.308 -0.971 1.00 0.00 C ATOM 248 CG PRO A 18 5.657 10.180 -1.306 1.00 0.00 C ATOM 249 CD PRO A 18 6.372 9.364 -2.347 1.00 0.00 C ATOM 0 HA PRO A 18 8.718 11.447 -1.464 1.00 0.00 H new ATOM 0 HB2 PRO A 18 6.395 11.672 0.042 1.00 0.00 H new ATOM 0 HB3 PRO A 18 6.419 12.153 -1.643 1.00 0.00 H new ATOM 0 HG2 PRO A 18 5.438 9.580 -0.423 1.00 0.00 H new ATOM 0 HG3 PRO A 18 4.704 10.549 -1.686 1.00 0.00 H new ATOM 0 HD2 PRO A 18 6.135 8.304 -2.259 1.00 0.00 H new ATOM 0 HD3 PRO A 18 6.096 9.670 -3.356 1.00 0.00 H new ATOM 257 N ASP A 19 8.661 11.173 1.166 1.00 0.00 N ATOM 258 CA ASP A 19 9.150 10.841 2.499 1.00 0.00 C ATOM 259 C ASP A 19 8.011 10.357 3.391 1.00 0.00 C ATOM 260 O ASP A 19 8.194 9.466 4.220 1.00 0.00 O ATOM 261 CB ASP A 19 9.831 12.055 3.133 1.00 0.00 C ATOM 262 CG ASP A 19 10.363 11.761 4.522 1.00 0.00 C ATOM 263 OD1 ASP A 19 11.316 10.962 4.634 1.00 0.00 O ATOM 264 OD2 ASP A 19 9.827 12.329 5.496 1.00 0.00 O ATOM 0 H ASP A 19 8.462 12.163 1.024 1.00 0.00 H new ATOM 0 HA ASP A 19 9.878 10.036 2.402 1.00 0.00 H new ATOM 0 HB2 ASP A 19 10.652 12.382 2.495 1.00 0.00 H new ATOM 0 HB3 ASP A 19 9.120 12.880 3.186 1.00 0.00 H new ATOM 269 N ALA A 20 6.836 10.951 3.215 1.00 0.00 N ATOM 270 CA ALA A 20 5.667 10.581 4.003 1.00 0.00 C ATOM 271 C ALA A 20 4.590 9.952 3.125 1.00 0.00 C ATOM 272 O ALA A 20 4.547 10.155 1.912 1.00 0.00 O ATOM 273 CB ALA A 20 5.113 11.797 4.731 1.00 0.00 C ATOM 0 H ALA A 20 6.668 11.691 2.533 1.00 0.00 H new ATOM 0 HA ALA A 20 5.977 9.841 4.740 1.00 0.00 H new ATOM 0 HB1 ALA A 20 4.240 11.505 5.315 1.00 0.00 H new ATOM 0 HB2 ALA A 20 5.876 12.202 5.396 1.00 0.00 H new ATOM 0 HB3 ALA A 20 4.825 12.556 4.004 1.00 0.00 H new ATOM 279 N PRO A 21 3.699 9.168 3.751 1.00 0.00 N ATOM 280 CA PRO A 21 2.605 8.493 3.045 1.00 0.00 C ATOM 281 C PRO A 21 1.545 9.470 2.549 1.00 0.00 C ATOM 282 O PRO A 21 0.963 10.235 3.318 1.00 0.00 O ATOM 283 CB PRO A 21 2.018 7.562 4.109 1.00 0.00 C ATOM 284 CG PRO A 21 2.363 8.205 5.407 1.00 0.00 C ATOM 285 CD PRO A 21 3.689 8.881 5.195 1.00 0.00 C ATOM 0 HA PRO A 21 2.954 7.976 2.152 1.00 0.00 H new ATOM 0 HB2 PRO A 21 0.939 7.459 3.993 1.00 0.00 H new ATOM 0 HB3 PRO A 21 2.444 6.561 4.038 1.00 0.00 H new ATOM 0 HG2 PRO A 21 1.600 8.926 5.700 1.00 0.00 H new ATOM 0 HG3 PRO A 21 2.425 7.465 6.205 1.00 0.00 H new ATOM 0 HD2 PRO A 21 3.774 9.793 5.786 1.00 0.00 H new ATOM 0 HD3 PRO A 21 4.519 8.236 5.482 1.00 0.00 H new ATOM 293 N PRO A 22 1.287 9.446 1.233 1.00 0.00 N ATOM 294 CA PRO A 22 0.294 10.323 0.605 1.00 0.00 C ATOM 295 C PRO A 22 -1.134 9.954 0.992 1.00 0.00 C ATOM 296 O PRO A 22 -1.416 8.834 1.420 1.00 0.00 O ATOM 297 CB PRO A 22 0.518 10.097 -0.893 1.00 0.00 C ATOM 298 CG PRO A 22 1.113 8.735 -0.985 1.00 0.00 C ATOM 299 CD PRO A 22 1.943 8.560 0.257 1.00 0.00 C ATOM 0 HA PRO A 22 0.413 11.361 0.916 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -0.419 10.158 -1.447 1.00 0.00 H new ATOM 0 HB3 PRO A 22 1.186 10.850 -1.312 1.00 0.00 H new ATOM 0 HG2 PRO A 22 0.336 7.973 -1.045 1.00 0.00 H new ATOM 0 HG3 PRO A 22 1.726 8.637 -1.881 1.00 0.00 H new ATOM 0 HD2 PRO A 22 1.948 7.524 0.595 1.00 0.00 H new ATOM 0 HD3 PRO A 22 2.982 8.845 0.090 1.00 0.00 H new ATOM 307 N PRO A 23 -2.057 10.915 0.838 1.00 0.00 N ATOM 308 CA PRO A 23 -3.471 10.713 1.165 1.00 0.00 C ATOM 309 C PRO A 23 -4.160 9.760 0.195 1.00 0.00 C ATOM 310 O PRO A 23 -4.301 10.061 -0.991 1.00 0.00 O ATOM 311 CB PRO A 23 -4.067 12.118 1.048 1.00 0.00 C ATOM 312 CG PRO A 23 -3.166 12.833 0.100 1.00 0.00 C ATOM 313 CD PRO A 23 -1.791 12.272 0.333 1.00 0.00 C ATOM 0 HA PRO A 23 -3.601 10.261 2.148 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -5.090 12.084 0.673 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -4.099 12.617 2.017 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -3.482 12.677 -0.932 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -3.185 13.908 0.280 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -1.205 12.251 -0.586 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -1.231 12.867 1.055 1.00 0.00 H new ATOM 321 N ILE A 24 -4.588 8.610 0.705 1.00 0.00 N ATOM 322 CA ILE A 24 -5.264 7.614 -0.117 1.00 0.00 C ATOM 323 C ILE A 24 -6.457 8.221 -0.847 1.00 0.00 C ATOM 324 O ILE A 24 -7.233 8.994 -0.284 1.00 0.00 O ATOM 325 CB ILE A 24 -5.747 6.420 0.727 1.00 0.00 C ATOM 326 CG1 ILE A 24 -4.567 5.773 1.456 1.00 0.00 C ATOM 327 CG2 ILE A 24 -6.456 5.401 -0.152 1.00 0.00 C ATOM 328 CD1 ILE A 24 -4.984 4.765 2.504 1.00 0.00 C ATOM 0 H ILE A 24 -4.479 8.345 1.684 1.00 0.00 H new ATOM 0 HA ILE A 24 -4.535 7.261 -0.847 1.00 0.00 H new ATOM 0 HB ILE A 24 -6.456 6.783 1.471 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -3.925 5.281 0.726 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -3.971 6.553 1.930 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -6.791 4.563 0.460 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -7.317 5.869 -0.630 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -5.769 5.039 -0.917 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -4.097 4.347 2.980 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -5.602 5.256 3.256 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -5.554 3.965 2.032 1.00 0.00 H new ATOM 340 N PRO A 25 -6.610 7.864 -2.131 1.00 0.00 N ATOM 341 CA PRO A 25 -7.708 8.360 -2.965 1.00 0.00 C ATOM 342 C PRO A 25 -9.059 7.792 -2.544 1.00 0.00 C ATOM 343 O PRO A 25 -9.143 6.983 -1.620 1.00 0.00 O ATOM 344 CB PRO A 25 -7.337 7.872 -4.368 1.00 0.00 C ATOM 345 CG PRO A 25 -6.479 6.676 -4.138 1.00 0.00 C ATOM 346 CD PRO A 25 -5.723 6.947 -2.866 1.00 0.00 C ATOM 0 HA PRO A 25 -7.819 9.442 -2.890 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -8.225 7.617 -4.946 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -6.803 8.641 -4.926 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -7.084 5.774 -4.048 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -5.795 6.520 -4.973 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -5.538 6.031 -2.305 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -4.752 7.400 -3.065 1.00 0.00 H new ATOM 354 N LYS A 26 -10.115 8.220 -3.228 1.00 0.00 N ATOM 355 CA LYS A 26 -11.463 7.753 -2.926 1.00 0.00 C ATOM 356 C LYS A 26 -11.683 6.343 -3.463 1.00 0.00 C ATOM 357 O LYS A 26 -11.680 6.123 -4.674 1.00 0.00 O ATOM 358 CB LYS A 26 -12.500 8.706 -3.525 1.00 0.00 C ATOM 359 CG LYS A 26 -13.920 8.427 -3.062 1.00 0.00 C ATOM 360 CD LYS A 26 -14.234 9.148 -1.762 1.00 0.00 C ATOM 361 CE LYS A 26 -14.780 10.544 -2.016 1.00 0.00 C ATOM 362 NZ LYS A 26 -15.091 11.258 -0.746 1.00 0.00 N ATOM 0 H LYS A 26 -10.063 8.890 -3.996 1.00 0.00 H new ATOM 0 HA LYS A 26 -11.580 7.732 -1.842 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -12.235 9.730 -3.262 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -12.461 8.636 -4.612 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -14.623 8.742 -3.833 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -14.055 7.354 -2.926 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -14.961 8.570 -1.191 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -13.331 9.214 -1.154 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -14.052 11.120 -2.588 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -15.682 10.476 -2.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -15.461 12.206 -0.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -15.804 10.722 -0.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -14.225 11.346 -0.176 1.00 0.00 H new ATOM 376 N GLU A 27 -11.874 5.391 -2.554 1.00 0.00 N ATOM 377 CA GLU A 27 -12.096 4.002 -2.938 1.00 0.00 C ATOM 378 C GLU A 27 -12.904 3.918 -4.230 1.00 0.00 C ATOM 379 O GLU A 27 -13.982 4.498 -4.356 1.00 0.00 O ATOM 380 CB GLU A 27 -12.821 3.251 -1.820 1.00 0.00 C ATOM 381 CG GLU A 27 -12.478 1.772 -1.759 1.00 0.00 C ATOM 382 CD GLU A 27 -13.405 0.922 -2.607 1.00 0.00 C ATOM 383 OE1 GLU A 27 -14.637 1.051 -2.449 1.00 0.00 O ATOM 384 OE2 GLU A 27 -12.898 0.129 -3.427 1.00 0.00 O ATOM 0 H GLU A 27 -11.879 5.557 -1.548 1.00 0.00 H new ATOM 0 HA GLU A 27 -11.124 3.538 -3.107 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -12.574 3.712 -0.864 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -13.897 3.361 -1.958 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -11.451 1.627 -2.094 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -12.527 1.434 -0.724 1.00 0.00 H new ATOM 391 N PRO A 28 -12.370 3.178 -5.213 1.00 0.00 N ATOM 392 CA PRO A 28 -13.024 2.999 -6.513 1.00 0.00 C ATOM 393 C PRO A 28 -14.281 2.141 -6.417 1.00 0.00 C ATOM 394 O PRO A 28 -14.223 0.981 -6.008 1.00 0.00 O ATOM 395 CB PRO A 28 -11.957 2.292 -7.352 1.00 0.00 C ATOM 396 CG PRO A 28 -11.098 1.589 -6.359 1.00 0.00 C ATOM 397 CD PRO A 28 -11.088 2.458 -5.132 1.00 0.00 C ATOM 0 HA PRO A 28 -13.359 3.947 -6.935 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -12.407 1.590 -8.054 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -11.380 3.005 -7.940 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -11.493 0.599 -6.133 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -10.089 1.449 -6.746 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -11.017 1.865 -4.220 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -10.241 3.144 -5.133 1.00 0.00 H new ATOM 405 N SER A 29 -15.417 2.719 -6.795 1.00 0.00 N ATOM 406 CA SER A 29 -16.689 2.008 -6.748 1.00 0.00 C ATOM 407 C SER A 29 -16.969 1.308 -8.075 1.00 0.00 C ATOM 408 O SER A 29 -18.065 1.414 -8.625 1.00 0.00 O ATOM 409 CB SER A 29 -17.826 2.976 -6.418 1.00 0.00 C ATOM 410 OG SER A 29 -17.551 3.701 -5.232 1.00 0.00 O ATOM 0 H SER A 29 -15.482 3.678 -7.137 1.00 0.00 H new ATOM 0 HA SER A 29 -16.627 1.252 -5.965 1.00 0.00 H new ATOM 0 HB2 SER A 29 -17.969 3.669 -7.247 1.00 0.00 H new ATOM 0 HB3 SER A 29 -18.757 2.422 -6.301 1.00 0.00 H new ATOM 0 HG SER A 29 -18.292 4.314 -5.044 1.00 0.00 H new ATOM 416 N ASN A 30 -15.971 0.593 -8.583 1.00 0.00 N ATOM 417 CA ASN A 30 -16.109 -0.124 -9.845 1.00 0.00 C ATOM 418 C ASN A 30 -15.541 -1.535 -9.734 1.00 0.00 C ATOM 419 O ASN A 30 -14.860 -2.015 -10.641 1.00 0.00 O ATOM 420 CB ASN A 30 -15.399 0.637 -10.967 1.00 0.00 C ATOM 421 CG ASN A 30 -15.959 0.301 -12.336 1.00 0.00 C ATOM 422 OD1 ASN A 30 -16.359 -0.834 -12.595 1.00 0.00 O ATOM 423 ND2 ASN A 30 -15.990 1.291 -13.222 1.00 0.00 N ATOM 0 H ASN A 30 -15.058 0.495 -8.140 1.00 0.00 H new ATOM 0 HA ASN A 30 -17.171 -0.197 -10.079 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -15.493 1.709 -10.792 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -14.335 0.402 -10.945 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -16.356 1.125 -14.160 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -15.648 2.217 -12.964 1.00 0.00 H new ATOM 430 N TYR A 31 -15.826 -2.195 -8.617 1.00 0.00 N ATOM 431 CA TYR A 31 -15.342 -3.551 -8.385 1.00 0.00 C ATOM 432 C TYR A 31 -16.501 -4.502 -8.103 1.00 0.00 C ATOM 433 O TYR A 31 -16.391 -5.403 -7.271 1.00 0.00 O ATOM 434 CB TYR A 31 -14.355 -3.571 -7.217 1.00 0.00 C ATOM 435 CG TYR A 31 -12.922 -3.319 -7.630 1.00 0.00 C ATOM 436 CD1 TYR A 31 -12.560 -2.141 -8.271 1.00 0.00 C ATOM 437 CD2 TYR A 31 -11.931 -4.260 -7.378 1.00 0.00 C ATOM 438 CE1 TYR A 31 -11.252 -1.907 -8.650 1.00 0.00 C ATOM 439 CE2 TYR A 31 -10.621 -4.034 -7.753 1.00 0.00 C ATOM 440 CZ TYR A 31 -10.287 -2.857 -8.389 1.00 0.00 C ATOM 441 OH TYR A 31 -8.983 -2.627 -8.765 1.00 0.00 O ATOM 0 H TYR A 31 -16.390 -1.813 -7.858 1.00 0.00 H new ATOM 0 HA TYR A 31 -14.832 -3.886 -9.288 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -14.652 -2.817 -6.488 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -14.416 -4.538 -6.718 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -13.314 -1.395 -8.477 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -12.189 -5.183 -6.881 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -10.987 -0.986 -9.148 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -9.862 -4.775 -7.549 1.00 0.00 H new ATOM 0 HH TYR A 31 -8.428 -3.393 -8.508 1.00 0.00 H new ATOM 451 N ASP A 32 -17.611 -4.295 -8.802 1.00 0.00 N ATOM 452 CA ASP A 32 -18.791 -5.134 -8.629 1.00 0.00 C ATOM 453 C ASP A 32 -18.499 -6.574 -9.038 1.00 0.00 C ATOM 454 O ASP A 32 -18.951 -7.518 -8.391 1.00 0.00 O ATOM 455 CB ASP A 32 -19.959 -4.585 -9.451 1.00 0.00 C ATOM 456 CG ASP A 32 -21.262 -5.301 -9.157 1.00 0.00 C ATOM 457 OD1 ASP A 32 -21.523 -6.342 -9.796 1.00 0.00 O ATOM 458 OD2 ASP A 32 -22.020 -4.822 -8.288 1.00 0.00 O ATOM 0 H ASP A 32 -17.719 -3.553 -9.494 1.00 0.00 H new ATOM 0 HA ASP A 32 -19.062 -5.123 -7.573 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -20.077 -3.522 -9.243 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -19.728 -4.678 -10.512 1.00 0.00 H new ATOM 463 N PHE A 33 -17.741 -6.735 -10.118 1.00 0.00 N ATOM 464 CA PHE A 33 -17.389 -8.060 -10.615 1.00 0.00 C ATOM 465 C PHE A 33 -17.198 -9.041 -9.461 1.00 0.00 C ATOM 466 O PHE A 33 -16.476 -8.758 -8.505 1.00 0.00 O ATOM 467 CB PHE A 33 -16.113 -7.991 -11.456 1.00 0.00 C ATOM 468 CG PHE A 33 -14.869 -7.776 -10.643 1.00 0.00 C ATOM 469 CD1 PHE A 33 -14.763 -6.689 -9.790 1.00 0.00 C ATOM 470 CD2 PHE A 33 -13.806 -8.660 -10.731 1.00 0.00 C ATOM 471 CE1 PHE A 33 -13.620 -6.488 -9.040 1.00 0.00 C ATOM 472 CE2 PHE A 33 -12.661 -8.464 -9.983 1.00 0.00 C ATOM 473 CZ PHE A 33 -12.567 -7.376 -9.137 1.00 0.00 C ATOM 0 H PHE A 33 -17.359 -5.964 -10.666 1.00 0.00 H new ATOM 0 HA PHE A 33 -18.209 -8.415 -11.240 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -16.011 -8.916 -12.023 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -16.208 -7.182 -12.180 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -15.583 -5.991 -9.711 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -13.873 -9.512 -11.392 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -13.550 -5.637 -8.379 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -11.840 -9.161 -10.060 1.00 0.00 H new ATOM 0 HZ PHE A 33 -11.672 -7.220 -8.553 1.00 0.00 H new ATOM 483 N SER A 34 -17.852 -10.194 -9.558 1.00 0.00 N ATOM 484 CA SER A 34 -17.758 -11.215 -8.521 1.00 0.00 C ATOM 485 C SER A 34 -16.756 -12.297 -8.913 1.00 0.00 C ATOM 486 O SER A 34 -17.101 -13.262 -9.593 1.00 0.00 O ATOM 487 CB SER A 34 -19.130 -11.843 -8.269 1.00 0.00 C ATOM 488 OG SER A 34 -19.981 -10.947 -7.574 1.00 0.00 O ATOM 0 H SER A 34 -18.452 -10.444 -10.344 1.00 0.00 H new ATOM 0 HA SER A 34 -17.411 -10.737 -7.605 1.00 0.00 H new ATOM 0 HB2 SER A 34 -19.587 -12.120 -9.219 1.00 0.00 H new ATOM 0 HB3 SER A 34 -19.013 -12.760 -7.692 1.00 0.00 H new ATOM 0 HG SER A 34 -20.852 -11.371 -7.427 1.00 0.00 H new ATOM 494 N GLY A 35 -15.511 -12.127 -8.479 1.00 0.00 N ATOM 495 CA GLY A 35 -14.476 -13.095 -8.793 1.00 0.00 C ATOM 496 C GLY A 35 -14.622 -14.377 -7.998 1.00 0.00 C ATOM 497 O GLY A 35 -15.706 -14.722 -7.529 1.00 0.00 O ATOM 0 H GLY A 35 -15.200 -11.336 -7.915 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -14.509 -13.326 -9.858 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -13.499 -12.656 -8.592 1.00 0.00 H new ATOM 501 N PRO A 36 -13.508 -15.108 -7.839 1.00 0.00 N ATOM 502 CA PRO A 36 -13.491 -16.372 -7.096 1.00 0.00 C ATOM 503 C PRO A 36 -13.688 -16.167 -5.598 1.00 0.00 C ATOM 504 O PRO A 36 -13.649 -17.121 -4.821 1.00 0.00 O ATOM 505 CB PRO A 36 -12.095 -16.931 -7.380 1.00 0.00 C ATOM 506 CG PRO A 36 -11.263 -15.735 -7.689 1.00 0.00 C ATOM 507 CD PRO A 36 -12.181 -14.758 -8.371 1.00 0.00 C ATOM 0 HA PRO A 36 -14.301 -17.035 -7.401 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -11.704 -17.474 -6.520 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -12.111 -17.629 -8.217 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -10.843 -15.306 -6.779 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -10.425 -15.999 -8.334 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -11.914 -13.727 -8.139 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -12.143 -14.861 -9.455 1.00 0.00 H new ATOM 515 N SER A 37 -13.901 -14.917 -5.199 1.00 0.00 N ATOM 516 CA SER A 37 -14.101 -14.587 -3.793 1.00 0.00 C ATOM 517 C SER A 37 -14.838 -15.710 -3.071 1.00 0.00 C ATOM 518 O SER A 37 -14.414 -16.161 -2.007 1.00 0.00 O ATOM 519 CB SER A 37 -14.885 -13.280 -3.661 1.00 0.00 C ATOM 520 OG SER A 37 -14.210 -12.213 -4.305 1.00 0.00 O ATOM 0 H SER A 37 -13.939 -14.116 -5.830 1.00 0.00 H new ATOM 0 HA SER A 37 -13.121 -14.463 -3.331 1.00 0.00 H new ATOM 0 HB2 SER A 37 -15.877 -13.402 -4.096 1.00 0.00 H new ATOM 0 HB3 SER A 37 -15.026 -13.042 -2.607 1.00 0.00 H new ATOM 0 HG SER A 37 -14.732 -11.389 -4.208 1.00 0.00 H new ATOM 526 N SER A 38 -15.943 -16.158 -3.658 1.00 0.00 N ATOM 527 CA SER A 38 -16.742 -17.226 -3.069 1.00 0.00 C ATOM 528 C SER A 38 -16.729 -17.138 -1.546 1.00 0.00 C ATOM 529 O SER A 38 -16.450 -18.120 -0.859 1.00 0.00 O ATOM 530 CB SER A 38 -16.216 -18.591 -3.517 1.00 0.00 C ATOM 531 OG SER A 38 -14.893 -18.804 -3.057 1.00 0.00 O ATOM 0 H SER A 38 -16.305 -15.798 -4.541 1.00 0.00 H new ATOM 0 HA SER A 38 -17.770 -17.110 -3.413 1.00 0.00 H new ATOM 0 HB2 SER A 38 -16.868 -19.378 -3.137 1.00 0.00 H new ATOM 0 HB3 SER A 38 -16.241 -18.655 -4.605 1.00 0.00 H new ATOM 0 HG SER A 38 -14.263 -18.341 -3.648 1.00 0.00 H new ATOM 537 N GLY A 39 -17.034 -15.954 -1.025 1.00 0.00 N ATOM 538 CA GLY A 39 -17.051 -15.758 0.413 1.00 0.00 C ATOM 539 C GLY A 39 -18.457 -15.621 0.962 1.00 0.00 C ATOM 540 O GLY A 39 -18.808 -16.262 1.954 1.00 0.00 O ATOM 0 H GLY A 39 -17.270 -15.127 -1.573 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -16.555 -16.599 0.897 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -16.478 -14.865 0.662 1.00 0.00 H new ATOM 544 N ILE A 40 -19.264 -14.785 0.318 1.00 0.00 N ATOM 545 CA ILE A 40 -20.639 -14.566 0.749 1.00 0.00 C ATOM 546 C ILE A 40 -21.628 -14.993 -0.331 1.00 0.00 C ATOM 547 O ILE A 40 -22.720 -14.436 -0.440 1.00 0.00 O ATOM 548 CB ILE A 40 -20.890 -13.089 1.104 1.00 0.00 C ATOM 549 CG1 ILE A 40 -20.677 -12.203 -0.125 1.00 0.00 C ATOM 550 CG2 ILE A 40 -19.977 -12.655 2.242 1.00 0.00 C ATOM 551 CD1 ILE A 40 -21.924 -12.017 -0.960 1.00 0.00 C ATOM 0 H ILE A 40 -18.989 -14.248 -0.504 1.00 0.00 H new ATOM 0 HA ILE A 40 -20.791 -15.176 1.640 1.00 0.00 H new ATOM 0 HB ILE A 40 -21.924 -12.980 1.432 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -20.318 -11.226 0.199 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -19.895 -12.640 -0.747 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -20.166 -11.609 2.481 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -20.173 -13.270 3.121 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -18.937 -12.776 1.940 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -21.698 -11.378 -1.814 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -22.272 -12.987 -1.315 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -22.701 -11.552 -0.354 1.00 0.00 H new ATOM 563 N GLU A 41 -21.237 -15.986 -1.124 1.00 0.00 N ATOM 564 CA GLU A 41 -22.091 -16.488 -2.195 1.00 0.00 C ATOM 565 C GLU A 41 -23.409 -17.016 -1.637 1.00 0.00 C ATOM 566 O GLU A 41 -23.539 -17.248 -0.436 1.00 0.00 O ATOM 567 CB GLU A 41 -21.374 -17.593 -2.972 1.00 0.00 C ATOM 568 CG GLU A 41 -21.800 -17.688 -4.428 1.00 0.00 C ATOM 569 CD GLU A 41 -23.005 -18.586 -4.626 1.00 0.00 C ATOM 570 OE1 GLU A 41 -23.179 -19.529 -3.826 1.00 0.00 O ATOM 571 OE2 GLU A 41 -23.773 -18.347 -5.581 1.00 0.00 O ATOM 0 H GLU A 41 -20.336 -16.458 -1.045 1.00 0.00 H new ATOM 0 HA GLU A 41 -22.308 -15.661 -2.871 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -20.299 -17.418 -2.927 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -21.562 -18.549 -2.484 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -22.030 -16.690 -4.801 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -20.968 -18.066 -5.022 1.00 0.00 H new ATOM 578 N GLY A 42 -24.386 -17.204 -2.520 1.00 0.00 N ATOM 579 CA GLY A 42 -25.682 -17.702 -2.098 1.00 0.00 C ATOM 580 C GLY A 42 -25.577 -18.704 -0.965 1.00 0.00 C ATOM 581 O GLY A 42 -25.166 -19.846 -1.174 1.00 0.00 O ATOM 0 H GLY A 42 -24.303 -17.020 -3.520 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -26.304 -16.865 -1.782 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -26.182 -18.169 -2.946 1.00 0.00 H new ATOM 585 N ARG A 43 -25.947 -18.277 0.237 1.00 0.00 N ATOM 586 CA ARG A 43 -25.889 -19.144 1.408 1.00 0.00 C ATOM 587 C ARG A 43 -26.163 -20.595 1.023 1.00 0.00 C ATOM 588 O ARG A 43 -27.220 -20.915 0.481 1.00 0.00 O ATOM 589 CB ARG A 43 -26.900 -18.685 2.460 1.00 0.00 C ATOM 590 CG ARG A 43 -26.709 -17.242 2.899 1.00 0.00 C ATOM 591 CD ARG A 43 -27.622 -16.300 2.129 1.00 0.00 C ATOM 592 NE ARG A 43 -27.015 -14.986 1.937 1.00 0.00 N ATOM 593 CZ ARG A 43 -27.672 -13.936 1.456 1.00 0.00 C ATOM 594 NH1 ARG A 43 -28.950 -14.047 1.121 1.00 0.00 N ATOM 595 NH2 ARG A 43 -27.050 -12.773 1.310 1.00 0.00 N ATOM 0 H ARG A 43 -26.290 -17.335 0.426 1.00 0.00 H new ATOM 0 HA ARG A 43 -24.885 -19.080 1.827 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -27.907 -18.804 2.060 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -26.824 -19.334 3.332 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -26.912 -17.155 3.966 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -25.670 -16.949 2.747 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -27.857 -16.736 1.158 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -28.564 -16.189 2.665 1.00 0.00 H new ATOM 0 HE ARG A 43 -26.033 -14.868 2.186 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -29.431 -14.940 1.232 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -29.452 -13.240 0.752 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -26.067 -12.685 1.567 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -27.555 -11.967 0.941 1.00 0.00 H new ATOM 609 N GLY A 44 -25.202 -21.469 1.307 1.00 0.00 N ATOM 610 CA GLY A 44 -25.358 -22.875 0.983 1.00 0.00 C ATOM 611 C GLY A 44 -24.029 -23.578 0.794 1.00 0.00 C ATOM 612 O GLY A 44 -23.882 -24.414 -0.098 1.00 0.00 O ATOM 0 H GLY A 44 -24.318 -21.228 1.756 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -25.916 -23.368 1.779 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -25.949 -22.971 0.072 1.00 0.00 H new ATOM 616 N SER A 45 -23.057 -23.238 1.634 1.00 0.00 N ATOM 617 CA SER A 45 -21.730 -23.838 1.552 1.00 0.00 C ATOM 618 C SER A 45 -21.327 -24.068 0.099 1.00 0.00 C ATOM 619 O SER A 45 -20.720 -25.086 -0.235 1.00 0.00 O ATOM 620 CB SER A 45 -21.698 -25.163 2.318 1.00 0.00 C ATOM 621 OG SER A 45 -21.511 -24.945 3.705 1.00 0.00 O ATOM 0 H SER A 45 -23.163 -22.550 2.380 1.00 0.00 H new ATOM 0 HA SER A 45 -21.017 -23.148 2.004 1.00 0.00 H new ATOM 0 HB2 SER A 45 -22.630 -25.704 2.154 1.00 0.00 H new ATOM 0 HB3 SER A 45 -20.893 -25.790 1.933 1.00 0.00 H new ATOM 0 HG SER A 45 -21.496 -25.806 4.172 1.00 0.00 H new ATOM 627 N SER A 46 -21.669 -23.115 -0.762 1.00 0.00 N ATOM 628 CA SER A 46 -21.347 -23.214 -2.180 1.00 0.00 C ATOM 629 C SER A 46 -20.030 -22.509 -2.489 1.00 0.00 C ATOM 630 O SER A 46 -19.474 -21.810 -1.643 1.00 0.00 O ATOM 631 CB SER A 46 -22.472 -22.609 -3.024 1.00 0.00 C ATOM 632 OG SER A 46 -23.661 -23.372 -2.910 1.00 0.00 O ATOM 0 H SER A 46 -22.169 -22.265 -0.502 1.00 0.00 H new ATOM 0 HA SER A 46 -21.242 -24.270 -2.430 1.00 0.00 H new ATOM 0 HB2 SER A 46 -22.661 -21.585 -2.703 1.00 0.00 H new ATOM 0 HB3 SER A 46 -22.164 -22.564 -4.068 1.00 0.00 H new ATOM 0 HG SER A 46 -23.758 -23.691 -1.989 1.00 0.00 H new ATOM 638 N GLY A 47 -19.535 -22.699 -3.708 1.00 0.00 N ATOM 639 CA GLY A 47 -18.287 -22.076 -4.108 1.00 0.00 C ATOM 640 C GLY A 47 -17.521 -22.908 -5.118 1.00 0.00 C ATOM 641 O GLY A 47 -16.675 -23.722 -4.747 1.00 0.00 O ATOM 0 H GLY A 47 -19.976 -23.274 -4.426 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -18.495 -21.094 -4.533 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -17.665 -21.917 -3.227 1.00 0.00 H new ATOM 645 N SER A 48 -17.819 -22.705 -6.397 1.00 0.00 N ATOM 646 CA SER A 48 -17.156 -23.447 -7.463 1.00 0.00 C ATOM 647 C SER A 48 -16.303 -22.519 -8.322 1.00 0.00 C ATOM 648 O SER A 48 -16.601 -21.332 -8.457 1.00 0.00 O ATOM 649 CB SER A 48 -18.190 -24.161 -8.336 1.00 0.00 C ATOM 650 OG SER A 48 -17.585 -25.179 -9.115 1.00 0.00 O ATOM 0 H SER A 48 -18.515 -22.033 -6.720 1.00 0.00 H new ATOM 0 HA SER A 48 -16.504 -24.190 -7.003 1.00 0.00 H new ATOM 0 HB2 SER A 48 -18.966 -24.594 -7.705 1.00 0.00 H new ATOM 0 HB3 SER A 48 -18.678 -23.439 -8.991 1.00 0.00 H new ATOM 0 HG SER A 48 -18.267 -25.621 -9.662 1.00 0.00 H new ATOM 656 N SER A 49 -15.240 -23.069 -8.901 1.00 0.00 N ATOM 657 CA SER A 49 -14.340 -22.290 -9.744 1.00 0.00 C ATOM 658 C SER A 49 -15.061 -21.792 -10.993 1.00 0.00 C ATOM 659 O SER A 49 -15.799 -22.537 -11.636 1.00 0.00 O ATOM 660 CB SER A 49 -13.126 -23.131 -10.143 1.00 0.00 C ATOM 661 OG SER A 49 -13.520 -24.287 -10.861 1.00 0.00 O ATOM 0 H SER A 49 -14.981 -24.051 -8.802 1.00 0.00 H new ATOM 0 HA SER A 49 -14.002 -21.426 -9.172 1.00 0.00 H new ATOM 0 HB2 SER A 49 -12.450 -22.533 -10.754 1.00 0.00 H new ATOM 0 HB3 SER A 49 -12.574 -23.424 -9.250 1.00 0.00 H new ATOM 0 HG SER A 49 -12.726 -24.806 -11.106 1.00 0.00 H new ATOM 667 N GLY A 50 -14.841 -20.525 -11.330 1.00 0.00 N ATOM 668 CA GLY A 50 -15.476 -19.947 -12.500 1.00 0.00 C ATOM 669 C GLY A 50 -14.801 -20.364 -13.791 1.00 0.00 C ATOM 670 O GLY A 50 -14.137 -21.399 -13.846 1.00 0.00 O ATOM 0 H GLY A 50 -14.234 -19.888 -10.814 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -16.523 -20.248 -12.527 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -15.459 -18.860 -12.419 1.00 0.00 H new ATOM 674 N SER A 51 -14.971 -19.557 -14.834 1.00 0.00 N ATOM 675 CA SER A 51 -14.377 -19.851 -16.133 1.00 0.00 C ATOM 676 C SER A 51 -12.979 -19.248 -16.239 1.00 0.00 C ATOM 677 O SER A 51 -12.611 -18.366 -15.464 1.00 0.00 O ATOM 678 CB SER A 51 -15.264 -19.311 -17.256 1.00 0.00 C ATOM 679 OG SER A 51 -16.591 -19.794 -17.135 1.00 0.00 O ATOM 0 H SER A 51 -15.515 -18.695 -14.805 1.00 0.00 H new ATOM 0 HA SER A 51 -14.296 -20.933 -16.232 1.00 0.00 H new ATOM 0 HB2 SER A 51 -15.266 -18.221 -17.230 1.00 0.00 H new ATOM 0 HB3 SER A 51 -14.853 -19.605 -18.222 1.00 0.00 H new ATOM 0 HG SER A 51 -17.138 -19.433 -17.863 1.00 0.00 H new ATOM 685 N SER A 52 -12.206 -19.732 -17.205 1.00 0.00 N ATOM 686 CA SER A 52 -10.847 -19.246 -17.412 1.00 0.00 C ATOM 687 C SER A 52 -10.857 -17.853 -18.036 1.00 0.00 C ATOM 688 O SER A 52 -11.169 -17.691 -19.215 1.00 0.00 O ATOM 689 CB SER A 52 -10.067 -20.211 -18.307 1.00 0.00 C ATOM 690 OG SER A 52 -8.816 -19.662 -18.682 1.00 0.00 O ATOM 0 H SER A 52 -12.497 -20.460 -17.857 1.00 0.00 H new ATOM 0 HA SER A 52 -10.358 -19.187 -16.440 1.00 0.00 H new ATOM 0 HB2 SER A 52 -9.911 -21.153 -17.782 1.00 0.00 H new ATOM 0 HB3 SER A 52 -10.651 -20.436 -19.199 1.00 0.00 H new ATOM 0 HG SER A 52 -8.337 -20.299 -19.252 1.00 0.00 H new ATOM 696 N GLY A 53 -10.514 -16.850 -17.233 1.00 0.00 N ATOM 697 CA GLY A 53 -10.490 -15.484 -17.722 1.00 0.00 C ATOM 698 C GLY A 53 -9.168 -14.794 -17.451 1.00 0.00 C ATOM 699 O GLY A 53 -8.470 -14.388 -18.380 1.00 0.00 O ATOM 0 H GLY A 53 -10.253 -16.959 -16.253 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -10.684 -15.482 -18.795 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -11.294 -14.919 -17.251 1.00 0.00 H new ATOM 703 N SER A 54 -8.825 -14.658 -16.174 1.00 0.00 N ATOM 704 CA SER A 54 -7.580 -14.006 -15.783 1.00 0.00 C ATOM 705 C SER A 54 -6.374 -14.797 -16.280 1.00 0.00 C ATOM 706 O SER A 54 -5.912 -15.728 -15.620 1.00 0.00 O ATOM 707 CB SER A 54 -7.514 -13.857 -14.262 1.00 0.00 C ATOM 708 OG SER A 54 -6.205 -13.517 -13.839 1.00 0.00 O ATOM 0 H SER A 54 -9.391 -14.990 -15.393 1.00 0.00 H new ATOM 0 HA SER A 54 -7.557 -13.016 -16.240 1.00 0.00 H new ATOM 0 HB2 SER A 54 -8.215 -13.088 -13.938 1.00 0.00 H new ATOM 0 HB3 SER A 54 -7.822 -14.789 -13.788 1.00 0.00 H new ATOM 0 HG SER A 54 -6.190 -13.426 -12.863 1.00 0.00 H new ATOM 714 N SER A 55 -5.867 -14.419 -17.449 1.00 0.00 N ATOM 715 CA SER A 55 -4.717 -15.094 -18.039 1.00 0.00 C ATOM 716 C SER A 55 -3.504 -15.003 -17.118 1.00 0.00 C ATOM 717 O SER A 55 -2.889 -16.015 -16.781 1.00 0.00 O ATOM 718 CB SER A 55 -4.383 -14.483 -19.401 1.00 0.00 C ATOM 719 OG SER A 55 -5.402 -14.758 -20.346 1.00 0.00 O ATOM 0 H SER A 55 -6.235 -13.648 -18.007 1.00 0.00 H new ATOM 0 HA SER A 55 -4.973 -16.145 -18.173 1.00 0.00 H new ATOM 0 HB2 SER A 55 -4.258 -13.405 -19.299 1.00 0.00 H new ATOM 0 HB3 SER A 55 -3.434 -14.881 -19.759 1.00 0.00 H new ATOM 0 HG SER A 55 -5.166 -14.356 -21.208 1.00 0.00 H new ATOM 725 N GLY A 56 -3.165 -13.783 -16.713 1.00 0.00 N ATOM 726 CA GLY A 56 -2.027 -13.582 -15.835 1.00 0.00 C ATOM 727 C GLY A 56 -0.891 -14.541 -16.130 1.00 0.00 C ATOM 728 O GLY A 56 -0.745 -15.565 -15.462 1.00 0.00 O ATOM 0 H GLY A 56 -3.658 -12.930 -16.977 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -1.669 -12.557 -15.938 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -2.344 -13.707 -14.800 1.00 0.00 H new ATOM 732 N ASP A 57 -0.085 -14.211 -17.133 1.00 0.00 N ATOM 733 CA ASP A 57 1.044 -15.051 -17.515 1.00 0.00 C ATOM 734 C ASP A 57 2.231 -14.823 -16.584 1.00 0.00 C ATOM 735 O ASP A 57 2.786 -15.769 -16.025 1.00 0.00 O ATOM 736 CB ASP A 57 1.453 -14.766 -18.961 1.00 0.00 C ATOM 737 CG ASP A 57 0.711 -15.638 -19.955 1.00 0.00 C ATOM 738 OD1 ASP A 57 -0.536 -15.573 -19.985 1.00 0.00 O ATOM 739 OD2 ASP A 57 1.376 -16.386 -20.701 1.00 0.00 O ATOM 0 H ASP A 57 -0.193 -13.368 -17.696 1.00 0.00 H new ATOM 0 HA ASP A 57 0.734 -16.093 -17.431 1.00 0.00 H new ATOM 0 HB2 ASP A 57 1.263 -13.717 -19.189 1.00 0.00 H new ATOM 0 HB3 ASP A 57 2.525 -14.927 -19.071 1.00 0.00 H new ATOM 744 N LYS A 58 2.616 -13.562 -16.422 1.00 0.00 N ATOM 745 CA LYS A 58 3.737 -13.208 -15.559 1.00 0.00 C ATOM 746 C LYS A 58 3.312 -12.188 -14.507 1.00 0.00 C ATOM 747 O LYS A 58 3.569 -10.993 -14.650 1.00 0.00 O ATOM 748 CB LYS A 58 4.892 -12.647 -16.392 1.00 0.00 C ATOM 749 CG LYS A 58 4.455 -11.623 -17.425 1.00 0.00 C ATOM 750 CD LYS A 58 4.062 -12.284 -18.735 1.00 0.00 C ATOM 751 CE LYS A 58 5.276 -12.548 -19.612 1.00 0.00 C ATOM 752 NZ LYS A 58 5.947 -11.285 -20.026 1.00 0.00 N ATOM 0 H LYS A 58 2.168 -12.767 -16.878 1.00 0.00 H new ATOM 0 HA LYS A 58 4.071 -14.112 -15.050 1.00 0.00 H new ATOM 0 HB2 LYS A 58 5.621 -12.189 -15.724 1.00 0.00 H new ATOM 0 HB3 LYS A 58 5.397 -13.470 -16.899 1.00 0.00 H new ATOM 0 HG2 LYS A 58 3.612 -11.051 -17.038 1.00 0.00 H new ATOM 0 HG3 LYS A 58 5.265 -10.915 -17.602 1.00 0.00 H new ATOM 0 HD2 LYS A 58 3.549 -13.223 -18.530 1.00 0.00 H new ATOM 0 HD3 LYS A 58 3.358 -11.646 -19.269 1.00 0.00 H new ATOM 0 HE2 LYS A 58 5.985 -13.175 -19.071 1.00 0.00 H new ATOM 0 HE3 LYS A 58 4.970 -13.104 -20.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 6.481 -11.447 -20.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 5.231 -10.548 -20.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 6.599 -10.976 -19.277 1.00 0.00 H new ATOM 766 N GLU A 59 2.663 -12.668 -13.451 1.00 0.00 N ATOM 767 CA GLU A 59 2.205 -11.796 -12.376 1.00 0.00 C ATOM 768 C GLU A 59 3.269 -10.761 -12.023 1.00 0.00 C ATOM 769 O GLU A 59 4.459 -10.973 -12.260 1.00 0.00 O ATOM 770 CB GLU A 59 1.850 -12.621 -11.137 1.00 0.00 C ATOM 771 CG GLU A 59 0.523 -13.353 -11.252 1.00 0.00 C ATOM 772 CD GLU A 59 0.336 -14.396 -10.168 1.00 0.00 C ATOM 773 OE1 GLU A 59 1.064 -15.410 -10.188 1.00 0.00 O ATOM 774 OE2 GLU A 59 -0.539 -14.197 -9.299 1.00 0.00 O ATOM 0 H GLU A 59 2.443 -13.655 -13.317 1.00 0.00 H new ATOM 0 HA GLU A 59 1.315 -11.272 -12.723 1.00 0.00 H new ATOM 0 HB2 GLU A 59 2.642 -13.348 -10.956 1.00 0.00 H new ATOM 0 HB3 GLU A 59 1.818 -11.962 -10.269 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -0.292 -12.631 -11.200 1.00 0.00 H new ATOM 0 HG3 GLU A 59 0.461 -13.834 -12.228 1.00 0.00 H new ATOM 781 N ARG A 60 2.832 -9.641 -11.458 1.00 0.00 N ATOM 782 CA ARG A 60 3.746 -8.572 -11.074 1.00 0.00 C ATOM 783 C ARG A 60 4.097 -8.662 -9.592 1.00 0.00 C ATOM 784 O ARG A 60 3.234 -8.923 -8.753 1.00 0.00 O ATOM 785 CB ARG A 60 3.125 -7.207 -11.380 1.00 0.00 C ATOM 786 CG ARG A 60 4.149 -6.132 -11.707 1.00 0.00 C ATOM 787 CD ARG A 60 3.483 -4.873 -12.239 1.00 0.00 C ATOM 788 NE ARG A 60 3.057 -5.024 -13.628 1.00 0.00 N ATOM 789 CZ ARG A 60 2.760 -4.000 -14.421 1.00 0.00 C ATOM 790 NH1 ARG A 60 2.843 -2.758 -13.965 1.00 0.00 N ATOM 791 NH2 ARG A 60 2.380 -4.218 -15.673 1.00 0.00 N ATOM 0 H ARG A 60 1.851 -9.450 -11.256 1.00 0.00 H new ATOM 0 HA ARG A 60 4.662 -8.686 -11.654 1.00 0.00 H new ATOM 0 HB2 ARG A 60 2.438 -7.310 -12.220 1.00 0.00 H new ATOM 0 HB3 ARG A 60 2.534 -6.885 -10.522 1.00 0.00 H new ATOM 0 HG2 ARG A 60 4.724 -5.891 -10.813 1.00 0.00 H new ATOM 0 HG3 ARG A 60 4.854 -6.512 -12.446 1.00 0.00 H new ATOM 0 HD2 ARG A 60 2.620 -4.630 -11.619 1.00 0.00 H new ATOM 0 HD3 ARG A 60 4.177 -4.036 -12.162 1.00 0.00 H new ATOM 0 HE ARG A 60 2.984 -5.967 -14.010 1.00 0.00 H new ATOM 0 HH11 ARG A 60 3.136 -2.586 -13.003 1.00 0.00 H new ATOM 0 HH12 ARG A 60 2.614 -1.974 -14.576 1.00 0.00 H new ATOM 0 HH21 ARG A 60 2.316 -5.172 -16.028 1.00 0.00 H new ATOM 0 HH22 ARG A 60 2.152 -3.431 -16.281 1.00 0.00 H new ATOM 805 N HIS A 61 5.370 -8.445 -9.276 1.00 0.00 N ATOM 806 CA HIS A 61 5.836 -8.502 -7.895 1.00 0.00 C ATOM 807 C HIS A 61 5.754 -7.128 -7.237 1.00 0.00 C ATOM 808 O HIS A 61 6.363 -6.167 -7.706 1.00 0.00 O ATOM 809 CB HIS A 61 7.273 -9.023 -7.840 1.00 0.00 C ATOM 810 CG HIS A 61 7.575 -9.817 -6.608 1.00 0.00 C ATOM 811 ND1 HIS A 61 8.663 -9.566 -5.798 1.00 0.00 N ATOM 812 CD2 HIS A 61 6.924 -10.863 -6.046 1.00 0.00 C ATOM 813 CE1 HIS A 61 8.668 -10.424 -4.793 1.00 0.00 C ATOM 814 NE2 HIS A 61 7.623 -11.221 -4.920 1.00 0.00 N ATOM 0 H HIS A 61 6.097 -8.228 -9.958 1.00 0.00 H new ATOM 0 HA HIS A 61 5.189 -9.187 -7.347 1.00 0.00 H new ATOM 0 HB2 HIS A 61 7.460 -9.643 -8.717 1.00 0.00 H new ATOM 0 HB3 HIS A 61 7.959 -8.178 -7.895 1.00 0.00 H new ATOM 0 HD2 HIS A 61 6.022 -11.329 -6.415 1.00 0.00 H new ATOM 0 HE1 HIS A 61 9.402 -10.466 -4.002 1.00 0.00 H new ATOM 0 HE2 HIS A 61 7.375 -11.980 -4.285 1.00 0.00 H new ATOM 823 N GLY A 62 4.996 -7.043 -6.148 1.00 0.00 N ATOM 824 CA GLY A 62 4.848 -5.782 -5.444 1.00 0.00 C ATOM 825 C GLY A 62 5.195 -5.895 -3.973 1.00 0.00 C ATOM 826 O GLY A 62 5.163 -6.986 -3.402 1.00 0.00 O ATOM 0 H GLY A 62 4.482 -7.824 -5.741 1.00 0.00 H new ATOM 0 HA2 GLY A 62 5.489 -5.033 -5.909 1.00 0.00 H new ATOM 0 HA3 GLY A 62 3.821 -5.431 -5.546 1.00 0.00 H new ATOM 830 N VAL A 63 5.528 -4.766 -3.357 1.00 0.00 N ATOM 831 CA VAL A 63 5.883 -4.743 -1.943 1.00 0.00 C ATOM 832 C VAL A 63 5.294 -3.520 -1.248 1.00 0.00 C ATOM 833 O VAL A 63 5.475 -2.390 -1.700 1.00 0.00 O ATOM 834 CB VAL A 63 7.411 -4.744 -1.747 1.00 0.00 C ATOM 835 CG1 VAL A 63 7.772 -4.236 -0.360 1.00 0.00 C ATOM 836 CG2 VAL A 63 7.976 -6.137 -1.978 1.00 0.00 C ATOM 0 H VAL A 63 5.559 -3.855 -3.815 1.00 0.00 H new ATOM 0 HA VAL A 63 5.466 -5.647 -1.498 1.00 0.00 H new ATOM 0 HB VAL A 63 7.855 -4.071 -2.480 1.00 0.00 H new ATOM 0 HG11 VAL A 63 8.855 -4.244 -0.240 1.00 0.00 H new ATOM 0 HG12 VAL A 63 7.401 -3.219 -0.237 1.00 0.00 H new ATOM 0 HG13 VAL A 63 7.319 -4.881 0.393 1.00 0.00 H new ATOM 0 HG21 VAL A 63 9.057 -6.120 -1.835 1.00 0.00 H new ATOM 0 HG22 VAL A 63 7.528 -6.834 -1.270 1.00 0.00 H new ATOM 0 HG23 VAL A 63 7.749 -6.458 -2.995 1.00 0.00 H new ATOM 846 N ALA A 64 4.588 -3.755 -0.147 1.00 0.00 N ATOM 847 CA ALA A 64 3.973 -2.673 0.612 1.00 0.00 C ATOM 848 C ALA A 64 5.032 -1.761 1.223 1.00 0.00 C ATOM 849 O ALA A 64 6.017 -2.233 1.792 1.00 0.00 O ATOM 850 CB ALA A 64 3.069 -3.237 1.698 1.00 0.00 C ATOM 0 H ALA A 64 4.428 -4.685 0.239 1.00 0.00 H new ATOM 0 HA ALA A 64 3.370 -2.078 -0.074 1.00 0.00 H new ATOM 0 HB1 ALA A 64 2.617 -2.418 2.257 1.00 0.00 H new ATOM 0 HB2 ALA A 64 2.285 -3.841 1.241 1.00 0.00 H new ATOM 0 HB3 ALA A 64 3.657 -3.857 2.375 1.00 0.00 H new ATOM 856 N ILE A 65 4.823 -0.455 1.102 1.00 0.00 N ATOM 857 CA ILE A 65 5.759 0.522 1.643 1.00 0.00 C ATOM 858 C ILE A 65 5.138 1.298 2.799 1.00 0.00 C ATOM 859 O ILE A 65 5.839 1.757 3.701 1.00 0.00 O ATOM 860 CB ILE A 65 6.223 1.517 0.562 1.00 0.00 C ATOM 861 CG1 ILE A 65 5.015 2.186 -0.097 1.00 0.00 C ATOM 862 CG2 ILE A 65 7.076 0.808 -0.479 1.00 0.00 C ATOM 863 CD1 ILE A 65 5.388 3.186 -1.169 1.00 0.00 C ATOM 0 H ILE A 65 4.013 -0.049 0.634 1.00 0.00 H new ATOM 0 HA ILE A 65 6.622 -0.036 2.006 1.00 0.00 H new ATOM 0 HB ILE A 65 6.830 2.289 1.035 1.00 0.00 H new ATOM 0 HG12 ILE A 65 4.378 1.417 -0.534 1.00 0.00 H new ATOM 0 HG13 ILE A 65 4.426 2.690 0.669 1.00 0.00 H new ATOM 0 HG21 ILE A 65 7.396 1.524 -1.236 1.00 0.00 H new ATOM 0 HG22 ILE A 65 7.952 0.373 0.003 1.00 0.00 H new ATOM 0 HG23 ILE A 65 6.492 0.018 -0.951 1.00 0.00 H new ATOM 0 HD11 ILE A 65 4.482 3.621 -1.592 1.00 0.00 H new ATOM 0 HD12 ILE A 65 6.000 3.976 -0.733 1.00 0.00 H new ATOM 0 HD13 ILE A 65 5.951 2.683 -1.955 1.00 0.00 H new ATOM 875 N TYR A 66 3.817 1.439 2.767 1.00 0.00 N ATOM 876 CA TYR A 66 3.100 2.160 3.812 1.00 0.00 C ATOM 877 C TYR A 66 2.083 1.254 4.499 1.00 0.00 C ATOM 878 O TYR A 66 1.299 0.572 3.841 1.00 0.00 O ATOM 879 CB TYR A 66 2.395 3.384 3.225 1.00 0.00 C ATOM 880 CG TYR A 66 3.346 4.450 2.730 1.00 0.00 C ATOM 881 CD1 TYR A 66 4.293 5.012 3.577 1.00 0.00 C ATOM 882 CD2 TYR A 66 3.297 4.896 1.414 1.00 0.00 C ATOM 883 CE1 TYR A 66 5.163 5.988 3.129 1.00 0.00 C ATOM 884 CE2 TYR A 66 4.164 5.869 0.957 1.00 0.00 C ATOM 885 CZ TYR A 66 5.095 6.412 1.818 1.00 0.00 C ATOM 886 OH TYR A 66 5.960 7.383 1.367 1.00 0.00 O ATOM 0 H TYR A 66 3.221 1.064 2.029 1.00 0.00 H new ATOM 0 HA TYR A 66 3.827 2.489 4.555 1.00 0.00 H new ATOM 0 HB2 TYR A 66 1.758 3.065 2.400 1.00 0.00 H new ATOM 0 HB3 TYR A 66 1.742 3.815 3.984 1.00 0.00 H new ATOM 0 HD1 TYR A 66 4.350 4.680 4.603 1.00 0.00 H new ATOM 0 HD2 TYR A 66 2.568 4.474 0.738 1.00 0.00 H new ATOM 0 HE1 TYR A 66 5.892 6.416 3.801 1.00 0.00 H new ATOM 0 HE2 TYR A 66 4.113 6.203 -0.069 1.00 0.00 H new ATOM 0 HH TYR A 66 5.781 7.567 0.421 1.00 0.00 H new ATOM 896 N ASN A 67 2.102 1.254 5.828 1.00 0.00 N ATOM 897 CA ASN A 67 1.182 0.433 6.606 1.00 0.00 C ATOM 898 C ASN A 67 -0.266 0.807 6.307 1.00 0.00 C ATOM 899 O ASN A 67 -0.705 1.919 6.602 1.00 0.00 O ATOM 900 CB ASN A 67 1.463 0.592 8.102 1.00 0.00 C ATOM 901 CG ASN A 67 2.618 -0.273 8.568 1.00 0.00 C ATOM 902 OD1 ASN A 67 2.576 -1.554 8.220 1.00 0.00 O flip ATOM 903 ND2 ASN A 67 3.537 0.205 9.233 1.00 0.00 N flip ATOM 0 H ASN A 67 2.745 1.814 6.389 1.00 0.00 H new ATOM 0 HA ASN A 67 1.336 -0.608 6.323 1.00 0.00 H new ATOM 0 HB2 ASN A 67 1.685 1.637 8.318 1.00 0.00 H new ATOM 0 HB3 ASN A 67 0.567 0.333 8.667 1.00 0.00 H new ATOM 0 HD21 ASN A 67 3.528 1.195 9.477 1.00 0.00 H new ATOM 0 HD22 ASN A 67 4.307 -0.389 9.539 1.00 0.00 H new ATOM 910 N PHE A 68 -1.004 -0.130 5.720 1.00 0.00 N ATOM 911 CA PHE A 68 -2.404 0.101 5.381 1.00 0.00 C ATOM 912 C PHE A 68 -3.325 -0.704 6.294 1.00 0.00 C ATOM 913 O PHE A 68 -3.056 -1.867 6.593 1.00 0.00 O ATOM 914 CB PHE A 68 -2.664 -0.271 3.920 1.00 0.00 C ATOM 915 CG PHE A 68 -4.095 -0.089 3.500 1.00 0.00 C ATOM 916 CD1 PHE A 68 -4.636 1.179 3.370 1.00 0.00 C ATOM 917 CD2 PHE A 68 -4.898 -1.187 3.236 1.00 0.00 C ATOM 918 CE1 PHE A 68 -5.953 1.349 2.985 1.00 0.00 C ATOM 919 CE2 PHE A 68 -6.215 -1.023 2.850 1.00 0.00 C ATOM 920 CZ PHE A 68 -6.743 0.247 2.724 1.00 0.00 C ATOM 0 H PHE A 68 -0.656 -1.056 5.469 1.00 0.00 H new ATOM 0 HA PHE A 68 -2.617 1.161 5.523 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -2.026 0.337 3.279 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -2.377 -1.310 3.761 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -4.022 2.045 3.572 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -4.490 -2.182 3.333 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -6.364 2.343 2.888 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -6.830 -1.887 2.647 1.00 0.00 H new ATOM 0 HZ PHE A 68 -7.772 0.378 2.422 1.00 0.00 H new ATOM 930 N GLN A 69 -4.410 -0.074 6.732 1.00 0.00 N ATOM 931 CA GLN A 69 -5.370 -0.731 7.612 1.00 0.00 C ATOM 932 C GLN A 69 -6.767 -0.717 7.000 1.00 0.00 C ATOM 933 O GLN A 69 -7.352 0.343 6.787 1.00 0.00 O ATOM 934 CB GLN A 69 -5.393 -0.045 8.979 1.00 0.00 C ATOM 935 CG GLN A 69 -4.079 -0.153 9.735 1.00 0.00 C ATOM 936 CD GLN A 69 -3.881 0.978 10.726 1.00 0.00 C ATOM 937 OE1 GLN A 69 -4.840 1.630 11.141 1.00 0.00 O ATOM 938 NE2 GLN A 69 -2.633 1.216 11.111 1.00 0.00 N ATOM 0 H GLN A 69 -4.646 0.889 6.493 1.00 0.00 H new ATOM 0 HA GLN A 69 -5.058 -1.768 7.739 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -5.639 1.008 8.844 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -6.187 -0.483 9.583 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -4.046 -1.105 10.265 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -3.254 -0.156 9.023 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -1.869 0.651 10.741 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -2.438 1.964 11.776 1.00 0.00 H new ATOM 947 N GLY A 70 -7.296 -1.904 6.718 1.00 0.00 N ATOM 948 CA GLY A 70 -8.620 -2.007 6.132 1.00 0.00 C ATOM 949 C GLY A 70 -9.651 -2.518 7.118 1.00 0.00 C ATOM 950 O GLY A 70 -9.360 -2.682 8.302 1.00 0.00 O ATOM 0 H GLY A 70 -6.831 -2.796 6.885 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -8.928 -1.029 5.763 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -8.582 -2.675 5.271 1.00 0.00 H new ATOM 954 N SER A 71 -10.862 -2.769 6.628 1.00 0.00 N ATOM 955 CA SER A 71 -11.942 -3.259 7.476 1.00 0.00 C ATOM 956 C SER A 71 -12.440 -4.617 6.990 1.00 0.00 C ATOM 957 O SER A 71 -12.585 -5.554 7.774 1.00 0.00 O ATOM 958 CB SER A 71 -13.098 -2.257 7.495 1.00 0.00 C ATOM 959 OG SER A 71 -12.900 -1.270 8.492 1.00 0.00 O ATOM 0 H SER A 71 -11.119 -2.641 5.649 1.00 0.00 H new ATOM 0 HA SER A 71 -11.553 -3.374 8.488 1.00 0.00 H new ATOM 0 HB2 SER A 71 -13.186 -1.780 6.519 1.00 0.00 H new ATOM 0 HB3 SER A 71 -14.035 -2.782 7.679 1.00 0.00 H new ATOM 0 HG SER A 71 -13.651 -0.641 8.483 1.00 0.00 H new ATOM 965 N GLY A 72 -12.700 -4.715 5.690 1.00 0.00 N ATOM 966 CA GLY A 72 -13.179 -5.961 5.121 1.00 0.00 C ATOM 967 C GLY A 72 -13.321 -5.893 3.613 1.00 0.00 C ATOM 968 O GLY A 72 -13.521 -4.818 3.050 1.00 0.00 O ATOM 0 H GLY A 72 -12.587 -3.954 5.021 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -12.490 -6.765 5.382 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -14.143 -6.212 5.563 1.00 0.00 H new ATOM 972 N ALA A 73 -13.216 -7.045 2.958 1.00 0.00 N ATOM 973 CA ALA A 73 -13.334 -7.111 1.507 1.00 0.00 C ATOM 974 C ALA A 73 -14.402 -6.148 0.998 1.00 0.00 C ATOM 975 O ALA A 73 -15.341 -5.793 1.710 1.00 0.00 O ATOM 976 CB ALA A 73 -13.652 -8.533 1.068 1.00 0.00 C ATOM 0 H ALA A 73 -13.050 -7.944 3.409 1.00 0.00 H new ATOM 0 HA ALA A 73 -12.378 -6.813 1.076 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -13.737 -8.568 -0.018 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -12.853 -9.201 1.391 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -14.593 -8.850 1.516 1.00 0.00 H new ATOM 982 N PRO A 74 -14.256 -5.714 -0.262 1.00 0.00 N ATOM 983 CA PRO A 74 -13.142 -6.130 -1.119 1.00 0.00 C ATOM 984 C PRO A 74 -11.809 -5.547 -0.661 1.00 0.00 C ATOM 985 O PRO A 74 -10.761 -5.848 -1.232 1.00 0.00 O ATOM 986 CB PRO A 74 -13.524 -5.574 -2.493 1.00 0.00 C ATOM 987 CG PRO A 74 -14.417 -4.419 -2.199 1.00 0.00 C ATOM 988 CD PRO A 74 -15.168 -4.784 -0.949 1.00 0.00 C ATOM 0 HA PRO A 74 -13.000 -7.211 -1.106 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -12.642 -5.261 -3.052 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -14.034 -6.325 -3.096 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -13.839 -3.506 -2.055 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -15.102 -4.235 -3.026 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -15.382 -3.907 -0.338 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -16.124 -5.254 -1.178 1.00 0.00 H new ATOM 996 N GLN A 75 -11.858 -4.713 0.373 1.00 0.00 N ATOM 997 CA GLN A 75 -10.654 -4.088 0.907 1.00 0.00 C ATOM 998 C GLN A 75 -9.761 -5.121 1.589 1.00 0.00 C ATOM 999 O GLN A 75 -10.250 -6.060 2.219 1.00 0.00 O ATOM 1000 CB GLN A 75 -11.023 -2.983 1.897 1.00 0.00 C ATOM 1001 CG GLN A 75 -11.412 -1.673 1.230 1.00 0.00 C ATOM 1002 CD GLN A 75 -12.367 -0.851 2.072 1.00 0.00 C ATOM 1003 OE1 GLN A 75 -11.959 -0.186 3.025 1.00 0.00 O ATOM 1004 NE2 GLN A 75 -13.648 -0.890 1.725 1.00 0.00 N ATOM 0 H GLN A 75 -12.718 -4.455 0.857 1.00 0.00 H new ATOM 0 HA GLN A 75 -10.103 -3.650 0.075 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -11.851 -3.325 2.518 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -10.178 -2.805 2.562 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -10.513 -1.089 1.033 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -11.873 -1.884 0.265 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -13.944 -1.454 0.928 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -14.336 -0.356 2.255 1.00 0.00 H new ATOM 1013 N LEU A 76 -8.452 -4.941 1.459 1.00 0.00 N ATOM 1014 CA LEU A 76 -7.490 -5.857 2.062 1.00 0.00 C ATOM 1015 C LEU A 76 -6.407 -5.092 2.816 1.00 0.00 C ATOM 1016 O LEU A 76 -5.942 -4.046 2.362 1.00 0.00 O ATOM 1017 CB LEU A 76 -6.853 -6.740 0.987 1.00 0.00 C ATOM 1018 CG LEU A 76 -5.624 -7.541 1.418 1.00 0.00 C ATOM 1019 CD1 LEU A 76 -6.042 -8.834 2.101 1.00 0.00 C ATOM 1020 CD2 LEU A 76 -4.730 -7.832 0.222 1.00 0.00 C ATOM 0 H LEU A 76 -8.032 -4.169 0.941 1.00 0.00 H new ATOM 0 HA LEU A 76 -8.024 -6.488 2.772 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -7.608 -7.438 0.624 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -6.573 -6.107 0.145 1.00 0.00 H new ATOM 0 HG LEU A 76 -5.057 -6.944 2.132 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -5.154 -9.391 2.401 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -6.640 -8.603 2.982 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -6.632 -9.436 1.410 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -3.860 -8.403 0.548 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -5.287 -8.409 -0.517 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -4.401 -6.893 -0.224 1.00 0.00 H new ATOM 1032 N SER A 77 -6.009 -5.621 3.968 1.00 0.00 N ATOM 1033 CA SER A 77 -4.981 -4.987 4.785 1.00 0.00 C ATOM 1034 C SER A 77 -3.591 -5.253 4.215 1.00 0.00 C ATOM 1035 O SER A 77 -3.418 -6.111 3.348 1.00 0.00 O ATOM 1036 CB SER A 77 -5.060 -5.495 6.226 1.00 0.00 C ATOM 1037 OG SER A 77 -5.081 -6.912 6.266 1.00 0.00 O ATOM 0 H SER A 77 -6.383 -6.487 4.357 1.00 0.00 H new ATOM 0 HA SER A 77 -5.157 -3.911 4.776 1.00 0.00 H new ATOM 0 HB2 SER A 77 -4.206 -5.124 6.793 1.00 0.00 H new ATOM 0 HB3 SER A 77 -5.956 -5.101 6.705 1.00 0.00 H new ATOM 0 HG SER A 77 -5.130 -7.212 7.198 1.00 0.00 H new ATOM 1043 N LEU A 78 -2.605 -4.513 4.708 1.00 0.00 N ATOM 1044 CA LEU A 78 -1.229 -4.669 4.248 1.00 0.00 C ATOM 1045 C LEU A 78 -0.243 -4.195 5.311 1.00 0.00 C ATOM 1046 O LEU A 78 -0.565 -3.334 6.130 1.00 0.00 O ATOM 1047 CB LEU A 78 -1.012 -3.887 2.951 1.00 0.00 C ATOM 1048 CG LEU A 78 -1.440 -4.593 1.664 1.00 0.00 C ATOM 1049 CD1 LEU A 78 -1.363 -3.639 0.482 1.00 0.00 C ATOM 1050 CD2 LEU A 78 -0.576 -5.821 1.417 1.00 0.00 C ATOM 0 H LEU A 78 -2.732 -3.799 5.426 1.00 0.00 H new ATOM 0 HA LEU A 78 -1.053 -5.728 4.061 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -1.555 -2.945 3.023 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.047 -3.640 2.872 1.00 0.00 H new ATOM 0 HG LEU A 78 -2.474 -4.918 1.777 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -1.671 -4.158 -0.425 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -2.024 -2.790 0.656 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -0.339 -3.284 0.367 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.895 -6.311 0.497 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.467 -5.519 1.325 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.681 -6.514 2.252 1.00 0.00 H new ATOM 1062 N GLN A 79 0.959 -4.760 5.290 1.00 0.00 N ATOM 1063 CA GLN A 79 1.993 -4.394 6.252 1.00 0.00 C ATOM 1064 C GLN A 79 3.295 -4.037 5.542 1.00 0.00 C ATOM 1065 O GLN A 79 3.745 -4.759 4.652 1.00 0.00 O ATOM 1066 CB GLN A 79 2.232 -5.540 7.237 1.00 0.00 C ATOM 1067 CG GLN A 79 1.286 -5.526 8.427 1.00 0.00 C ATOM 1068 CD GLN A 79 1.625 -6.589 9.454 1.00 0.00 C ATOM 1069 OE1 GLN A 79 2.267 -7.591 9.138 1.00 0.00 O ATOM 1070 NE2 GLN A 79 1.196 -6.374 10.692 1.00 0.00 N ATOM 0 H GLN A 79 1.242 -5.473 4.618 1.00 0.00 H new ATOM 0 HA GLN A 79 1.649 -3.518 6.802 1.00 0.00 H new ATOM 0 HB2 GLN A 79 2.126 -6.489 6.711 1.00 0.00 H new ATOM 0 HB3 GLN A 79 3.259 -5.489 7.599 1.00 0.00 H new ATOM 0 HG2 GLN A 79 1.319 -4.545 8.901 1.00 0.00 H new ATOM 0 HG3 GLN A 79 0.265 -5.677 8.077 1.00 0.00 H new ATOM 0 HE21 GLN A 79 0.667 -5.529 10.909 1.00 0.00 H new ATOM 0 HE22 GLN A 79 1.395 -7.054 11.426 1.00 0.00 H new ATOM 1079 N ILE A 80 3.894 -2.921 5.942 1.00 0.00 N ATOM 1080 CA ILE A 80 5.145 -2.470 5.344 1.00 0.00 C ATOM 1081 C ILE A 80 6.169 -3.598 5.296 1.00 0.00 C ATOM 1082 O ILE A 80 6.502 -4.193 6.320 1.00 0.00 O ATOM 1083 CB ILE A 80 5.743 -1.281 6.120 1.00 0.00 C ATOM 1084 CG1 ILE A 80 4.755 -0.113 6.147 1.00 0.00 C ATOM 1085 CG2 ILE A 80 7.063 -0.853 5.497 1.00 0.00 C ATOM 1086 CD1 ILE A 80 5.216 1.048 7.000 1.00 0.00 C ATOM 0 H ILE A 80 3.534 -2.312 6.677 1.00 0.00 H new ATOM 0 HA ILE A 80 4.912 -2.150 4.328 1.00 0.00 H new ATOM 0 HB ILE A 80 5.933 -1.594 7.147 1.00 0.00 H new ATOM 0 HG12 ILE A 80 4.591 0.238 5.128 1.00 0.00 H new ATOM 0 HG13 ILE A 80 3.794 -0.469 6.520 1.00 0.00 H new ATOM 0 HG21 ILE A 80 7.473 -0.012 6.056 1.00 0.00 H new ATOM 0 HG22 ILE A 80 7.766 -1.686 5.526 1.00 0.00 H new ATOM 0 HG23 ILE A 80 6.897 -0.554 4.462 1.00 0.00 H new ATOM 0 HD11 ILE A 80 4.467 1.839 6.973 1.00 0.00 H new ATOM 0 HD12 ILE A 80 5.352 0.713 8.028 1.00 0.00 H new ATOM 0 HD13 ILE A 80 6.161 1.430 6.615 1.00 0.00 H new ATOM 1098 N GLY A 81 6.668 -3.886 4.097 1.00 0.00 N ATOM 1099 CA GLY A 81 7.651 -4.942 3.937 1.00 0.00 C ATOM 1100 C GLY A 81 7.022 -6.267 3.556 1.00 0.00 C ATOM 1101 O GLY A 81 7.622 -7.325 3.750 1.00 0.00 O ATOM 0 H GLY A 81 6.409 -3.407 3.234 1.00 0.00 H new ATOM 0 HA2 GLY A 81 8.370 -4.651 3.171 1.00 0.00 H new ATOM 0 HA3 GLY A 81 8.206 -5.061 4.867 1.00 0.00 H new ATOM 1105 N ASP A 82 5.811 -6.211 3.014 1.00 0.00 N ATOM 1106 CA ASP A 82 5.100 -7.417 2.605 1.00 0.00 C ATOM 1107 C ASP A 82 5.031 -7.518 1.085 1.00 0.00 C ATOM 1108 O ASP A 82 4.808 -6.523 0.395 1.00 0.00 O ATOM 1109 CB ASP A 82 3.688 -7.426 3.193 1.00 0.00 C ATOM 1110 CG ASP A 82 2.731 -6.545 2.416 1.00 0.00 C ATOM 1111 OD1 ASP A 82 2.502 -6.828 1.221 1.00 0.00 O ATOM 1112 OD2 ASP A 82 2.211 -5.571 3.001 1.00 0.00 O ATOM 0 H ASP A 82 5.301 -5.344 2.847 1.00 0.00 H new ATOM 0 HA ASP A 82 5.649 -8.279 2.984 1.00 0.00 H new ATOM 0 HB2 ASP A 82 3.309 -8.448 3.204 1.00 0.00 H new ATOM 0 HB3 ASP A 82 3.727 -7.089 4.229 1.00 0.00 H new ATOM 1117 N VAL A 83 5.226 -8.727 0.568 1.00 0.00 N ATOM 1118 CA VAL A 83 5.186 -8.959 -0.872 1.00 0.00 C ATOM 1119 C VAL A 83 3.898 -9.665 -1.279 1.00 0.00 C ATOM 1120 O VAL A 83 3.684 -10.830 -0.944 1.00 0.00 O ATOM 1121 CB VAL A 83 6.390 -9.799 -1.338 1.00 0.00 C ATOM 1122 CG1 VAL A 83 6.257 -10.149 -2.812 1.00 0.00 C ATOM 1123 CG2 VAL A 83 7.691 -9.057 -1.073 1.00 0.00 C ATOM 0 H VAL A 83 5.413 -9.561 1.124 1.00 0.00 H new ATOM 0 HA VAL A 83 5.227 -7.981 -1.352 1.00 0.00 H new ATOM 0 HB VAL A 83 6.406 -10.728 -0.768 1.00 0.00 H new ATOM 0 HG11 VAL A 83 7.116 -10.743 -3.124 1.00 0.00 H new ATOM 0 HG12 VAL A 83 5.344 -10.723 -2.969 1.00 0.00 H new ATOM 0 HG13 VAL A 83 6.216 -9.233 -3.401 1.00 0.00 H new ATOM 0 HG21 VAL A 83 8.531 -9.665 -1.408 1.00 0.00 H new ATOM 0 HG22 VAL A 83 7.688 -8.112 -1.616 1.00 0.00 H new ATOM 0 HG23 VAL A 83 7.788 -8.862 -0.005 1.00 0.00 H new ATOM 1133 N VAL A 84 3.043 -8.953 -2.006 1.00 0.00 N ATOM 1134 CA VAL A 84 1.776 -9.512 -2.461 1.00 0.00 C ATOM 1135 C VAL A 84 1.792 -9.756 -3.966 1.00 0.00 C ATOM 1136 O VAL A 84 2.386 -8.988 -4.723 1.00 0.00 O ATOM 1137 CB VAL A 84 0.596 -8.584 -2.116 1.00 0.00 C ATOM 1138 CG1 VAL A 84 0.607 -8.236 -0.635 1.00 0.00 C ATOM 1139 CG2 VAL A 84 0.641 -7.325 -2.968 1.00 0.00 C ATOM 0 H VAL A 84 3.205 -7.988 -2.293 1.00 0.00 H new ATOM 0 HA VAL A 84 1.645 -10.462 -1.942 1.00 0.00 H new ATOM 0 HB VAL A 84 -0.333 -9.110 -2.335 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.234 -7.580 -0.409 1.00 0.00 H new ATOM 0 HG12 VAL A 84 0.523 -9.149 -0.046 1.00 0.00 H new ATOM 0 HG13 VAL A 84 1.540 -7.729 -0.387 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -0.200 -6.681 -2.711 1.00 0.00 H new ATOM 0 HG22 VAL A 84 1.575 -6.794 -2.783 1.00 0.00 H new ATOM 0 HG23 VAL A 84 0.581 -7.597 -4.022 1.00 0.00 H new ATOM 1149 N ARG A 85 1.135 -10.829 -4.393 1.00 0.00 N ATOM 1150 CA ARG A 85 1.075 -11.175 -5.808 1.00 0.00 C ATOM 1151 C ARG A 85 -0.008 -10.369 -6.519 1.00 0.00 C ATOM 1152 O ARG A 85 -1.177 -10.408 -6.136 1.00 0.00 O ATOM 1153 CB ARG A 85 0.806 -12.671 -5.978 1.00 0.00 C ATOM 1154 CG ARG A 85 1.381 -13.252 -7.260 1.00 0.00 C ATOM 1155 CD ARG A 85 2.862 -13.566 -7.113 1.00 0.00 C ATOM 1156 NE ARG A 85 3.086 -14.882 -6.520 1.00 0.00 N ATOM 1157 CZ ARG A 85 4.293 -15.388 -6.290 1.00 0.00 C ATOM 1158 NH1 ARG A 85 5.378 -14.693 -6.602 1.00 0.00 N ATOM 1159 NH2 ARG A 85 4.415 -16.593 -5.747 1.00 0.00 N ATOM 0 H ARG A 85 0.637 -11.474 -3.780 1.00 0.00 H new ATOM 0 HA ARG A 85 2.038 -10.933 -6.257 1.00 0.00 H new ATOM 0 HB2 ARG A 85 1.226 -13.206 -5.126 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -0.270 -12.842 -5.962 1.00 0.00 H new ATOM 0 HG2 ARG A 85 0.840 -14.160 -7.524 1.00 0.00 H new ATOM 0 HG3 ARG A 85 1.237 -12.546 -8.078 1.00 0.00 H new ATOM 0 HD2 ARG A 85 3.341 -13.523 -8.091 1.00 0.00 H new ATOM 0 HD3 ARG A 85 3.334 -12.804 -6.493 1.00 0.00 H new ATOM 0 HE ARG A 85 2.272 -15.443 -6.269 1.00 0.00 H new ATOM 0 HH11 ARG A 85 5.288 -13.767 -7.020 1.00 0.00 H new ATOM 0 HH12 ARG A 85 6.303 -15.084 -6.424 1.00 0.00 H new ATOM 0 HH21 ARG A 85 3.582 -17.131 -5.506 1.00 0.00 H new ATOM 0 HH22 ARG A 85 5.341 -16.981 -5.570 1.00 0.00 H new ATOM 1173 N ILE A 86 0.390 -9.638 -7.555 1.00 0.00 N ATOM 1174 CA ILE A 86 -0.546 -8.823 -8.319 1.00 0.00 C ATOM 1175 C ILE A 86 -1.149 -9.615 -9.475 1.00 0.00 C ATOM 1176 O ILE A 86 -0.428 -10.128 -10.330 1.00 0.00 O ATOM 1177 CB ILE A 86 0.133 -7.559 -8.878 1.00 0.00 C ATOM 1178 CG1 ILE A 86 0.632 -6.674 -7.733 1.00 0.00 C ATOM 1179 CG2 ILE A 86 -0.830 -6.789 -9.769 1.00 0.00 C ATOM 1180 CD1 ILE A 86 1.666 -5.657 -8.163 1.00 0.00 C ATOM 0 H ILE A 86 1.354 -9.594 -7.884 1.00 0.00 H new ATOM 0 HA ILE A 86 -1.338 -8.526 -7.632 1.00 0.00 H new ATOM 0 HB ILE A 86 0.990 -7.861 -9.480 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -0.217 -6.153 -7.291 1.00 0.00 H new ATOM 0 HG13 ILE A 86 1.058 -7.307 -6.954 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -0.335 -5.899 -10.156 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -1.141 -7.421 -10.600 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -1.705 -6.495 -9.190 1.00 0.00 H new ATOM 0 HD11 ILE A 86 1.974 -5.065 -7.301 1.00 0.00 H new ATOM 0 HD12 ILE A 86 2.532 -6.172 -8.578 1.00 0.00 H new ATOM 0 HD13 ILE A 86 1.237 -5.000 -8.920 1.00 0.00 H new ATOM 1192 N GLN A 87 -2.474 -9.709 -9.493 1.00 0.00 N ATOM 1193 CA GLN A 87 -3.174 -10.438 -10.544 1.00 0.00 C ATOM 1194 C GLN A 87 -3.853 -9.477 -11.514 1.00 0.00 C ATOM 1195 O GLN A 87 -3.821 -9.679 -12.727 1.00 0.00 O ATOM 1196 CB GLN A 87 -4.210 -11.385 -9.936 1.00 0.00 C ATOM 1197 CG GLN A 87 -3.631 -12.336 -8.901 1.00 0.00 C ATOM 1198 CD GLN A 87 -4.440 -13.611 -8.763 1.00 0.00 C ATOM 1199 OE1 GLN A 87 -4.166 -14.608 -9.431 1.00 0.00 O ATOM 1200 NE2 GLN A 87 -5.443 -13.585 -7.893 1.00 0.00 N ATOM 0 H GLN A 87 -3.085 -9.290 -8.792 1.00 0.00 H new ATOM 0 HA GLN A 87 -2.438 -11.023 -11.096 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -5.001 -10.796 -9.473 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -4.671 -11.967 -10.734 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -2.607 -12.588 -9.177 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -3.586 -11.832 -7.935 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -5.634 -12.736 -7.360 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -6.022 -14.414 -7.757 1.00 0.00 H new ATOM 1209 N GLU A 88 -4.467 -8.431 -10.969 1.00 0.00 N ATOM 1210 CA GLU A 88 -5.155 -7.439 -11.788 1.00 0.00 C ATOM 1211 C GLU A 88 -4.786 -6.024 -11.352 1.00 0.00 C ATOM 1212 O GLU A 88 -4.466 -5.783 -10.188 1.00 0.00 O ATOM 1213 CB GLU A 88 -6.670 -7.634 -11.697 1.00 0.00 C ATOM 1214 CG GLU A 88 -7.413 -7.227 -12.959 1.00 0.00 C ATOM 1215 CD GLU A 88 -7.277 -8.249 -14.071 1.00 0.00 C ATOM 1216 OE1 GLU A 88 -7.718 -9.401 -13.874 1.00 0.00 O ATOM 1217 OE2 GLU A 88 -6.730 -7.898 -15.137 1.00 0.00 O ATOM 0 H GLU A 88 -4.502 -8.249 -9.966 1.00 0.00 H new ATOM 0 HA GLU A 88 -4.839 -7.576 -12.822 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -6.881 -8.682 -11.483 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -7.053 -7.054 -10.857 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -8.469 -7.088 -12.726 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -7.034 -6.266 -13.306 1.00 0.00 H new ATOM 1224 N THR A 89 -4.833 -5.090 -12.297 1.00 0.00 N ATOM 1225 CA THR A 89 -4.502 -3.699 -12.013 1.00 0.00 C ATOM 1226 C THR A 89 -5.525 -2.753 -12.631 1.00 0.00 C ATOM 1227 O THR A 89 -5.620 -2.639 -13.854 1.00 0.00 O ATOM 1228 CB THR A 89 -3.100 -3.336 -12.540 1.00 0.00 C ATOM 1229 OG1 THR A 89 -2.111 -4.150 -11.901 1.00 0.00 O ATOM 1230 CG2 THR A 89 -2.793 -1.867 -12.292 1.00 0.00 C ATOM 0 H THR A 89 -5.097 -5.272 -13.265 1.00 0.00 H new ATOM 0 HA THR A 89 -4.515 -3.586 -10.929 1.00 0.00 H new ATOM 0 HB THR A 89 -3.081 -3.518 -13.614 1.00 0.00 H new ATOM 0 HG1 THR A 89 -1.738 -3.669 -11.133 1.00 0.00 H new ATOM 0 HG21 THR A 89 -1.798 -1.634 -12.672 1.00 0.00 H new ATOM 0 HG22 THR A 89 -3.531 -1.250 -12.804 1.00 0.00 H new ATOM 0 HG23 THR A 89 -2.829 -1.663 -11.222 1.00 0.00 H new ATOM 1238 N CYS A 90 -6.288 -2.076 -11.780 1.00 0.00 N ATOM 1239 CA CYS A 90 -7.305 -1.139 -12.243 1.00 0.00 C ATOM 1240 C CYS A 90 -7.120 0.229 -11.595 1.00 0.00 C ATOM 1241 O CYS A 90 -6.810 0.328 -10.409 1.00 0.00 O ATOM 1242 CB CYS A 90 -8.703 -1.678 -11.934 1.00 0.00 C ATOM 1243 SG CYS A 90 -9.244 -3.003 -13.039 1.00 0.00 S ATOM 0 H CYS A 90 -6.222 -2.159 -10.766 1.00 0.00 H new ATOM 0 HA CYS A 90 -7.196 -1.027 -13.322 1.00 0.00 H new ATOM 0 HB2 CYS A 90 -8.721 -2.045 -10.908 1.00 0.00 H new ATOM 0 HB3 CYS A 90 -9.418 -0.857 -11.991 1.00 0.00 H new ATOM 0 HG CYS A 90 -10.436 -3.394 -12.697 1.00 0.00 H new ATOM 1249 N GLY A 91 -7.310 1.282 -12.384 1.00 0.00 N ATOM 1250 CA GLY A 91 -7.158 2.631 -11.870 1.00 0.00 C ATOM 1251 C GLY A 91 -5.964 2.768 -10.946 1.00 0.00 C ATOM 1252 O GLY A 91 -4.839 2.440 -11.322 1.00 0.00 O ATOM 0 H GLY A 91 -7.566 1.225 -13.370 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -7.050 3.324 -12.704 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -8.063 2.916 -11.334 1.00 0.00 H new ATOM 1256 N ASP A 92 -6.209 3.255 -9.734 1.00 0.00 N ATOM 1257 CA ASP A 92 -5.144 3.435 -8.754 1.00 0.00 C ATOM 1258 C ASP A 92 -5.264 2.413 -7.628 1.00 0.00 C ATOM 1259 O ASP A 92 -5.155 2.756 -6.450 1.00 0.00 O ATOM 1260 CB ASP A 92 -5.186 4.852 -8.179 1.00 0.00 C ATOM 1261 CG ASP A 92 -4.345 5.826 -8.980 1.00 0.00 C ATOM 1262 OD1 ASP A 92 -4.329 5.713 -10.224 1.00 0.00 O ATOM 1263 OD2 ASP A 92 -3.702 6.702 -8.364 1.00 0.00 O ATOM 0 H ASP A 92 -7.135 3.532 -9.407 1.00 0.00 H new ATOM 0 HA ASP A 92 -4.190 3.283 -9.258 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -6.218 5.201 -8.156 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -4.833 4.833 -7.148 1.00 0.00 H new ATOM 1268 N TRP A 93 -5.490 1.157 -7.997 1.00 0.00 N ATOM 1269 CA TRP A 93 -5.625 0.085 -7.018 1.00 0.00 C ATOM 1270 C TRP A 93 -5.246 -1.260 -7.627 1.00 0.00 C ATOM 1271 O TRP A 93 -5.621 -1.567 -8.759 1.00 0.00 O ATOM 1272 CB TRP A 93 -7.058 0.032 -6.485 1.00 0.00 C ATOM 1273 CG TRP A 93 -7.446 1.249 -5.701 1.00 0.00 C ATOM 1274 CD1 TRP A 93 -7.683 2.500 -6.194 1.00 0.00 C ATOM 1275 CD2 TRP A 93 -7.639 1.330 -4.284 1.00 0.00 C ATOM 1276 NE1 TRP A 93 -8.012 3.354 -5.169 1.00 0.00 N ATOM 1277 CE2 TRP A 93 -7.993 2.661 -3.988 1.00 0.00 C ATOM 1278 CE3 TRP A 93 -7.550 0.408 -3.238 1.00 0.00 C ATOM 1279 CZ2 TRP A 93 -8.256 3.089 -2.689 1.00 0.00 C ATOM 1280 CZ3 TRP A 93 -7.810 0.835 -1.950 1.00 0.00 C ATOM 1281 CH2 TRP A 93 -8.161 2.165 -1.684 1.00 0.00 C ATOM 0 H TRP A 93 -5.584 0.856 -8.967 1.00 0.00 H new ATOM 0 HA TRP A 93 -4.944 0.293 -6.192 1.00 0.00 H new ATOM 0 HB2 TRP A 93 -7.745 -0.086 -7.323 1.00 0.00 H new ATOM 0 HB3 TRP A 93 -7.171 -0.849 -5.854 1.00 0.00 H new ATOM 0 HD1 TRP A 93 -7.621 2.777 -7.236 1.00 0.00 H new ATOM 0 HE1 TRP A 93 -8.234 4.344 -5.271 1.00 0.00 H new ATOM 0 HE3 TRP A 93 -7.283 -0.620 -3.433 1.00 0.00 H new ATOM 0 HZ2 TRP A 93 -8.525 4.114 -2.482 1.00 0.00 H new ATOM 0 HZ3 TRP A 93 -7.741 0.131 -1.134 1.00 0.00 H new ATOM 0 HH2 TRP A 93 -8.360 2.467 -0.666 1.00 0.00 H new ATOM 1292 N TYR A 94 -4.502 -2.059 -6.871 1.00 0.00 N ATOM 1293 CA TYR A 94 -4.070 -3.371 -7.338 1.00 0.00 C ATOM 1294 C TYR A 94 -5.037 -4.458 -6.879 1.00 0.00 C ATOM 1295 O TYR A 94 -5.826 -4.253 -5.956 1.00 0.00 O ATOM 1296 CB TYR A 94 -2.661 -3.678 -6.830 1.00 0.00 C ATOM 1297 CG TYR A 94 -1.569 -2.991 -7.619 1.00 0.00 C ATOM 1298 CD1 TYR A 94 -1.463 -3.166 -8.993 1.00 0.00 C ATOM 1299 CD2 TYR A 94 -0.644 -2.166 -6.990 1.00 0.00 C ATOM 1300 CE1 TYR A 94 -0.467 -2.541 -9.718 1.00 0.00 C ATOM 1301 CE2 TYR A 94 0.354 -1.536 -7.707 1.00 0.00 C ATOM 1302 CZ TYR A 94 0.439 -1.727 -9.071 1.00 0.00 C ATOM 1303 OH TYR A 94 1.432 -1.101 -9.789 1.00 0.00 O ATOM 0 H TYR A 94 -4.185 -1.821 -5.931 1.00 0.00 H new ATOM 0 HA TYR A 94 -4.060 -3.356 -8.428 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -2.587 -3.377 -5.785 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -2.499 -4.755 -6.863 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -2.172 -3.802 -9.503 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -0.707 -2.015 -5.922 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -0.398 -2.689 -10.786 1.00 0.00 H new ATOM 0 HE2 TYR A 94 1.064 -0.897 -7.203 1.00 0.00 H new ATOM 0 HH TYR A 94 1.985 -0.564 -9.184 1.00 0.00 H new ATOM 1313 N ARG A 95 -4.968 -5.615 -7.529 1.00 0.00 N ATOM 1314 CA ARG A 95 -5.837 -6.735 -7.189 1.00 0.00 C ATOM 1315 C ARG A 95 -5.033 -8.025 -7.052 1.00 0.00 C ATOM 1316 O ARG A 95 -4.475 -8.526 -8.027 1.00 0.00 O ATOM 1317 CB ARG A 95 -6.922 -6.908 -8.253 1.00 0.00 C ATOM 1318 CG ARG A 95 -8.226 -7.468 -7.708 1.00 0.00 C ATOM 1319 CD ARG A 95 -8.248 -8.987 -7.767 1.00 0.00 C ATOM 1320 NE ARG A 95 -9.277 -9.554 -6.900 1.00 0.00 N ATOM 1321 CZ ARG A 95 -9.418 -10.857 -6.681 1.00 0.00 C ATOM 1322 NH1 ARG A 95 -8.599 -11.723 -7.263 1.00 0.00 N ATOM 1323 NH2 ARG A 95 -10.379 -11.296 -5.878 1.00 0.00 N ATOM 0 H ARG A 95 -4.319 -5.801 -8.294 1.00 0.00 H new ATOM 0 HA ARG A 95 -6.309 -6.518 -6.231 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -7.118 -5.943 -8.720 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -6.550 -7.571 -9.034 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -8.361 -7.141 -6.677 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -9.063 -7.068 -8.281 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -8.423 -9.307 -8.794 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -7.273 -9.375 -7.474 1.00 0.00 H new ATOM 0 HE ARG A 95 -9.923 -8.915 -6.437 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -7.859 -11.389 -7.880 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -8.709 -12.723 -7.093 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -11.010 -10.633 -5.428 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -10.486 -12.296 -5.711 1.00 0.00 H new ATOM 1337 N GLY A 96 -4.979 -8.556 -5.835 1.00 0.00 N ATOM 1338 CA GLY A 96 -4.240 -9.782 -5.593 1.00 0.00 C ATOM 1339 C GLY A 96 -4.406 -10.288 -4.174 1.00 0.00 C ATOM 1340 O GLY A 96 -5.485 -10.181 -3.591 1.00 0.00 O ATOM 0 H GLY A 96 -5.433 -8.160 -5.012 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -4.576 -10.549 -6.291 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -3.182 -9.611 -5.793 1.00 0.00 H new ATOM 1344 N TYR A 97 -3.335 -10.843 -3.617 1.00 0.00 N ATOM 1345 CA TYR A 97 -3.368 -11.372 -2.258 1.00 0.00 C ATOM 1346 C TYR A 97 -1.963 -11.445 -1.668 1.00 0.00 C ATOM 1347 O TYR A 97 -0.969 -11.357 -2.389 1.00 0.00 O ATOM 1348 CB TYR A 97 -4.012 -12.760 -2.244 1.00 0.00 C ATOM 1349 CG TYR A 97 -3.261 -13.784 -3.065 1.00 0.00 C ATOM 1350 CD1 TYR A 97 -2.008 -14.237 -2.669 1.00 0.00 C ATOM 1351 CD2 TYR A 97 -3.803 -14.297 -4.237 1.00 0.00 C ATOM 1352 CE1 TYR A 97 -1.318 -15.172 -3.416 1.00 0.00 C ATOM 1353 CE2 TYR A 97 -3.120 -15.234 -4.989 1.00 0.00 C ATOM 1354 CZ TYR A 97 -1.878 -15.668 -4.575 1.00 0.00 C ATOM 1355 OH TYR A 97 -1.195 -16.599 -5.323 1.00 0.00 O ATOM 0 H TYR A 97 -2.434 -10.938 -4.085 1.00 0.00 H new ATOM 0 HA TYR A 97 -3.965 -10.696 -1.646 1.00 0.00 H new ATOM 0 HB2 TYR A 97 -4.078 -13.110 -1.214 1.00 0.00 H new ATOM 0 HB3 TYR A 97 -5.032 -12.682 -2.620 1.00 0.00 H new ATOM 0 HD1 TYR A 97 -1.566 -13.851 -1.762 1.00 0.00 H new ATOM 0 HD2 TYR A 97 -4.774 -13.958 -4.566 1.00 0.00 H new ATOM 0 HE1 TYR A 97 -0.345 -15.513 -3.094 1.00 0.00 H new ATOM 0 HE2 TYR A 97 -3.557 -15.624 -5.896 1.00 0.00 H new ATOM 0 HH TYR A 97 -1.729 -16.845 -6.107 1.00 0.00 H new ATOM 1365 N LEU A 98 -1.890 -11.607 -0.351 1.00 0.00 N ATOM 1366 CA LEU A 98 -0.607 -11.692 0.338 1.00 0.00 C ATOM 1367 C LEU A 98 0.048 -13.050 0.104 1.00 0.00 C ATOM 1368 O LEU A 98 -0.493 -14.086 0.493 1.00 0.00 O ATOM 1369 CB LEU A 98 -0.796 -11.456 1.838 1.00 0.00 C ATOM 1370 CG LEU A 98 0.484 -11.372 2.670 1.00 0.00 C ATOM 1371 CD1 LEU A 98 1.382 -10.257 2.157 1.00 0.00 C ATOM 1372 CD2 LEU A 98 0.152 -11.157 4.140 1.00 0.00 C ATOM 0 H LEU A 98 -2.703 -11.682 0.260 1.00 0.00 H new ATOM 0 HA LEU A 98 0.047 -10.919 -0.066 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -1.354 -10.530 1.972 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -1.413 -12.261 2.237 1.00 0.00 H new ATOM 0 HG LEU A 98 1.020 -12.316 2.573 1.00 0.00 H new ATOM 0 HD11 LEU A 98 2.288 -10.212 2.761 1.00 0.00 H new ATOM 0 HD12 LEU A 98 1.648 -10.453 1.118 1.00 0.00 H new ATOM 0 HD13 LEU A 98 0.855 -9.305 2.223 1.00 0.00 H new ATOM 0 HD21 LEU A 98 1.075 -11.100 4.717 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -0.406 -10.228 4.255 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -0.451 -11.989 4.502 1.00 0.00 H new ATOM 1384 N ILE A 99 1.214 -13.036 -0.532 1.00 0.00 N ATOM 1385 CA ILE A 99 1.944 -14.266 -0.814 1.00 0.00 C ATOM 1386 C ILE A 99 2.317 -14.992 0.474 1.00 0.00 C ATOM 1387 O ILE A 99 1.989 -16.164 0.657 1.00 0.00 O ATOM 1388 CB ILE A 99 3.225 -13.988 -1.623 1.00 0.00 C ATOM 1389 CG1 ILE A 99 2.893 -13.191 -2.886 1.00 0.00 C ATOM 1390 CG2 ILE A 99 3.919 -15.293 -1.981 1.00 0.00 C ATOM 1391 CD1 ILE A 99 4.092 -12.502 -3.498 1.00 0.00 C ATOM 0 H ILE A 99 1.674 -12.187 -0.862 1.00 0.00 H new ATOM 0 HA ILE A 99 1.281 -14.898 -1.405 1.00 0.00 H new ATOM 0 HB ILE A 99 3.903 -13.395 -1.009 1.00 0.00 H new ATOM 0 HG12 ILE A 99 2.454 -13.862 -3.624 1.00 0.00 H new ATOM 0 HG13 ILE A 99 2.138 -12.443 -2.646 1.00 0.00 H new ATOM 0 HG21 ILE A 99 4.822 -15.080 -2.552 1.00 0.00 H new ATOM 0 HG22 ILE A 99 4.184 -15.826 -1.068 1.00 0.00 H new ATOM 0 HG23 ILE A 99 3.248 -15.910 -2.579 1.00 0.00 H new ATOM 0 HD11 ILE A 99 3.782 -11.956 -4.389 1.00 0.00 H new ATOM 0 HD12 ILE A 99 4.519 -11.806 -2.776 1.00 0.00 H new ATOM 0 HD13 ILE A 99 4.840 -13.247 -3.770 1.00 0.00 H new ATOM 1403 N LYS A 100 3.004 -14.287 1.366 1.00 0.00 N ATOM 1404 CA LYS A 100 3.421 -14.862 2.640 1.00 0.00 C ATOM 1405 C LYS A 100 2.248 -15.541 3.340 1.00 0.00 C ATOM 1406 O LYS A 100 2.432 -16.487 4.106 1.00 0.00 O ATOM 1407 CB LYS A 100 4.009 -13.776 3.544 1.00 0.00 C ATOM 1408 CG LYS A 100 3.028 -12.666 3.879 1.00 0.00 C ATOM 1409 CD LYS A 100 3.484 -11.865 5.087 1.00 0.00 C ATOM 1410 CE LYS A 100 4.532 -10.830 4.707 1.00 0.00 C ATOM 1411 NZ LYS A 100 5.898 -11.420 4.647 1.00 0.00 N ATOM 0 H LYS A 100 3.284 -13.316 1.230 1.00 0.00 H new ATOM 0 HA LYS A 100 4.185 -15.613 2.439 1.00 0.00 H new ATOM 0 HB2 LYS A 100 4.356 -14.235 4.470 1.00 0.00 H new ATOM 0 HB3 LYS A 100 4.882 -13.343 3.056 1.00 0.00 H new ATOM 0 HG2 LYS A 100 2.921 -12.003 3.021 1.00 0.00 H new ATOM 0 HG3 LYS A 100 2.045 -13.095 4.075 1.00 0.00 H new ATOM 0 HD2 LYS A 100 2.626 -11.367 5.539 1.00 0.00 H new ATOM 0 HD3 LYS A 100 3.893 -12.540 5.839 1.00 0.00 H new ATOM 0 HE2 LYS A 100 4.281 -10.397 3.739 1.00 0.00 H new ATOM 0 HE3 LYS A 100 4.519 -10.017 5.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 6.586 -10.744 5.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 5.922 -12.298 5.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 6.142 -11.631 3.658 1.00 0.00 H new ATOM 1425 N HIS A 101 1.041 -15.053 3.071 1.00 0.00 N ATOM 1426 CA HIS A 101 -0.163 -15.614 3.673 1.00 0.00 C ATOM 1427 C HIS A 101 -1.358 -15.468 2.737 1.00 0.00 C ATOM 1428 O HIS A 101 -1.905 -14.376 2.576 1.00 0.00 O ATOM 1429 CB HIS A 101 -0.458 -14.929 5.008 1.00 0.00 C ATOM 1430 CG HIS A 101 0.647 -15.066 6.009 1.00 0.00 C ATOM 1431 ND1 HIS A 101 0.971 -16.262 6.614 1.00 0.00 N ATOM 1432 CD2 HIS A 101 1.507 -14.149 6.510 1.00 0.00 C ATOM 1433 CE1 HIS A 101 1.980 -16.075 7.444 1.00 0.00 C ATOM 1434 NE2 HIS A 101 2.325 -14.800 7.400 1.00 0.00 N ATOM 0 H HIS A 101 0.871 -14.270 2.440 1.00 0.00 H new ATOM 0 HA HIS A 101 0.010 -16.676 3.849 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -0.646 -13.870 4.830 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -1.372 -15.349 5.428 1.00 0.00 H new ATOM 0 HD2 HIS A 101 1.543 -13.100 6.257 1.00 0.00 H new ATOM 0 HE1 HIS A 101 2.445 -16.835 8.055 1.00 0.00 H new ATOM 0 HE2 HIS A 101 3.076 -14.370 7.939 1.00 0.00 H new ATOM 1443 N LYS A 102 -1.759 -16.574 2.120 1.00 0.00 N ATOM 1444 CA LYS A 102 -2.890 -16.570 1.200 1.00 0.00 C ATOM 1445 C LYS A 102 -4.208 -16.707 1.956 1.00 0.00 C ATOM 1446 O LYS A 102 -5.173 -17.273 1.443 1.00 0.00 O ATOM 1447 CB LYS A 102 -2.752 -17.707 0.184 1.00 0.00 C ATOM 1448 CG LYS A 102 -1.594 -17.523 -0.781 1.00 0.00 C ATOM 1449 CD LYS A 102 -1.527 -18.654 -1.794 1.00 0.00 C ATOM 1450 CE LYS A 102 -0.101 -18.902 -2.259 1.00 0.00 C ATOM 1451 NZ LYS A 102 0.266 -18.035 -3.412 1.00 0.00 N ATOM 0 H LYS A 102 -1.317 -17.485 2.241 1.00 0.00 H new ATOM 0 HA LYS A 102 -2.892 -15.617 0.672 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -2.622 -18.648 0.719 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -3.678 -17.789 -0.385 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -1.702 -16.572 -1.303 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -0.658 -17.477 -0.224 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -1.930 -19.565 -1.351 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -2.154 -18.413 -2.652 1.00 0.00 H new ATOM 0 HE2 LYS A 102 0.587 -18.719 -1.434 1.00 0.00 H new ATOM 0 HE3 LYS A 102 0.012 -19.949 -2.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 0.617 -18.626 -4.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -0.571 -17.505 -3.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 1.009 -17.368 -3.122 1.00 0.00 H new ATOM 1465 N MET A 103 -4.241 -16.185 3.178 1.00 0.00 N ATOM 1466 CA MET A 103 -5.441 -16.248 4.003 1.00 0.00 C ATOM 1467 C MET A 103 -6.256 -14.964 3.876 1.00 0.00 C ATOM 1468 O MET A 103 -7.387 -14.884 4.357 1.00 0.00 O ATOM 1469 CB MET A 103 -5.068 -16.486 5.467 1.00 0.00 C ATOM 1470 CG MET A 103 -4.285 -17.769 5.694 1.00 0.00 C ATOM 1471 SD MET A 103 -3.175 -17.664 7.111 1.00 0.00 S ATOM 1472 CE MET A 103 -4.307 -17.121 8.389 1.00 0.00 C ATOM 0 H MET A 103 -3.451 -15.714 3.618 1.00 0.00 H new ATOM 0 HA MET A 103 -6.050 -17.081 3.651 1.00 0.00 H new ATOM 0 HB2 MET A 103 -4.478 -15.642 5.825 1.00 0.00 H new ATOM 0 HB3 MET A 103 -5.979 -16.515 6.065 1.00 0.00 H new ATOM 0 HG2 MET A 103 -4.982 -18.594 5.844 1.00 0.00 H new ATOM 0 HG3 MET A 103 -3.706 -18.000 4.800 1.00 0.00 H new ATOM 0 HE1 MET A 103 -3.834 -17.230 9.365 1.00 0.00 H new ATOM 0 HE2 MET A 103 -4.565 -16.075 8.226 1.00 0.00 H new ATOM 0 HE3 MET A 103 -5.212 -17.727 8.355 1.00 0.00 H new ATOM 1482 N LEU A 104 -5.675 -13.962 3.226 1.00 0.00 N ATOM 1483 CA LEU A 104 -6.347 -12.682 3.035 1.00 0.00 C ATOM 1484 C LEU A 104 -6.219 -12.209 1.591 1.00 0.00 C ATOM 1485 O LEU A 104 -5.113 -12.074 1.068 1.00 0.00 O ATOM 1486 CB LEU A 104 -5.763 -11.631 3.981 1.00 0.00 C ATOM 1487 CG LEU A 104 -4.237 -11.567 4.053 1.00 0.00 C ATOM 1488 CD1 LEU A 104 -3.777 -10.156 4.387 1.00 0.00 C ATOM 1489 CD2 LEU A 104 -3.708 -12.559 5.078 1.00 0.00 C ATOM 0 H LEU A 104 -4.740 -14.011 2.822 1.00 0.00 H new ATOM 0 HA LEU A 104 -7.405 -12.818 3.261 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -6.134 -10.652 3.678 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -6.146 -11.820 4.984 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.835 -11.837 3.076 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -2.688 -10.130 4.434 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -4.124 -9.468 3.616 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -4.189 -9.858 5.351 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -2.620 -12.499 5.115 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -4.118 -12.321 6.060 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -4.006 -13.568 4.795 1.00 0.00 H new ATOM 1501 N GLN A 105 -7.358 -11.957 0.953 1.00 0.00 N ATOM 1502 CA GLN A 105 -7.372 -11.498 -0.431 1.00 0.00 C ATOM 1503 C GLN A 105 -8.269 -10.274 -0.589 1.00 0.00 C ATOM 1504 O GLN A 105 -9.247 -10.111 0.140 1.00 0.00 O ATOM 1505 CB GLN A 105 -7.849 -12.618 -1.357 1.00 0.00 C ATOM 1506 CG GLN A 105 -7.160 -13.949 -1.107 1.00 0.00 C ATOM 1507 CD GLN A 105 -7.496 -14.987 -2.159 1.00 0.00 C ATOM 1508 OE1 GLN A 105 -7.987 -14.657 -3.239 1.00 0.00 O ATOM 1509 NE2 GLN A 105 -7.233 -16.251 -1.850 1.00 0.00 N ATOM 0 H GLN A 105 -8.282 -12.063 1.372 1.00 0.00 H new ATOM 0 HA GLN A 105 -6.355 -11.218 -0.705 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -8.924 -12.746 -1.234 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -7.680 -12.319 -2.392 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -6.081 -13.796 -1.084 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -7.450 -14.325 -0.126 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -6.826 -16.480 -0.943 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -7.438 -16.993 -2.519 1.00 0.00 H new ATOM 1518 N GLY A 106 -7.929 -9.416 -1.546 1.00 0.00 N ATOM 1519 CA GLY A 106 -8.713 -8.219 -1.782 1.00 0.00 C ATOM 1520 C GLY A 106 -8.001 -7.227 -2.681 1.00 0.00 C ATOM 1521 O GLY A 106 -7.269 -7.618 -3.590 1.00 0.00 O ATOM 0 H GLY A 106 -7.124 -9.529 -2.162 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -9.666 -8.496 -2.234 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -8.939 -7.743 -0.828 1.00 0.00 H new ATOM 1525 N ILE A 107 -8.216 -5.941 -2.427 1.00 0.00 N ATOM 1526 CA ILE A 107 -7.590 -4.891 -3.220 1.00 0.00 C ATOM 1527 C ILE A 107 -6.869 -3.884 -2.329 1.00 0.00 C ATOM 1528 O ILE A 107 -7.082 -3.847 -1.117 1.00 0.00 O ATOM 1529 CB ILE A 107 -8.624 -4.145 -4.085 1.00 0.00 C ATOM 1530 CG1 ILE A 107 -9.696 -3.508 -3.199 1.00 0.00 C ATOM 1531 CG2 ILE A 107 -9.256 -5.095 -5.091 1.00 0.00 C ATOM 1532 CD1 ILE A 107 -10.661 -2.624 -3.959 1.00 0.00 C ATOM 0 H ILE A 107 -8.819 -5.601 -1.678 1.00 0.00 H new ATOM 0 HA ILE A 107 -6.866 -5.379 -3.873 1.00 0.00 H new ATOM 0 HB ILE A 107 -8.115 -3.353 -4.634 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -10.257 -4.297 -2.697 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -9.210 -2.918 -2.422 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -9.984 -4.554 -5.695 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -8.482 -5.507 -5.739 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -9.755 -5.906 -4.561 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -11.393 -2.206 -3.268 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -10.112 -1.814 -4.439 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -11.174 -3.214 -4.718 1.00 0.00 H new ATOM 1544 N PHE A 108 -6.015 -3.069 -2.938 1.00 0.00 N ATOM 1545 CA PHE A 108 -5.262 -2.061 -2.201 1.00 0.00 C ATOM 1546 C PHE A 108 -4.761 -0.964 -3.136 1.00 0.00 C ATOM 1547 O PHE A 108 -4.689 -1.136 -4.353 1.00 0.00 O ATOM 1548 CB PHE A 108 -4.080 -2.706 -1.474 1.00 0.00 C ATOM 1549 CG PHE A 108 -3.545 -3.927 -2.166 1.00 0.00 C ATOM 1550 CD1 PHE A 108 -2.617 -3.809 -3.188 1.00 0.00 C ATOM 1551 CD2 PHE A 108 -3.971 -5.192 -1.796 1.00 0.00 C ATOM 1552 CE1 PHE A 108 -2.122 -4.930 -3.827 1.00 0.00 C ATOM 1553 CE2 PHE A 108 -3.479 -6.317 -2.430 1.00 0.00 C ATOM 1554 CZ PHE A 108 -2.555 -6.186 -3.448 1.00 0.00 C ATOM 0 H PHE A 108 -5.827 -3.087 -3.940 1.00 0.00 H new ATOM 0 HA PHE A 108 -5.930 -1.611 -1.466 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -3.279 -1.973 -1.377 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -4.388 -2.976 -0.464 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -2.276 -2.829 -3.489 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -4.696 -5.300 -1.003 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -1.398 -4.824 -4.621 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -3.817 -7.298 -2.130 1.00 0.00 H new ATOM 0 HZ PHE A 108 -2.172 -7.064 -3.947 1.00 0.00 H new ATOM 1564 N PRO A 109 -4.406 0.192 -2.555 1.00 0.00 N ATOM 1565 CA PRO A 109 -3.905 1.340 -3.317 1.00 0.00 C ATOM 1566 C PRO A 109 -2.516 1.091 -3.895 1.00 0.00 C ATOM 1567 O PRO A 109 -1.572 0.793 -3.163 1.00 0.00 O ATOM 1568 CB PRO A 109 -3.858 2.462 -2.278 1.00 0.00 C ATOM 1569 CG PRO A 109 -3.715 1.762 -0.970 1.00 0.00 C ATOM 1570 CD PRO A 109 -4.466 0.467 -1.110 1.00 0.00 C ATOM 0 HA PRO A 109 -4.535 1.564 -4.178 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -3.020 3.135 -2.460 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -4.765 3.066 -2.307 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -2.666 1.581 -0.737 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -4.123 2.364 -0.158 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -4.003 -0.331 -0.530 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -5.494 0.559 -0.761 1.00 0.00 H new ATOM 1578 N LYS A 110 -2.398 1.214 -5.213 1.00 0.00 N ATOM 1579 CA LYS A 110 -1.124 1.004 -5.890 1.00 0.00 C ATOM 1580 C LYS A 110 -0.036 1.888 -5.289 1.00 0.00 C ATOM 1581 O LYS A 110 1.133 1.505 -5.242 1.00 0.00 O ATOM 1582 CB LYS A 110 -1.264 1.295 -7.386 1.00 0.00 C ATOM 1583 CG LYS A 110 -2.328 0.456 -8.072 1.00 0.00 C ATOM 1584 CD LYS A 110 -2.709 1.035 -9.424 1.00 0.00 C ATOM 1585 CE LYS A 110 -1.837 0.475 -10.537 1.00 0.00 C ATOM 1586 NZ LYS A 110 -0.601 1.282 -10.733 1.00 0.00 N ATOM 0 H LYS A 110 -3.170 1.458 -5.834 1.00 0.00 H new ATOM 0 HA LYS A 110 -0.836 -0.039 -5.754 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -1.502 2.350 -7.522 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -0.305 1.119 -7.873 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -1.962 -0.562 -8.202 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -3.212 0.399 -7.437 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -3.755 0.813 -9.634 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -2.613 2.120 -9.396 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -1.565 -0.554 -10.302 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -2.406 0.450 -11.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -0.572 1.642 -11.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -0.600 2.082 -10.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 0.234 0.686 -10.559 1.00 0.00 H new ATOM 1600 N SER A 111 -0.429 3.072 -4.830 1.00 0.00 N ATOM 1601 CA SER A 111 0.514 4.012 -4.234 1.00 0.00 C ATOM 1602 C SER A 111 1.184 3.403 -3.006 1.00 0.00 C ATOM 1603 O SER A 111 2.172 3.933 -2.497 1.00 0.00 O ATOM 1604 CB SER A 111 -0.201 5.308 -3.848 1.00 0.00 C ATOM 1605 OG SER A 111 0.702 6.400 -3.824 1.00 0.00 O ATOM 0 H SER A 111 -1.393 3.403 -4.859 1.00 0.00 H new ATOM 0 HA SER A 111 1.283 4.236 -4.973 1.00 0.00 H new ATOM 0 HB2 SER A 111 -1.003 5.510 -4.558 1.00 0.00 H new ATOM 0 HB3 SER A 111 -0.665 5.194 -2.868 1.00 0.00 H new ATOM 0 HG SER A 111 0.221 7.217 -3.576 1.00 0.00 H new ATOM 1611 N PHE A 112 0.640 2.286 -2.535 1.00 0.00 N ATOM 1612 CA PHE A 112 1.183 1.604 -1.366 1.00 0.00 C ATOM 1613 C PHE A 112 1.994 0.379 -1.779 1.00 0.00 C ATOM 1614 O PHE A 112 2.786 -0.146 -0.997 1.00 0.00 O ATOM 1615 CB PHE A 112 0.054 1.188 -0.421 1.00 0.00 C ATOM 1616 CG PHE A 112 -0.429 2.302 0.463 1.00 0.00 C ATOM 1617 CD1 PHE A 112 -0.839 3.508 -0.082 1.00 0.00 C ATOM 1618 CD2 PHE A 112 -0.473 2.143 1.839 1.00 0.00 C ATOM 1619 CE1 PHE A 112 -1.283 4.535 0.730 1.00 0.00 C ATOM 1620 CE2 PHE A 112 -0.917 3.166 2.655 1.00 0.00 C ATOM 1621 CZ PHE A 112 -1.323 4.364 2.100 1.00 0.00 C ATOM 0 H PHE A 112 -0.177 1.834 -2.945 1.00 0.00 H new ATOM 0 HA PHE A 112 1.844 2.297 -0.847 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -0.783 0.814 -1.010 1.00 0.00 H new ATOM 0 HB3 PHE A 112 0.399 0.363 0.203 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -0.811 3.647 -1.153 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -0.157 1.209 2.279 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -1.599 5.471 0.293 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -0.947 3.029 3.726 1.00 0.00 H new ATOM 0 HZ PHE A 112 -1.671 5.165 2.736 1.00 0.00 H new ATOM 1631 N ILE A 113 1.788 -0.070 -3.013 1.00 0.00 N ATOM 1632 CA ILE A 113 2.500 -1.232 -3.530 1.00 0.00 C ATOM 1633 C ILE A 113 3.679 -0.813 -4.400 1.00 0.00 C ATOM 1634 O ILE A 113 3.530 -0.008 -5.321 1.00 0.00 O ATOM 1635 CB ILE A 113 1.568 -2.143 -4.351 1.00 0.00 C ATOM 1636 CG1 ILE A 113 0.382 -2.598 -3.499 1.00 0.00 C ATOM 1637 CG2 ILE A 113 2.336 -3.343 -4.885 1.00 0.00 C ATOM 1638 CD1 ILE A 113 0.790 -3.273 -2.208 1.00 0.00 C ATOM 0 H ILE A 113 1.135 0.353 -3.672 1.00 0.00 H new ATOM 0 HA ILE A 113 2.869 -1.786 -2.667 1.00 0.00 H new ATOM 0 HB ILE A 113 1.184 -1.575 -5.199 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -0.241 -1.734 -3.267 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -0.231 -3.286 -4.081 1.00 0.00 H new ATOM 0 HG21 ILE A 113 1.664 -3.977 -5.463 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.150 -2.999 -5.524 1.00 0.00 H new ATOM 0 HG23 ILE A 113 2.746 -3.913 -4.051 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -0.101 -3.569 -1.655 1.00 0.00 H new ATOM 0 HD12 ILE A 113 1.388 -4.156 -2.432 1.00 0.00 H new ATOM 0 HD13 ILE A 113 1.378 -2.581 -1.605 1.00 0.00 H new ATOM 1650 N HIS A 114 4.852 -1.364 -4.105 1.00 0.00 N ATOM 1651 CA HIS A 114 6.058 -1.049 -4.862 1.00 0.00 C ATOM 1652 C HIS A 114 6.420 -2.191 -5.806 1.00 0.00 C ATOM 1653 O HIS A 114 6.757 -3.290 -5.365 1.00 0.00 O ATOM 1654 CB HIS A 114 7.223 -0.767 -3.913 1.00 0.00 C ATOM 1655 CG HIS A 114 8.458 -0.282 -4.608 1.00 0.00 C ATOM 1656 ND1 HIS A 114 9.727 -0.753 -4.590 1.00 0.00 N flip ATOM 1657 CD2 HIS A 114 8.470 0.818 -5.439 1.00 0.00 C flip ATOM 1658 CE1 HIS A 114 10.475 0.062 -5.403 1.00 0.00 C flip ATOM 1659 NE2 HIS A 114 9.693 1.002 -5.904 1.00 0.00 N flip ATOM 0 H HIS A 114 4.993 -2.031 -3.347 1.00 0.00 H new ATOM 0 HA HIS A 114 5.861 -0.157 -5.457 1.00 0.00 H new ATOM 0 HB2 HIS A 114 6.912 -0.022 -3.181 1.00 0.00 H new ATOM 0 HB3 HIS A 114 7.460 -1.677 -3.361 1.00 0.00 H new ATOM 0 HD1 HIS A 114 10.065 -1.563 -4.069 1.00 0.00 H new ATOM 0 HD2 HIS A 114 7.614 1.433 -5.673 1.00 0.00 H new ATOM 0 HE1 HIS A 114 11.531 -0.047 -5.601 1.00 0.00 H new ATOM 1668 N ILE A 115 6.348 -1.923 -7.106 1.00 0.00 N ATOM 1669 CA ILE A 115 6.669 -2.929 -8.111 1.00 0.00 C ATOM 1670 C ILE A 115 8.164 -3.230 -8.130 1.00 0.00 C ATOM 1671 O ILE A 115 8.981 -2.357 -8.425 1.00 0.00 O ATOM 1672 CB ILE A 115 6.230 -2.479 -9.517 1.00 0.00 C ATOM 1673 CG1 ILE A 115 4.735 -2.154 -9.529 1.00 0.00 C ATOM 1674 CG2 ILE A 115 6.551 -3.556 -10.542 1.00 0.00 C ATOM 1675 CD1 ILE A 115 3.859 -3.325 -9.142 1.00 0.00 C ATOM 0 H ILE A 115 6.070 -1.019 -7.487 1.00 0.00 H new ATOM 0 HA ILE A 115 6.122 -3.832 -7.840 1.00 0.00 H new ATOM 0 HB ILE A 115 6.781 -1.577 -9.782 1.00 0.00 H new ATOM 0 HG12 ILE A 115 4.546 -1.327 -8.844 1.00 0.00 H new ATOM 0 HG13 ILE A 115 4.453 -1.814 -10.525 1.00 0.00 H new ATOM 0 HG21 ILE A 115 6.235 -3.223 -11.531 1.00 0.00 H new ATOM 0 HG22 ILE A 115 7.625 -3.744 -10.548 1.00 0.00 H new ATOM 0 HG23 ILE A 115 6.024 -4.474 -10.282 1.00 0.00 H new ATOM 0 HD11 ILE A 115 2.812 -3.022 -9.172 1.00 0.00 H new ATOM 0 HD12 ILE A 115 4.019 -4.146 -9.841 1.00 0.00 H new ATOM 0 HD13 ILE A 115 4.113 -3.652 -8.134 1.00 0.00 H new ATOM 1687 N LYS A 116 8.516 -4.472 -7.815 1.00 0.00 N ATOM 1688 CA LYS A 116 9.912 -4.891 -7.798 1.00 0.00 C ATOM 1689 C LYS A 116 10.429 -5.119 -9.215 1.00 0.00 C ATOM 1690 O LYS A 116 11.065 -6.133 -9.497 1.00 0.00 O ATOM 1691 CB LYS A 116 10.072 -6.171 -6.974 1.00 0.00 C ATOM 1692 CG LYS A 116 9.557 -6.046 -5.550 1.00 0.00 C ATOM 1693 CD LYS A 116 10.649 -5.580 -4.602 1.00 0.00 C ATOM 1694 CE LYS A 116 11.662 -6.682 -4.334 1.00 0.00 C ATOM 1695 NZ LYS A 116 12.521 -6.373 -3.158 1.00 0.00 N ATOM 0 H LYS A 116 7.853 -5.206 -7.568 1.00 0.00 H new ATOM 0 HA LYS A 116 10.498 -4.095 -7.339 1.00 0.00 H new ATOM 0 HB2 LYS A 116 9.543 -6.983 -7.473 1.00 0.00 H new ATOM 0 HB3 LYS A 116 11.126 -6.447 -6.947 1.00 0.00 H new ATOM 0 HG2 LYS A 116 8.726 -5.342 -5.523 1.00 0.00 H new ATOM 0 HG3 LYS A 116 9.170 -7.009 -5.216 1.00 0.00 H new ATOM 0 HD2 LYS A 116 11.156 -4.714 -5.027 1.00 0.00 H new ATOM 0 HD3 LYS A 116 10.203 -5.258 -3.661 1.00 0.00 H new ATOM 0 HE2 LYS A 116 11.138 -7.623 -4.164 1.00 0.00 H new ATOM 0 HE3 LYS A 116 12.289 -6.821 -5.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 13.198 -7.149 -3.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 13.040 -5.489 -3.330 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 11.926 -6.266 -2.312 1.00 0.00 H new ATOM 1709 N GLU A 117 10.152 -4.167 -10.101 1.00 0.00 N ATOM 1710 CA GLU A 117 10.590 -4.265 -11.488 1.00 0.00 C ATOM 1711 C GLU A 117 11.926 -3.555 -11.688 1.00 0.00 C ATOM 1712 O GLU A 117 11.968 -2.372 -12.028 1.00 0.00 O ATOM 1713 CB GLU A 117 9.537 -3.666 -12.423 1.00 0.00 C ATOM 1714 CG GLU A 117 8.502 -4.673 -12.898 1.00 0.00 C ATOM 1715 CD GLU A 117 8.909 -5.365 -14.184 1.00 0.00 C ATOM 1716 OE1 GLU A 117 10.056 -5.851 -14.260 1.00 0.00 O ATOM 1717 OE2 GLU A 117 8.078 -5.419 -15.115 1.00 0.00 O ATOM 0 H GLU A 117 9.627 -3.320 -9.883 1.00 0.00 H new ATOM 0 HA GLU A 117 10.719 -5.321 -11.727 1.00 0.00 H new ATOM 0 HB2 GLU A 117 9.029 -2.850 -11.909 1.00 0.00 H new ATOM 0 HB3 GLU A 117 10.037 -3.234 -13.290 1.00 0.00 H new ATOM 0 HG2 GLU A 117 8.345 -5.421 -12.121 1.00 0.00 H new ATOM 0 HG3 GLU A 117 7.549 -4.166 -13.049 1.00 0.00 H new ATOM 1724 N VAL A 118 13.016 -4.285 -11.475 1.00 0.00 N ATOM 1725 CA VAL A 118 14.354 -3.726 -11.632 1.00 0.00 C ATOM 1726 C VAL A 118 14.702 -3.539 -13.104 1.00 0.00 C ATOM 1727 O VAL A 118 15.266 -2.517 -13.495 1.00 0.00 O ATOM 1728 CB VAL A 118 15.418 -4.625 -10.974 1.00 0.00 C ATOM 1729 CG1 VAL A 118 16.810 -4.056 -11.200 1.00 0.00 C ATOM 1730 CG2 VAL A 118 15.133 -4.787 -9.488 1.00 0.00 C ATOM 0 H VAL A 118 12.999 -5.265 -11.193 1.00 0.00 H new ATOM 0 HA VAL A 118 14.352 -2.755 -11.136 1.00 0.00 H new ATOM 0 HB VAL A 118 15.375 -5.610 -11.438 1.00 0.00 H new ATOM 0 HG11 VAL A 118 17.549 -4.704 -10.728 1.00 0.00 H new ATOM 0 HG12 VAL A 118 17.010 -3.997 -12.270 1.00 0.00 H new ATOM 0 HG13 VAL A 118 16.871 -3.059 -10.764 1.00 0.00 H new ATOM 0 HG21 VAL A 118 15.894 -5.425 -9.039 1.00 0.00 H new ATOM 0 HG22 VAL A 118 15.148 -3.810 -9.006 1.00 0.00 H new ATOM 0 HG23 VAL A 118 14.152 -5.243 -9.353 1.00 0.00 H new ATOM 1740 N THR A 119 14.361 -4.533 -13.918 1.00 0.00 N ATOM 1741 CA THR A 119 14.638 -4.479 -15.348 1.00 0.00 C ATOM 1742 C THR A 119 13.711 -3.494 -16.051 1.00 0.00 C ATOM 1743 O THR A 119 12.501 -3.710 -16.127 1.00 0.00 O ATOM 1744 CB THR A 119 14.486 -5.865 -16.002 1.00 0.00 C ATOM 1745 OG1 THR A 119 13.438 -6.599 -15.358 1.00 0.00 O ATOM 1746 CG2 THR A 119 15.787 -6.649 -15.918 1.00 0.00 C ATOM 0 H THR A 119 13.892 -5.385 -13.611 1.00 0.00 H new ATOM 0 HA THR A 119 15.670 -4.144 -15.458 1.00 0.00 H new ATOM 0 HB THR A 119 14.235 -5.721 -17.053 1.00 0.00 H new ATOM 0 HG1 THR A 119 13.347 -7.478 -15.781 1.00 0.00 H new ATOM 0 HG21 THR A 119 15.655 -7.624 -16.386 1.00 0.00 H new ATOM 0 HG22 THR A 119 16.575 -6.102 -16.435 1.00 0.00 H new ATOM 0 HG23 THR A 119 16.064 -6.783 -14.872 1.00 0.00 H new TER 1754 THR A 119