USER MOD reduce.3.24.130724 H: found=0, std=0, add=910, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 908 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 67 ASN : amide:sc= 0.72 K(o=1.4,f=0.63) USER MOD Set 1.2: A 70 SER OG : rot 162:sc= 0.657 USER MOD Set 2.1: A 58 LYS NZ :NH3+ 148:sc= 1.89 (180deg=0) USER MOD Set 2.2: A 71 THR OG1 : rot 180:sc= 0.832 USER MOD Set 2.3: A 72 SER OG : rot 180:sc= 0.808 USER MOD Set 3.1: A 48 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 93 LYS NZ :NH3+ -160:sc= 1.77 (180deg=1.56) USER MOD Set 4.1: A 34 ASN : amide:sc= -0.0608 K(o=0.11,f=-2.8!) USER MOD Set 4.2: A 37 THR OG1 : rot 51:sc= 0.168 USER MOD Set 5.1: A 12 TYR OH : rot 180:sc= 0.342 USER MOD Set 5.2: A 16 LYS NZ :NH3+ 180:sc= 0.355 (180deg=0) USER MOD Single : A 1 ARG N :NH3+ 179:sc= 0.927 (180deg=0.926) USER MOD Single : A 5 GLN : amide:sc= 0.823 K(o=0.82,f=-6.3!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 MET CE :methyl -171:sc= -0.267 (180deg=-0.572) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 THR OG1 : rot 130:sc= 0.379 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 GLN : amide:sc= 0.674 K(o=0.67,f=0) USER MOD Single : A 38 MET CE :methyl 174:sc= -1.82 (180deg=-1.83) USER MOD Single : A 40 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 43 GLN : amide:sc= 0.306 K(o=0.31,f=-0.31) USER MOD Single : A 44 LYS NZ :NH3+ -179:sc= 1.3 (180deg=1.29) USER MOD Single : A 50 THR OG1 : rot 86:sc= 0.17 USER MOD Single : A 52 THR OG1 : rot 78:sc= 0.272 USER MOD Single : A 56 GLN : amide:sc= -0.0214 X(o=-0.021,f=-0.019) USER MOD Single : A 59 HIS : no HD1:sc= -0.012 X(o=-0.012,f=0) USER MOD Single : A 61 TYR OH : rot 169:sc= 1.21 USER MOD Single : A 75 THR OG1 : rot -150:sc= -0.3 USER MOD Single : A 76 CYS SG : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 80:sc= 1.21 USER MOD Single : A 80 HIS : no HD1:sc= -0.882 X(o=-0.88,f=-0.81) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ -158:sc= 0.762 (180deg=0.441) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 1 -6.705 0.833 -7.369 1.00 0.00 N ATOM 2 CA ARG A 1 -5.383 0.960 -6.694 1.00 0.00 C ATOM 3 C ARG A 1 -5.170 -0.051 -5.571 1.00 0.00 C ATOM 4 O ARG A 1 -4.118 -0.680 -5.529 1.00 0.00 O ATOM 5 CB ARG A 1 -5.065 2.405 -6.239 1.00 0.00 C ATOM 6 CG ARG A 1 -3.565 2.617 -5.926 1.00 0.00 C ATOM 7 CD ARG A 1 -3.163 2.422 -4.455 1.00 0.00 C ATOM 8 NE ARG A 1 -1.696 2.377 -4.297 1.00 0.00 N ATOM 9 CZ ARG A 1 -0.842 3.380 -4.315 1.00 0.00 C ATOM 10 NH1 ARG A 1 -1.205 4.617 -4.499 1.00 0.00 N ATOM 11 NH2 ARG A 1 0.421 3.137 -4.135 1.00 0.00 N ATOM 0 H1 ARG A 1 -6.789 1.560 -8.108 1.00 0.00 H new ATOM 0 H2 ARG A 1 -6.786 -0.110 -7.800 1.00 0.00 H new ATOM 0 H3 ARG A 1 -7.465 0.960 -6.671 1.00 0.00 H new ATOM 0 HA ARG A 1 -4.656 0.711 -7.467 1.00 0.00 H new ATOM 0 HB2 ARG A 1 -5.371 3.102 -7.019 1.00 0.00 H new ATOM 0 HB3 ARG A 1 -5.654 2.640 -5.352 1.00 0.00 H new ATOM 0 HG2 ARG A 1 -2.983 1.928 -6.538 1.00 0.00 H new ATOM 0 HG3 ARG A 1 -3.287 3.626 -6.230 1.00 0.00 H new ATOM 0 HD2 ARG A 1 -3.570 3.236 -3.854 1.00 0.00 H new ATOM 0 HD3 ARG A 1 -3.599 1.498 -4.077 1.00 0.00 H new ATOM 0 HE ARG A 1 -1.292 1.451 -4.156 1.00 0.00 H new ATOM 0 HH11 ARG A 1 -2.190 4.844 -4.638 1.00 0.00 H new ATOM 0 HH12 ARG A 1 -0.505 5.359 -4.504 1.00 0.00 H new ATOM 0 HH21 ARG A 1 0.740 2.180 -3.982 1.00 0.00 H new ATOM 0 HH22 ARG A 1 1.094 3.903 -4.146 1.00 0.00 H new ATOM 27 N ALA A 2 -6.098 -0.178 -4.618 1.00 0.00 N ATOM 28 CA ALA A 2 -5.861 -0.965 -3.396 1.00 0.00 C ATOM 29 C ALA A 2 -5.843 -2.490 -3.619 1.00 0.00 C ATOM 30 O ALA A 2 -5.094 -3.201 -2.951 1.00 0.00 O ATOM 31 CB ALA A 2 -6.917 -0.566 -2.358 1.00 0.00 C ATOM 0 H ALA A 2 -7.021 0.253 -4.666 1.00 0.00 H new ATOM 0 HA ALA A 2 -4.858 -0.732 -3.040 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -6.761 -1.137 -1.443 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -6.830 0.499 -2.141 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -7.912 -0.776 -2.752 1.00 0.00 H new ATOM 37 N ASP A 3 -6.619 -2.997 -4.579 1.00 0.00 N ATOM 38 CA ASP A 3 -6.590 -4.423 -4.945 1.00 0.00 C ATOM 39 C ASP A 3 -5.284 -4.804 -5.672 1.00 0.00 C ATOM 40 O ASP A 3 -4.697 -5.849 -5.393 1.00 0.00 O ATOM 41 CB ASP A 3 -7.811 -4.744 -5.815 1.00 0.00 C ATOM 42 CG ASP A 3 -7.920 -6.249 -6.108 1.00 0.00 C ATOM 43 OD1 ASP A 3 -8.253 -7.021 -5.177 1.00 0.00 O ATOM 44 OD2 ASP A 3 -7.709 -6.659 -7.274 1.00 0.00 O ATOM 0 H ASP A 3 -7.280 -2.442 -5.122 1.00 0.00 H new ATOM 0 HA ASP A 3 -6.625 -5.015 -4.031 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -8.716 -4.405 -5.311 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -7.744 -4.194 -6.754 1.00 0.00 H new ATOM 49 N GLU A 4 -4.793 -3.903 -6.533 1.00 0.00 N ATOM 50 CA GLU A 4 -3.485 -4.057 -7.178 1.00 0.00 C ATOM 51 C GLU A 4 -2.402 -3.992 -6.104 1.00 0.00 C ATOM 52 O GLU A 4 -1.527 -4.848 -6.040 1.00 0.00 O ATOM 53 CB GLU A 4 -3.270 -2.947 -8.222 1.00 0.00 C ATOM 54 CG GLU A 4 -4.271 -2.960 -9.394 1.00 0.00 C ATOM 55 CD GLU A 4 -5.696 -2.468 -9.052 1.00 0.00 C ATOM 56 OE1 GLU A 4 -5.884 -1.729 -8.053 1.00 0.00 O ATOM 57 OE2 GLU A 4 -6.644 -2.793 -9.807 1.00 0.00 O ATOM 0 H GLU A 4 -5.289 -3.052 -6.800 1.00 0.00 H new ATOM 0 HA GLU A 4 -3.438 -5.017 -7.692 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -3.330 -1.980 -7.722 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -2.261 -3.036 -8.624 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -3.873 -2.339 -10.197 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -4.339 -3.977 -9.781 1.00 0.00 H new ATOM 64 N GLN A 5 -2.511 -3.023 -5.192 1.00 0.00 N ATOM 65 CA GLN A 5 -1.559 -2.869 -4.102 1.00 0.00 C ATOM 66 C GLN A 5 -1.482 -4.132 -3.233 1.00 0.00 C ATOM 67 O GLN A 5 -0.387 -4.606 -2.936 1.00 0.00 O ATOM 68 CB GLN A 5 -1.924 -1.620 -3.277 1.00 0.00 C ATOM 69 CG GLN A 5 -0.839 -1.198 -2.282 1.00 0.00 C ATOM 70 CD GLN A 5 0.422 -0.732 -3.000 1.00 0.00 C ATOM 71 OE1 GLN A 5 0.508 0.384 -3.496 1.00 0.00 O ATOM 72 NE2 GLN A 5 1.422 -1.574 -3.114 1.00 0.00 N ATOM 0 H GLN A 5 -3.259 -2.329 -5.192 1.00 0.00 H new ATOM 0 HA GLN A 5 -0.562 -2.729 -4.520 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -2.122 -0.792 -3.957 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -2.848 -1.813 -2.732 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -1.216 -0.396 -1.648 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -0.598 -2.035 -1.627 1.00 0.00 H new ATOM 0 HE21 GLN A 5 1.354 -2.505 -2.702 1.00 0.00 H new ATOM 0 HE22 GLN A 5 2.267 -1.298 -3.614 1.00 0.00 H new ATOM 81 N ALA A 6 -2.629 -4.725 -2.891 1.00 0.00 N ATOM 82 CA ALA A 6 -2.687 -5.971 -2.135 1.00 0.00 C ATOM 83 C ALA A 6 -2.034 -7.136 -2.901 1.00 0.00 C ATOM 84 O ALA A 6 -1.146 -7.811 -2.370 1.00 0.00 O ATOM 85 CB ALA A 6 -4.149 -6.266 -1.779 1.00 0.00 C ATOM 0 H ALA A 6 -3.546 -4.349 -3.134 1.00 0.00 H new ATOM 0 HA ALA A 6 -2.113 -5.860 -1.215 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -4.205 -7.196 -1.213 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -4.549 -5.450 -1.177 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -4.734 -6.362 -2.694 1.00 0.00 H new ATOM 91 N PHE A 7 -2.393 -7.331 -4.176 1.00 0.00 N ATOM 92 CA PHE A 7 -1.826 -8.411 -4.986 1.00 0.00 C ATOM 93 C PHE A 7 -0.366 -8.161 -5.406 1.00 0.00 C ATOM 94 O PHE A 7 0.357 -9.113 -5.712 1.00 0.00 O ATOM 95 CB PHE A 7 -2.786 -8.787 -6.134 1.00 0.00 C ATOM 96 CG PHE A 7 -2.751 -8.050 -7.470 1.00 0.00 C ATOM 97 CD1 PHE A 7 -1.604 -8.068 -8.290 1.00 0.00 C ATOM 98 CD2 PHE A 7 -3.942 -7.496 -7.984 1.00 0.00 C ATOM 99 CE1 PHE A 7 -1.637 -7.510 -9.577 1.00 0.00 C ATOM 100 CE2 PHE A 7 -3.980 -6.949 -9.281 1.00 0.00 C ATOM 101 CZ PHE A 7 -2.823 -6.947 -10.076 1.00 0.00 C ATOM 0 H PHE A 7 -3.075 -6.753 -4.667 1.00 0.00 H new ATOM 0 HA PHE A 7 -1.743 -9.299 -4.359 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -2.625 -9.843 -6.349 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -3.800 -8.692 -5.745 1.00 0.00 H new ATOM 0 HD1 PHE A 7 -0.692 -8.515 -7.924 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -4.835 -7.491 -7.376 1.00 0.00 H new ATOM 0 HE1 PHE A 7 -0.746 -7.513 -10.187 1.00 0.00 H new ATOM 0 HE2 PHE A 7 -4.899 -6.531 -9.664 1.00 0.00 H new ATOM 0 HZ PHE A 7 -2.845 -6.515 -11.066 1.00 0.00 H new ATOM 111 N LEU A 8 0.110 -6.913 -5.315 1.00 0.00 N ATOM 112 CA LEU A 8 1.515 -6.628 -5.611 1.00 0.00 C ATOM 113 C LEU A 8 2.367 -6.668 -4.338 1.00 0.00 C ATOM 114 O LEU A 8 3.564 -6.905 -4.445 1.00 0.00 O ATOM 115 CB LEU A 8 1.623 -5.269 -6.316 1.00 0.00 C ATOM 116 CG LEU A 8 1.099 -5.315 -7.764 1.00 0.00 C ATOM 117 CD1 LEU A 8 1.069 -3.894 -8.327 1.00 0.00 C ATOM 118 CD2 LEU A 8 1.970 -6.215 -8.639 1.00 0.00 C ATOM 0 H LEU A 8 -0.445 -6.101 -5.044 1.00 0.00 H new ATOM 0 HA LEU A 8 1.902 -7.399 -6.277 1.00 0.00 H new ATOM 0 HB2 LEU A 8 1.060 -4.525 -5.752 1.00 0.00 H new ATOM 0 HB3 LEU A 8 2.664 -4.946 -6.319 1.00 0.00 H new ATOM 0 HG LEU A 8 0.093 -5.733 -7.763 1.00 0.00 H new ATOM 0 HD11 LEU A 8 0.699 -3.917 -9.352 1.00 0.00 H new ATOM 0 HD12 LEU A 8 0.411 -3.275 -7.717 1.00 0.00 H new ATOM 0 HD13 LEU A 8 2.076 -3.476 -8.313 1.00 0.00 H new ATOM 0 HD21 LEU A 8 1.575 -6.227 -9.655 1.00 0.00 H new ATOM 0 HD22 LEU A 8 2.991 -5.833 -8.651 1.00 0.00 H new ATOM 0 HD23 LEU A 8 1.966 -7.228 -8.236 1.00 0.00 H new ATOM 130 N VAL A 9 1.774 -6.499 -3.144 1.00 0.00 N ATOM 131 CA VAL A 9 2.467 -6.825 -1.882 1.00 0.00 C ATOM 132 C VAL A 9 2.628 -8.347 -1.777 1.00 0.00 C ATOM 133 O VAL A 9 3.702 -8.840 -1.436 1.00 0.00 O ATOM 134 CB VAL A 9 1.723 -6.240 -0.660 1.00 0.00 C ATOM 135 CG1 VAL A 9 2.190 -6.823 0.681 1.00 0.00 C ATOM 136 CG2 VAL A 9 1.955 -4.722 -0.594 1.00 0.00 C ATOM 0 H VAL A 9 0.826 -6.142 -3.024 1.00 0.00 H new ATOM 0 HA VAL A 9 3.456 -6.366 -1.887 1.00 0.00 H new ATOM 0 HB VAL A 9 0.673 -6.497 -0.801 1.00 0.00 H new ATOM 0 HG11 VAL A 9 1.624 -6.366 1.493 1.00 0.00 H new ATOM 0 HG12 VAL A 9 2.026 -7.901 0.686 1.00 0.00 H new ATOM 0 HG13 VAL A 9 3.252 -6.617 0.817 1.00 0.00 H new ATOM 0 HG21 VAL A 9 1.430 -4.311 0.268 1.00 0.00 H new ATOM 0 HG22 VAL A 9 3.022 -4.521 -0.499 1.00 0.00 H new ATOM 0 HG23 VAL A 9 1.578 -4.256 -1.505 1.00 0.00 H new ATOM 146 N ALA A 10 1.586 -9.090 -2.159 1.00 0.00 N ATOM 147 CA ALA A 10 1.665 -10.549 -2.277 1.00 0.00 C ATOM 148 C ALA A 10 2.761 -11.010 -3.266 1.00 0.00 C ATOM 149 O ALA A 10 3.627 -11.815 -2.896 1.00 0.00 O ATOM 150 CB ALA A 10 0.281 -11.100 -2.636 1.00 0.00 C ATOM 0 H ALA A 10 0.672 -8.702 -2.393 1.00 0.00 H new ATOM 0 HA ALA A 10 1.967 -10.959 -1.313 1.00 0.00 H new ATOM 0 HB1 ALA A 10 0.333 -12.185 -2.725 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -0.430 -10.834 -1.854 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -0.046 -10.673 -3.584 1.00 0.00 H new ATOM 156 N LEU A 11 2.799 -10.455 -4.489 1.00 0.00 N ATOM 157 CA LEU A 11 3.895 -10.754 -5.419 1.00 0.00 C ATOM 158 C LEU A 11 5.255 -10.202 -4.962 1.00 0.00 C ATOM 159 O LEU A 11 6.258 -10.862 -5.191 1.00 0.00 O ATOM 160 CB LEU A 11 3.541 -10.320 -6.848 1.00 0.00 C ATOM 161 CG LEU A 11 4.587 -10.733 -7.912 1.00 0.00 C ATOM 162 CD1 LEU A 11 4.958 -12.215 -7.942 1.00 0.00 C ATOM 163 CD2 LEU A 11 4.011 -10.399 -9.282 1.00 0.00 C ATOM 0 H LEU A 11 2.097 -9.809 -4.850 1.00 0.00 H new ATOM 0 HA LEU A 11 4.013 -11.838 -5.419 1.00 0.00 H new ATOM 0 HB2 LEU A 11 2.576 -10.749 -7.118 1.00 0.00 H new ATOM 0 HB3 LEU A 11 3.426 -9.236 -6.869 1.00 0.00 H new ATOM 0 HG LEU A 11 5.496 -10.191 -7.652 1.00 0.00 H new ATOM 0 HD11 LEU A 11 5.697 -12.389 -8.724 1.00 0.00 H new ATOM 0 HD12 LEU A 11 5.375 -12.505 -6.978 1.00 0.00 H new ATOM 0 HD13 LEU A 11 4.067 -12.809 -8.146 1.00 0.00 H new ATOM 0 HD21 LEU A 11 4.726 -10.679 -10.055 1.00 0.00 H new ATOM 0 HD22 LEU A 11 3.082 -10.950 -9.430 1.00 0.00 H new ATOM 0 HD23 LEU A 11 3.812 -9.329 -9.342 1.00 0.00 H new ATOM 175 N TYR A 12 5.332 -9.067 -4.262 1.00 0.00 N ATOM 176 CA TYR A 12 6.564 -8.576 -3.623 1.00 0.00 C ATOM 177 C TYR A 12 7.120 -9.579 -2.602 1.00 0.00 C ATOM 178 O TYR A 12 8.321 -9.864 -2.617 1.00 0.00 O ATOM 179 CB TYR A 12 6.291 -7.209 -2.979 1.00 0.00 C ATOM 180 CG TYR A 12 7.226 -6.760 -1.870 1.00 0.00 C ATOM 181 CD1 TYR A 12 8.620 -6.792 -2.050 1.00 0.00 C ATOM 182 CD2 TYR A 12 6.689 -6.290 -0.655 1.00 0.00 C ATOM 183 CE1 TYR A 12 9.479 -6.320 -1.040 1.00 0.00 C ATOM 184 CE2 TYR A 12 7.541 -5.822 0.362 1.00 0.00 C ATOM 185 CZ TYR A 12 8.941 -5.821 0.166 1.00 0.00 C ATOM 186 OH TYR A 12 9.764 -5.352 1.144 1.00 0.00 O ATOM 0 H TYR A 12 4.531 -8.452 -4.119 1.00 0.00 H new ATOM 0 HA TYR A 12 7.332 -8.462 -4.388 1.00 0.00 H new ATOM 0 HB2 TYR A 12 6.315 -6.455 -3.766 1.00 0.00 H new ATOM 0 HB3 TYR A 12 5.277 -7.221 -2.580 1.00 0.00 H new ATOM 0 HD1 TYR A 12 9.034 -7.181 -2.969 1.00 0.00 H new ATOM 0 HD2 TYR A 12 5.620 -6.289 -0.504 1.00 0.00 H new ATOM 0 HE1 TYR A 12 10.549 -6.340 -1.187 1.00 0.00 H new ATOM 0 HE2 TYR A 12 7.126 -5.464 1.292 1.00 0.00 H new ATOM 0 HH TYR A 12 9.227 -5.046 1.905 1.00 0.00 H new ATOM 196 N LYS A 13 6.264 -10.181 -1.769 1.00 0.00 N ATOM 197 CA LYS A 13 6.668 -11.263 -0.863 1.00 0.00 C ATOM 198 C LYS A 13 7.164 -12.482 -1.638 1.00 0.00 C ATOM 199 O LYS A 13 8.245 -12.980 -1.326 1.00 0.00 O ATOM 200 CB LYS A 13 5.516 -11.624 0.092 1.00 0.00 C ATOM 201 CG LYS A 13 5.222 -10.541 1.148 1.00 0.00 C ATOM 202 CD LYS A 13 6.246 -10.455 2.291 1.00 0.00 C ATOM 203 CE LYS A 13 6.221 -11.714 3.173 1.00 0.00 C ATOM 204 NZ LYS A 13 7.101 -11.569 4.362 1.00 0.00 N ATOM 0 H LYS A 13 5.277 -9.934 -1.703 1.00 0.00 H new ATOM 0 HA LYS A 13 7.504 -10.909 -0.260 1.00 0.00 H new ATOM 0 HB2 LYS A 13 4.614 -11.802 -0.493 1.00 0.00 H new ATOM 0 HB3 LYS A 13 5.756 -12.558 0.600 1.00 0.00 H new ATOM 0 HG2 LYS A 13 5.173 -9.573 0.650 1.00 0.00 H new ATOM 0 HG3 LYS A 13 4.237 -10.729 1.576 1.00 0.00 H new ATOM 0 HD2 LYS A 13 7.245 -10.322 1.875 1.00 0.00 H new ATOM 0 HD3 LYS A 13 6.036 -9.578 2.903 1.00 0.00 H new ATOM 0 HE2 LYS A 13 5.199 -11.911 3.498 1.00 0.00 H new ATOM 0 HE3 LYS A 13 6.540 -12.576 2.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 7.059 -12.437 4.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 8.080 -11.406 4.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 6.781 -10.762 4.935 1.00 0.00 H new ATOM 218 N TYR A 14 6.461 -12.934 -2.682 1.00 0.00 N ATOM 219 CA TYR A 14 6.921 -14.082 -3.481 1.00 0.00 C ATOM 220 C TYR A 14 8.211 -13.801 -4.269 1.00 0.00 C ATOM 221 O TYR A 14 9.072 -14.673 -4.381 1.00 0.00 O ATOM 222 CB TYR A 14 5.760 -14.455 -4.420 1.00 0.00 C ATOM 223 CG TYR A 14 5.996 -15.637 -5.342 1.00 0.00 C ATOM 224 CD1 TYR A 14 5.656 -16.938 -4.923 1.00 0.00 C ATOM 225 CD2 TYR A 14 6.496 -15.429 -6.644 1.00 0.00 C ATOM 226 CE1 TYR A 14 5.819 -18.027 -5.801 1.00 0.00 C ATOM 227 CE2 TYR A 14 6.647 -16.514 -7.529 1.00 0.00 C ATOM 228 CZ TYR A 14 6.314 -17.821 -7.107 1.00 0.00 C ATOM 229 OH TYR A 14 6.459 -18.879 -7.954 1.00 0.00 O ATOM 0 H TYR A 14 5.579 -12.529 -2.994 1.00 0.00 H new ATOM 0 HA TYR A 14 7.182 -14.906 -2.817 1.00 0.00 H new ATOM 0 HB2 TYR A 14 4.881 -14.666 -3.811 1.00 0.00 H new ATOM 0 HB3 TYR A 14 5.522 -13.585 -5.032 1.00 0.00 H new ATOM 0 HD1 TYR A 14 5.270 -17.101 -3.928 1.00 0.00 H new ATOM 0 HD2 TYR A 14 6.764 -14.433 -6.964 1.00 0.00 H new ATOM 0 HE1 TYR A 14 5.564 -19.024 -5.474 1.00 0.00 H new ATOM 0 HE2 TYR A 14 7.017 -16.347 -8.530 1.00 0.00 H new ATOM 0 HH TYR A 14 6.810 -18.564 -8.813 1.00 0.00 H new ATOM 239 N MET A 15 8.368 -12.576 -4.769 1.00 0.00 N ATOM 240 CA MET A 15 9.562 -12.049 -5.425 1.00 0.00 C ATOM 241 C MET A 15 10.771 -12.095 -4.468 1.00 0.00 C ATOM 242 O MET A 15 11.810 -12.667 -4.810 1.00 0.00 O ATOM 243 CB MET A 15 9.242 -10.617 -5.904 1.00 0.00 C ATOM 244 CG MET A 15 10.450 -9.778 -6.314 1.00 0.00 C ATOM 245 SD MET A 15 10.948 -9.772 -8.068 1.00 0.00 S ATOM 246 CE MET A 15 10.946 -11.535 -8.488 1.00 0.00 C ATOM 0 H MET A 15 7.620 -11.884 -4.724 1.00 0.00 H new ATOM 0 HA MET A 15 9.835 -12.658 -6.286 1.00 0.00 H new ATOM 0 HB2 MET A 15 8.560 -10.680 -6.752 1.00 0.00 H new ATOM 0 HB3 MET A 15 8.712 -10.095 -5.107 1.00 0.00 H new ATOM 0 HG2 MET A 15 10.252 -8.747 -6.022 1.00 0.00 H new ATOM 0 HG3 MET A 15 11.304 -10.117 -5.728 1.00 0.00 H new ATOM 0 HE1 MET A 15 11.384 -11.674 -9.476 1.00 0.00 H new ATOM 0 HE2 MET A 15 11.531 -12.085 -7.751 1.00 0.00 H new ATOM 0 HE3 MET A 15 9.922 -11.907 -8.490 1.00 0.00 H new ATOM 256 N LYS A 16 10.629 -11.531 -3.254 1.00 0.00 N ATOM 257 CA LYS A 16 11.679 -11.606 -2.222 1.00 0.00 C ATOM 258 C LYS A 16 12.026 -13.058 -1.870 1.00 0.00 C ATOM 259 O LYS A 16 13.198 -13.411 -1.770 1.00 0.00 O ATOM 260 CB LYS A 16 11.203 -10.809 -0.992 1.00 0.00 C ATOM 261 CG LYS A 16 12.315 -10.612 0.053 1.00 0.00 C ATOM 262 CD LYS A 16 11.806 -9.965 1.354 1.00 0.00 C ATOM 263 CE LYS A 16 11.207 -8.567 1.134 1.00 0.00 C ATOM 264 NZ LYS A 16 10.818 -7.928 2.420 1.00 0.00 N ATOM 0 H LYS A 16 9.796 -11.018 -2.964 1.00 0.00 H new ATOM 0 HA LYS A 16 12.601 -11.167 -2.602 1.00 0.00 H new ATOM 0 HB2 LYS A 16 10.836 -9.835 -1.315 1.00 0.00 H new ATOM 0 HB3 LYS A 16 10.363 -11.328 -0.530 1.00 0.00 H new ATOM 0 HG2 LYS A 16 12.764 -11.578 0.285 1.00 0.00 H new ATOM 0 HG3 LYS A 16 13.101 -9.989 -0.373 1.00 0.00 H new ATOM 0 HD2 LYS A 16 11.052 -10.611 1.804 1.00 0.00 H new ATOM 0 HD3 LYS A 16 12.630 -9.894 2.064 1.00 0.00 H new ATOM 0 HE2 LYS A 16 11.932 -7.937 0.619 1.00 0.00 H new ATOM 0 HE3 LYS A 16 10.334 -8.643 0.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 10.418 -6.987 2.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 10.108 -8.517 2.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 11.656 -7.833 3.028 1.00 0.00 H new ATOM 278 N GLU A 17 11.001 -13.901 -1.757 1.00 0.00 N ATOM 279 CA GLU A 17 11.183 -15.333 -1.443 1.00 0.00 C ATOM 280 C GLU A 17 11.938 -16.091 -2.557 1.00 0.00 C ATOM 281 O GLU A 17 12.733 -16.984 -2.260 1.00 0.00 O ATOM 282 CB GLU A 17 9.819 -15.959 -1.116 1.00 0.00 C ATOM 283 CG GLU A 17 9.917 -17.404 -0.608 1.00 0.00 C ATOM 284 CD GLU A 17 8.527 -18.043 -0.475 1.00 0.00 C ATOM 285 OE1 GLU A 17 8.027 -18.573 -1.498 1.00 0.00 O ATOM 286 OE2 GLU A 17 7.939 -18.026 0.632 1.00 0.00 O ATOM 0 H GLU A 17 10.027 -13.623 -1.878 1.00 0.00 H new ATOM 0 HA GLU A 17 11.821 -15.420 -0.563 1.00 0.00 H new ATOM 0 HB2 GLU A 17 9.319 -15.350 -0.363 1.00 0.00 H new ATOM 0 HB3 GLU A 17 9.194 -15.937 -2.009 1.00 0.00 H new ATOM 0 HG2 GLU A 17 10.526 -17.993 -1.294 1.00 0.00 H new ATOM 0 HG3 GLU A 17 10.421 -17.419 0.359 1.00 0.00 H new ATOM 293 N ARG A 18 11.773 -15.681 -3.829 1.00 0.00 N ATOM 294 CA ARG A 18 12.617 -16.161 -4.951 1.00 0.00 C ATOM 295 C ARG A 18 14.117 -15.803 -4.845 1.00 0.00 C ATOM 296 O ARG A 18 14.891 -16.218 -5.709 1.00 0.00 O ATOM 297 CB ARG A 18 12.027 -15.657 -6.291 1.00 0.00 C ATOM 298 CG ARG A 18 11.328 -16.729 -7.142 1.00 0.00 C ATOM 299 CD ARG A 18 9.990 -17.211 -6.567 1.00 0.00 C ATOM 300 NE ARG A 18 10.143 -18.303 -5.586 1.00 0.00 N ATOM 301 CZ ARG A 18 9.471 -18.440 -4.457 1.00 0.00 C ATOM 302 NH1 ARG A 18 8.686 -17.526 -3.989 1.00 0.00 N ATOM 303 NH2 ARG A 18 9.564 -19.507 -3.723 1.00 0.00 N ATOM 0 H ARG A 18 11.057 -15.012 -4.112 1.00 0.00 H new ATOM 0 HA ARG A 18 12.592 -17.250 -4.901 1.00 0.00 H new ATOM 0 HB2 ARG A 18 11.313 -14.862 -6.079 1.00 0.00 H new ATOM 0 HB3 ARG A 18 12.831 -15.215 -6.880 1.00 0.00 H new ATOM 0 HG2 ARG A 18 11.159 -16.330 -8.142 1.00 0.00 H new ATOM 0 HG3 ARG A 18 11.995 -17.585 -7.249 1.00 0.00 H new ATOM 0 HD2 ARG A 18 9.482 -16.372 -6.092 1.00 0.00 H new ATOM 0 HD3 ARG A 18 9.351 -17.550 -7.383 1.00 0.00 H new ATOM 0 HE ARG A 18 10.835 -19.021 -5.801 1.00 0.00 H new ATOM 0 HH11 ARG A 18 8.563 -16.650 -4.497 1.00 0.00 H new ATOM 0 HH12 ARG A 18 8.189 -17.681 -3.112 1.00 0.00 H new ATOM 0 HH21 ARG A 18 10.171 -20.274 -4.013 1.00 0.00 H new ATOM 0 HH22 ARG A 18 9.030 -19.578 -2.857 1.00 0.00 H new ATOM 317 N LYS A 19 14.533 -15.052 -3.812 1.00 0.00 N ATOM 318 CA LYS A 19 15.911 -14.623 -3.492 1.00 0.00 C ATOM 319 C LYS A 19 16.413 -13.511 -4.419 1.00 0.00 C ATOM 320 O LYS A 19 17.615 -13.384 -4.664 1.00 0.00 O ATOM 321 CB LYS A 19 16.889 -15.815 -3.354 1.00 0.00 C ATOM 322 CG LYS A 19 16.413 -16.871 -2.343 1.00 0.00 C ATOM 323 CD LYS A 19 17.469 -17.975 -2.177 1.00 0.00 C ATOM 324 CE LYS A 19 16.995 -19.103 -1.251 1.00 0.00 C ATOM 325 NZ LYS A 19 16.878 -18.668 0.167 1.00 0.00 N ATOM 0 H LYS A 19 13.867 -14.700 -3.125 1.00 0.00 H new ATOM 0 HA LYS A 19 15.874 -14.170 -2.501 1.00 0.00 H new ATOM 0 HB2 LYS A 19 17.018 -16.286 -4.328 1.00 0.00 H new ATOM 0 HB3 LYS A 19 17.866 -15.442 -3.048 1.00 0.00 H new ATOM 0 HG2 LYS A 19 16.218 -16.399 -1.380 1.00 0.00 H new ATOM 0 HG3 LYS A 19 15.473 -17.307 -2.680 1.00 0.00 H new ATOM 0 HD2 LYS A 19 17.714 -18.390 -3.155 1.00 0.00 H new ATOM 0 HD3 LYS A 19 18.385 -17.541 -1.777 1.00 0.00 H new ATOM 0 HE2 LYS A 19 16.028 -19.469 -1.596 1.00 0.00 H new ATOM 0 HE3 LYS A 19 17.693 -19.938 -1.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 16.555 -19.467 0.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 17.805 -18.344 0.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 16.192 -17.889 0.236 1.00 0.00 H new ATOM 339 N THR A 20 15.483 -12.694 -4.927 1.00 0.00 N ATOM 340 CA THR A 20 15.815 -11.533 -5.761 1.00 0.00 C ATOM 341 C THR A 20 14.861 -10.364 -5.424 1.00 0.00 C ATOM 342 O THR A 20 13.835 -10.189 -6.078 1.00 0.00 O ATOM 343 CB THR A 20 15.903 -11.949 -7.245 1.00 0.00 C ATOM 344 OG1 THR A 20 16.357 -10.883 -8.055 1.00 0.00 O ATOM 345 CG2 THR A 20 14.622 -12.519 -7.863 1.00 0.00 C ATOM 0 H THR A 20 14.482 -12.818 -4.772 1.00 0.00 H new ATOM 0 HA THR A 20 16.810 -11.148 -5.539 1.00 0.00 H new ATOM 0 HB THR A 20 16.622 -12.768 -7.226 1.00 0.00 H new ATOM 0 HG1 THR A 20 17.093 -11.194 -8.622 1.00 0.00 H new ATOM 0 HG21 THR A 20 14.804 -12.775 -8.907 1.00 0.00 H new ATOM 0 HG22 THR A 20 14.321 -13.413 -7.317 1.00 0.00 H new ATOM 0 HG23 THR A 20 13.828 -11.775 -7.806 1.00 0.00 H new ATOM 353 N PRO A 21 15.113 -9.628 -4.315 1.00 0.00 N ATOM 354 CA PRO A 21 14.236 -8.570 -3.795 1.00 0.00 C ATOM 355 C PRO A 21 13.789 -7.518 -4.821 1.00 0.00 C ATOM 356 O PRO A 21 14.518 -7.190 -5.762 1.00 0.00 O ATOM 357 CB PRO A 21 15.009 -7.917 -2.642 1.00 0.00 C ATOM 358 CG PRO A 21 15.899 -9.044 -2.134 1.00 0.00 C ATOM 359 CD PRO A 21 16.250 -9.799 -3.413 1.00 0.00 C ATOM 0 HA PRO A 21 13.296 -9.023 -3.481 1.00 0.00 H new ATOM 0 HB2 PRO A 21 15.596 -7.064 -2.983 1.00 0.00 H new ATOM 0 HB3 PRO A 21 14.338 -7.552 -1.864 1.00 0.00 H new ATOM 0 HG2 PRO A 21 16.788 -8.662 -1.632 1.00 0.00 H new ATOM 0 HG3 PRO A 21 15.378 -9.680 -1.419 1.00 0.00 H new ATOM 0 HD2 PRO A 21 17.163 -9.405 -3.859 1.00 0.00 H new ATOM 0 HD3 PRO A 21 16.427 -10.854 -3.206 1.00 0.00 H new ATOM 367 N ILE A 22 12.595 -6.951 -4.602 1.00 0.00 N ATOM 368 CA ILE A 22 11.950 -6.061 -5.589 1.00 0.00 C ATOM 369 C ILE A 22 12.733 -4.777 -5.893 1.00 0.00 C ATOM 370 O ILE A 22 12.582 -4.229 -6.979 1.00 0.00 O ATOM 371 CB ILE A 22 10.480 -5.783 -5.197 1.00 0.00 C ATOM 372 CG1 ILE A 22 9.635 -5.377 -6.424 1.00 0.00 C ATOM 373 CG2 ILE A 22 10.380 -4.738 -4.071 1.00 0.00 C ATOM 374 CD1 ILE A 22 8.122 -5.479 -6.179 1.00 0.00 C ATOM 0 H ILE A 22 12.052 -7.090 -3.750 1.00 0.00 H new ATOM 0 HA ILE A 22 11.955 -6.603 -6.535 1.00 0.00 H new ATOM 0 HB ILE A 22 10.067 -6.714 -4.810 1.00 0.00 H new ATOM 0 HG12 ILE A 22 9.883 -4.353 -6.705 1.00 0.00 H new ATOM 0 HG13 ILE A 22 9.903 -6.013 -7.268 1.00 0.00 H new ATOM 0 HG21 ILE A 22 9.332 -4.569 -3.823 1.00 0.00 H new ATOM 0 HG22 ILE A 22 10.907 -5.102 -3.189 1.00 0.00 H new ATOM 0 HG23 ILE A 22 10.830 -3.802 -4.402 1.00 0.00 H new ATOM 0 HD11 ILE A 22 7.587 -5.180 -7.080 1.00 0.00 H new ATOM 0 HD12 ILE A 22 7.863 -6.507 -5.927 1.00 0.00 H new ATOM 0 HD13 ILE A 22 7.842 -4.822 -5.355 1.00 0.00 H new ATOM 386 N GLU A 23 13.615 -4.320 -4.995 1.00 0.00 N ATOM 387 CA GLU A 23 14.496 -3.166 -5.263 1.00 0.00 C ATOM 388 C GLU A 23 15.345 -3.261 -6.555 1.00 0.00 C ATOM 389 O GLU A 23 15.826 -2.243 -7.056 1.00 0.00 O ATOM 390 CB GLU A 23 15.374 -2.960 -4.013 1.00 0.00 C ATOM 391 CG GLU A 23 16.108 -1.613 -3.971 1.00 0.00 C ATOM 392 CD GLU A 23 16.783 -1.399 -2.602 1.00 0.00 C ATOM 393 OE1 GLU A 23 17.935 -1.862 -2.409 1.00 0.00 O ATOM 394 OE2 GLU A 23 16.173 -0.755 -1.712 1.00 0.00 O ATOM 0 H GLU A 23 13.741 -4.732 -4.070 1.00 0.00 H new ATOM 0 HA GLU A 23 13.861 -2.301 -5.456 1.00 0.00 H new ATOM 0 HB2 GLU A 23 14.748 -3.047 -3.125 1.00 0.00 H new ATOM 0 HB3 GLU A 23 16.110 -3.763 -3.964 1.00 0.00 H new ATOM 0 HG2 GLU A 23 16.858 -1.578 -4.761 1.00 0.00 H new ATOM 0 HG3 GLU A 23 15.404 -0.804 -4.165 1.00 0.00 H new ATOM 401 N ARG A 24 15.482 -4.460 -7.142 1.00 0.00 N ATOM 402 CA ARG A 24 16.051 -4.686 -8.484 1.00 0.00 C ATOM 403 C ARG A 24 15.325 -3.939 -9.623 1.00 0.00 C ATOM 404 O ARG A 24 15.886 -3.786 -10.707 1.00 0.00 O ATOM 405 CB ARG A 24 16.107 -6.203 -8.746 1.00 0.00 C ATOM 406 CG ARG A 24 14.738 -6.832 -9.079 1.00 0.00 C ATOM 407 CD ARG A 24 14.827 -8.364 -9.049 1.00 0.00 C ATOM 408 NE ARG A 24 13.771 -8.978 -9.875 1.00 0.00 N ATOM 409 CZ ARG A 24 13.907 -10.039 -10.650 1.00 0.00 C ATOM 410 NH1 ARG A 24 14.971 -10.787 -10.618 1.00 0.00 N ATOM 411 NH2 ARG A 24 12.964 -10.373 -11.483 1.00 0.00 N ATOM 0 H ARG A 24 15.192 -5.325 -6.685 1.00 0.00 H new ATOM 0 HA ARG A 24 17.055 -4.261 -8.486 1.00 0.00 H new ATOM 0 HB2 ARG A 24 16.794 -6.394 -9.571 1.00 0.00 H new ATOM 0 HB3 ARG A 24 16.519 -6.698 -7.867 1.00 0.00 H new ATOM 0 HG2 ARG A 24 13.991 -6.491 -8.362 1.00 0.00 H new ATOM 0 HG3 ARG A 24 14.409 -6.500 -10.064 1.00 0.00 H new ATOM 0 HD2 ARG A 24 15.805 -8.681 -9.411 1.00 0.00 H new ATOM 0 HD3 ARG A 24 14.738 -8.716 -8.021 1.00 0.00 H new ATOM 0 HE ARG A 24 12.849 -8.543 -9.845 1.00 0.00 H new ATOM 0 HH11 ARG A 24 15.734 -10.561 -9.980 1.00 0.00 H new ATOM 0 HH12 ARG A 24 15.042 -11.599 -11.231 1.00 0.00 H new ATOM 0 HH21 ARG A 24 12.113 -9.814 -11.541 1.00 0.00 H new ATOM 0 HH22 ARG A 24 13.076 -11.194 -12.078 1.00 0.00 H new ATOM 425 N ILE A 25 14.082 -3.502 -9.393 1.00 0.00 N ATOM 426 CA ILE A 25 13.226 -2.739 -10.321 1.00 0.00 C ATOM 427 C ILE A 25 13.882 -1.402 -10.769 1.00 0.00 C ATOM 428 O ILE A 25 14.597 -0.780 -9.975 1.00 0.00 O ATOM 429 CB ILE A 25 11.841 -2.570 -9.638 1.00 0.00 C ATOM 430 CG1 ILE A 25 10.668 -2.428 -10.622 1.00 0.00 C ATOM 431 CG2 ILE A 25 11.838 -1.454 -8.576 1.00 0.00 C ATOM 432 CD1 ILE A 25 9.298 -2.566 -9.941 1.00 0.00 C ATOM 0 H ILE A 25 13.615 -3.679 -8.504 1.00 0.00 H new ATOM 0 HA ILE A 25 13.093 -3.280 -11.258 1.00 0.00 H new ATOM 0 HB ILE A 25 11.672 -3.513 -9.118 1.00 0.00 H new ATOM 0 HG12 ILE A 25 10.728 -1.457 -11.113 1.00 0.00 H new ATOM 0 HG13 ILE A 25 10.759 -3.185 -11.400 1.00 0.00 H new ATOM 0 HG21 ILE A 25 10.846 -1.379 -8.130 1.00 0.00 H new ATOM 0 HG22 ILE A 25 12.568 -1.688 -7.801 1.00 0.00 H new ATOM 0 HG23 ILE A 25 12.098 -0.505 -9.045 1.00 0.00 H new ATOM 0 HD11 ILE A 25 8.509 -2.457 -10.685 1.00 0.00 H new ATOM 0 HD12 ILE A 25 9.222 -3.547 -9.473 1.00 0.00 H new ATOM 0 HD13 ILE A 25 9.190 -1.792 -9.181 1.00 0.00 H new ATOM 444 N PRO A 26 13.686 -0.949 -12.027 1.00 0.00 N ATOM 445 CA PRO A 26 14.299 0.272 -12.570 1.00 0.00 C ATOM 446 C PRO A 26 13.582 1.566 -12.106 1.00 0.00 C ATOM 447 O PRO A 26 12.878 1.586 -11.093 1.00 0.00 O ATOM 448 CB PRO A 26 14.273 0.051 -14.096 1.00 0.00 C ATOM 449 CG PRO A 26 12.993 -0.744 -14.310 1.00 0.00 C ATOM 450 CD PRO A 26 13.023 -1.674 -13.103 1.00 0.00 C ATOM 0 HA PRO A 26 15.314 0.430 -12.206 1.00 0.00 H new ATOM 0 HB2 PRO A 26 14.256 0.996 -14.640 1.00 0.00 H new ATOM 0 HB3 PRO A 26 15.150 -0.498 -14.438 1.00 0.00 H new ATOM 0 HG2 PRO A 26 12.108 -0.107 -14.318 1.00 0.00 H new ATOM 0 HG3 PRO A 26 13.000 -1.291 -15.253 1.00 0.00 H new ATOM 0 HD2 PRO A 26 12.013 -1.960 -12.811 1.00 0.00 H new ATOM 0 HD3 PRO A 26 13.560 -2.593 -13.337 1.00 0.00 H new ATOM 458 N TYR A 27 13.760 2.648 -12.874 1.00 0.00 N ATOM 459 CA TYR A 27 13.028 3.906 -12.656 1.00 0.00 C ATOM 460 C TYR A 27 12.238 4.228 -13.939 1.00 0.00 C ATOM 461 O TYR A 27 12.534 3.692 -15.012 1.00 0.00 O ATOM 462 CB TYR A 27 14.032 5.016 -12.295 1.00 0.00 C ATOM 463 CG TYR A 27 13.577 6.073 -11.306 1.00 0.00 C ATOM 464 CD1 TYR A 27 13.317 5.710 -9.970 1.00 0.00 C ATOM 465 CD2 TYR A 27 13.544 7.430 -11.682 1.00 0.00 C ATOM 466 CE1 TYR A 27 13.010 6.696 -9.013 1.00 0.00 C ATOM 467 CE2 TYR A 27 13.244 8.423 -10.726 1.00 0.00 C ATOM 468 CZ TYR A 27 12.974 8.058 -9.388 1.00 0.00 C ATOM 469 OH TYR A 27 12.668 9.003 -8.457 1.00 0.00 O ATOM 0 H TYR A 27 14.410 2.679 -13.659 1.00 0.00 H new ATOM 0 HA TYR A 27 12.323 3.823 -11.829 1.00 0.00 H new ATOM 0 HB2 TYR A 27 14.928 4.542 -11.894 1.00 0.00 H new ATOM 0 HB3 TYR A 27 14.323 5.520 -13.217 1.00 0.00 H new ATOM 0 HD1 TYR A 27 13.353 4.671 -9.678 1.00 0.00 H new ATOM 0 HD2 TYR A 27 13.749 7.711 -12.705 1.00 0.00 H new ATOM 0 HE1 TYR A 27 12.802 6.411 -7.992 1.00 0.00 H new ATOM 0 HE2 TYR A 27 13.221 9.463 -11.017 1.00 0.00 H new ATOM 0 HH TYR A 27 12.686 9.890 -8.873 1.00 0.00 H new ATOM 479 N LEU A 28 11.246 5.112 -13.854 1.00 0.00 N ATOM 480 CA LEU A 28 10.244 5.349 -14.898 1.00 0.00 C ATOM 481 C LEU A 28 10.418 6.719 -15.584 1.00 0.00 C ATOM 482 O LEU A 28 9.504 7.541 -15.652 1.00 0.00 O ATOM 483 CB LEU A 28 8.860 5.064 -14.277 1.00 0.00 C ATOM 484 CG LEU A 28 7.702 4.920 -15.276 1.00 0.00 C ATOM 485 CD1 LEU A 28 7.969 3.879 -16.364 1.00 0.00 C ATOM 486 CD2 LEU A 28 6.438 4.500 -14.522 1.00 0.00 C ATOM 0 H LEU A 28 11.111 5.702 -13.033 1.00 0.00 H new ATOM 0 HA LEU A 28 10.370 4.668 -15.739 1.00 0.00 H new ATOM 0 HB2 LEU A 28 8.926 4.148 -13.690 1.00 0.00 H new ATOM 0 HB3 LEU A 28 8.620 5.870 -13.583 1.00 0.00 H new ATOM 0 HG LEU A 28 7.587 5.889 -15.761 1.00 0.00 H new ATOM 0 HD11 LEU A 28 7.112 3.827 -17.036 1.00 0.00 H new ATOM 0 HD12 LEU A 28 8.857 4.163 -16.929 1.00 0.00 H new ATOM 0 HD13 LEU A 28 8.128 2.904 -15.903 1.00 0.00 H new ATOM 0 HD21 LEU A 28 5.612 4.396 -15.226 1.00 0.00 H new ATOM 0 HD22 LEU A 28 6.612 3.547 -14.023 1.00 0.00 H new ATOM 0 HD23 LEU A 28 6.189 5.258 -13.779 1.00 0.00 H new ATOM 498 N GLY A 29 11.643 6.982 -16.053 1.00 0.00 N ATOM 499 CA GLY A 29 11.938 8.135 -16.919 1.00 0.00 C ATOM 500 C GLY A 29 12.231 9.427 -16.152 1.00 0.00 C ATOM 501 O GLY A 29 13.232 10.093 -16.415 1.00 0.00 O ATOM 0 H GLY A 29 12.458 6.405 -15.845 1.00 0.00 H new ATOM 0 HA2 GLY A 29 12.795 7.895 -17.548 1.00 0.00 H new ATOM 0 HA3 GLY A 29 11.091 8.303 -17.585 1.00 0.00 H new ATOM 505 N PHE A 30 11.387 9.745 -15.169 1.00 0.00 N ATOM 506 CA PHE A 30 11.515 10.925 -14.300 1.00 0.00 C ATOM 507 C PHE A 30 10.978 10.715 -12.865 1.00 0.00 C ATOM 508 O PHE A 30 10.988 11.645 -12.053 1.00 0.00 O ATOM 509 CB PHE A 30 10.816 12.120 -14.980 1.00 0.00 C ATOM 510 CG PHE A 30 9.295 12.048 -15.004 1.00 0.00 C ATOM 511 CD1 PHE A 30 8.628 11.189 -15.901 1.00 0.00 C ATOM 512 CD2 PHE A 30 8.540 12.848 -14.122 1.00 0.00 C ATOM 513 CE1 PHE A 30 7.224 11.118 -15.905 1.00 0.00 C ATOM 514 CE2 PHE A 30 7.135 12.792 -14.140 1.00 0.00 C ATOM 515 CZ PHE A 30 6.476 11.923 -15.029 1.00 0.00 C ATOM 0 H PHE A 30 10.571 9.175 -14.946 1.00 0.00 H new ATOM 0 HA PHE A 30 12.580 11.121 -14.176 1.00 0.00 H new ATOM 0 HB2 PHE A 30 11.113 13.035 -14.468 1.00 0.00 H new ATOM 0 HB3 PHE A 30 11.177 12.197 -16.006 1.00 0.00 H new ATOM 0 HD1 PHE A 30 9.199 10.582 -16.589 1.00 0.00 H new ATOM 0 HD2 PHE A 30 9.043 13.507 -13.430 1.00 0.00 H new ATOM 0 HE1 PHE A 30 6.720 10.444 -16.582 1.00 0.00 H new ATOM 0 HE2 PHE A 30 6.561 13.416 -13.471 1.00 0.00 H new ATOM 0 HZ PHE A 30 5.397 11.875 -15.038 1.00 0.00 H new ATOM 525 N LYS A 31 10.517 9.493 -12.558 1.00 0.00 N ATOM 526 CA LYS A 31 9.889 9.161 -11.267 1.00 0.00 C ATOM 527 C LYS A 31 10.015 7.658 -10.992 1.00 0.00 C ATOM 528 O LYS A 31 10.366 6.900 -11.894 1.00 0.00 O ATOM 529 CB LYS A 31 8.410 9.604 -11.278 1.00 0.00 C ATOM 530 CG LYS A 31 7.559 8.945 -12.383 1.00 0.00 C ATOM 531 CD LYS A 31 6.118 9.473 -12.420 1.00 0.00 C ATOM 532 CE LYS A 31 5.316 9.093 -11.167 1.00 0.00 C ATOM 533 NZ LYS A 31 3.941 9.660 -11.210 1.00 0.00 N ATOM 0 H LYS A 31 10.569 8.702 -13.200 1.00 0.00 H new ATOM 0 HA LYS A 31 10.401 9.694 -10.466 1.00 0.00 H new ATOM 0 HB2 LYS A 31 7.967 9.375 -10.309 1.00 0.00 H new ATOM 0 HB3 LYS A 31 8.368 10.686 -11.400 1.00 0.00 H new ATOM 0 HG2 LYS A 31 8.030 9.120 -13.350 1.00 0.00 H new ATOM 0 HG3 LYS A 31 7.542 7.866 -12.227 1.00 0.00 H new ATOM 0 HD2 LYS A 31 6.135 10.558 -12.520 1.00 0.00 H new ATOM 0 HD3 LYS A 31 5.614 9.080 -13.303 1.00 0.00 H new ATOM 0 HE2 LYS A 31 5.261 8.008 -11.084 1.00 0.00 H new ATOM 0 HE3 LYS A 31 5.833 9.455 -10.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 3.425 9.385 -10.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 3.995 10.697 -11.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 3.441 9.294 -12.045 1.00 0.00 H new ATOM 547 N GLN A 32 9.718 7.212 -9.772 1.00 0.00 N ATOM 548 CA GLN A 32 9.659 5.783 -9.436 1.00 0.00 C ATOM 549 C GLN A 32 8.711 4.975 -10.342 1.00 0.00 C ATOM 550 O GLN A 32 7.743 5.502 -10.899 1.00 0.00 O ATOM 551 CB GLN A 32 9.290 5.585 -7.953 1.00 0.00 C ATOM 552 CG GLN A 32 7.866 6.037 -7.574 1.00 0.00 C ATOM 553 CD GLN A 32 7.375 5.347 -6.305 1.00 0.00 C ATOM 554 OE1 GLN A 32 7.488 5.855 -5.195 1.00 0.00 O ATOM 555 NE2 GLN A 32 6.822 4.156 -6.415 1.00 0.00 N ATOM 0 H GLN A 32 9.511 7.828 -8.986 1.00 0.00 H new ATOM 0 HA GLN A 32 10.660 5.390 -9.615 1.00 0.00 H new ATOM 0 HB2 GLN A 32 9.399 4.529 -7.704 1.00 0.00 H new ATOM 0 HB3 GLN A 32 10.005 6.133 -7.339 1.00 0.00 H new ATOM 0 HG2 GLN A 32 7.853 7.117 -7.429 1.00 0.00 H new ATOM 0 HG3 GLN A 32 7.184 5.817 -8.395 1.00 0.00 H new ATOM 0 HE21 GLN A 32 6.722 3.723 -7.333 1.00 0.00 H new ATOM 0 HE22 GLN A 32 6.494 3.667 -5.582 1.00 0.00 H new ATOM 564 N ILE A 33 8.961 3.666 -10.428 1.00 0.00 N ATOM 565 CA ILE A 33 8.018 2.728 -11.055 1.00 0.00 C ATOM 566 C ILE A 33 6.673 2.737 -10.299 1.00 0.00 C ATOM 567 O ILE A 33 6.630 2.852 -9.070 1.00 0.00 O ATOM 568 CB ILE A 33 8.692 1.335 -11.160 1.00 0.00 C ATOM 569 CG1 ILE A 33 9.792 1.350 -12.253 1.00 0.00 C ATOM 570 CG2 ILE A 33 7.686 0.206 -11.421 1.00 0.00 C ATOM 571 CD1 ILE A 33 9.300 1.205 -13.701 1.00 0.00 C ATOM 0 H ILE A 33 9.810 3.228 -10.071 1.00 0.00 H new ATOM 0 HA ILE A 33 7.773 3.033 -12.072 1.00 0.00 H new ATOM 0 HB ILE A 33 9.149 1.129 -10.192 1.00 0.00 H new ATOM 0 HG12 ILE A 33 10.347 2.284 -12.170 1.00 0.00 H new ATOM 0 HG13 ILE A 33 10.494 0.543 -12.046 1.00 0.00 H new ATOM 0 HG21 ILE A 33 8.215 -0.745 -11.485 1.00 0.00 H new ATOM 0 HG22 ILE A 33 6.964 0.166 -10.605 1.00 0.00 H new ATOM 0 HG23 ILE A 33 7.163 0.394 -12.359 1.00 0.00 H new ATOM 0 HD11 ILE A 33 10.153 1.229 -14.379 1.00 0.00 H new ATOM 0 HD12 ILE A 33 8.773 0.257 -13.813 1.00 0.00 H new ATOM 0 HD13 ILE A 33 8.624 2.026 -13.939 1.00 0.00 H new ATOM 583 N ASN A 34 5.572 2.635 -11.051 1.00 0.00 N ATOM 584 CA ASN A 34 4.188 2.781 -10.587 1.00 0.00 C ATOM 585 C ASN A 34 3.366 1.594 -11.136 1.00 0.00 C ATOM 586 O ASN A 34 2.596 1.703 -12.090 1.00 0.00 O ATOM 587 CB ASN A 34 3.697 4.190 -10.992 1.00 0.00 C ATOM 588 CG ASN A 34 2.566 4.727 -10.126 1.00 0.00 C ATOM 589 OD1 ASN A 34 2.310 4.276 -9.019 1.00 0.00 O ATOM 590 ND2 ASN A 34 1.883 5.753 -10.584 1.00 0.00 N ATOM 0 H ASN A 34 5.625 2.438 -12.050 1.00 0.00 H new ATOM 0 HA ASN A 34 4.079 2.731 -9.504 1.00 0.00 H new ATOM 0 HB2 ASN A 34 4.537 4.883 -10.945 1.00 0.00 H new ATOM 0 HB3 ASN A 34 3.364 4.163 -12.030 1.00 0.00 H new ATOM 0 HD21 ASN A 34 1.144 6.168 -10.016 1.00 0.00 H new ATOM 0 HD22 ASN A 34 2.092 6.134 -11.507 1.00 0.00 H new ATOM 597 N LEU A 35 3.646 0.417 -10.576 1.00 0.00 N ATOM 598 CA LEU A 35 3.261 -0.915 -11.058 1.00 0.00 C ATOM 599 C LEU A 35 1.754 -1.191 -11.276 1.00 0.00 C ATOM 600 O LEU A 35 1.389 -1.808 -12.278 1.00 0.00 O ATOM 601 CB LEU A 35 3.954 -1.900 -10.103 1.00 0.00 C ATOM 602 CG LEU A 35 3.984 -3.376 -10.524 1.00 0.00 C ATOM 603 CD1 LEU A 35 4.604 -3.622 -11.898 1.00 0.00 C ATOM 604 CD2 LEU A 35 4.820 -4.121 -9.484 1.00 0.00 C ATOM 0 H LEU A 35 4.186 0.363 -9.712 1.00 0.00 H new ATOM 0 HA LEU A 35 3.594 -1.028 -12.090 1.00 0.00 H new ATOM 0 HB2 LEU A 35 4.982 -1.567 -9.961 1.00 0.00 H new ATOM 0 HB3 LEU A 35 3.461 -1.835 -9.133 1.00 0.00 H new ATOM 0 HG LEU A 35 2.952 -3.722 -10.585 1.00 0.00 H new ATOM 0 HD11 LEU A 35 4.587 -4.689 -12.119 1.00 0.00 H new ATOM 0 HD12 LEU A 35 4.034 -3.085 -12.656 1.00 0.00 H new ATOM 0 HD13 LEU A 35 5.635 -3.268 -11.901 1.00 0.00 H new ATOM 0 HD21 LEU A 35 4.868 -5.178 -9.745 1.00 0.00 H new ATOM 0 HD22 LEU A 35 5.828 -3.706 -9.463 1.00 0.00 H new ATOM 0 HD23 LEU A 35 4.361 -4.010 -8.501 1.00 0.00 H new ATOM 616 N TRP A 36 0.863 -0.696 -10.411 1.00 0.00 N ATOM 617 CA TRP A 36 -0.597 -0.731 -10.639 1.00 0.00 C ATOM 618 C TRP A 36 -1.000 0.133 -11.867 1.00 0.00 C ATOM 619 O TRP A 36 -1.812 -0.273 -12.705 1.00 0.00 O ATOM 620 CB TRP A 36 -1.317 -0.257 -9.366 1.00 0.00 C ATOM 621 CG TRP A 36 -1.118 1.171 -8.964 1.00 0.00 C ATOM 622 CD1 TRP A 36 -0.013 1.684 -8.379 1.00 0.00 C ATOM 623 CD2 TRP A 36 -2.049 2.292 -9.105 1.00 0.00 C ATOM 624 NE1 TRP A 36 -0.171 3.041 -8.197 1.00 0.00 N ATOM 625 CE2 TRP A 36 -1.421 3.467 -8.590 1.00 0.00 C ATOM 626 CE3 TRP A 36 -3.366 2.428 -9.597 1.00 0.00 C ATOM 627 CZ2 TRP A 36 -2.062 4.713 -8.567 1.00 0.00 C ATOM 628 CZ3 TRP A 36 -4.027 3.673 -9.562 1.00 0.00 C ATOM 629 CH2 TRP A 36 -3.377 4.814 -9.055 1.00 0.00 C ATOM 0 H TRP A 36 1.128 -0.257 -9.529 1.00 0.00 H new ATOM 0 HA TRP A 36 -0.897 -1.755 -10.861 1.00 0.00 H new ATOM 0 HB2 TRP A 36 -2.386 -0.426 -9.499 1.00 0.00 H new ATOM 0 HB3 TRP A 36 -0.995 -0.890 -8.539 1.00 0.00 H new ATOM 0 HD1 TRP A 36 0.861 1.117 -8.097 1.00 0.00 H new ATOM 0 HE1 TRP A 36 0.550 3.655 -7.818 1.00 0.00 H new ATOM 0 HE3 TRP A 36 -3.874 1.567 -10.006 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 -1.553 5.583 -8.180 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 -5.040 3.752 -9.927 1.00 0.00 H new ATOM 0 HH2 TRP A 36 -3.887 5.766 -9.041 1.00 0.00 H new ATOM 640 N THR A 37 -0.382 1.316 -12.008 1.00 0.00 N ATOM 641 CA THR A 37 -0.632 2.282 -13.092 1.00 0.00 C ATOM 642 C THR A 37 -0.168 1.776 -14.453 1.00 0.00 C ATOM 643 O THR A 37 -0.945 1.849 -15.406 1.00 0.00 O ATOM 644 CB THR A 37 0.003 3.650 -12.801 1.00 0.00 C ATOM 645 OG1 THR A 37 -0.545 4.140 -11.604 1.00 0.00 O ATOM 646 CG2 THR A 37 -0.283 4.704 -13.872 1.00 0.00 C ATOM 0 H THR A 37 0.328 1.638 -11.350 1.00 0.00 H new ATOM 0 HA THR A 37 -1.715 2.400 -13.131 1.00 0.00 H new ATOM 0 HB THR A 37 1.080 3.490 -12.760 1.00 0.00 H new ATOM 0 HG1 THR A 37 -0.484 3.451 -10.910 1.00 0.00 H new ATOM 0 HG21 THR A 37 0.198 5.643 -13.596 1.00 0.00 H new ATOM 0 HG22 THR A 37 0.108 4.364 -14.831 1.00 0.00 H new ATOM 0 HG23 THR A 37 -1.359 4.858 -13.953 1.00 0.00 H new ATOM 654 N MET A 38 1.049 1.221 -14.565 1.00 0.00 N ATOM 655 CA MET A 38 1.507 0.639 -15.838 1.00 0.00 C ATOM 656 C MET A 38 0.587 -0.499 -16.306 1.00 0.00 C ATOM 657 O MET A 38 0.386 -0.667 -17.504 1.00 0.00 O ATOM 658 CB MET A 38 2.981 0.187 -15.786 1.00 0.00 C ATOM 659 CG MET A 38 3.210 -1.138 -15.042 1.00 0.00 C ATOM 660 SD MET A 38 4.858 -1.864 -15.201 1.00 0.00 S ATOM 661 CE MET A 38 5.816 -0.751 -14.155 1.00 0.00 C ATOM 0 H MET A 38 1.725 1.163 -13.803 1.00 0.00 H new ATOM 0 HA MET A 38 1.450 1.436 -16.579 1.00 0.00 H new ATOM 0 HB2 MET A 38 3.354 0.087 -16.805 1.00 0.00 H new ATOM 0 HB3 MET A 38 3.571 0.967 -15.305 1.00 0.00 H new ATOM 0 HG2 MET A 38 3.007 -0.977 -13.983 1.00 0.00 H new ATOM 0 HG3 MET A 38 2.479 -1.863 -15.400 1.00 0.00 H new ATOM 0 HE1 MET A 38 6.835 -1.126 -14.062 1.00 0.00 H new ATOM 0 HE2 MET A 38 5.834 0.243 -14.602 1.00 0.00 H new ATOM 0 HE3 MET A 38 5.358 -0.696 -13.167 1.00 0.00 H new ATOM 671 N PHE A 39 -0.004 -1.240 -15.361 1.00 0.00 N ATOM 672 CA PHE A 39 -0.973 -2.285 -15.681 1.00 0.00 C ATOM 673 C PHE A 39 -2.293 -1.718 -16.207 1.00 0.00 C ATOM 674 O PHE A 39 -2.691 -2.100 -17.305 1.00 0.00 O ATOM 675 CB PHE A 39 -1.176 -3.214 -14.488 1.00 0.00 C ATOM 676 CG PHE A 39 -2.169 -4.325 -14.760 1.00 0.00 C ATOM 677 CD1 PHE A 39 -1.806 -5.401 -15.591 1.00 0.00 C ATOM 678 CD2 PHE A 39 -3.466 -4.271 -14.211 1.00 0.00 C ATOM 679 CE1 PHE A 39 -2.730 -6.420 -15.870 1.00 0.00 C ATOM 680 CE2 PHE A 39 -4.391 -5.292 -14.492 1.00 0.00 C ATOM 681 CZ PHE A 39 -4.022 -6.365 -15.320 1.00 0.00 C ATOM 0 H PHE A 39 0.176 -1.131 -14.363 1.00 0.00 H new ATOM 0 HA PHE A 39 -0.560 -2.878 -16.497 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -0.218 -3.652 -14.209 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -1.519 -2.629 -13.635 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -0.814 -5.443 -16.015 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -3.749 -3.446 -13.575 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -2.448 -7.246 -16.507 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -5.385 -5.251 -14.071 1.00 0.00 H new ATOM 0 HZ PHE A 39 -4.733 -7.149 -15.534 1.00 0.00 H new ATOM 691 N GLN A 40 -2.951 -0.771 -15.521 1.00 0.00 N ATOM 692 CA GLN A 40 -4.179 -0.183 -16.097 1.00 0.00 C ATOM 693 C GLN A 40 -3.933 0.598 -17.407 1.00 0.00 C ATOM 694 O GLN A 40 -4.812 0.633 -18.271 1.00 0.00 O ATOM 695 CB GLN A 40 -4.969 0.649 -15.071 1.00 0.00 C ATOM 696 CG GLN A 40 -4.222 1.879 -14.528 1.00 0.00 C ATOM 697 CD GLN A 40 -5.091 2.802 -13.669 1.00 0.00 C ATOM 698 OE1 GLN A 40 -6.314 2.795 -13.708 1.00 0.00 O ATOM 699 NE2 GLN A 40 -4.496 3.656 -12.864 1.00 0.00 N ATOM 0 H GLN A 40 -2.675 -0.407 -14.609 1.00 0.00 H new ATOM 0 HA GLN A 40 -4.804 -1.033 -16.370 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -5.900 0.980 -15.532 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -5.239 0.006 -14.233 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -3.371 1.543 -13.936 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -3.822 2.449 -15.367 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -3.478 3.683 -12.812 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -5.053 4.291 -12.292 1.00 0.00 H new ATOM 708 N ALA A 41 -2.740 1.170 -17.608 1.00 0.00 N ATOM 709 CA ALA A 41 -2.334 1.734 -18.893 1.00 0.00 C ATOM 710 C ALA A 41 -2.165 0.636 -19.961 1.00 0.00 C ATOM 711 O ALA A 41 -2.797 0.707 -21.012 1.00 0.00 O ATOM 712 CB ALA A 41 -1.053 2.554 -18.699 1.00 0.00 C ATOM 0 H ALA A 41 -2.030 1.253 -16.880 1.00 0.00 H new ATOM 0 HA ALA A 41 -3.118 2.396 -19.261 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -0.744 2.978 -19.654 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -1.240 3.359 -17.988 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -0.262 1.909 -18.316 1.00 0.00 H new ATOM 718 N ALA A 42 -1.400 -0.425 -19.685 1.00 0.00 N ATOM 719 CA ALA A 42 -1.258 -1.572 -20.585 1.00 0.00 C ATOM 720 C ALA A 42 -2.608 -2.214 -20.947 1.00 0.00 C ATOM 721 O ALA A 42 -2.801 -2.609 -22.088 1.00 0.00 O ATOM 722 CB ALA A 42 -0.302 -2.596 -19.959 1.00 0.00 C ATOM 0 H ALA A 42 -0.859 -0.512 -18.825 1.00 0.00 H new ATOM 0 HA ALA A 42 -0.838 -1.212 -21.524 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -0.195 -3.450 -20.628 1.00 0.00 H new ATOM 0 HB2 ALA A 42 0.673 -2.135 -19.801 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -0.704 -2.932 -19.003 1.00 0.00 H new ATOM 728 N GLN A 43 -3.559 -2.255 -20.006 1.00 0.00 N ATOM 729 CA GLN A 43 -4.896 -2.800 -20.249 1.00 0.00 C ATOM 730 C GLN A 43 -5.685 -2.012 -21.301 1.00 0.00 C ATOM 731 O GLN A 43 -6.282 -2.632 -22.186 1.00 0.00 O ATOM 732 CB GLN A 43 -5.689 -2.921 -18.937 1.00 0.00 C ATOM 733 CG GLN A 43 -5.247 -4.118 -18.072 1.00 0.00 C ATOM 734 CD GLN A 43 -5.462 -5.477 -18.740 1.00 0.00 C ATOM 735 OE1 GLN A 43 -6.445 -5.727 -19.425 1.00 0.00 O ATOM 736 NE2 GLN A 43 -4.541 -6.403 -18.586 1.00 0.00 N ATOM 0 H GLN A 43 -3.421 -1.911 -19.056 1.00 0.00 H new ATOM 0 HA GLN A 43 -4.751 -3.799 -20.661 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -5.572 -2.002 -18.362 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -6.750 -3.019 -19.168 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -4.191 -4.007 -17.828 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -5.796 -4.096 -17.130 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -3.715 -6.212 -18.019 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -4.652 -7.313 -19.034 1.00 0.00 H new ATOM 745 N LYS A 44 -5.639 -0.672 -21.277 1.00 0.00 N ATOM 746 CA LYS A 44 -6.291 0.144 -22.319 1.00 0.00 C ATOM 747 C LYS A 44 -5.474 0.149 -23.615 1.00 0.00 C ATOM 748 O LYS A 44 -6.058 0.068 -24.696 1.00 0.00 O ATOM 749 CB LYS A 44 -6.714 1.529 -21.799 1.00 0.00 C ATOM 750 CG LYS A 44 -5.583 2.554 -21.678 1.00 0.00 C ATOM 751 CD LYS A 44 -6.046 3.886 -21.077 1.00 0.00 C ATOM 752 CE LYS A 44 -6.319 3.777 -19.569 1.00 0.00 C ATOM 753 NZ LYS A 44 -6.505 5.120 -18.960 1.00 0.00 N ATOM 0 H LYS A 44 -5.162 -0.131 -20.555 1.00 0.00 H new ATOM 0 HA LYS A 44 -7.236 -0.329 -22.587 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -7.478 1.931 -22.465 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -7.177 1.406 -20.820 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -4.788 2.139 -21.059 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -5.157 2.735 -22.665 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -5.285 4.646 -21.253 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -6.951 4.217 -21.586 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -7.210 3.171 -19.400 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -5.489 3.265 -19.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -6.671 5.018 -17.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -5.652 5.693 -19.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -7.323 5.590 -19.398 1.00 0.00 H new ATOM 767 N LEU A 45 -4.140 0.122 -23.502 1.00 0.00 N ATOM 768 CA LEU A 45 -3.258 -0.154 -24.644 1.00 0.00 C ATOM 769 C LEU A 45 -3.259 -1.657 -25.086 1.00 0.00 C ATOM 770 O LEU A 45 -2.373 -2.081 -25.833 1.00 0.00 O ATOM 771 CB LEU A 45 -1.833 0.433 -24.387 1.00 0.00 C ATOM 772 CG LEU A 45 -1.599 1.975 -24.463 1.00 0.00 C ATOM 773 CD1 LEU A 45 -2.420 2.652 -25.561 1.00 0.00 C ATOM 774 CD2 LEU A 45 -1.880 2.708 -23.157 1.00 0.00 C ATOM 0 H LEU A 45 -3.645 0.289 -22.626 1.00 0.00 H new ATOM 0 HA LEU A 45 -3.667 0.366 -25.511 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -1.522 0.106 -23.395 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -1.156 -0.033 -25.103 1.00 0.00 H new ATOM 0 HG LEU A 45 -0.536 2.053 -24.692 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -2.213 3.722 -25.562 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -2.152 2.229 -26.529 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -3.481 2.488 -25.375 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -1.695 3.774 -23.291 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -2.920 2.554 -22.870 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -1.227 2.321 -22.375 1.00 0.00 H new ATOM 786 N GLY A 46 -4.247 -2.462 -24.651 1.00 0.00 N ATOM 787 CA GLY A 46 -4.491 -3.795 -25.248 1.00 0.00 C ATOM 788 C GLY A 46 -3.954 -5.021 -24.489 1.00 0.00 C ATOM 789 O GLY A 46 -3.555 -6.016 -25.102 1.00 0.00 O ATOM 0 H GLY A 46 -4.886 -2.218 -23.895 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -5.567 -3.918 -25.368 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -4.056 -3.801 -26.248 1.00 0.00 H new ATOM 793 N GLY A 47 -3.951 -4.935 -23.161 1.00 0.00 N ATOM 794 CA GLY A 47 -3.329 -5.935 -22.292 1.00 0.00 C ATOM 795 C GLY A 47 -1.843 -6.176 -22.574 1.00 0.00 C ATOM 796 O GLY A 47 -1.188 -5.452 -23.328 1.00 0.00 O ATOM 0 H GLY A 47 -4.383 -4.164 -22.652 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -3.444 -5.620 -21.255 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -3.865 -6.878 -22.400 1.00 0.00 H new ATOM 800 N TYR A 48 -1.315 -7.249 -21.981 1.00 0.00 N ATOM 801 CA TYR A 48 0.019 -7.744 -22.344 1.00 0.00 C ATOM 802 C TYR A 48 0.083 -8.226 -23.805 1.00 0.00 C ATOM 803 O TYR A 48 1.160 -8.260 -24.404 1.00 0.00 O ATOM 804 CB TYR A 48 0.413 -8.899 -21.405 1.00 0.00 C ATOM 805 CG TYR A 48 -0.265 -10.224 -21.727 1.00 0.00 C ATOM 806 CD1 TYR A 48 -1.585 -10.474 -21.301 1.00 0.00 C ATOM 807 CD2 TYR A 48 0.408 -11.186 -22.507 1.00 0.00 C ATOM 808 CE1 TYR A 48 -2.242 -11.659 -21.679 1.00 0.00 C ATOM 809 CE2 TYR A 48 -0.239 -12.382 -22.873 1.00 0.00 C ATOM 810 CZ TYR A 48 -1.570 -12.616 -22.469 1.00 0.00 C ATOM 811 OH TYR A 48 -2.182 -13.783 -22.804 1.00 0.00 O ATOM 0 H TYR A 48 -1.784 -7.789 -21.254 1.00 0.00 H new ATOM 0 HA TYR A 48 0.718 -6.914 -22.239 1.00 0.00 H new ATOM 0 HB2 TYR A 48 1.493 -9.036 -21.450 1.00 0.00 H new ATOM 0 HB3 TYR A 48 0.169 -8.619 -20.380 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -2.095 -9.752 -20.681 1.00 0.00 H new ATOM 0 HD2 TYR A 48 1.424 -11.005 -22.825 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -3.260 -11.836 -21.365 1.00 0.00 H new ATOM 0 HE2 TYR A 48 0.284 -13.120 -23.463 1.00 0.00 H new ATOM 0 HH TYR A 48 -1.576 -14.325 -23.352 1.00 0.00 H new ATOM 821 N GLU A 49 -1.061 -8.613 -24.385 1.00 0.00 N ATOM 822 CA GLU A 49 -1.064 -9.318 -25.670 1.00 0.00 C ATOM 823 C GLU A 49 -0.801 -8.372 -26.848 1.00 0.00 C ATOM 824 O GLU A 49 0.078 -8.638 -27.668 1.00 0.00 O ATOM 825 CB GLU A 49 -2.390 -10.080 -25.830 1.00 0.00 C ATOM 826 CG GLU A 49 -2.269 -11.171 -26.899 1.00 0.00 C ATOM 827 CD GLU A 49 -3.611 -11.900 -27.105 1.00 0.00 C ATOM 828 OE1 GLU A 49 -4.477 -11.383 -27.854 1.00 0.00 O ATOM 829 OE2 GLU A 49 -3.808 -13.001 -26.535 1.00 0.00 O ATOM 0 H GLU A 49 -1.987 -8.451 -23.988 1.00 0.00 H new ATOM 0 HA GLU A 49 -0.243 -10.036 -25.675 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -2.673 -10.528 -24.878 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -3.183 -9.384 -26.103 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -1.945 -10.727 -27.840 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -1.503 -11.889 -26.605 1.00 0.00 H new ATOM 836 N THR A 50 -1.480 -7.220 -26.890 1.00 0.00 N ATOM 837 CA THR A 50 -1.168 -6.155 -27.853 1.00 0.00 C ATOM 838 C THR A 50 0.205 -5.547 -27.570 1.00 0.00 C ATOM 839 O THR A 50 0.913 -5.190 -28.507 1.00 0.00 O ATOM 840 CB THR A 50 -2.233 -5.051 -27.866 1.00 0.00 C ATOM 841 OG1 THR A 50 -3.511 -5.614 -28.103 1.00 0.00 O ATOM 842 CG2 THR A 50 -2.016 -4.008 -28.962 1.00 0.00 C ATOM 0 H THR A 50 -2.255 -7.000 -26.264 1.00 0.00 H new ATOM 0 HA THR A 50 -1.158 -6.620 -28.839 1.00 0.00 H new ATOM 0 HB THR A 50 -2.160 -4.567 -26.892 1.00 0.00 H new ATOM 0 HG1 THR A 50 -3.903 -5.906 -27.253 1.00 0.00 H new ATOM 0 HG21 THR A 50 -2.806 -3.258 -28.912 1.00 0.00 H new ATOM 0 HG22 THR A 50 -1.049 -3.526 -28.820 1.00 0.00 H new ATOM 0 HG23 THR A 50 -2.039 -4.495 -29.937 1.00 0.00 H new ATOM 850 N ILE A 51 0.642 -5.492 -26.305 1.00 0.00 N ATOM 851 CA ILE A 51 2.005 -5.057 -25.968 1.00 0.00 C ATOM 852 C ILE A 51 3.063 -5.961 -26.621 1.00 0.00 C ATOM 853 O ILE A 51 4.029 -5.459 -27.196 1.00 0.00 O ATOM 854 CB ILE A 51 2.139 -4.931 -24.422 1.00 0.00 C ATOM 855 CG1 ILE A 51 2.083 -3.452 -23.985 1.00 0.00 C ATOM 856 CG2 ILE A 51 3.397 -5.597 -23.837 1.00 0.00 C ATOM 857 CD1 ILE A 51 0.709 -2.794 -24.196 1.00 0.00 C ATOM 0 H ILE A 51 0.072 -5.743 -25.498 1.00 0.00 H new ATOM 0 HA ILE A 51 2.193 -4.068 -26.385 1.00 0.00 H new ATOM 0 HB ILE A 51 1.286 -5.476 -24.018 1.00 0.00 H new ATOM 0 HG12 ILE A 51 2.350 -3.384 -22.930 1.00 0.00 H new ATOM 0 HG13 ILE A 51 2.834 -2.890 -24.541 1.00 0.00 H new ATOM 0 HG21 ILE A 51 3.411 -5.462 -22.756 1.00 0.00 H new ATOM 0 HG22 ILE A 51 3.386 -6.662 -24.069 1.00 0.00 H new ATOM 0 HG23 ILE A 51 4.286 -5.140 -24.271 1.00 0.00 H new ATOM 0 HD11 ILE A 51 0.748 -1.756 -23.866 1.00 0.00 H new ATOM 0 HD12 ILE A 51 0.448 -2.829 -25.254 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -0.044 -3.330 -23.618 1.00 0.00 H new ATOM 869 N THR A 52 2.847 -7.276 -26.591 1.00 0.00 N ATOM 870 CA THR A 52 3.772 -8.249 -27.195 1.00 0.00 C ATOM 871 C THR A 52 3.687 -8.233 -28.723 1.00 0.00 C ATOM 872 O THR A 52 4.713 -8.251 -29.408 1.00 0.00 O ATOM 873 CB THR A 52 3.486 -9.655 -26.638 1.00 0.00 C ATOM 874 OG1 THR A 52 3.751 -9.656 -25.250 1.00 0.00 O ATOM 875 CG2 THR A 52 4.362 -10.754 -27.245 1.00 0.00 C ATOM 0 H THR A 52 2.031 -7.701 -26.150 1.00 0.00 H new ATOM 0 HA THR A 52 4.791 -7.965 -26.930 1.00 0.00 H new ATOM 0 HB THR A 52 2.446 -9.869 -26.884 1.00 0.00 H new ATOM 0 HG1 THR A 52 3.007 -9.231 -24.775 1.00 0.00 H new ATOM 0 HG21 THR A 52 4.100 -11.715 -26.801 1.00 0.00 H new ATOM 0 HG22 THR A 52 4.200 -10.795 -28.322 1.00 0.00 H new ATOM 0 HG23 THR A 52 5.411 -10.536 -27.044 1.00 0.00 H new ATOM 883 N ALA A 53 2.470 -8.129 -29.265 1.00 0.00 N ATOM 884 CA ALA A 53 2.254 -8.089 -30.710 1.00 0.00 C ATOM 885 C ALA A 53 2.657 -6.754 -31.374 1.00 0.00 C ATOM 886 O ALA A 53 2.938 -6.748 -32.576 1.00 0.00 O ATOM 887 CB ALA A 53 0.774 -8.396 -30.967 1.00 0.00 C ATOM 0 H ALA A 53 1.612 -8.071 -28.716 1.00 0.00 H new ATOM 0 HA ALA A 53 2.905 -8.834 -31.168 1.00 0.00 H new ATOM 0 HB1 ALA A 53 0.579 -8.374 -32.039 1.00 0.00 H new ATOM 0 HB2 ALA A 53 0.534 -9.384 -30.575 1.00 0.00 H new ATOM 0 HB3 ALA A 53 0.156 -7.648 -30.470 1.00 0.00 H new ATOM 893 N ARG A 54 2.686 -5.630 -30.633 1.00 0.00 N ATOM 894 CA ARG A 54 2.830 -4.291 -31.261 1.00 0.00 C ATOM 895 C ARG A 54 3.816 -3.331 -30.572 1.00 0.00 C ATOM 896 O ARG A 54 3.905 -2.184 -31.003 1.00 0.00 O ATOM 897 CB ARG A 54 1.431 -3.630 -31.394 1.00 0.00 C ATOM 898 CG ARG A 54 0.400 -4.406 -32.237 1.00 0.00 C ATOM 899 CD ARG A 54 0.784 -4.472 -33.723 1.00 0.00 C ATOM 900 NE ARG A 54 -0.181 -5.281 -34.493 1.00 0.00 N ATOM 901 CZ ARG A 54 -0.032 -6.524 -34.920 1.00 0.00 C ATOM 902 NH1 ARG A 54 1.020 -7.244 -34.645 1.00 0.00 N ATOM 903 NH2 ARG A 54 -0.958 -7.083 -35.646 1.00 0.00 N ATOM 0 H ARG A 54 2.613 -5.615 -29.616 1.00 0.00 H new ATOM 0 HA ARG A 54 3.275 -4.476 -32.239 1.00 0.00 H new ATOM 0 HB2 ARG A 54 1.021 -3.487 -30.394 1.00 0.00 H new ATOM 0 HB3 ARG A 54 1.558 -2.640 -31.831 1.00 0.00 H new ATOM 0 HG2 ARG A 54 0.303 -5.418 -31.845 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -0.576 -3.931 -32.138 1.00 0.00 H new ATOM 0 HD2 ARG A 54 0.826 -3.464 -34.135 1.00 0.00 H new ATOM 0 HD3 ARG A 54 1.782 -4.899 -33.824 1.00 0.00 H new ATOM 0 HE ARG A 54 -1.066 -4.829 -34.723 1.00 0.00 H new ATOM 0 HH11 ARG A 54 1.772 -6.852 -34.078 1.00 0.00 H new ATOM 0 HH12 ARG A 54 1.091 -8.199 -34.997 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -1.801 -6.562 -35.887 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -0.840 -8.042 -35.974 1.00 0.00 H new ATOM 917 N ARG A 55 4.586 -3.775 -29.560 1.00 0.00 N ATOM 918 CA ARG A 55 5.507 -2.946 -28.738 1.00 0.00 C ATOM 919 C ARG A 55 4.875 -1.599 -28.388 1.00 0.00 C ATOM 920 O ARG A 55 5.365 -0.519 -28.717 1.00 0.00 O ATOM 921 CB ARG A 55 6.957 -2.907 -29.279 1.00 0.00 C ATOM 922 CG ARG A 55 7.206 -2.546 -30.761 1.00 0.00 C ATOM 923 CD ARG A 55 7.029 -3.687 -31.785 1.00 0.00 C ATOM 924 NE ARG A 55 7.837 -4.883 -31.446 1.00 0.00 N ATOM 925 CZ ARG A 55 7.399 -6.075 -31.072 1.00 0.00 C ATOM 926 NH1 ARG A 55 6.138 -6.396 -31.093 1.00 0.00 N ATOM 927 NH2 ARG A 55 8.234 -6.982 -30.658 1.00 0.00 N ATOM 0 H ARG A 55 4.588 -4.755 -29.277 1.00 0.00 H new ATOM 0 HA ARG A 55 5.644 -3.444 -27.778 1.00 0.00 H new ATOM 0 HB2 ARG A 55 7.514 -2.194 -28.671 1.00 0.00 H new ATOM 0 HB3 ARG A 55 7.398 -3.888 -29.103 1.00 0.00 H new ATOM 0 HG2 ARG A 55 6.530 -1.735 -31.033 1.00 0.00 H new ATOM 0 HG3 ARG A 55 8.221 -2.159 -30.852 1.00 0.00 H new ATOM 0 HD2 ARG A 55 5.976 -3.966 -31.836 1.00 0.00 H new ATOM 0 HD3 ARG A 55 7.312 -3.330 -32.775 1.00 0.00 H new ATOM 0 HE ARG A 55 8.849 -4.775 -31.508 1.00 0.00 H new ATOM 0 HH11 ARG A 55 5.444 -5.717 -31.406 1.00 0.00 H new ATOM 0 HH12 ARG A 55 5.844 -7.326 -30.796 1.00 0.00 H new ATOM 0 HH21 ARG A 55 9.232 -6.777 -30.620 1.00 0.00 H new ATOM 0 HH22 ARG A 55 7.890 -7.899 -30.371 1.00 0.00 H new ATOM 941 N GLN A 56 3.736 -1.730 -27.703 1.00 0.00 N ATOM 942 CA GLN A 56 2.840 -0.597 -27.446 1.00 0.00 C ATOM 943 C GLN A 56 3.185 0.165 -26.150 1.00 0.00 C ATOM 944 O GLN A 56 2.489 1.105 -25.771 1.00 0.00 O ATOM 945 CB GLN A 56 1.373 -1.048 -27.579 1.00 0.00 C ATOM 946 CG GLN A 56 0.437 0.136 -27.891 1.00 0.00 C ATOM 947 CD GLN A 56 -0.801 -0.261 -28.690 1.00 0.00 C ATOM 948 OE1 GLN A 56 -1.936 -0.107 -28.264 1.00 0.00 O ATOM 949 NE2 GLN A 56 -0.623 -0.746 -29.902 1.00 0.00 N ATOM 0 H GLN A 56 3.410 -2.615 -27.314 1.00 0.00 H new ATOM 0 HA GLN A 56 2.996 0.161 -28.214 1.00 0.00 H new ATOM 0 HB2 GLN A 56 1.292 -1.794 -28.370 1.00 0.00 H new ATOM 0 HB3 GLN A 56 1.055 -1.529 -26.654 1.00 0.00 H new ATOM 0 HG2 GLN A 56 0.123 0.597 -26.955 1.00 0.00 H new ATOM 0 HG3 GLN A 56 0.992 0.891 -28.448 1.00 0.00 H new ATOM 0 HE21 GLN A 56 0.321 -0.878 -30.265 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -1.429 -0.990 -30.477 1.00 0.00 H new ATOM 958 N TRP A 57 4.304 -0.179 -25.502 1.00 0.00 N ATOM 959 CA TRP A 57 4.908 0.592 -24.404 1.00 0.00 C ATOM 960 C TRP A 57 5.155 2.054 -24.780 1.00 0.00 C ATOM 961 O TRP A 57 4.953 2.932 -23.947 1.00 0.00 O ATOM 962 CB TRP A 57 6.180 -0.090 -23.898 1.00 0.00 C ATOM 963 CG TRP A 57 5.884 -1.330 -23.132 1.00 0.00 C ATOM 964 CD1 TRP A 57 5.806 -2.577 -23.640 1.00 0.00 C ATOM 965 CD2 TRP A 57 5.500 -1.433 -21.727 1.00 0.00 C ATOM 966 NE1 TRP A 57 5.367 -3.436 -22.654 1.00 0.00 N ATOM 967 CE2 TRP A 57 5.139 -2.783 -21.462 1.00 0.00 C ATOM 968 CE3 TRP A 57 5.369 -0.510 -20.666 1.00 0.00 C ATOM 969 CZ2 TRP A 57 4.647 -3.194 -20.218 1.00 0.00 C ATOM 970 CZ3 TRP A 57 4.895 -0.914 -19.407 1.00 0.00 C ATOM 971 CH2 TRP A 57 4.526 -2.250 -19.183 1.00 0.00 C ATOM 0 H TRP A 57 4.830 -1.023 -25.731 1.00 0.00 H new ATOM 0 HA TRP A 57 4.187 0.610 -23.586 1.00 0.00 H new ATOM 0 HB2 TRP A 57 6.822 -0.332 -24.745 1.00 0.00 H new ATOM 0 HB3 TRP A 57 6.735 0.603 -23.265 1.00 0.00 H new ATOM 0 HD1 TRP A 57 6.048 -2.858 -24.654 1.00 0.00 H new ATOM 0 HE1 TRP A 57 5.227 -4.437 -22.791 1.00 0.00 H new ATOM 0 HE3 TRP A 57 5.638 0.524 -20.825 1.00 0.00 H new ATOM 0 HZ2 TRP A 57 4.364 -4.223 -20.055 1.00 0.00 H new ATOM 0 HZ3 TRP A 57 4.814 -0.193 -18.607 1.00 0.00 H new ATOM 0 HH2 TRP A 57 4.150 -2.552 -18.217 1.00 0.00 H new ATOM 982 N LYS A 58 5.460 2.349 -26.048 1.00 0.00 N ATOM 983 CA LYS A 58 5.537 3.741 -26.537 1.00 0.00 C ATOM 984 C LYS A 58 4.222 4.532 -26.375 1.00 0.00 C ATOM 985 O LYS A 58 4.270 5.749 -26.212 1.00 0.00 O ATOM 986 CB LYS A 58 6.061 3.755 -27.987 1.00 0.00 C ATOM 987 CG LYS A 58 7.517 3.263 -28.105 1.00 0.00 C ATOM 988 CD LYS A 58 8.559 4.307 -27.663 1.00 0.00 C ATOM 989 CE LYS A 58 9.955 3.670 -27.586 1.00 0.00 C ATOM 990 NZ LYS A 58 11.043 4.681 -27.656 1.00 0.00 N ATOM 0 H LYS A 58 5.659 1.646 -26.760 1.00 0.00 H new ATOM 0 HA LYS A 58 6.247 4.270 -25.902 1.00 0.00 H new ATOM 0 HB2 LYS A 58 5.420 3.127 -28.605 1.00 0.00 H new ATOM 0 HB3 LYS A 58 5.992 4.768 -28.383 1.00 0.00 H new ATOM 0 HG2 LYS A 58 7.638 2.364 -27.501 1.00 0.00 H new ATOM 0 HG3 LYS A 58 7.714 2.981 -29.139 1.00 0.00 H new ATOM 0 HD2 LYS A 58 8.570 5.139 -28.367 1.00 0.00 H new ATOM 0 HD3 LYS A 58 8.284 4.715 -26.690 1.00 0.00 H new ATOM 0 HE2 LYS A 58 10.044 3.108 -26.656 1.00 0.00 H new ATOM 0 HE3 LYS A 58 10.072 2.957 -28.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 11.855 4.356 -27.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 11.336 4.808 -28.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 10.700 5.587 -27.278 1.00 0.00 H new ATOM 1004 N HIS A 59 3.065 3.856 -26.326 1.00 0.00 N ATOM 1005 CA HIS A 59 1.778 4.492 -25.990 1.00 0.00 C ATOM 1006 C HIS A 59 1.385 4.327 -24.501 1.00 0.00 C ATOM 1007 O HIS A 59 0.590 5.112 -23.980 1.00 0.00 O ATOM 1008 CB HIS A 59 0.683 3.956 -26.921 1.00 0.00 C ATOM 1009 CG HIS A 59 0.909 4.271 -28.383 1.00 0.00 C ATOM 1010 ND1 HIS A 59 0.305 5.282 -29.100 1.00 0.00 N ATOM 1011 CD2 HIS A 59 1.744 3.615 -29.250 1.00 0.00 C ATOM 1012 CE1 HIS A 59 0.760 5.238 -30.362 1.00 0.00 C ATOM 1013 NE2 HIS A 59 1.644 4.232 -30.504 1.00 0.00 N ATOM 0 H HIS A 59 2.992 2.857 -26.517 1.00 0.00 H new ATOM 0 HA HIS A 59 1.892 5.565 -26.143 1.00 0.00 H new ATOM 0 HB2 HIS A 59 0.614 2.875 -26.799 1.00 0.00 H new ATOM 0 HB3 HIS A 59 -0.276 4.373 -26.614 1.00 0.00 H new ATOM 0 HD2 HIS A 59 2.370 2.769 -29.008 1.00 0.00 H new ATOM 0 HE1 HIS A 59 0.460 5.913 -31.150 1.00 0.00 H new ATOM 0 HE2 HIS A 59 2.142 3.971 -31.355 1.00 0.00 H new ATOM 1021 N ILE A 60 1.976 3.376 -23.765 1.00 0.00 N ATOM 1022 CA ILE A 60 1.877 3.373 -22.294 1.00 0.00 C ATOM 1023 C ILE A 60 2.600 4.630 -21.797 1.00 0.00 C ATOM 1024 O ILE A 60 2.076 5.333 -20.943 1.00 0.00 O ATOM 1025 CB ILE A 60 2.440 2.078 -21.662 1.00 0.00 C ATOM 1026 CG1 ILE A 60 1.502 0.901 -22.018 1.00 0.00 C ATOM 1027 CG2 ILE A 60 2.590 2.219 -20.135 1.00 0.00 C ATOM 1028 CD1 ILE A 60 2.065 -0.483 -21.681 1.00 0.00 C ATOM 0 H ILE A 60 2.521 2.607 -24.155 1.00 0.00 H new ATOM 0 HA ILE A 60 0.831 3.390 -21.987 1.00 0.00 H new ATOM 0 HB ILE A 60 3.435 1.887 -22.064 1.00 0.00 H new ATOM 0 HG12 ILE A 60 0.557 1.033 -21.491 1.00 0.00 H new ATOM 0 HG13 ILE A 60 1.280 0.939 -23.084 1.00 0.00 H new ATOM 0 HG21 ILE A 60 2.988 1.292 -19.721 1.00 0.00 H new ATOM 0 HG22 ILE A 60 3.272 3.039 -19.911 1.00 0.00 H new ATOM 0 HG23 ILE A 60 1.616 2.426 -19.691 1.00 0.00 H new ATOM 0 HD11 ILE A 60 1.342 -1.248 -21.964 1.00 0.00 H new ATOM 0 HD12 ILE A 60 2.994 -0.641 -22.229 1.00 0.00 H new ATOM 0 HD13 ILE A 60 2.260 -0.546 -20.610 1.00 0.00 H new ATOM 1040 N TYR A 61 3.737 4.983 -22.411 1.00 0.00 N ATOM 1041 CA TYR A 61 4.419 6.257 -22.205 1.00 0.00 C ATOM 1042 C TYR A 61 3.548 7.476 -22.577 1.00 0.00 C ATOM 1043 O TYR A 61 3.660 8.531 -21.951 1.00 0.00 O ATOM 1044 CB TYR A 61 5.739 6.257 -22.981 1.00 0.00 C ATOM 1045 CG TYR A 61 6.745 7.250 -22.444 1.00 0.00 C ATOM 1046 CD1 TYR A 61 7.600 6.874 -21.391 1.00 0.00 C ATOM 1047 CD2 TYR A 61 6.825 8.547 -22.987 1.00 0.00 C ATOM 1048 CE1 TYR A 61 8.555 7.778 -20.901 1.00 0.00 C ATOM 1049 CE2 TYR A 61 7.788 9.452 -22.503 1.00 0.00 C ATOM 1050 CZ TYR A 61 8.671 9.057 -21.475 1.00 0.00 C ATOM 1051 OH TYR A 61 9.643 9.892 -21.043 1.00 0.00 O ATOM 0 H TYR A 61 4.214 4.375 -23.077 1.00 0.00 H new ATOM 0 HA TYR A 61 4.622 6.357 -21.139 1.00 0.00 H new ATOM 0 HB2 TYR A 61 6.172 5.257 -22.949 1.00 0.00 H new ATOM 0 HB3 TYR A 61 5.538 6.484 -24.028 1.00 0.00 H new ATOM 0 HD1 TYR A 61 7.521 5.887 -20.959 1.00 0.00 H new ATOM 0 HD2 TYR A 61 6.148 8.847 -23.774 1.00 0.00 H new ATOM 0 HE1 TYR A 61 9.200 7.492 -20.084 1.00 0.00 H new ATOM 0 HE2 TYR A 61 7.851 10.447 -22.918 1.00 0.00 H new ATOM 0 HH TYR A 61 9.708 10.660 -21.649 1.00 0.00 H new ATOM 1061 N ASP A 62 2.645 7.314 -23.555 1.00 0.00 N ATOM 1062 CA ASP A 62 1.614 8.323 -23.837 1.00 0.00 C ATOM 1063 C ASP A 62 0.677 8.520 -22.632 1.00 0.00 C ATOM 1064 O ASP A 62 0.471 9.653 -22.191 1.00 0.00 O ATOM 1065 CB ASP A 62 0.857 8.067 -25.148 1.00 0.00 C ATOM 1066 CG ASP A 62 0.052 9.307 -25.569 1.00 0.00 C ATOM 1067 OD1 ASP A 62 0.665 10.295 -26.040 1.00 0.00 O ATOM 1068 OD2 ASP A 62 -1.196 9.294 -25.447 1.00 0.00 O ATOM 0 H ASP A 62 2.608 6.496 -24.163 1.00 0.00 H new ATOM 0 HA ASP A 62 2.135 9.267 -23.994 1.00 0.00 H new ATOM 0 HB2 ASP A 62 1.564 7.803 -25.935 1.00 0.00 H new ATOM 0 HB3 ASP A 62 0.185 7.217 -25.025 1.00 0.00 H new ATOM 1073 N GLU A 63 0.191 7.429 -22.026 1.00 0.00 N ATOM 1074 CA GLU A 63 -0.522 7.505 -20.734 1.00 0.00 C ATOM 1075 C GLU A 63 0.327 8.031 -19.551 1.00 0.00 C ATOM 1076 O GLU A 63 -0.231 8.672 -18.656 1.00 0.00 O ATOM 1077 CB GLU A 63 -1.143 6.145 -20.366 1.00 0.00 C ATOM 1078 CG GLU A 63 -2.437 5.853 -21.131 1.00 0.00 C ATOM 1079 CD GLU A 63 -3.585 6.775 -20.677 1.00 0.00 C ATOM 1080 OE1 GLU A 63 -4.191 6.507 -19.612 1.00 0.00 O ATOM 1081 OE2 GLU A 63 -3.905 7.757 -21.390 1.00 0.00 O ATOM 0 H GLU A 63 0.275 6.485 -22.403 1.00 0.00 H new ATOM 0 HA GLU A 63 -1.304 8.247 -20.895 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -0.421 5.355 -20.570 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -1.347 6.122 -19.295 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -2.266 5.983 -22.200 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -2.723 4.812 -20.979 1.00 0.00 H new ATOM 1088 N LEU A 64 1.652 7.813 -19.523 1.00 0.00 N ATOM 1089 CA LEU A 64 2.535 8.355 -18.469 1.00 0.00 C ATOM 1090 C LEU A 64 2.689 9.886 -18.515 1.00 0.00 C ATOM 1091 O LEU A 64 2.986 10.499 -17.486 1.00 0.00 O ATOM 1092 CB LEU A 64 3.950 7.731 -18.517 1.00 0.00 C ATOM 1093 CG LEU A 64 4.033 6.214 -18.320 1.00 0.00 C ATOM 1094 CD1 LEU A 64 5.494 5.780 -18.300 1.00 0.00 C ATOM 1095 CD2 LEU A 64 3.363 5.712 -17.040 1.00 0.00 C ATOM 0 H LEU A 64 2.142 7.259 -20.225 1.00 0.00 H new ATOM 0 HA LEU A 64 2.034 8.085 -17.539 1.00 0.00 H new ATOM 0 HB2 LEU A 64 4.399 7.975 -19.480 1.00 0.00 H new ATOM 0 HB3 LEU A 64 4.560 8.209 -17.751 1.00 0.00 H new ATOM 0 HG LEU A 64 3.491 5.776 -19.158 1.00 0.00 H new ATOM 0 HD11 LEU A 64 5.551 4.701 -18.160 1.00 0.00 H new ATOM 0 HD12 LEU A 64 5.966 6.049 -19.245 1.00 0.00 H new ATOM 0 HD13 LEU A 64 6.011 6.280 -17.481 1.00 0.00 H new ATOM 0 HD21 LEU A 64 3.466 4.629 -16.976 1.00 0.00 H new ATOM 0 HD22 LEU A 64 3.839 6.174 -16.175 1.00 0.00 H new ATOM 0 HD23 LEU A 64 2.305 5.975 -17.056 1.00 0.00 H new ATOM 1107 N GLY A 65 2.528 10.504 -19.694 1.00 0.00 N ATOM 1108 CA GLY A 65 2.871 11.920 -19.887 1.00 0.00 C ATOM 1109 C GLY A 65 4.355 12.223 -19.607 1.00 0.00 C ATOM 1110 O GLY A 65 4.676 13.267 -19.030 1.00 0.00 O ATOM 0 H GLY A 65 2.162 10.045 -20.528 1.00 0.00 H new ATOM 0 HA2 GLY A 65 2.634 12.209 -20.911 1.00 0.00 H new ATOM 0 HA3 GLY A 65 2.251 12.531 -19.231 1.00 0.00 H new ATOM 1114 N GLY A 66 5.242 11.281 -19.959 1.00 0.00 N ATOM 1115 CA GLY A 66 6.675 11.391 -19.650 1.00 0.00 C ATOM 1116 C GLY A 66 7.451 12.427 -20.485 1.00 0.00 C ATOM 1117 O GLY A 66 6.922 13.034 -21.422 1.00 0.00 O ATOM 0 H GLY A 66 4.990 10.430 -20.461 1.00 0.00 H new ATOM 0 HA2 GLY A 66 6.784 11.644 -18.595 1.00 0.00 H new ATOM 0 HA3 GLY A 66 7.137 10.414 -19.793 1.00 0.00 H new ATOM 1121 N ASN A 67 8.732 12.614 -20.141 1.00 0.00 N ATOM 1122 CA ASN A 67 9.701 13.465 -20.848 1.00 0.00 C ATOM 1123 C ASN A 67 9.736 13.173 -22.373 1.00 0.00 C ATOM 1124 O ASN A 67 9.865 11.999 -22.726 1.00 0.00 O ATOM 1125 CB ASN A 67 11.075 13.218 -20.198 1.00 0.00 C ATOM 1126 CG ASN A 67 12.178 14.067 -20.814 1.00 0.00 C ATOM 1127 OD1 ASN A 67 12.071 15.281 -20.914 1.00 0.00 O ATOM 1128 ND2 ASN A 67 13.260 13.474 -21.265 1.00 0.00 N ATOM 0 H ASN A 67 9.140 12.156 -19.326 1.00 0.00 H new ATOM 0 HA ASN A 67 9.412 14.512 -20.759 1.00 0.00 H new ATOM 0 HB2 ASN A 67 11.011 13.431 -19.131 1.00 0.00 H new ATOM 0 HB3 ASN A 67 11.335 12.164 -20.297 1.00 0.00 H new ATOM 0 HD21 ASN A 67 14.003 14.026 -21.694 1.00 0.00 H new ATOM 0 HD22 ASN A 67 13.358 12.462 -21.186 1.00 0.00 H new ATOM 1135 N PRO A 68 9.653 14.172 -23.281 1.00 0.00 N ATOM 1136 CA PRO A 68 9.509 13.988 -24.741 1.00 0.00 C ATOM 1137 C PRO A 68 10.480 13.063 -25.511 1.00 0.00 C ATOM 1138 O PRO A 68 10.228 12.815 -26.694 1.00 0.00 O ATOM 1139 CB PRO A 68 9.554 15.401 -25.333 1.00 0.00 C ATOM 1140 CG PRO A 68 8.945 16.257 -24.232 1.00 0.00 C ATOM 1141 CD PRO A 68 9.453 15.585 -22.960 1.00 0.00 C ATOM 0 HA PRO A 68 8.578 13.435 -24.868 1.00 0.00 H new ATOM 0 HB2 PRO A 68 10.574 15.708 -25.565 1.00 0.00 H new ATOM 0 HB3 PRO A 68 8.982 15.468 -26.259 1.00 0.00 H new ATOM 0 HG2 PRO A 68 9.272 17.295 -24.299 1.00 0.00 H new ATOM 0 HG3 PRO A 68 7.856 16.262 -24.279 1.00 0.00 H new ATOM 0 HD2 PRO A 68 10.385 16.042 -22.627 1.00 0.00 H new ATOM 0 HD3 PRO A 68 8.734 15.699 -22.149 1.00 0.00 H new ATOM 1149 N GLY A 69 11.559 12.549 -24.901 1.00 0.00 N ATOM 1150 CA GLY A 69 12.485 11.620 -25.579 1.00 0.00 C ATOM 1151 C GLY A 69 12.971 10.420 -24.756 1.00 0.00 C ATOM 1152 O GLY A 69 13.427 9.445 -25.356 1.00 0.00 O ATOM 0 H GLY A 69 11.815 12.760 -23.936 1.00 0.00 H new ATOM 0 HA2 GLY A 69 11.994 11.243 -26.476 1.00 0.00 H new ATOM 0 HA3 GLY A 69 13.357 12.186 -25.907 1.00 0.00 H new ATOM 1156 N SER A 70 12.798 10.402 -23.426 1.00 0.00 N ATOM 1157 CA SER A 70 13.019 9.185 -22.607 1.00 0.00 C ATOM 1158 C SER A 70 11.942 8.105 -22.812 1.00 0.00 C ATOM 1159 O SER A 70 11.741 7.251 -21.950 1.00 0.00 O ATOM 1160 CB SER A 70 13.106 9.547 -21.116 1.00 0.00 C ATOM 1161 OG SER A 70 13.969 10.657 -20.900 1.00 0.00 O ATOM 0 H SER A 70 12.505 11.216 -22.886 1.00 0.00 H new ATOM 0 HA SER A 70 13.964 8.762 -22.947 1.00 0.00 H new ATOM 0 HB2 SER A 70 12.110 9.779 -20.738 1.00 0.00 H new ATOM 0 HB3 SER A 70 13.468 8.687 -20.552 1.00 0.00 H new ATOM 0 HG SER A 70 13.789 11.044 -20.018 1.00 0.00 H new ATOM 1167 N THR A 71 11.241 8.132 -23.947 1.00 0.00 N ATOM 1168 CA THR A 71 10.086 7.292 -24.302 1.00 0.00 C ATOM 1169 C THR A 71 10.363 5.787 -24.232 1.00 0.00 C ATOM 1170 O THR A 71 9.449 4.992 -24.011 1.00 0.00 O ATOM 1171 CB THR A 71 9.572 7.670 -25.703 1.00 0.00 C ATOM 1172 OG1 THR A 71 10.544 7.336 -26.671 1.00 0.00 O ATOM 1173 CG2 THR A 71 9.259 9.157 -25.876 1.00 0.00 C ATOM 0 H THR A 71 11.478 8.783 -24.695 1.00 0.00 H new ATOM 0 HA THR A 71 9.323 7.493 -23.550 1.00 0.00 H new ATOM 0 HB THR A 71 8.643 7.113 -25.829 1.00 0.00 H new ATOM 0 HG1 THR A 71 10.214 7.576 -27.562 1.00 0.00 H new ATOM 0 HG21 THR A 71 8.903 9.338 -26.890 1.00 0.00 H new ATOM 0 HG22 THR A 71 8.489 9.452 -25.163 1.00 0.00 H new ATOM 0 HG23 THR A 71 10.161 9.742 -25.698 1.00 0.00 H new ATOM 1181 N SER A 72 11.630 5.382 -24.387 1.00 0.00 N ATOM 1182 CA SER A 72 12.100 3.997 -24.222 1.00 0.00 C ATOM 1183 C SER A 72 12.086 3.508 -22.766 1.00 0.00 C ATOM 1184 O SER A 72 12.221 2.308 -22.533 1.00 0.00 O ATOM 1185 CB SER A 72 13.504 3.836 -24.814 1.00 0.00 C ATOM 1186 OG SER A 72 13.481 4.149 -26.199 1.00 0.00 O ATOM 0 H SER A 72 12.380 6.026 -24.638 1.00 0.00 H new ATOM 0 HA SER A 72 11.390 3.372 -24.764 1.00 0.00 H new ATOM 0 HB2 SER A 72 14.204 4.491 -24.295 1.00 0.00 H new ATOM 0 HB3 SER A 72 13.855 2.814 -24.668 1.00 0.00 H new ATOM 0 HG SER A 72 14.381 4.046 -26.573 1.00 0.00 H new ATOM 1192 N ALA A 73 11.897 4.390 -21.776 1.00 0.00 N ATOM 1193 CA ALA A 73 11.688 3.952 -20.390 1.00 0.00 C ATOM 1194 C ALA A 73 10.545 2.928 -20.259 1.00 0.00 C ATOM 1195 O ALA A 73 10.728 1.886 -19.638 1.00 0.00 O ATOM 1196 CB ALA A 73 11.452 5.177 -19.498 1.00 0.00 C ATOM 0 H ALA A 73 11.884 5.402 -21.907 1.00 0.00 H new ATOM 0 HA ALA A 73 12.589 3.435 -20.059 1.00 0.00 H new ATOM 0 HB1 ALA A 73 11.297 4.853 -18.469 1.00 0.00 H new ATOM 0 HB2 ALA A 73 12.321 5.834 -19.545 1.00 0.00 H new ATOM 0 HB3 ALA A 73 10.571 5.716 -19.846 1.00 0.00 H new ATOM 1202 N ALA A 74 9.399 3.165 -20.913 1.00 0.00 N ATOM 1203 CA ALA A 74 8.314 2.188 -21.088 1.00 0.00 C ATOM 1204 C ALA A 74 8.790 0.878 -21.757 1.00 0.00 C ATOM 1205 O ALA A 74 8.415 -0.216 -21.335 1.00 0.00 O ATOM 1206 CB ALA A 74 7.207 2.903 -21.858 1.00 0.00 C ATOM 0 H ALA A 74 9.195 4.066 -21.347 1.00 0.00 H new ATOM 0 HA ALA A 74 7.936 1.851 -20.123 1.00 0.00 H new ATOM 0 HB1 ALA A 74 6.373 2.219 -22.016 1.00 0.00 H new ATOM 0 HB2 ALA A 74 6.865 3.766 -21.287 1.00 0.00 H new ATOM 0 HB3 ALA A 74 7.591 3.235 -22.823 1.00 0.00 H new ATOM 1212 N THR A 75 9.680 0.969 -22.746 1.00 0.00 N ATOM 1213 CA THR A 75 10.226 -0.220 -23.424 1.00 0.00 C ATOM 1214 C THR A 75 11.113 -1.074 -22.503 1.00 0.00 C ATOM 1215 O THR A 75 11.036 -2.302 -22.549 1.00 0.00 O ATOM 1216 CB THR A 75 11.004 0.227 -24.676 1.00 0.00 C ATOM 1217 OG1 THR A 75 10.177 1.027 -25.496 1.00 0.00 O ATOM 1218 CG2 THR A 75 11.499 -0.932 -25.538 1.00 0.00 C ATOM 0 H THR A 75 10.042 1.854 -23.100 1.00 0.00 H new ATOM 0 HA THR A 75 9.390 -0.857 -23.713 1.00 0.00 H new ATOM 0 HB THR A 75 11.870 0.773 -24.301 1.00 0.00 H new ATOM 0 HG1 THR A 75 10.443 0.919 -26.433 1.00 0.00 H new ATOM 0 HG21 THR A 75 12.037 -0.540 -26.401 1.00 0.00 H new ATOM 0 HG22 THR A 75 12.166 -1.563 -24.951 1.00 0.00 H new ATOM 0 HG23 THR A 75 10.648 -1.521 -25.879 1.00 0.00 H new ATOM 1226 N CYS A 76 11.899 -0.463 -21.610 1.00 0.00 N ATOM 1227 CA CYS A 76 12.619 -1.176 -20.544 1.00 0.00 C ATOM 1228 C CYS A 76 11.687 -1.633 -19.405 1.00 0.00 C ATOM 1229 O CYS A 76 11.891 -2.697 -18.821 1.00 0.00 O ATOM 1230 CB CYS A 76 13.735 -0.262 -20.020 1.00 0.00 C ATOM 1231 SG CYS A 76 14.859 -1.204 -18.945 1.00 0.00 S ATOM 0 H CYS A 76 12.056 0.545 -21.605 1.00 0.00 H new ATOM 0 HA CYS A 76 13.047 -2.089 -20.958 1.00 0.00 H new ATOM 0 HB2 CYS A 76 14.290 0.164 -20.856 1.00 0.00 H new ATOM 0 HB3 CYS A 76 13.303 0.572 -19.467 1.00 0.00 H new ATOM 0 HG CYS A 76 15.801 -0.421 -18.509 1.00 0.00 H new ATOM 1237 N THR A 77 10.627 -0.865 -19.130 1.00 0.00 N ATOM 1238 CA THR A 77 9.604 -1.234 -18.132 1.00 0.00 C ATOM 1239 C THR A 77 8.933 -2.577 -18.447 1.00 0.00 C ATOM 1240 O THR A 77 8.618 -3.331 -17.521 1.00 0.00 O ATOM 1241 CB THR A 77 8.564 -0.109 -18.004 1.00 0.00 C ATOM 1242 OG1 THR A 77 9.201 1.051 -17.520 1.00 0.00 O ATOM 1243 CG2 THR A 77 7.461 -0.413 -17.006 1.00 0.00 C ATOM 0 H THR A 77 10.450 0.029 -19.589 1.00 0.00 H new ATOM 0 HA THR A 77 10.109 -1.361 -17.174 1.00 0.00 H new ATOM 0 HB THR A 77 8.129 0.009 -18.997 1.00 0.00 H new ATOM 0 HG1 THR A 77 9.663 1.502 -18.257 1.00 0.00 H new ATOM 0 HG21 THR A 77 6.764 0.424 -16.968 1.00 0.00 H new ATOM 0 HG22 THR A 77 6.930 -1.314 -17.314 1.00 0.00 H new ATOM 0 HG23 THR A 77 7.896 -0.568 -16.019 1.00 0.00 H new ATOM 1251 N ARG A 78 8.838 -2.944 -19.738 1.00 0.00 N ATOM 1252 CA ARG A 78 8.349 -4.263 -20.160 1.00 0.00 C ATOM 1253 C ARG A 78 9.097 -5.395 -19.468 1.00 0.00 C ATOM 1254 O ARG A 78 8.500 -6.429 -19.166 1.00 0.00 O ATOM 1255 CB ARG A 78 8.509 -4.380 -21.688 1.00 0.00 C ATOM 1256 CG ARG A 78 7.873 -5.661 -22.256 1.00 0.00 C ATOM 1257 CD ARG A 78 7.990 -5.705 -23.782 1.00 0.00 C ATOM 1258 NE ARG A 78 7.395 -6.942 -24.323 1.00 0.00 N ATOM 1259 CZ ARG A 78 7.637 -7.483 -25.503 1.00 0.00 C ATOM 1260 NH1 ARG A 78 8.405 -6.911 -26.388 1.00 0.00 N ATOM 1261 NH2 ARG A 78 7.111 -8.631 -25.819 1.00 0.00 N ATOM 0 H ARG A 78 9.098 -2.334 -20.513 1.00 0.00 H new ATOM 0 HA ARG A 78 7.300 -4.352 -19.877 1.00 0.00 H new ATOM 0 HB2 ARG A 78 8.054 -3.512 -22.164 1.00 0.00 H new ATOM 0 HB3 ARG A 78 9.569 -4.363 -21.940 1.00 0.00 H new ATOM 0 HG2 ARG A 78 8.362 -6.535 -21.825 1.00 0.00 H new ATOM 0 HG3 ARG A 78 6.823 -5.708 -21.967 1.00 0.00 H new ATOM 0 HD2 ARG A 78 7.490 -4.838 -24.214 1.00 0.00 H new ATOM 0 HD3 ARG A 78 9.039 -5.645 -24.072 1.00 0.00 H new ATOM 0 HE ARG A 78 6.728 -7.429 -23.724 1.00 0.00 H new ATOM 0 HH11 ARG A 78 8.843 -6.014 -26.179 1.00 0.00 H new ATOM 0 HH12 ARG A 78 8.568 -7.361 -27.289 1.00 0.00 H new ATOM 0 HH21 ARG A 78 6.509 -9.117 -25.154 1.00 0.00 H new ATOM 0 HH22 ARG A 78 7.301 -9.045 -26.732 1.00 0.00 H new ATOM 1275 N ARG A 79 10.391 -5.198 -19.186 1.00 0.00 N ATOM 1276 CA ARG A 79 11.251 -6.267 -18.683 1.00 0.00 C ATOM 1277 C ARG A 79 11.055 -6.584 -17.199 1.00 0.00 C ATOM 1278 O ARG A 79 11.486 -7.639 -16.737 1.00 0.00 O ATOM 1279 CB ARG A 79 12.729 -5.929 -18.966 1.00 0.00 C ATOM 1280 CG ARG A 79 13.039 -5.605 -20.440 1.00 0.00 C ATOM 1281 CD ARG A 79 14.477 -5.100 -20.589 1.00 0.00 C ATOM 1282 NE ARG A 79 14.767 -4.726 -21.987 1.00 0.00 N ATOM 1283 CZ ARG A 79 15.640 -3.826 -22.411 1.00 0.00 C ATOM 1284 NH1 ARG A 79 16.367 -3.119 -21.592 1.00 0.00 N ATOM 1285 NH2 ARG A 79 15.796 -3.613 -23.685 1.00 0.00 N ATOM 0 H ARG A 79 10.864 -4.301 -19.300 1.00 0.00 H new ATOM 0 HA ARG A 79 10.958 -7.169 -19.220 1.00 0.00 H new ATOM 0 HB2 ARG A 79 13.018 -5.077 -18.351 1.00 0.00 H new ATOM 0 HB3 ARG A 79 13.347 -6.771 -18.654 1.00 0.00 H new ATOM 0 HG2 ARG A 79 12.895 -6.496 -21.052 1.00 0.00 H new ATOM 0 HG3 ARG A 79 12.343 -4.851 -20.806 1.00 0.00 H new ATOM 0 HD2 ARG A 79 14.632 -4.239 -19.939 1.00 0.00 H new ATOM 0 HD3 ARG A 79 15.173 -5.874 -20.265 1.00 0.00 H new ATOM 0 HE ARG A 79 14.235 -5.216 -22.707 1.00 0.00 H new ATOM 0 HH11 ARG A 79 16.274 -3.250 -20.585 1.00 0.00 H new ATOM 0 HH12 ARG A 79 17.029 -2.435 -21.958 1.00 0.00 H new ATOM 0 HH21 ARG A 79 15.244 -4.141 -24.362 1.00 0.00 H new ATOM 0 HH22 ARG A 79 16.470 -2.918 -24.007 1.00 0.00 H new ATOM 1299 N HIS A 80 10.369 -5.701 -16.469 1.00 0.00 N ATOM 1300 CA HIS A 80 9.906 -5.936 -15.099 1.00 0.00 C ATOM 1301 C HIS A 80 8.396 -6.196 -15.059 1.00 0.00 C ATOM 1302 O HIS A 80 7.957 -7.032 -14.273 1.00 0.00 O ATOM 1303 CB HIS A 80 10.378 -4.800 -14.180 1.00 0.00 C ATOM 1304 CG HIS A 80 11.853 -4.935 -13.884 1.00 0.00 C ATOM 1305 ND1 HIS A 80 12.415 -5.506 -12.761 1.00 0.00 N ATOM 1306 CD2 HIS A 80 12.884 -4.650 -14.739 1.00 0.00 C ATOM 1307 CE1 HIS A 80 13.750 -5.556 -12.937 1.00 0.00 C ATOM 1308 NE2 HIS A 80 14.084 -5.043 -14.133 1.00 0.00 N ATOM 0 H HIS A 80 10.114 -4.779 -16.823 1.00 0.00 H new ATOM 0 HA HIS A 80 10.358 -6.849 -14.711 1.00 0.00 H new ATOM 0 HB2 HIS A 80 10.183 -3.837 -14.653 1.00 0.00 H new ATOM 0 HB3 HIS A 80 9.811 -4.819 -13.249 1.00 0.00 H new ATOM 0 HD2 HIS A 80 12.788 -4.199 -15.715 1.00 0.00 H new ATOM 0 HE1 HIS A 80 14.452 -5.952 -12.218 1.00 0.00 H new ATOM 0 HE2 HIS A 80 15.023 -4.957 -14.522 1.00 0.00 H new ATOM 1316 N TYR A 81 7.608 -5.625 -15.974 1.00 0.00 N ATOM 1317 CA TYR A 81 6.200 -5.990 -16.165 1.00 0.00 C ATOM 1318 C TYR A 81 6.010 -7.495 -16.414 1.00 0.00 C ATOM 1319 O TYR A 81 5.090 -8.092 -15.852 1.00 0.00 O ATOM 1320 CB TYR A 81 5.619 -5.183 -17.332 1.00 0.00 C ATOM 1321 CG TYR A 81 4.165 -5.476 -17.653 1.00 0.00 C ATOM 1322 CD1 TYR A 81 3.827 -6.483 -18.582 1.00 0.00 C ATOM 1323 CD2 TYR A 81 3.146 -4.709 -17.057 1.00 0.00 C ATOM 1324 CE1 TYR A 81 2.479 -6.715 -18.916 1.00 0.00 C ATOM 1325 CE2 TYR A 81 1.801 -4.924 -17.403 1.00 0.00 C ATOM 1326 CZ TYR A 81 1.459 -5.930 -18.331 1.00 0.00 C ATOM 1327 OH TYR A 81 0.151 -6.127 -18.652 1.00 0.00 O ATOM 0 H TYR A 81 7.930 -4.893 -16.607 1.00 0.00 H new ATOM 0 HA TYR A 81 5.669 -5.753 -15.243 1.00 0.00 H new ATOM 0 HB2 TYR A 81 5.719 -4.122 -17.105 1.00 0.00 H new ATOM 0 HB3 TYR A 81 6.218 -5.377 -18.222 1.00 0.00 H new ATOM 0 HD1 TYR A 81 4.605 -7.078 -19.038 1.00 0.00 H new ATOM 0 HD2 TYR A 81 3.399 -3.951 -16.330 1.00 0.00 H new ATOM 0 HE1 TYR A 81 2.224 -7.493 -19.620 1.00 0.00 H new ATOM 0 HE2 TYR A 81 1.027 -4.317 -16.957 1.00 0.00 H new ATOM 0 HH TYR A 81 -0.407 -5.496 -18.151 1.00 0.00 H new ATOM 1337 N GLU A 82 6.912 -8.144 -17.170 1.00 0.00 N ATOM 1338 CA GLU A 82 6.826 -9.578 -17.462 1.00 0.00 C ATOM 1339 C GLU A 82 7.057 -10.462 -16.222 1.00 0.00 C ATOM 1340 O GLU A 82 6.825 -11.671 -16.277 1.00 0.00 O ATOM 1341 CB GLU A 82 7.795 -9.973 -18.589 1.00 0.00 C ATOM 1342 CG GLU A 82 9.261 -9.832 -18.174 1.00 0.00 C ATOM 1343 CD GLU A 82 10.205 -10.575 -19.132 1.00 0.00 C ATOM 1344 OE1 GLU A 82 10.522 -10.046 -20.225 1.00 0.00 O ATOM 1345 OE2 GLU A 82 10.634 -11.701 -18.776 1.00 0.00 O ATOM 0 H GLU A 82 7.719 -7.686 -17.594 1.00 0.00 H new ATOM 0 HA GLU A 82 5.803 -9.758 -17.793 1.00 0.00 H new ATOM 0 HB2 GLU A 82 7.602 -11.004 -18.886 1.00 0.00 H new ATOM 0 HB3 GLU A 82 7.606 -9.349 -19.462 1.00 0.00 H new ATOM 0 HG2 GLU A 82 9.530 -8.776 -18.147 1.00 0.00 H new ATOM 0 HG3 GLU A 82 9.391 -10.220 -17.164 1.00 0.00 H new ATOM 1352 N ARG A 83 7.530 -9.850 -15.124 1.00 0.00 N ATOM 1353 CA ARG A 83 7.965 -10.580 -13.926 1.00 0.00 C ATOM 1354 C ARG A 83 7.299 -10.113 -12.620 1.00 0.00 C ATOM 1355 O ARG A 83 7.356 -10.832 -11.624 1.00 0.00 O ATOM 1356 CB ARG A 83 9.507 -10.526 -13.826 1.00 0.00 C ATOM 1357 CG ARG A 83 10.166 -11.914 -13.901 1.00 0.00 C ATOM 1358 CD ARG A 83 10.167 -12.520 -15.314 1.00 0.00 C ATOM 1359 NE ARG A 83 10.740 -13.879 -15.296 1.00 0.00 N ATOM 1360 CZ ARG A 83 11.212 -14.570 -16.322 1.00 0.00 C ATOM 1361 NH1 ARG A 83 11.258 -14.110 -17.540 1.00 0.00 N ATOM 1362 NH2 ARG A 83 11.662 -15.779 -16.133 1.00 0.00 N ATOM 0 H ARG A 83 7.621 -8.837 -15.044 1.00 0.00 H new ATOM 0 HA ARG A 83 7.634 -11.611 -14.047 1.00 0.00 H new ATOM 0 HB2 ARG A 83 9.896 -9.902 -14.631 1.00 0.00 H new ATOM 0 HB3 ARG A 83 9.788 -10.047 -12.888 1.00 0.00 H new ATOM 0 HG2 ARG A 83 11.194 -11.838 -13.547 1.00 0.00 H new ATOM 0 HG3 ARG A 83 9.645 -12.591 -13.225 1.00 0.00 H new ATOM 0 HD2 ARG A 83 9.149 -12.554 -15.702 1.00 0.00 H new ATOM 0 HD3 ARG A 83 10.743 -11.885 -15.987 1.00 0.00 H new ATOM 0 HE ARG A 83 10.777 -14.340 -14.387 1.00 0.00 H new ATOM 0 HH11 ARG A 83 10.919 -13.170 -17.743 1.00 0.00 H new ATOM 0 HH12 ARG A 83 11.633 -14.690 -18.290 1.00 0.00 H new ATOM 0 HH21 ARG A 83 11.649 -16.188 -15.199 1.00 0.00 H new ATOM 0 HH22 ARG A 83 12.027 -16.316 -16.920 1.00 0.00 H new ATOM 1376 N LEU A 84 6.647 -8.943 -12.646 1.00 0.00 N ATOM 1377 CA LEU A 84 6.044 -8.336 -11.445 1.00 0.00 C ATOM 1378 C LEU A 84 4.555 -7.974 -11.610 1.00 0.00 C ATOM 1379 O LEU A 84 3.988 -7.351 -10.719 1.00 0.00 O ATOM 1380 CB LEU A 84 6.912 -7.137 -11.015 1.00 0.00 C ATOM 1381 CG LEU A 84 8.167 -7.564 -10.237 1.00 0.00 C ATOM 1382 CD1 LEU A 84 9.122 -6.380 -10.115 1.00 0.00 C ATOM 1383 CD2 LEU A 84 7.803 -8.045 -8.829 1.00 0.00 C ATOM 0 H LEU A 84 6.521 -8.391 -13.494 1.00 0.00 H new ATOM 0 HA LEU A 84 6.037 -9.081 -10.649 1.00 0.00 H new ATOM 0 HB2 LEU A 84 7.211 -6.574 -11.899 1.00 0.00 H new ATOM 0 HB3 LEU A 84 6.317 -6.466 -10.396 1.00 0.00 H new ATOM 0 HG LEU A 84 8.640 -8.381 -10.782 1.00 0.00 H new ATOM 0 HD11 LEU A 84 10.011 -6.685 -9.563 1.00 0.00 H new ATOM 0 HD12 LEU A 84 9.411 -6.042 -11.110 1.00 0.00 H new ATOM 0 HD13 LEU A 84 8.627 -5.566 -9.585 1.00 0.00 H new ATOM 0 HD21 LEU A 84 8.709 -8.341 -8.300 1.00 0.00 H new ATOM 0 HD22 LEU A 84 7.312 -7.238 -8.284 1.00 0.00 H new ATOM 0 HD23 LEU A 84 7.128 -8.898 -8.899 1.00 0.00 H new ATOM 1395 N ILE A 85 3.926 -8.401 -12.714 1.00 0.00 N ATOM 1396 CA ILE A 85 2.450 -8.337 -12.843 1.00 0.00 C ATOM 1397 C ILE A 85 1.894 -9.252 -13.941 1.00 0.00 C ATOM 1398 O ILE A 85 0.832 -9.830 -13.734 1.00 0.00 O ATOM 1399 CB ILE A 85 1.940 -6.879 -12.976 1.00 0.00 C ATOM 1400 CG1 ILE A 85 0.402 -6.793 -12.888 1.00 0.00 C ATOM 1401 CG2 ILE A 85 2.454 -6.187 -14.247 1.00 0.00 C ATOM 1402 CD1 ILE A 85 -0.055 -5.521 -12.164 1.00 0.00 C ATOM 0 H ILE A 85 4.403 -8.792 -13.526 1.00 0.00 H new ATOM 0 HA ILE A 85 2.052 -8.731 -11.907 1.00 0.00 H new ATOM 0 HB ILE A 85 2.354 -6.339 -12.124 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -0.021 -6.812 -13.892 1.00 0.00 H new ATOM 0 HG13 ILE A 85 0.018 -7.668 -12.363 1.00 0.00 H new ATOM 0 HG21 ILE A 85 2.066 -5.169 -14.289 1.00 0.00 H new ATOM 0 HG22 ILE A 85 3.544 -6.160 -14.231 1.00 0.00 H new ATOM 0 HG23 ILE A 85 2.117 -6.740 -15.124 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -1.144 -5.497 -12.123 1.00 0.00 H new ATOM 0 HD12 ILE A 85 0.347 -5.515 -11.151 1.00 0.00 H new ATOM 0 HD13 ILE A 85 0.307 -4.646 -12.703 1.00 0.00 H new ATOM 1414 N LEU A 86 2.621 -9.502 -15.036 1.00 0.00 N ATOM 1415 CA LEU A 86 2.277 -10.555 -16.006 1.00 0.00 C ATOM 1416 C LEU A 86 2.067 -11.958 -15.367 1.00 0.00 C ATOM 1417 O LEU A 86 1.118 -12.641 -15.760 1.00 0.00 O ATOM 1418 CB LEU A 86 3.336 -10.557 -17.124 1.00 0.00 C ATOM 1419 CG LEU A 86 3.128 -11.566 -18.271 1.00 0.00 C ATOM 1420 CD1 LEU A 86 1.748 -11.448 -18.922 1.00 0.00 C ATOM 1421 CD2 LEU A 86 4.174 -11.354 -19.367 1.00 0.00 C ATOM 0 H LEU A 86 3.465 -8.982 -15.277 1.00 0.00 H new ATOM 0 HA LEU A 86 1.301 -10.322 -16.432 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.379 -9.556 -17.554 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.308 -10.751 -16.672 1.00 0.00 H new ATOM 0 HG LEU A 86 3.222 -12.554 -17.819 1.00 0.00 H new ATOM 0 HD11 LEU A 86 1.659 -12.183 -19.722 1.00 0.00 H new ATOM 0 HD12 LEU A 86 0.976 -11.631 -18.174 1.00 0.00 H new ATOM 0 HD13 LEU A 86 1.624 -10.446 -19.334 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.012 -12.075 -20.169 1.00 0.00 H new ATOM 0 HD22 LEU A 86 4.085 -10.343 -19.764 1.00 0.00 H new ATOM 0 HD23 LEU A 86 5.171 -11.493 -18.950 1.00 0.00 H new ATOM 1433 N PRO A 87 2.853 -12.405 -14.358 1.00 0.00 N ATOM 1434 CA PRO A 87 2.553 -13.650 -13.638 1.00 0.00 C ATOM 1435 C PRO A 87 1.360 -13.565 -12.667 1.00 0.00 C ATOM 1436 O PRO A 87 0.893 -14.618 -12.229 1.00 0.00 O ATOM 1437 CB PRO A 87 3.845 -14.027 -12.903 1.00 0.00 C ATOM 1438 CG PRO A 87 4.528 -12.683 -12.681 1.00 0.00 C ATOM 1439 CD PRO A 87 4.171 -11.920 -13.954 1.00 0.00 C ATOM 0 HA PRO A 87 2.238 -14.409 -14.354 1.00 0.00 H new ATOM 0 HB2 PRO A 87 3.638 -14.534 -11.960 1.00 0.00 H new ATOM 0 HB3 PRO A 87 4.464 -14.699 -13.497 1.00 0.00 H new ATOM 0 HG2 PRO A 87 4.156 -12.181 -11.788 1.00 0.00 H new ATOM 0 HG3 PRO A 87 5.606 -12.790 -12.560 1.00 0.00 H new ATOM 0 HD2 PRO A 87 4.153 -10.845 -13.773 1.00 0.00 H new ATOM 0 HD3 PRO A 87 4.909 -12.099 -14.736 1.00 0.00 H new ATOM 1447 N TYR A 88 0.847 -12.368 -12.334 1.00 0.00 N ATOM 1448 CA TYR A 88 -0.303 -12.222 -11.423 1.00 0.00 C ATOM 1449 C TYR A 88 -1.624 -11.937 -12.155 1.00 0.00 C ATOM 1450 O TYR A 88 -2.623 -12.584 -11.856 1.00 0.00 O ATOM 1451 CB TYR A 88 0.021 -11.230 -10.293 1.00 0.00 C ATOM 1452 CG TYR A 88 0.366 -11.921 -8.978 1.00 0.00 C ATOM 1453 CD1 TYR A 88 1.337 -12.944 -8.932 1.00 0.00 C ATOM 1454 CD2 TYR A 88 -0.326 -11.576 -7.803 1.00 0.00 C ATOM 1455 CE1 TYR A 88 1.582 -13.635 -7.729 1.00 0.00 C ATOM 1456 CE2 TYR A 88 -0.075 -12.256 -6.596 1.00 0.00 C ATOM 1457 CZ TYR A 88 0.883 -13.290 -6.555 1.00 0.00 C ATOM 1458 OH TYR A 88 1.137 -13.953 -5.394 1.00 0.00 O ATOM 0 H TYR A 88 1.213 -11.483 -12.684 1.00 0.00 H new ATOM 0 HA TYR A 88 -0.476 -13.188 -10.948 1.00 0.00 H new ATOM 0 HB2 TYR A 88 0.857 -10.601 -10.597 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -0.834 -10.571 -10.138 1.00 0.00 H new ATOM 0 HD1 TYR A 88 1.894 -13.198 -9.822 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -1.057 -10.782 -7.827 1.00 0.00 H new ATOM 0 HE1 TYR A 88 2.309 -14.433 -7.706 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -0.616 -11.986 -5.701 1.00 0.00 H new ATOM 0 HH TYR A 88 0.571 -13.592 -4.680 1.00 0.00 H new ATOM 1468 N GLU A 89 -1.623 -11.114 -13.210 1.00 0.00 N ATOM 1469 CA GLU A 89 -2.789 -10.994 -14.125 1.00 0.00 C ATOM 1470 C GLU A 89 -3.196 -12.347 -14.778 1.00 0.00 C ATOM 1471 O GLU A 89 -4.301 -12.506 -15.296 1.00 0.00 O ATOM 1472 CB GLU A 89 -2.553 -9.866 -15.144 1.00 0.00 C ATOM 1473 CG GLU A 89 -1.566 -10.183 -16.277 1.00 0.00 C ATOM 1474 CD GLU A 89 -2.257 -10.773 -17.522 1.00 0.00 C ATOM 1475 OE1 GLU A 89 -3.045 -10.049 -18.175 1.00 0.00 O ATOM 1476 OE2 GLU A 89 -1.989 -11.948 -17.866 1.00 0.00 O ATOM 0 H GLU A 89 -0.834 -10.518 -13.460 1.00 0.00 H new ATOM 0 HA GLU A 89 -3.656 -10.716 -13.526 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -3.512 -9.597 -15.588 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -2.192 -8.988 -14.608 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -1.037 -9.272 -16.558 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -0.817 -10.887 -15.914 1.00 0.00 H new ATOM 1483 N ARG A 90 -2.303 -13.338 -14.618 1.00 0.00 N ATOM 1484 CA ARG A 90 -2.611 -14.744 -14.920 1.00 0.00 C ATOM 1485 C ARG A 90 -3.900 -15.235 -14.237 1.00 0.00 C ATOM 1486 O ARG A 90 -4.657 -15.974 -14.867 1.00 0.00 O ATOM 1487 CB ARG A 90 -1.397 -15.601 -14.523 1.00 0.00 C ATOM 1488 CG ARG A 90 -1.528 -17.075 -14.941 1.00 0.00 C ATOM 1489 CD ARG A 90 -0.322 -17.906 -14.479 1.00 0.00 C ATOM 1490 NE ARG A 90 0.914 -17.557 -15.214 1.00 0.00 N ATOM 1491 CZ ARG A 90 2.122 -17.358 -14.711 1.00 0.00 C ATOM 1492 NH1 ARG A 90 2.357 -17.331 -13.430 1.00 0.00 N ATOM 1493 NH2 ARG A 90 3.138 -17.184 -15.508 1.00 0.00 N ATOM 0 H ARG A 90 -1.353 -13.188 -14.278 1.00 0.00 H new ATOM 0 HA ARG A 90 -2.801 -14.838 -15.989 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -0.500 -15.180 -14.978 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -1.262 -15.548 -13.443 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -2.441 -17.493 -14.518 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -1.620 -17.139 -16.025 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -0.164 -17.751 -13.412 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -0.538 -18.965 -14.618 1.00 0.00 H new ATOM 0 HE ARG A 90 0.825 -17.458 -16.225 1.00 0.00 H new ATOM 0 HH11 ARG A 90 1.593 -17.467 -12.768 1.00 0.00 H new ATOM 0 HH12 ARG A 90 3.305 -17.174 -13.089 1.00 0.00 H new ATOM 0 HH21 ARG A 90 3.002 -17.201 -16.519 1.00 0.00 H new ATOM 0 HH22 ARG A 90 4.069 -17.031 -15.121 1.00 0.00 H new ATOM 1507 N PHE A 91 -4.202 -14.806 -13.003 1.00 0.00 N ATOM 1508 CA PHE A 91 -5.476 -15.171 -12.357 1.00 0.00 C ATOM 1509 C PHE A 91 -6.723 -14.639 -13.092 1.00 0.00 C ATOM 1510 O PHE A 91 -7.777 -15.271 -13.022 1.00 0.00 O ATOM 1511 CB PHE A 91 -5.498 -14.861 -10.844 1.00 0.00 C ATOM 1512 CG PHE A 91 -5.150 -13.461 -10.350 1.00 0.00 C ATOM 1513 CD1 PHE A 91 -5.851 -12.318 -10.795 1.00 0.00 C ATOM 1514 CD2 PHE A 91 -4.152 -13.307 -9.367 1.00 0.00 C ATOM 1515 CE1 PHE A 91 -5.506 -11.040 -10.320 1.00 0.00 C ATOM 1516 CE2 PHE A 91 -3.821 -12.033 -8.875 1.00 0.00 C ATOM 1517 CZ PHE A 91 -4.482 -10.898 -9.368 1.00 0.00 C ATOM 0 H PHE A 91 -3.593 -14.215 -12.437 1.00 0.00 H new ATOM 0 HA PHE A 91 -5.532 -16.256 -12.446 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -6.498 -15.095 -10.479 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -4.812 -15.556 -10.360 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -6.658 -12.426 -11.505 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -3.636 -14.177 -8.988 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -6.028 -10.168 -10.687 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -3.058 -11.928 -8.118 1.00 0.00 H new ATOM 0 HZ PHE A 91 -4.204 -9.916 -9.016 1.00 0.00 H new ATOM 1527 N ILE A 92 -6.623 -13.545 -13.858 1.00 0.00 N ATOM 1528 CA ILE A 92 -7.777 -12.986 -14.589 1.00 0.00 C ATOM 1529 C ILE A 92 -8.191 -13.917 -15.740 1.00 0.00 C ATOM 1530 O ILE A 92 -9.380 -14.171 -15.943 1.00 0.00 O ATOM 1531 CB ILE A 92 -7.469 -11.557 -15.111 1.00 0.00 C ATOM 1532 CG1 ILE A 92 -6.953 -10.640 -13.974 1.00 0.00 C ATOM 1533 CG2 ILE A 92 -8.722 -10.944 -15.766 1.00 0.00 C ATOM 1534 CD1 ILE A 92 -6.566 -9.224 -14.425 1.00 0.00 C ATOM 0 H ILE A 92 -5.755 -13.026 -13.990 1.00 0.00 H new ATOM 0 HA ILE A 92 -8.614 -12.911 -13.895 1.00 0.00 H new ATOM 0 HB ILE A 92 -6.681 -11.637 -15.860 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -7.723 -10.566 -13.206 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -6.086 -11.110 -13.511 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -8.490 -9.942 -16.127 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -9.037 -11.567 -16.603 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -9.526 -10.888 -15.032 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -6.216 -8.651 -13.566 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -5.772 -9.283 -15.169 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -7.435 -8.731 -14.860 1.00 0.00 H new ATOM 1546 N LYS A 93 -7.208 -14.477 -16.460 1.00 0.00 N ATOM 1547 CA LYS A 93 -7.459 -15.277 -17.679 1.00 0.00 C ATOM 1548 C LYS A 93 -7.515 -16.792 -17.439 1.00 0.00 C ATOM 1549 O LYS A 93 -7.867 -17.537 -18.357 1.00 0.00 O ATOM 1550 CB LYS A 93 -6.414 -14.886 -18.745 1.00 0.00 C ATOM 1551 CG LYS A 93 -4.980 -15.333 -18.411 1.00 0.00 C ATOM 1552 CD LYS A 93 -3.952 -14.613 -19.292 1.00 0.00 C ATOM 1553 CE LYS A 93 -2.537 -15.131 -18.999 1.00 0.00 C ATOM 1554 NZ LYS A 93 -1.503 -14.156 -19.432 1.00 0.00 N ATOM 0 H LYS A 93 -6.220 -14.392 -16.220 1.00 0.00 H new ATOM 0 HA LYS A 93 -8.461 -15.039 -18.037 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -6.705 -15.321 -19.701 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -6.426 -13.803 -18.870 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -4.769 -15.129 -17.361 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -4.891 -16.410 -18.551 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -4.192 -14.769 -20.344 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -3.997 -13.539 -19.111 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -2.432 -15.325 -17.931 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -2.382 -16.080 -19.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -0.591 -14.643 -19.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -1.782 -13.735 -20.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -1.411 -13.407 -18.717 1.00 0.00 H new ATOM 1568 N GLY A 94 -7.196 -17.239 -16.217 1.00 0.00 N ATOM 1569 CA GLY A 94 -7.185 -18.670 -15.870 1.00 0.00 C ATOM 1570 C GLY A 94 -7.946 -19.050 -14.593 1.00 0.00 C ATOM 1571 O GLY A 94 -8.214 -20.234 -14.389 1.00 0.00 O ATOM 0 H GLY A 94 -6.940 -16.625 -15.444 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -7.608 -19.231 -16.704 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -6.149 -18.991 -15.763 1.00 0.00 H new ATOM 1575 N GLU A 95 -8.336 -18.087 -13.748 1.00 0.00 N ATOM 1576 CA GLU A 95 -9.001 -18.327 -12.449 1.00 0.00 C ATOM 1577 C GLU A 95 -10.169 -17.361 -12.158 1.00 0.00 C ATOM 1578 O GLU A 95 -10.602 -17.210 -11.013 1.00 0.00 O ATOM 1579 CB GLU A 95 -7.960 -18.323 -11.309 1.00 0.00 C ATOM 1580 CG GLU A 95 -6.886 -19.411 -11.441 1.00 0.00 C ATOM 1581 CD GLU A 95 -6.026 -19.490 -10.164 1.00 0.00 C ATOM 1582 OE1 GLU A 95 -6.460 -20.138 -9.181 1.00 0.00 O ATOM 1583 OE2 GLU A 95 -4.911 -18.914 -10.141 1.00 0.00 O ATOM 0 H GLU A 95 -8.198 -17.096 -13.947 1.00 0.00 H new ATOM 0 HA GLU A 95 -9.459 -19.314 -12.510 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -7.473 -17.348 -11.279 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -8.477 -18.451 -10.358 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.360 -20.375 -11.626 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -6.250 -19.198 -12.300 1.00 0.00 H new ATOM 1590 N GLU A 96 -10.714 -16.737 -13.203 1.00 0.00 N ATOM 1591 CA GLU A 96 -11.857 -15.816 -13.127 1.00 0.00 C ATOM 1592 C GLU A 96 -12.703 -15.777 -14.415 1.00 0.00 C ATOM 1593 O GLU A 96 -13.930 -15.834 -14.330 1.00 0.00 O ATOM 1594 CB GLU A 96 -11.357 -14.406 -12.751 1.00 0.00 C ATOM 1595 CG GLU A 96 -12.512 -13.450 -12.426 1.00 0.00 C ATOM 1596 CD GLU A 96 -11.980 -12.092 -11.924 1.00 0.00 C ATOM 1597 OE1 GLU A 96 -11.745 -11.185 -12.758 1.00 0.00 O ATOM 1598 OE2 GLU A 96 -11.811 -11.918 -10.691 1.00 0.00 O ATOM 0 H GLU A 96 -10.365 -16.859 -14.154 1.00 0.00 H new ATOM 0 HA GLU A 96 -12.524 -16.193 -12.351 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -10.692 -14.476 -11.890 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -10.771 -13.998 -13.575 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -13.125 -13.299 -13.315 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -13.155 -13.896 -11.667 1.00 0.00 H new ATOM 1605 N ASP A 97 -12.078 -15.725 -15.600 1.00 0.00 N ATOM 1606 CA ASP A 97 -12.806 -15.712 -16.886 1.00 0.00 C ATOM 1607 C ASP A 97 -13.335 -17.105 -17.315 1.00 0.00 C ATOM 1608 O ASP A 97 -12.940 -17.652 -18.350 1.00 0.00 O ATOM 1609 CB ASP A 97 -11.925 -15.043 -17.957 1.00 0.00 C ATOM 1610 CG ASP A 97 -12.669 -14.814 -19.288 1.00 0.00 C ATOM 1611 OD1 ASP A 97 -13.877 -14.467 -19.267 1.00 0.00 O ATOM 1612 OD2 ASP A 97 -12.037 -14.930 -20.366 1.00 0.00 O ATOM 0 H ASP A 97 -11.063 -15.691 -15.699 1.00 0.00 H new ATOM 0 HA ASP A 97 -13.712 -15.120 -16.758 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -11.565 -14.086 -17.578 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -11.048 -15.664 -18.139 1.00 0.00 H new ATOM 1617 N LYS A 98 -14.203 -17.701 -16.480 1.00 0.00 N ATOM 1618 CA LYS A 98 -14.784 -19.031 -16.734 1.00 0.00 C ATOM 1619 C LYS A 98 -16.260 -19.134 -16.286 1.00 0.00 C ATOM 1620 O LYS A 98 -16.650 -18.449 -15.337 1.00 0.00 O ATOM 1621 CB LYS A 98 -13.887 -20.110 -16.091 1.00 0.00 C ATOM 1622 CG LYS A 98 -13.692 -19.961 -14.567 1.00 0.00 C ATOM 1623 CD LYS A 98 -12.792 -21.061 -13.979 1.00 0.00 C ATOM 1624 CE LYS A 98 -11.346 -20.920 -14.478 1.00 0.00 C ATOM 1625 NZ LYS A 98 -10.447 -21.955 -13.904 1.00 0.00 N ATOM 0 H LYS A 98 -14.522 -17.275 -15.610 1.00 0.00 H new ATOM 0 HA LYS A 98 -14.809 -19.199 -17.811 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -14.318 -21.090 -16.294 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -12.910 -20.085 -16.573 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -13.255 -18.986 -14.353 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -14.664 -19.990 -14.075 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -12.811 -21.007 -12.891 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -13.182 -22.040 -14.256 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -11.331 -20.992 -15.566 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -10.969 -19.931 -14.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -9.462 -21.624 -13.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -10.707 -22.129 -12.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -10.542 -22.837 -14.447 1.00 0.00 H new ATOM 1639 N PRO A 99 -17.090 -19.983 -16.932 1.00 0.00 N ATOM 1640 CA PRO A 99 -18.554 -20.019 -16.765 1.00 0.00 C ATOM 1641 C PRO A 99 -19.057 -20.763 -15.501 1.00 0.00 C ATOM 1642 O PRO A 99 -20.110 -21.407 -15.536 1.00 0.00 O ATOM 1643 CB PRO A 99 -19.064 -20.636 -18.077 1.00 0.00 C ATOM 1644 CG PRO A 99 -17.968 -21.637 -18.422 1.00 0.00 C ATOM 1645 CD PRO A 99 -16.709 -20.868 -18.031 1.00 0.00 C ATOM 0 HA PRO A 99 -18.948 -19.018 -16.588 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -20.031 -21.122 -17.947 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -19.187 -19.885 -18.857 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -18.071 -22.566 -17.861 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -17.974 -21.901 -19.479 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -15.917 -21.551 -17.723 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -16.326 -20.295 -18.876 1.00 0.00 H new ATOM 1653 N LEU A 100 -18.321 -20.700 -14.382 1.00 0.00 N ATOM 1654 CA LEU A 100 -18.782 -21.277 -13.106 1.00 0.00 C ATOM 1655 C LEU A 100 -20.143 -20.664 -12.673 1.00 0.00 C ATOM 1656 O LEU A 100 -20.248 -19.431 -12.622 1.00 0.00 O ATOM 1657 CB LEU A 100 -17.712 -21.074 -12.017 1.00 0.00 C ATOM 1658 CG LEU A 100 -16.429 -21.908 -12.205 1.00 0.00 C ATOM 1659 CD1 LEU A 100 -15.402 -21.502 -11.147 1.00 0.00 C ATOM 1660 CD2 LEU A 100 -16.670 -23.414 -12.059 1.00 0.00 C ATOM 0 H LEU A 100 -17.404 -20.256 -14.332 1.00 0.00 H new ATOM 0 HA LEU A 100 -18.936 -22.347 -13.246 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -17.441 -20.019 -11.987 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -18.149 -21.319 -11.049 1.00 0.00 H new ATOM 0 HG LEU A 100 -16.075 -21.711 -13.217 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -14.494 -22.090 -11.277 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -15.167 -20.443 -11.255 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -15.812 -21.683 -10.153 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -15.731 -23.948 -12.202 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -17.060 -23.625 -11.063 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -17.391 -23.741 -12.808 1.00 0.00 H new ATOM 1672 N PRO A 101 -21.188 -21.473 -12.379 1.00 0.00 N ATOM 1673 CA PRO A 101 -22.529 -20.978 -12.046 1.00 0.00 C ATOM 1674 C PRO A 101 -22.594 -20.000 -10.851 1.00 0.00 C ATOM 1675 O PRO A 101 -21.811 -20.134 -9.901 1.00 0.00 O ATOM 1676 CB PRO A 101 -23.369 -22.224 -11.740 1.00 0.00 C ATOM 1677 CG PRO A 101 -22.691 -23.317 -12.555 1.00 0.00 C ATOM 1678 CD PRO A 101 -21.217 -22.927 -12.496 1.00 0.00 C ATOM 0 HA PRO A 101 -22.895 -20.393 -12.890 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -23.368 -22.458 -10.675 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -24.409 -22.089 -12.036 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -22.864 -24.305 -12.128 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -23.060 -23.344 -13.580 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -20.723 -23.396 -11.645 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -20.690 -23.257 -13.392 1.00 0.00 H new ATOM 1686 N PRO A 102 -23.564 -19.060 -10.838 1.00 0.00 N ATOM 1687 CA PRO A 102 -23.872 -18.230 -9.669 1.00 0.00 C ATOM 1688 C PRO A 102 -24.575 -19.042 -8.562 1.00 0.00 C ATOM 1689 O PRO A 102 -25.044 -20.157 -8.805 1.00 0.00 O ATOM 1690 CB PRO A 102 -24.762 -17.107 -10.212 1.00 0.00 C ATOM 1691 CG PRO A 102 -25.512 -17.777 -11.362 1.00 0.00 C ATOM 1692 CD PRO A 102 -24.484 -18.756 -11.928 1.00 0.00 C ATOM 0 HA PRO A 102 -22.971 -17.838 -9.196 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -25.446 -16.732 -9.450 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -24.172 -16.258 -10.557 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -26.408 -18.291 -11.013 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -25.832 -17.052 -12.110 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -24.969 -19.662 -12.291 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -23.954 -18.317 -12.773 1.00 0.00 H new ATOM 1700 N ILE A 103 -24.657 -18.465 -7.351 1.00 0.00 N ATOM 1701 CA ILE A 103 -25.206 -19.157 -6.157 1.00 0.00 C ATOM 1702 C ILE A 103 -24.719 -20.616 -5.977 1.00 0.00 C ATOM 1703 O ILE A 103 -25.489 -21.528 -5.662 1.00 0.00 O ATOM 1704 CB ILE A 103 -26.731 -18.941 -5.947 1.00 0.00 C ATOM 1705 CG1 ILE A 103 -27.682 -19.550 -7.009 1.00 0.00 C ATOM 1706 CG2 ILE A 103 -27.024 -17.453 -5.688 1.00 0.00 C ATOM 1707 CD1 ILE A 103 -28.053 -18.668 -8.211 1.00 0.00 C ATOM 0 H ILE A 103 -24.348 -17.511 -7.166 1.00 0.00 H new ATOM 0 HA ILE A 103 -24.752 -18.641 -5.311 1.00 0.00 H new ATOM 0 HB ILE A 103 -26.971 -19.532 -5.063 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -27.223 -20.463 -7.389 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -28.605 -19.842 -6.508 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -28.095 -17.313 -5.542 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -26.491 -17.127 -4.795 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -26.694 -16.863 -6.543 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -28.722 -19.218 -8.873 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -28.552 -17.765 -7.859 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -27.149 -18.395 -8.755 1.00 0.00 H new ATOM 1719 N LYS A 104 -23.406 -20.812 -6.178 1.00 0.00 N ATOM 1720 CA LYS A 104 -22.760 -22.135 -6.064 1.00 0.00 C ATOM 1721 C LYS A 104 -21.260 -21.915 -5.761 1.00 0.00 C ATOM 1722 O LYS A 104 -20.667 -21.015 -6.365 1.00 0.00 O ATOM 1723 CB LYS A 104 -22.966 -22.897 -7.391 1.00 0.00 C ATOM 1724 CG LYS A 104 -22.458 -24.349 -7.336 1.00 0.00 C ATOM 1725 CD LYS A 104 -22.748 -25.152 -8.614 1.00 0.00 C ATOM 1726 CE LYS A 104 -24.253 -25.392 -8.807 1.00 0.00 C ATOM 1727 NZ LYS A 104 -24.522 -26.340 -9.921 1.00 0.00 N ATOM 0 H LYS A 104 -22.761 -20.061 -6.424 1.00 0.00 H new ATOM 0 HA LYS A 104 -23.194 -22.727 -5.259 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -24.027 -22.898 -7.642 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -22.450 -22.367 -8.192 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -21.383 -24.342 -7.158 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -22.919 -24.854 -6.487 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -22.351 -24.617 -9.477 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -22.230 -26.110 -8.567 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -24.680 -25.785 -7.884 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -24.750 -24.443 -9.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -25.548 -26.477 -10.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -24.137 -25.954 -10.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -24.069 -27.254 -9.716 1.00 0.00 H new ATOM 1741 N PRO A 105 -20.627 -22.670 -4.839 1.00 0.00 N ATOM 1742 CA PRO A 105 -19.224 -22.449 -4.474 1.00 0.00 C ATOM 1743 C PRO A 105 -18.266 -22.770 -5.635 1.00 0.00 C ATOM 1744 O PRO A 105 -18.359 -23.830 -6.261 1.00 0.00 O ATOM 1745 CB PRO A 105 -18.972 -23.334 -3.246 1.00 0.00 C ATOM 1746 CG PRO A 105 -20.018 -24.439 -3.370 1.00 0.00 C ATOM 1747 CD PRO A 105 -21.203 -23.726 -4.019 1.00 0.00 C ATOM 0 HA PRO A 105 -19.033 -21.400 -4.247 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -17.960 -23.740 -3.246 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -19.090 -22.774 -2.319 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -19.660 -25.265 -3.984 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -20.282 -24.855 -2.398 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -21.791 -24.416 -4.625 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -21.873 -23.314 -3.264 1.00 0.00 H new ATOM 1755 N ARG A 106 -17.334 -21.849 -5.921 1.00 0.00 N ATOM 1756 CA ARG A 106 -16.268 -22.027 -6.928 1.00 0.00 C ATOM 1757 C ARG A 106 -15.264 -23.122 -6.525 1.00 0.00 C ATOM 1758 O ARG A 106 -15.067 -23.369 -5.330 1.00 0.00 O ATOM 1759 CB ARG A 106 -15.602 -20.668 -7.242 1.00 0.00 C ATOM 1760 CG ARG A 106 -14.777 -20.036 -6.102 1.00 0.00 C ATOM 1761 CD ARG A 106 -13.283 -20.385 -6.164 1.00 0.00 C ATOM 1762 NE ARG A 106 -12.589 -19.702 -7.276 1.00 0.00 N ATOM 1763 CZ ARG A 106 -11.451 -20.069 -7.845 1.00 0.00 C ATOM 1764 NH1 ARG A 106 -10.862 -21.203 -7.597 1.00 0.00 N ATOM 1765 NH2 ARG A 106 -10.859 -19.284 -8.698 1.00 0.00 N ATOM 0 H ARG A 106 -17.296 -20.943 -5.453 1.00 0.00 H new ATOM 0 HA ARG A 106 -16.719 -22.387 -7.852 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -14.950 -20.797 -8.106 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -16.381 -19.963 -7.533 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -14.891 -18.953 -6.138 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -15.180 -20.367 -5.145 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -12.810 -20.111 -5.221 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -13.169 -21.463 -6.276 1.00 0.00 H new ATOM 0 HE ARG A 106 -13.033 -18.860 -7.643 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -11.277 -21.859 -6.936 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -9.986 -21.435 -8.064 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -11.272 -18.381 -8.931 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -9.983 -19.572 -9.133 1.00 0.00 H new ATOM 1779 N LYS A 107 -14.646 -23.761 -7.528 1.00 0.00 N ATOM 1780 CA LYS A 107 -13.715 -24.893 -7.313 1.00 0.00 C ATOM 1781 C LYS A 107 -12.545 -24.585 -6.363 1.00 0.00 C ATOM 1782 O LYS A 107 -12.271 -25.422 -5.472 1.00 0.00 O ATOM 1783 CB LYS A 107 -13.195 -25.403 -8.670 1.00 0.00 C ATOM 1784 CG LYS A 107 -14.311 -26.000 -9.546 1.00 0.00 C ATOM 1785 CD LYS A 107 -13.749 -26.553 -10.863 1.00 0.00 C ATOM 1786 CE LYS A 107 -14.877 -27.165 -11.703 1.00 0.00 C ATOM 1787 NZ LYS A 107 -14.367 -27.739 -12.975 1.00 0.00 N ATOM 1788 OXT LYS A 107 -11.891 -23.531 -6.535 1.00 0.00 O ATOM 0 H LYS A 107 -14.772 -23.514 -8.510 1.00 0.00 H new ATOM 0 HA LYS A 107 -14.292 -25.670 -6.811 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -12.719 -24.581 -9.205 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -12.428 -26.159 -8.500 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -14.817 -26.797 -9.001 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -15.058 -25.235 -9.759 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -13.261 -25.755 -11.422 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -12.990 -27.307 -10.655 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -15.378 -27.944 -11.128 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -15.623 -26.401 -11.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -15.158 -28.143 -13.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -13.911 -26.991 -13.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -13.674 -28.485 -12.766 1.00 0.00 H new TER 1802 LYS A 107