USER MOD reduce.3.24.130724 H: found=0, std=0, add=1094, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1089 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 113 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 19 TYR OH : rot 30:sc= 0 USER MOD Set 2.2: A 103 HIS : no HD1:sc= -2 K(o=-2.2,f=-1.5) USER MOD Set 2.3: A 110 SER OG : rot 120:sc= -0.247 USER MOD Set 3.1: A 79 GLN : amide:sc= -0.219 X(o=0.17,f=0.35) USER MOD Set 3.2: A 84 THR OG1 : rot -47:sc= 0.389 USER MOD Set 4.1: A 54 THR OG1 : rot 180:sc= -0.811 USER MOD Set 4.2: A 57 MET CE :methyl -164:sc= -2.72! (180deg=-3.1) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0.0138 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=-0.00093) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= -0.564 X(o=-0.56,f=-0.1) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 GLN : amide:sc= -0.782 K(o=-0.78,f=-0.17) USER MOD Single : A 31 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 GLN : amide:sc= -0.0308 X(o=-0.031,f=0.096) USER MOD Single : A 37 GLN : amide:sc= -0.429 X(o=-0.43,f=-0.13) USER MOD Single : A 39 THR OG1 : rot -27:sc= 0.523 USER MOD Single : A 40 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 41 GLN : amide:sc= -0.0698 X(o=-0.07,f=-0.07) USER MOD Single : A 42 GLN : amide:sc= 0.379 X(o=0.38,f=0) USER MOD Single : A 46 HIS : no HD1:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 48 GLN : amide:sc= -0.168 K(o=-0.17,f=-1.1) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot -39:sc= 0.207 USER MOD Single : A 64 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 66 GLN : amide:sc= -0.617 X(o=-0.62,f=-0.86) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= -0.84 K(o=-0.84,f=0) USER MOD Single : A 69 MET CE :methyl -162:sc= -0.0338 (180deg=-0.763) USER MOD Single : A 81 MET CE :methyl -140:sc= -1.31 (180deg=-4.1!) USER MOD Single : A 82 HIS : no HD1:sc= -15.3! C(o=-15!,f=-17!) USER MOD Single : A 88 LYS NZ :NH3+ -141:sc= 0 (180deg=-0.924) USER MOD Single : A 90 THR OG1 : rot -69:sc= -3.17! USER MOD Single : A 92 MET CE :methyl 150:sc= -1.11 (180deg=-3.21!) USER MOD Single : A 98 ASN : amide:sc= -0.0654 K(o=-0.065,f=-0.69) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 104 MET CE :methyl -141:sc= -10! (180deg=-10.4!) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -0.192 X(o=-0.19,f=-0.59) USER MOD Single : A 125 HIS : no HD1:sc= -1.52 X(o=-1.5,f=-1.5) USER MOD Single : A 126 GLN : amide:sc= -0.0275 K(o=-0.028,f=-0.56) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 ASN : amide:sc= -0.0468 K(o=-0.047,f=-0.88) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 25.749 0.616 -4.294 1.00 0.00 N ATOM 2 CA GLY A 1 25.166 1.695 -3.450 1.00 0.00 C ATOM 3 C GLY A 1 26.220 2.644 -2.908 1.00 0.00 C ATOM 4 O GLY A 1 27.301 2.208 -2.511 1.00 0.00 O ATOM 0 H1 GLY A 1 24.989 -0.004 -4.639 1.00 0.00 H new ATOM 0 H2 GLY A 1 26.245 1.039 -5.104 1.00 0.00 H new ATOM 0 H3 GLY A 1 26.421 0.058 -3.729 1.00 0.00 H new ATOM 0 HA2 GLY A 1 24.441 2.259 -4.037 1.00 0.00 H new ATOM 0 HA3 GLY A 1 24.623 1.247 -2.618 1.00 0.00 H new ATOM 10 N PRO A 2 25.933 3.958 -2.876 1.00 0.00 N ATOM 11 CA PRO A 2 26.878 4.962 -2.372 1.00 0.00 C ATOM 12 C PRO A 2 27.286 4.694 -0.927 1.00 0.00 C ATOM 13 O PRO A 2 28.456 4.441 -0.639 1.00 0.00 O ATOM 14 CB PRO A 2 26.100 6.279 -2.471 1.00 0.00 C ATOM 15 CG PRO A 2 25.031 6.021 -3.477 1.00 0.00 C ATOM 16 CD PRO A 2 24.671 4.571 -3.329 1.00 0.00 C ATOM 0 HA PRO A 2 27.808 4.962 -2.940 1.00 0.00 H new ATOM 0 HB2 PRO A 2 25.675 6.560 -1.507 1.00 0.00 H new ATOM 0 HB3 PRO A 2 26.748 7.098 -2.785 1.00 0.00 H new ATOM 0 HG2 PRO A 2 24.165 6.659 -3.300 1.00 0.00 H new ATOM 0 HG3 PRO A 2 25.384 6.235 -4.486 1.00 0.00 H new ATOM 0 HD2 PRO A 2 23.870 4.426 -2.604 1.00 0.00 H new ATOM 0 HD3 PRO A 2 24.330 4.142 -4.271 1.00 0.00 H new ATOM 24 N LEU A 3 26.314 4.753 -0.023 1.00 0.00 N ATOM 25 CA LEU A 3 26.572 4.518 1.393 1.00 0.00 C ATOM 26 C LEU A 3 26.414 3.041 1.737 1.00 0.00 C ATOM 27 O LEU A 3 26.233 2.204 0.852 1.00 0.00 O ATOM 28 CB LEU A 3 25.625 5.360 2.253 1.00 0.00 C ATOM 29 CG LEU A 3 25.233 6.712 1.653 1.00 0.00 C ATOM 30 CD1 LEU A 3 23.967 7.239 2.309 1.00 0.00 C ATOM 31 CD2 LEU A 3 26.370 7.711 1.805 1.00 0.00 C ATOM 0 H LEU A 3 25.341 4.961 -0.246 1.00 0.00 H new ATOM 0 HA LEU A 3 27.600 4.813 1.603 1.00 0.00 H new ATOM 0 HB2 LEU A 3 24.718 4.785 2.437 1.00 0.00 H new ATOM 0 HB3 LEU A 3 26.095 5.532 3.221 1.00 0.00 H new ATOM 0 HG LEU A 3 25.036 6.574 0.590 1.00 0.00 H new ATOM 0 HD11 LEU A 3 23.703 8.201 1.870 1.00 0.00 H new ATOM 0 HD12 LEU A 3 23.153 6.532 2.149 1.00 0.00 H new ATOM 0 HD13 LEU A 3 24.136 7.362 3.379 1.00 0.00 H new ATOM 0 HD21 LEU A 3 26.074 8.667 1.373 1.00 0.00 H new ATOM 0 HD22 LEU A 3 26.597 7.845 2.863 1.00 0.00 H new ATOM 0 HD23 LEU A 3 27.254 7.337 1.288 1.00 0.00 H new ATOM 43 N GLY A 4 26.486 2.726 3.026 1.00 0.00 N ATOM 44 CA GLY A 4 26.350 1.349 3.465 1.00 0.00 C ATOM 45 C GLY A 4 24.975 1.051 4.028 1.00 0.00 C ATOM 46 O GLY A 4 24.846 0.613 5.171 1.00 0.00 O ATOM 0 H GLY A 4 26.636 3.401 3.776 1.00 0.00 H new ATOM 0 HA2 GLY A 4 26.547 0.683 2.625 1.00 0.00 H new ATOM 0 HA3 GLY A 4 27.103 1.137 4.224 1.00 0.00 H new ATOM 50 N SER A 5 23.943 1.290 3.223 1.00 0.00 N ATOM 51 CA SER A 5 22.569 1.045 3.647 1.00 0.00 C ATOM 52 C SER A 5 22.021 -0.228 3.010 1.00 0.00 C ATOM 53 O SER A 5 21.669 -1.180 3.708 1.00 0.00 O ATOM 54 CB SER A 5 21.681 2.235 3.279 1.00 0.00 C ATOM 55 OG SER A 5 20.416 2.144 3.914 1.00 0.00 O ATOM 0 H SER A 5 24.033 1.653 2.274 1.00 0.00 H new ATOM 0 HA SER A 5 22.566 0.918 4.730 1.00 0.00 H new ATOM 0 HB2 SER A 5 22.172 3.163 3.571 1.00 0.00 H new ATOM 0 HB3 SER A 5 21.547 2.272 2.198 1.00 0.00 H new ATOM 0 HG SER A 5 19.868 2.917 3.664 1.00 0.00 H new ATOM 61 N ALA A 6 21.954 -0.239 1.683 1.00 0.00 N ATOM 62 CA ALA A 6 21.450 -1.395 0.951 1.00 0.00 C ATOM 63 C ALA A 6 22.574 -2.100 0.200 1.00 0.00 C ATOM 64 O ALA A 6 23.749 -1.773 0.371 1.00 0.00 O ATOM 65 CB ALA A 6 20.351 -0.972 -0.013 1.00 0.00 C ATOM 0 H ALA A 6 22.243 0.541 1.092 1.00 0.00 H new ATOM 0 HA ALA A 6 21.033 -2.098 1.672 1.00 0.00 H new ATOM 0 HB1 ALA A 6 19.984 -1.845 -0.553 1.00 0.00 H new ATOM 0 HB2 ALA A 6 19.531 -0.520 0.545 1.00 0.00 H new ATOM 0 HB3 ALA A 6 20.749 -0.247 -0.723 1.00 0.00 H new ATOM 71 N ALA A 7 22.206 -3.072 -0.631 1.00 0.00 N ATOM 72 CA ALA A 7 23.184 -3.826 -1.408 1.00 0.00 C ATOM 73 C ALA A 7 22.550 -4.412 -2.665 1.00 0.00 C ATOM 74 O ALA A 7 21.838 -5.414 -2.604 1.00 0.00 O ATOM 75 CB ALA A 7 23.795 -4.929 -0.558 1.00 0.00 C ATOM 0 H ALA A 7 21.238 -3.355 -0.783 1.00 0.00 H new ATOM 0 HA ALA A 7 23.974 -3.141 -1.717 1.00 0.00 H new ATOM 0 HB1 ALA A 7 24.523 -5.484 -1.150 1.00 0.00 H new ATOM 0 HB2 ALA A 7 24.291 -4.489 0.307 1.00 0.00 H new ATOM 0 HB3 ALA A 7 23.010 -5.606 -0.221 1.00 0.00 H new ATOM 81 N ALA A 8 22.815 -3.780 -3.805 1.00 0.00 N ATOM 82 CA ALA A 8 22.272 -4.239 -5.079 1.00 0.00 C ATOM 83 C ALA A 8 23.311 -4.127 -6.190 1.00 0.00 C ATOM 84 O ALA A 8 23.255 -4.856 -7.181 1.00 0.00 O ATOM 85 CB ALA A 8 21.023 -3.446 -5.437 1.00 0.00 C ATOM 0 H ALA A 8 23.402 -2.949 -3.872 1.00 0.00 H new ATOM 0 HA ALA A 8 22.003 -5.290 -4.974 1.00 0.00 H new ATOM 0 HB1 ALA A 8 20.629 -3.799 -6.390 1.00 0.00 H new ATOM 0 HB2 ALA A 8 20.271 -3.582 -4.660 1.00 0.00 H new ATOM 0 HB3 ALA A 8 21.274 -2.388 -5.518 1.00 0.00 H new ATOM 91 N ALA A 9 24.260 -3.210 -6.014 1.00 0.00 N ATOM 92 CA ALA A 9 25.317 -2.996 -6.998 1.00 0.00 C ATOM 93 C ALA A 9 24.734 -2.703 -8.378 1.00 0.00 C ATOM 94 O ALA A 9 24.786 -3.542 -9.277 1.00 0.00 O ATOM 95 CB ALA A 9 26.240 -4.204 -7.054 1.00 0.00 C ATOM 0 H ALA A 9 24.318 -2.602 -5.197 1.00 0.00 H new ATOM 0 HA ALA A 9 25.897 -2.127 -6.688 1.00 0.00 H new ATOM 0 HB1 ALA A 9 27.023 -4.030 -7.792 1.00 0.00 H new ATOM 0 HB2 ALA A 9 26.693 -4.362 -6.075 1.00 0.00 H new ATOM 0 HB3 ALA A 9 25.667 -5.087 -7.335 1.00 0.00 H new ATOM 101 N THR A 10 24.177 -1.506 -8.537 1.00 0.00 N ATOM 102 CA THR A 10 23.584 -1.099 -9.806 1.00 0.00 C ATOM 103 C THR A 10 23.783 0.396 -10.048 1.00 0.00 C ATOM 104 O THR A 10 23.291 1.226 -9.283 1.00 0.00 O ATOM 105 CB THR A 10 22.091 -1.435 -9.829 1.00 0.00 C ATOM 106 OG1 THR A 10 21.436 -0.727 -10.866 1.00 0.00 O ATOM 107 CG2 THR A 10 21.381 -1.110 -8.532 1.00 0.00 C ATOM 0 H THR A 10 24.124 -0.801 -7.802 1.00 0.00 H new ATOM 0 HA THR A 10 24.086 -1.648 -10.603 1.00 0.00 H new ATOM 0 HB THR A 10 22.040 -2.512 -9.990 1.00 0.00 H new ATOM 0 HG1 THR A 10 20.483 -0.955 -10.867 1.00 0.00 H new ATOM 0 HG21 THR A 10 20.327 -1.373 -8.618 1.00 0.00 H new ATOM 0 HG22 THR A 10 21.831 -1.678 -7.718 1.00 0.00 H new ATOM 0 HG23 THR A 10 21.473 -0.044 -8.324 1.00 0.00 H new ATOM 115 N PRO A 11 24.505 0.763 -11.124 1.00 0.00 N ATOM 116 CA PRO A 11 24.758 2.168 -11.460 1.00 0.00 C ATOM 117 C PRO A 11 23.508 2.876 -11.970 1.00 0.00 C ATOM 118 O PRO A 11 23.521 4.083 -12.214 1.00 0.00 O ATOM 119 CB PRO A 11 25.812 2.085 -12.564 1.00 0.00 C ATOM 120 CG PRO A 11 25.588 0.756 -13.198 1.00 0.00 C ATOM 121 CD PRO A 11 25.129 -0.158 -12.095 1.00 0.00 C ATOM 0 HA PRO A 11 25.076 2.743 -10.591 1.00 0.00 H new ATOM 0 HB2 PRO A 11 25.695 2.893 -13.286 1.00 0.00 H new ATOM 0 HB3 PRO A 11 26.820 2.165 -12.157 1.00 0.00 H new ATOM 0 HG2 PRO A 11 24.839 0.822 -13.987 1.00 0.00 H new ATOM 0 HG3 PRO A 11 26.504 0.384 -13.658 1.00 0.00 H new ATOM 0 HD2 PRO A 11 24.418 -0.901 -12.458 1.00 0.00 H new ATOM 0 HD3 PRO A 11 25.962 -0.704 -11.653 1.00 0.00 H new ATOM 129 N ALA A 12 22.429 2.116 -12.131 1.00 0.00 N ATOM 130 CA ALA A 12 21.169 2.667 -12.614 1.00 0.00 C ATOM 131 C ALA A 12 20.322 3.190 -11.458 1.00 0.00 C ATOM 132 O ALA A 12 19.336 2.565 -11.064 1.00 0.00 O ATOM 133 CB ALA A 12 20.402 1.619 -13.405 1.00 0.00 C ATOM 0 H ALA A 12 22.403 1.116 -11.934 1.00 0.00 H new ATOM 0 HA ALA A 12 21.395 3.506 -13.273 1.00 0.00 H new ATOM 0 HB1 ALA A 12 19.463 2.045 -13.759 1.00 0.00 H new ATOM 0 HB2 ALA A 12 20.999 1.298 -14.258 1.00 0.00 H new ATOM 0 HB3 ALA A 12 20.193 0.762 -12.765 1.00 0.00 H new ATOM 139 N VAL A 13 20.713 4.339 -10.914 1.00 0.00 N ATOM 140 CA VAL A 13 19.988 4.946 -9.803 1.00 0.00 C ATOM 141 C VAL A 13 18.896 5.882 -10.311 1.00 0.00 C ATOM 142 O VAL A 13 18.465 6.794 -9.604 1.00 0.00 O ATOM 143 CB VAL A 13 20.931 5.732 -8.869 1.00 0.00 C ATOM 144 CG1 VAL A 13 20.386 5.743 -7.449 1.00 0.00 C ATOM 145 CG2 VAL A 13 22.335 5.147 -8.904 1.00 0.00 C ATOM 0 H VAL A 13 21.528 4.868 -11.225 1.00 0.00 H new ATOM 0 HA VAL A 13 19.535 4.130 -9.239 1.00 0.00 H new ATOM 0 HB VAL A 13 20.985 6.761 -9.223 1.00 0.00 H new ATOM 0 HG11 VAL A 13 21.064 6.302 -6.803 1.00 0.00 H new ATOM 0 HG12 VAL A 13 19.404 6.216 -7.440 1.00 0.00 H new ATOM 0 HG13 VAL A 13 20.299 4.719 -7.085 1.00 0.00 H new ATOM 0 HG21 VAL A 13 22.983 5.717 -8.238 1.00 0.00 H new ATOM 0 HG22 VAL A 13 22.304 4.107 -8.578 1.00 0.00 H new ATOM 0 HG23 VAL A 13 22.725 5.197 -9.921 1.00 0.00 H new ATOM 155 N ARG A 14 18.450 5.648 -11.541 1.00 0.00 N ATOM 156 CA ARG A 14 17.406 6.469 -12.146 1.00 0.00 C ATOM 157 C ARG A 14 16.041 5.805 -12.007 1.00 0.00 C ATOM 158 O ARG A 14 15.088 6.419 -11.527 1.00 0.00 O ATOM 159 CB ARG A 14 17.718 6.717 -13.623 1.00 0.00 C ATOM 160 CG ARG A 14 16.810 7.748 -14.272 1.00 0.00 C ATOM 161 CD ARG A 14 16.794 7.600 -15.785 1.00 0.00 C ATOM 162 NE ARG A 14 16.613 8.884 -16.459 1.00 0.00 N ATOM 163 CZ ARG A 14 17.618 9.676 -16.820 1.00 0.00 C ATOM 164 NH1 ARG A 14 18.872 9.318 -16.573 1.00 0.00 N ATOM 165 NH2 ARG A 14 17.370 10.828 -17.428 1.00 0.00 N ATOM 0 H ARG A 14 18.795 4.897 -12.139 1.00 0.00 H new ATOM 0 HA ARG A 14 17.379 7.424 -11.621 1.00 0.00 H new ATOM 0 HB2 ARG A 14 18.753 7.046 -13.717 1.00 0.00 H new ATOM 0 HB3 ARG A 14 17.632 5.776 -14.167 1.00 0.00 H new ATOM 0 HG2 ARG A 14 15.797 7.639 -13.884 1.00 0.00 H new ATOM 0 HG3 ARG A 14 17.147 8.750 -14.007 1.00 0.00 H new ATOM 0 HD2 ARG A 14 17.729 7.146 -16.115 1.00 0.00 H new ATOM 0 HD3 ARG A 14 15.991 6.922 -16.074 1.00 0.00 H new ATOM 0 HE ARG A 14 15.662 9.190 -16.664 1.00 0.00 H new ATOM 0 HH11 ARG A 14 19.067 8.433 -16.105 1.00 0.00 H new ATOM 0 HH12 ARG A 14 19.641 9.928 -16.851 1.00 0.00 H new ATOM 0 HH21 ARG A 14 16.408 11.107 -17.619 1.00 0.00 H new ATOM 0 HH22 ARG A 14 18.142 11.435 -17.705 1.00 0.00 H new ATOM 179 N THR A 15 15.954 4.548 -12.432 1.00 0.00 N ATOM 180 CA THR A 15 14.705 3.800 -12.357 1.00 0.00 C ATOM 181 C THR A 15 14.672 2.915 -11.117 1.00 0.00 C ATOM 182 O THR A 15 15.705 2.656 -10.499 1.00 0.00 O ATOM 183 CB THR A 15 14.523 2.944 -13.612 1.00 0.00 C ATOM 184 OG1 THR A 15 15.355 1.799 -13.562 1.00 0.00 O ATOM 185 CG2 THR A 15 14.836 3.685 -14.894 1.00 0.00 C ATOM 0 H THR A 15 16.734 4.027 -12.832 1.00 0.00 H new ATOM 0 HA THR A 15 13.886 4.517 -12.291 1.00 0.00 H new ATOM 0 HB THR A 15 13.469 2.666 -13.622 1.00 0.00 H new ATOM 0 HG1 THR A 15 15.223 1.263 -14.372 1.00 0.00 H new ATOM 0 HG21 THR A 15 14.686 3.020 -15.744 1.00 0.00 H new ATOM 0 HG22 THR A 15 14.175 4.547 -14.987 1.00 0.00 H new ATOM 0 HG23 THR A 15 15.872 4.023 -14.875 1.00 0.00 H new ATOM 193 N VAL A 16 13.479 2.450 -10.760 1.00 0.00 N ATOM 194 CA VAL A 16 13.308 1.590 -9.595 1.00 0.00 C ATOM 195 C VAL A 16 13.478 0.118 -9.969 1.00 0.00 C ATOM 196 O VAL A 16 13.142 -0.287 -11.083 1.00 0.00 O ATOM 197 CB VAL A 16 11.925 1.789 -8.946 1.00 0.00 C ATOM 198 CG1 VAL A 16 11.861 3.130 -8.231 1.00 0.00 C ATOM 199 CG2 VAL A 16 10.824 1.678 -9.989 1.00 0.00 C ATOM 0 H VAL A 16 12.615 2.655 -11.262 1.00 0.00 H new ATOM 0 HA VAL A 16 14.079 1.871 -8.878 1.00 0.00 H new ATOM 0 HB VAL A 16 11.773 1.002 -8.208 1.00 0.00 H new ATOM 0 HG11 VAL A 16 10.877 3.254 -7.778 1.00 0.00 H new ATOM 0 HG12 VAL A 16 12.625 3.165 -7.454 1.00 0.00 H new ATOM 0 HG13 VAL A 16 12.035 3.933 -8.947 1.00 0.00 H new ATOM 0 HG21 VAL A 16 9.855 1.821 -9.512 1.00 0.00 H new ATOM 0 HG22 VAL A 16 10.969 2.442 -10.753 1.00 0.00 H new ATOM 0 HG23 VAL A 16 10.859 0.691 -10.451 1.00 0.00 H new ATOM 209 N PRO A 17 14.003 -0.704 -9.042 1.00 0.00 N ATOM 210 CA PRO A 17 14.216 -2.136 -9.285 1.00 0.00 C ATOM 211 C PRO A 17 12.948 -2.840 -9.757 1.00 0.00 C ATOM 212 O PRO A 17 11.840 -2.472 -9.364 1.00 0.00 O ATOM 213 CB PRO A 17 14.646 -2.673 -7.918 1.00 0.00 C ATOM 214 CG PRO A 17 15.219 -1.493 -7.211 1.00 0.00 C ATOM 215 CD PRO A 17 14.434 -0.305 -7.688 1.00 0.00 C ATOM 0 HA PRO A 17 14.948 -2.308 -10.074 1.00 0.00 H new ATOM 0 HB2 PRO A 17 13.799 -3.089 -7.372 1.00 0.00 H new ATOM 0 HB3 PRO A 17 15.383 -3.470 -8.019 1.00 0.00 H new ATOM 0 HG2 PRO A 17 15.136 -1.607 -6.130 1.00 0.00 H new ATOM 0 HG3 PRO A 17 16.279 -1.378 -7.439 1.00 0.00 H new ATOM 0 HD2 PRO A 17 13.583 -0.099 -7.039 1.00 0.00 H new ATOM 0 HD3 PRO A 17 15.044 0.598 -7.710 1.00 0.00 H new ATOM 223 N GLN A 18 13.119 -3.854 -10.599 1.00 0.00 N ATOM 224 CA GLN A 18 11.989 -4.613 -11.121 1.00 0.00 C ATOM 225 C GLN A 18 11.417 -5.539 -10.053 1.00 0.00 C ATOM 226 O GLN A 18 11.767 -6.719 -9.987 1.00 0.00 O ATOM 227 CB GLN A 18 12.417 -5.428 -12.345 1.00 0.00 C ATOM 228 CG GLN A 18 13.117 -4.603 -13.412 1.00 0.00 C ATOM 229 CD GLN A 18 14.140 -5.407 -14.192 1.00 0.00 C ATOM 230 OE1 GLN A 18 13.855 -6.512 -14.655 1.00 0.00 O ATOM 231 NE2 GLN A 18 15.338 -4.853 -14.343 1.00 0.00 N ATOM 0 H GLN A 18 14.029 -4.169 -10.934 1.00 0.00 H new ATOM 0 HA GLN A 18 11.213 -3.907 -11.417 1.00 0.00 H new ATOM 0 HB2 GLN A 18 13.082 -6.229 -12.023 1.00 0.00 H new ATOM 0 HB3 GLN A 18 11.537 -5.900 -12.782 1.00 0.00 H new ATOM 0 HG2 GLN A 18 12.374 -4.201 -14.101 1.00 0.00 H new ATOM 0 HG3 GLN A 18 13.610 -3.752 -12.943 1.00 0.00 H new ATOM 0 HE21 GLN A 18 15.530 -3.935 -13.942 1.00 0.00 H new ATOM 0 HE22 GLN A 18 16.066 -5.346 -14.860 1.00 0.00 H new ATOM 240 N TYR A 19 10.540 -4.996 -9.216 1.00 0.00 N ATOM 241 CA TYR A 19 9.920 -5.773 -8.148 1.00 0.00 C ATOM 242 C TYR A 19 8.874 -6.730 -8.708 1.00 0.00 C ATOM 243 O TYR A 19 8.435 -7.655 -8.025 1.00 0.00 O ATOM 244 CB TYR A 19 9.277 -4.842 -7.119 1.00 0.00 C ATOM 245 CG TYR A 19 10.038 -4.760 -5.815 1.00 0.00 C ATOM 246 CD1 TYR A 19 11.294 -4.167 -5.757 1.00 0.00 C ATOM 247 CD2 TYR A 19 9.502 -5.275 -4.641 1.00 0.00 C ATOM 248 CE1 TYR A 19 11.993 -4.091 -4.567 1.00 0.00 C ATOM 249 CE2 TYR A 19 10.195 -5.203 -3.447 1.00 0.00 C ATOM 250 CZ TYR A 19 11.440 -4.609 -3.415 1.00 0.00 C ATOM 251 OH TYR A 19 12.132 -4.536 -2.229 1.00 0.00 O ATOM 0 H TYR A 19 10.242 -4.021 -9.256 1.00 0.00 H new ATOM 0 HA TYR A 19 10.699 -6.360 -7.661 1.00 0.00 H new ATOM 0 HB2 TYR A 19 9.197 -3.842 -7.546 1.00 0.00 H new ATOM 0 HB3 TYR A 19 8.262 -5.184 -6.916 1.00 0.00 H new ATOM 0 HD1 TYR A 19 11.731 -3.759 -6.657 1.00 0.00 H new ATOM 0 HD2 TYR A 19 8.527 -5.740 -4.662 1.00 0.00 H new ATOM 0 HE1 TYR A 19 12.968 -3.628 -4.540 1.00 0.00 H new ATOM 0 HE2 TYR A 19 9.764 -5.610 -2.544 1.00 0.00 H new ATOM 0 HH TYR A 19 12.703 -3.740 -2.232 1.00 0.00 H new ATOM 261 N LYS A 20 8.481 -6.502 -9.958 1.00 0.00 N ATOM 262 CA LYS A 20 7.486 -7.343 -10.612 1.00 0.00 C ATOM 263 C LYS A 20 8.156 -8.411 -11.472 1.00 0.00 C ATOM 264 O LYS A 20 8.395 -8.204 -12.662 1.00 0.00 O ATOM 265 CB LYS A 20 6.553 -6.489 -11.473 1.00 0.00 C ATOM 266 CG LYS A 20 5.392 -5.886 -10.699 1.00 0.00 C ATOM 267 CD LYS A 20 5.783 -4.577 -10.032 1.00 0.00 C ATOM 268 CE LYS A 20 4.567 -3.716 -9.735 1.00 0.00 C ATOM 269 NZ LYS A 20 4.921 -2.505 -8.944 1.00 0.00 N ATOM 0 H LYS A 20 8.837 -5.742 -10.537 1.00 0.00 H new ATOM 0 HA LYS A 20 6.901 -7.840 -9.838 1.00 0.00 H new ATOM 0 HB2 LYS A 20 7.129 -5.685 -11.931 1.00 0.00 H new ATOM 0 HB3 LYS A 20 6.159 -7.101 -12.284 1.00 0.00 H new ATOM 0 HG2 LYS A 20 4.554 -5.715 -11.374 1.00 0.00 H new ATOM 0 HG3 LYS A 20 5.052 -6.593 -9.942 1.00 0.00 H new ATOM 0 HD2 LYS A 20 6.317 -4.786 -9.105 1.00 0.00 H new ATOM 0 HD3 LYS A 20 6.469 -4.029 -10.678 1.00 0.00 H new ATOM 0 HE2 LYS A 20 4.100 -3.413 -10.672 1.00 0.00 H new ATOM 0 HE3 LYS A 20 3.831 -4.305 -9.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 4.063 -1.945 -8.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 5.344 -2.793 -8.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 5.604 -1.929 -9.477 1.00 0.00 H new ATOM 283 N TYR A 21 8.459 -9.552 -10.859 1.00 0.00 N ATOM 284 CA TYR A 21 9.102 -10.653 -11.567 1.00 0.00 C ATOM 285 C TYR A 21 8.090 -11.419 -12.415 1.00 0.00 C ATOM 286 O TYR A 21 7.432 -12.342 -11.932 1.00 0.00 O ATOM 287 CB TYR A 21 9.773 -11.603 -10.572 1.00 0.00 C ATOM 288 CG TYR A 21 11.138 -12.080 -11.014 1.00 0.00 C ATOM 289 CD1 TYR A 21 11.272 -13.166 -11.871 1.00 0.00 C ATOM 290 CD2 TYR A 21 12.294 -11.446 -10.573 1.00 0.00 C ATOM 291 CE1 TYR A 21 12.517 -13.605 -12.277 1.00 0.00 C ATOM 292 CE2 TYR A 21 13.543 -11.880 -10.975 1.00 0.00 C ATOM 293 CZ TYR A 21 13.649 -12.960 -11.827 1.00 0.00 C ATOM 294 OH TYR A 21 14.891 -13.394 -12.229 1.00 0.00 O ATOM 0 H TYR A 21 8.269 -9.737 -9.874 1.00 0.00 H new ATOM 0 HA TYR A 21 9.861 -10.234 -12.228 1.00 0.00 H new ATOM 0 HB2 TYR A 21 9.868 -11.100 -9.610 1.00 0.00 H new ATOM 0 HB3 TYR A 21 9.128 -12.468 -10.417 1.00 0.00 H new ATOM 0 HD1 TYR A 21 10.388 -13.675 -12.225 1.00 0.00 H new ATOM 0 HD2 TYR A 21 12.215 -10.601 -9.905 1.00 0.00 H new ATOM 0 HE1 TYR A 21 12.603 -14.450 -12.944 1.00 0.00 H new ATOM 0 HE2 TYR A 21 14.432 -11.376 -10.624 1.00 0.00 H new ATOM 0 HH TYR A 21 15.582 -12.830 -11.822 1.00 0.00 H new ATOM 304 N ALA A 22 7.968 -11.027 -13.679 1.00 0.00 N ATOM 305 CA ALA A 22 7.034 -11.673 -14.593 1.00 0.00 C ATOM 306 C ALA A 22 7.598 -12.987 -15.122 1.00 0.00 C ATOM 307 O ALA A 22 8.468 -12.994 -15.994 1.00 0.00 O ATOM 308 CB ALA A 22 6.694 -10.741 -15.747 1.00 0.00 C ATOM 0 H ALA A 22 8.505 -10.265 -14.093 1.00 0.00 H new ATOM 0 HA ALA A 22 6.122 -11.897 -14.039 1.00 0.00 H new ATOM 0 HB1 ALA A 22 5.996 -11.237 -16.421 1.00 0.00 H new ATOM 0 HB2 ALA A 22 6.238 -9.831 -15.357 1.00 0.00 H new ATOM 0 HB3 ALA A 22 7.604 -10.487 -16.290 1.00 0.00 H new ATOM 314 N ALA A 23 7.095 -14.097 -14.592 1.00 0.00 N ATOM 315 CA ALA A 23 7.545 -15.418 -15.015 1.00 0.00 C ATOM 316 C ALA A 23 6.893 -15.820 -16.334 1.00 0.00 C ATOM 317 O ALA A 23 5.691 -15.634 -16.526 1.00 0.00 O ATOM 318 CB ALA A 23 7.240 -16.449 -13.938 1.00 0.00 C ATOM 0 H ALA A 23 6.376 -14.108 -13.869 1.00 0.00 H new ATOM 0 HA ALA A 23 8.623 -15.378 -15.168 1.00 0.00 H new ATOM 0 HB1 ALA A 23 7.581 -17.431 -14.267 1.00 0.00 H new ATOM 0 HB2 ALA A 23 7.755 -16.176 -13.017 1.00 0.00 H new ATOM 0 HB3 ALA A 23 6.165 -16.480 -13.758 1.00 0.00 H new ATOM 324 N GLY A 24 7.694 -16.371 -17.241 1.00 0.00 N ATOM 325 CA GLY A 24 7.178 -16.790 -18.531 1.00 0.00 C ATOM 326 C GLY A 24 6.739 -18.241 -18.539 1.00 0.00 C ATOM 327 O GLY A 24 7.099 -19.001 -19.439 1.00 0.00 O ATOM 0 H GLY A 24 8.692 -16.535 -17.105 1.00 0.00 H new ATOM 0 HA2 GLY A 24 6.333 -16.157 -18.804 1.00 0.00 H new ATOM 0 HA3 GLY A 24 7.945 -16.642 -19.291 1.00 0.00 H new ATOM 331 N VAL A 25 5.959 -18.627 -17.533 1.00 0.00 N ATOM 332 CA VAL A 25 5.471 -19.998 -17.424 1.00 0.00 C ATOM 333 C VAL A 25 4.127 -20.157 -18.129 1.00 0.00 C ATOM 334 O VAL A 25 3.729 -21.266 -18.484 1.00 0.00 O ATOM 335 CB VAL A 25 5.327 -20.430 -15.953 1.00 0.00 C ATOM 336 CG1 VAL A 25 5.209 -21.943 -15.850 1.00 0.00 C ATOM 337 CG2 VAL A 25 6.500 -19.923 -15.128 1.00 0.00 C ATOM 0 H VAL A 25 5.651 -18.009 -16.782 1.00 0.00 H new ATOM 0 HA VAL A 25 6.209 -20.638 -17.907 1.00 0.00 H new ATOM 0 HB VAL A 25 4.414 -19.988 -15.553 1.00 0.00 H new ATOM 0 HG11 VAL A 25 5.108 -22.230 -14.803 1.00 0.00 H new ATOM 0 HG12 VAL A 25 4.332 -22.278 -16.404 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.102 -22.407 -16.269 1.00 0.00 H new ATOM 0 HG21 VAL A 25 6.379 -20.239 -14.092 1.00 0.00 H new ATOM 0 HG22 VAL A 25 7.429 -20.332 -15.526 1.00 0.00 H new ATOM 0 HG23 VAL A 25 6.534 -18.834 -15.174 1.00 0.00 H new ATOM 347 N ARG A 26 3.436 -19.040 -18.335 1.00 0.00 N ATOM 348 CA ARG A 26 2.140 -19.055 -19.003 1.00 0.00 C ATOM 349 C ARG A 26 2.309 -19.163 -20.514 1.00 0.00 C ATOM 350 O ARG A 26 3.421 -19.074 -21.032 1.00 0.00 O ATOM 351 CB ARG A 26 1.350 -17.790 -18.658 1.00 0.00 C ATOM 352 CG ARG A 26 0.565 -17.895 -17.362 1.00 0.00 C ATOM 353 CD ARG A 26 -0.069 -16.565 -16.986 1.00 0.00 C ATOM 354 NE ARG A 26 -0.223 -16.421 -15.541 1.00 0.00 N ATOM 355 CZ ARG A 26 -0.112 -15.261 -14.899 1.00 0.00 C ATOM 356 NH1 ARG A 26 0.153 -14.149 -15.572 1.00 0.00 N ATOM 357 NH2 ARG A 26 -0.265 -15.214 -13.582 1.00 0.00 N ATOM 0 H ARG A 26 3.752 -18.113 -18.049 1.00 0.00 H new ATOM 0 HA ARG A 26 1.589 -19.928 -18.652 1.00 0.00 H new ATOM 0 HB2 ARG A 26 2.040 -16.949 -18.587 1.00 0.00 H new ATOM 0 HB3 ARG A 26 0.661 -17.569 -19.473 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -0.211 -18.653 -17.466 1.00 0.00 H new ATOM 0 HG3 ARG A 26 1.226 -18.224 -16.560 1.00 0.00 H new ATOM 0 HD2 ARG A 26 0.545 -15.750 -17.368 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -1.045 -16.480 -17.465 1.00 0.00 H new ATOM 0 HE ARG A 26 -0.427 -17.257 -14.993 1.00 0.00 H new ATOM 0 HH11 ARG A 26 0.272 -14.182 -16.584 1.00 0.00 H new ATOM 0 HH12 ARG A 26 0.237 -13.261 -15.077 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -0.468 -16.067 -13.061 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -0.180 -14.325 -13.090 1.00 0.00 H new ATOM 371 N ASN A 27 1.196 -19.353 -21.217 1.00 0.00 N ATOM 372 CA ASN A 27 1.219 -19.474 -22.671 1.00 0.00 C ATOM 373 C ASN A 27 1.165 -18.097 -23.333 1.00 0.00 C ATOM 374 O ASN A 27 0.157 -17.396 -23.240 1.00 0.00 O ATOM 375 CB ASN A 27 0.042 -20.327 -23.149 1.00 0.00 C ATOM 376 CG ASN A 27 0.355 -21.810 -23.129 1.00 0.00 C ATOM 377 OD1 ASN A 27 -0.426 -22.615 -22.620 1.00 0.00 O ATOM 378 ND2 ASN A 27 1.503 -22.181 -23.684 1.00 0.00 N ATOM 0 H ASN A 27 0.267 -19.426 -20.803 1.00 0.00 H new ATOM 0 HA ASN A 27 2.152 -19.959 -22.957 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -0.824 -20.133 -22.516 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -0.230 -20.030 -24.162 1.00 0.00 H new ATOM 0 HD21 ASN A 27 1.767 -23.166 -23.700 1.00 0.00 H new ATOM 0 HD22 ASN A 27 2.121 -21.481 -24.095 1.00 0.00 H new ATOM 385 N PRO A 28 2.252 -17.691 -24.018 1.00 0.00 N ATOM 386 CA PRO A 28 2.316 -16.391 -24.694 1.00 0.00 C ATOM 387 C PRO A 28 1.479 -16.357 -25.969 1.00 0.00 C ATOM 388 O PRO A 28 1.975 -16.649 -27.058 1.00 0.00 O ATOM 389 CB PRO A 28 3.800 -16.240 -25.023 1.00 0.00 C ATOM 390 CG PRO A 28 4.299 -17.636 -25.158 1.00 0.00 C ATOM 391 CD PRO A 28 3.501 -18.460 -24.183 1.00 0.00 C ATOM 0 HA PRO A 28 1.918 -15.588 -24.074 1.00 0.00 H new ATOM 0 HB2 PRO A 28 3.946 -15.676 -25.944 1.00 0.00 H new ATOM 0 HB3 PRO A 28 4.328 -15.705 -24.234 1.00 0.00 H new ATOM 0 HG2 PRO A 28 4.166 -18.001 -26.177 1.00 0.00 H new ATOM 0 HG3 PRO A 28 5.365 -17.692 -24.935 1.00 0.00 H new ATOM 0 HD2 PRO A 28 3.307 -19.461 -24.569 1.00 0.00 H new ATOM 0 HD3 PRO A 28 4.026 -18.580 -23.235 1.00 0.00 H new ATOM 399 N GLN A 29 0.208 -15.996 -25.827 1.00 0.00 N ATOM 400 CA GLN A 29 -0.697 -15.917 -26.968 1.00 0.00 C ATOM 401 C GLN A 29 -0.471 -14.628 -27.750 1.00 0.00 C ATOM 402 O GLN A 29 0.452 -13.867 -27.456 1.00 0.00 O ATOM 403 CB GLN A 29 -2.151 -15.995 -26.499 1.00 0.00 C ATOM 404 CG GLN A 29 -2.425 -17.158 -25.559 1.00 0.00 C ATOM 405 CD GLN A 29 -2.996 -18.364 -26.275 1.00 0.00 C ATOM 406 OE1 GLN A 29 -4.177 -18.395 -26.619 1.00 0.00 O ATOM 407 NE2 GLN A 29 -2.156 -19.366 -26.507 1.00 0.00 N ATOM 0 H GLN A 29 -0.219 -15.753 -24.933 1.00 0.00 H new ATOM 0 HA GLN A 29 -0.490 -16.762 -27.625 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -2.413 -15.063 -25.997 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -2.801 -16.081 -27.370 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -1.499 -17.442 -25.059 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -3.121 -16.837 -24.784 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -1.184 -19.298 -26.204 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -2.482 -20.204 -26.988 1.00 0.00 H new ATOM 416 N GLN A 30 -1.317 -14.388 -28.747 1.00 0.00 N ATOM 417 CA GLN A 30 -1.206 -13.188 -29.567 1.00 0.00 C ATOM 418 C GLN A 30 -1.702 -11.961 -28.804 1.00 0.00 C ATOM 419 O GLN A 30 -0.970 -11.388 -27.997 1.00 0.00 O ATOM 420 CB GLN A 30 -1.994 -13.360 -30.869 1.00 0.00 C ATOM 421 CG GLN A 30 -1.490 -14.502 -31.738 1.00 0.00 C ATOM 422 CD GLN A 30 -2.443 -15.681 -31.763 1.00 0.00 C ATOM 423 OE1 GLN A 30 -2.023 -16.835 -31.682 1.00 0.00 O ATOM 424 NE2 GLN A 30 -3.735 -15.396 -31.875 1.00 0.00 N ATOM 0 H GLN A 30 -2.085 -15.007 -29.006 1.00 0.00 H new ATOM 0 HA GLN A 30 -0.154 -13.036 -29.810 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -3.043 -13.532 -30.629 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -1.946 -12.432 -31.439 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -1.339 -14.140 -32.755 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -0.519 -14.832 -31.370 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -4.039 -14.425 -31.939 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -4.423 -16.149 -31.897 1.00 0.00 H new ATOM 433 N HIS A 31 -2.949 -11.564 -29.061 1.00 0.00 N ATOM 434 CA HIS A 31 -3.541 -10.407 -28.396 1.00 0.00 C ATOM 435 C HIS A 31 -2.635 -9.184 -28.509 1.00 0.00 C ATOM 436 O HIS A 31 -2.614 -8.329 -27.623 1.00 0.00 O ATOM 437 CB HIS A 31 -3.813 -10.723 -26.922 1.00 0.00 C ATOM 438 CG HIS A 31 -4.847 -11.786 -26.720 1.00 0.00 C ATOM 439 ND1 HIS A 31 -4.654 -12.813 -25.825 1.00 0.00 N ATOM 440 CD2 HIS A 31 -6.056 -11.938 -27.314 1.00 0.00 C ATOM 441 CE1 HIS A 31 -5.741 -13.561 -25.894 1.00 0.00 C ATOM 442 NE2 HIS A 31 -6.616 -13.070 -26.783 1.00 0.00 N ATOM 0 H HIS A 31 -3.568 -12.028 -29.726 1.00 0.00 H new ATOM 0 HA HIS A 31 -4.484 -10.180 -28.893 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -2.883 -11.037 -26.448 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -4.136 -9.813 -26.417 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -6.493 -11.292 -28.061 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -5.904 -14.454 -25.309 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -7.526 -13.465 -27.019 1.00 0.00 H new ATOM 450 N LEU A 32 -1.889 -9.107 -29.607 1.00 0.00 N ATOM 451 CA LEU A 32 -0.979 -7.991 -29.838 1.00 0.00 C ATOM 452 C LEU A 32 -1.696 -6.835 -30.529 1.00 0.00 C ATOM 453 O LEU A 32 -1.152 -6.206 -31.438 1.00 0.00 O ATOM 454 CB LEU A 32 0.214 -8.445 -30.681 1.00 0.00 C ATOM 455 CG LEU A 32 1.288 -9.224 -29.917 1.00 0.00 C ATOM 456 CD1 LEU A 32 1.266 -10.692 -30.313 1.00 0.00 C ATOM 457 CD2 LEU A 32 2.662 -8.621 -30.167 1.00 0.00 C ATOM 0 H LEU A 32 -1.897 -9.805 -30.351 1.00 0.00 H new ATOM 0 HA LEU A 32 -0.619 -7.643 -28.870 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -0.153 -9.067 -31.497 1.00 0.00 H new ATOM 0 HB3 LEU A 32 0.676 -7.567 -31.132 1.00 0.00 H new ATOM 0 HG LEU A 32 1.072 -9.155 -28.851 1.00 0.00 H new ATOM 0 HD11 LEU A 32 2.036 -11.230 -29.760 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.289 -11.117 -30.081 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.457 -10.783 -31.382 1.00 0.00 H new ATOM 0 HD21 LEU A 32 3.413 -9.187 -29.616 1.00 0.00 H new ATOM 0 HD22 LEU A 32 2.888 -8.659 -31.233 1.00 0.00 H new ATOM 0 HD23 LEU A 32 2.671 -7.584 -29.831 1.00 0.00 H new ATOM 469 N ASN A 33 -2.920 -6.559 -30.090 1.00 0.00 N ATOM 470 CA ASN A 33 -3.712 -5.477 -30.663 1.00 0.00 C ATOM 471 C ASN A 33 -3.688 -4.249 -29.759 1.00 0.00 C ATOM 472 O ASN A 33 -4.422 -3.287 -29.981 1.00 0.00 O ATOM 473 CB ASN A 33 -5.157 -5.935 -30.879 1.00 0.00 C ATOM 474 CG ASN A 33 -5.687 -5.554 -32.248 1.00 0.00 C ATOM 475 OD1 ASN A 33 -5.615 -6.338 -33.194 1.00 0.00 O ATOM 476 ND2 ASN A 33 -6.228 -4.347 -32.358 1.00 0.00 N ATOM 0 H ASN A 33 -3.385 -7.070 -29.339 1.00 0.00 H new ATOM 0 HA ASN A 33 -3.274 -5.208 -31.624 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -5.214 -7.017 -30.759 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -5.793 -5.495 -30.111 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -6.605 -4.037 -33.254 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -6.267 -3.730 -31.547 1.00 0.00 H new ATOM 483 N ALA A 34 -2.835 -4.291 -28.738 1.00 0.00 N ATOM 484 CA ALA A 34 -2.712 -3.184 -27.797 1.00 0.00 C ATOM 485 C ALA A 34 -1.625 -2.208 -28.237 1.00 0.00 C ATOM 486 O ALA A 34 -0.560 -2.130 -27.623 1.00 0.00 O ATOM 487 CB ALA A 34 -2.419 -3.711 -26.399 1.00 0.00 C ATOM 0 H ALA A 34 -2.219 -5.080 -28.543 1.00 0.00 H new ATOM 0 HA ALA A 34 -3.660 -2.646 -27.779 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -2.329 -2.874 -25.706 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -3.232 -4.363 -26.078 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -1.486 -4.274 -26.411 1.00 0.00 H new ATOM 493 N GLN A 35 -1.902 -1.466 -29.305 1.00 0.00 N ATOM 494 CA GLN A 35 -0.947 -0.494 -29.829 1.00 0.00 C ATOM 495 C GLN A 35 -1.238 0.915 -29.301 1.00 0.00 C ATOM 496 O GLN A 35 -0.341 1.576 -28.777 1.00 0.00 O ATOM 497 CB GLN A 35 -0.963 -0.500 -31.361 1.00 0.00 C ATOM 498 CG GLN A 35 -0.067 -1.563 -31.975 1.00 0.00 C ATOM 499 CD GLN A 35 -0.617 -2.964 -31.797 1.00 0.00 C ATOM 500 OE1 GLN A 35 -0.439 -3.586 -30.750 1.00 0.00 O ATOM 501 NE2 GLN A 35 -1.287 -3.471 -32.826 1.00 0.00 N ATOM 0 H GLN A 35 -2.778 -1.519 -29.824 1.00 0.00 H new ATOM 0 HA GLN A 35 0.046 -0.784 -29.485 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -1.986 -0.656 -31.705 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -0.651 0.480 -31.723 1.00 0.00 H new ATOM 0 HG2 GLN A 35 0.057 -1.358 -33.038 1.00 0.00 H new ATOM 0 HG3 GLN A 35 0.922 -1.505 -31.521 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -1.411 -2.920 -33.675 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -1.678 -4.411 -32.767 1.00 0.00 H new ATOM 510 N PRO A 36 -2.493 1.403 -29.420 1.00 0.00 N ATOM 511 CA PRO A 36 -2.863 2.743 -28.945 1.00 0.00 C ATOM 512 C PRO A 36 -2.713 2.880 -27.433 1.00 0.00 C ATOM 513 O PRO A 36 -2.221 1.973 -26.761 1.00 0.00 O ATOM 514 CB PRO A 36 -4.336 2.887 -29.348 1.00 0.00 C ATOM 515 CG PRO A 36 -4.565 1.838 -30.382 1.00 0.00 C ATOM 516 CD PRO A 36 -3.642 0.710 -30.029 1.00 0.00 C ATOM 0 HA PRO A 36 -2.219 3.512 -29.372 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -4.994 2.745 -28.491 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -4.540 3.882 -29.745 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -5.604 1.508 -30.381 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -4.352 2.220 -31.381 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -4.106 0.010 -29.334 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -3.348 0.138 -30.909 1.00 0.00 H new ATOM 524 N GLN A 37 -3.144 4.021 -26.903 1.00 0.00 N ATOM 525 CA GLN A 37 -3.063 4.278 -25.470 1.00 0.00 C ATOM 526 C GLN A 37 -4.221 3.613 -24.734 1.00 0.00 C ATOM 527 O GLN A 37 -5.383 3.790 -25.097 1.00 0.00 O ATOM 528 CB GLN A 37 -3.073 5.784 -25.200 1.00 0.00 C ATOM 529 CG GLN A 37 -1.854 6.275 -24.436 1.00 0.00 C ATOM 530 CD GLN A 37 -2.212 7.248 -23.330 1.00 0.00 C ATOM 531 OE1 GLN A 37 -1.589 8.301 -23.189 1.00 0.00 O ATOM 532 NE2 GLN A 37 -3.222 6.901 -22.541 1.00 0.00 N ATOM 0 H GLN A 37 -3.553 4.782 -27.445 1.00 0.00 H new ATOM 0 HA GLN A 37 -2.128 3.855 -25.102 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -3.133 6.314 -26.150 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -3.971 6.037 -24.636 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -1.330 5.421 -24.008 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -1.165 6.757 -25.130 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -3.710 6.018 -22.695 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -3.510 7.517 -21.781 1.00 0.00 H new ATOM 541 N VAL A 38 -3.895 2.849 -23.696 1.00 0.00 N ATOM 542 CA VAL A 38 -4.909 2.159 -22.908 1.00 0.00 C ATOM 543 C VAL A 38 -5.455 3.063 -21.806 1.00 0.00 C ATOM 544 O VAL A 38 -4.699 3.592 -20.990 1.00 0.00 O ATOM 545 CB VAL A 38 -4.353 0.863 -22.282 1.00 0.00 C ATOM 546 CG1 VAL A 38 -3.067 1.142 -21.518 1.00 0.00 C ATOM 547 CG2 VAL A 38 -5.389 0.210 -21.378 1.00 0.00 C ATOM 0 H VAL A 38 -2.937 2.693 -23.382 1.00 0.00 H new ATOM 0 HA VAL A 38 -5.719 1.897 -23.589 1.00 0.00 H new ATOM 0 HB VAL A 38 -4.124 0.168 -23.090 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -2.693 0.214 -21.085 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -2.321 1.552 -22.199 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -3.265 1.860 -20.722 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -4.974 -0.702 -20.948 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -5.659 0.898 -20.577 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -6.277 -0.035 -21.960 1.00 0.00 H new ATOM 557 N THR A 39 -6.772 3.242 -21.795 1.00 0.00 N ATOM 558 CA THR A 39 -7.421 4.081 -20.795 1.00 0.00 C ATOM 559 C THR A 39 -8.166 3.230 -19.773 1.00 0.00 C ATOM 560 O THR A 39 -8.767 3.753 -18.834 1.00 0.00 O ATOM 561 CB THR A 39 -8.390 5.056 -21.469 1.00 0.00 C ATOM 562 OG1 THR A 39 -8.936 5.955 -20.519 1.00 0.00 O ATOM 563 CG2 THR A 39 -9.542 4.370 -22.170 1.00 0.00 C ATOM 0 H THR A 39 -7.410 2.817 -22.468 1.00 0.00 H new ATOM 0 HA THR A 39 -6.649 4.648 -20.275 1.00 0.00 H new ATOM 0 HB THR A 39 -7.797 5.583 -22.216 1.00 0.00 H new ATOM 0 HG1 THR A 39 -8.946 5.531 -19.635 1.00 0.00 H new ATOM 0 HG21 THR A 39 -10.189 5.120 -22.625 1.00 0.00 H new ATOM 0 HG22 THR A 39 -9.154 3.707 -22.944 1.00 0.00 H new ATOM 0 HG23 THR A 39 -10.114 3.788 -21.447 1.00 0.00 H new ATOM 571 N MET A 40 -8.123 1.915 -19.963 1.00 0.00 N ATOM 572 CA MET A 40 -8.791 0.989 -19.057 1.00 0.00 C ATOM 573 C MET A 40 -7.862 0.575 -17.921 1.00 0.00 C ATOM 574 O MET A 40 -6.699 0.977 -17.882 1.00 0.00 O ATOM 575 CB MET A 40 -9.268 -0.250 -19.818 1.00 0.00 C ATOM 576 CG MET A 40 -9.870 0.064 -21.179 1.00 0.00 C ATOM 577 SD MET A 40 -11.656 -0.177 -21.220 1.00 0.00 S ATOM 578 CE MET A 40 -12.227 1.519 -21.286 1.00 0.00 C ATOM 0 H MET A 40 -7.632 1.467 -20.737 1.00 0.00 H new ATOM 0 HA MET A 40 -9.655 1.498 -18.630 1.00 0.00 H new ATOM 0 HB2 MET A 40 -8.427 -0.930 -19.951 1.00 0.00 H new ATOM 0 HB3 MET A 40 -10.009 -0.773 -19.214 1.00 0.00 H new ATOM 0 HG2 MET A 40 -9.640 1.096 -21.444 1.00 0.00 H new ATOM 0 HG3 MET A 40 -9.404 -0.570 -21.933 1.00 0.00 H new ATOM 0 HE1 MET A 40 -13.316 1.535 -21.316 1.00 0.00 H new ATOM 0 HE2 MET A 40 -11.880 2.054 -20.402 1.00 0.00 H new ATOM 0 HE3 MET A 40 -11.832 2.001 -22.180 1.00 0.00 H new ATOM 588 N GLN A 41 -8.385 -0.233 -17.001 1.00 0.00 N ATOM 589 CA GLN A 41 -7.608 -0.706 -15.858 1.00 0.00 C ATOM 590 C GLN A 41 -7.166 0.459 -14.975 1.00 0.00 C ATOM 591 O GLN A 41 -6.220 0.335 -14.196 1.00 0.00 O ATOM 592 CB GLN A 41 -6.388 -1.501 -16.330 1.00 0.00 C ATOM 593 CG GLN A 41 -6.603 -3.005 -16.329 1.00 0.00 C ATOM 594 CD GLN A 41 -6.717 -3.578 -14.930 1.00 0.00 C ATOM 595 OE1 GLN A 41 -7.768 -4.084 -14.537 1.00 0.00 O ATOM 596 NE2 GLN A 41 -5.632 -3.497 -14.168 1.00 0.00 N ATOM 0 H GLN A 41 -9.346 -0.574 -17.025 1.00 0.00 H new ATOM 0 HA GLN A 41 -8.248 -1.361 -15.266 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -6.124 -1.181 -17.338 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -5.540 -1.263 -15.688 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -7.509 -3.239 -16.888 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -5.775 -3.487 -16.848 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -4.782 -3.069 -14.535 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -5.649 -3.863 -13.216 1.00 0.00 H new ATOM 605 N GLN A 42 -7.861 1.585 -15.097 1.00 0.00 N ATOM 606 CA GLN A 42 -7.550 2.769 -14.303 1.00 0.00 C ATOM 607 C GLN A 42 -8.767 3.687 -14.191 1.00 0.00 C ATOM 608 O GLN A 42 -9.029 4.493 -15.083 1.00 0.00 O ATOM 609 CB GLN A 42 -6.373 3.533 -14.917 1.00 0.00 C ATOM 610 CG GLN A 42 -6.454 3.668 -16.429 1.00 0.00 C ATOM 611 CD GLN A 42 -5.120 4.027 -17.056 1.00 0.00 C ATOM 612 OE1 GLN A 42 -4.561 5.090 -16.786 1.00 0.00 O ATOM 613 NE2 GLN A 42 -4.606 3.140 -17.899 1.00 0.00 N ATOM 0 H GLN A 42 -8.645 1.703 -15.739 1.00 0.00 H new ATOM 0 HA GLN A 42 -7.273 2.438 -13.302 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -6.327 4.528 -14.474 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -5.445 3.024 -14.656 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -6.811 2.730 -16.855 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -7.188 4.433 -16.683 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -5.105 2.272 -18.093 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -3.712 3.327 -18.353 1.00 0.00 H new ATOM 622 N PRO A 43 -9.533 3.572 -13.090 1.00 0.00 N ATOM 623 CA PRO A 43 -10.730 4.394 -12.869 1.00 0.00 C ATOM 624 C PRO A 43 -10.415 5.886 -12.879 1.00 0.00 C ATOM 625 O PRO A 43 -9.250 6.285 -12.903 1.00 0.00 O ATOM 626 CB PRO A 43 -11.220 3.962 -11.483 1.00 0.00 C ATOM 627 CG PRO A 43 -10.620 2.616 -11.264 1.00 0.00 C ATOM 628 CD PRO A 43 -9.299 2.634 -11.977 1.00 0.00 C ATOM 0 HA PRO A 43 -11.469 4.250 -13.657 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -10.901 4.666 -10.714 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -12.309 3.920 -11.445 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -10.487 2.416 -10.201 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -11.266 1.831 -11.658 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -8.494 2.974 -11.326 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -9.021 1.643 -12.336 1.00 0.00 H new ATOM 636 N ALA A 44 -11.461 6.707 -12.859 1.00 0.00 N ATOM 637 CA ALA A 44 -11.295 8.156 -12.860 1.00 0.00 C ATOM 638 C ALA A 44 -11.077 8.681 -11.444 1.00 0.00 C ATOM 639 O ALA A 44 -11.825 9.531 -10.962 1.00 0.00 O ATOM 640 CB ALA A 44 -12.505 8.826 -13.496 1.00 0.00 C ATOM 0 H ALA A 44 -12.431 6.393 -12.842 1.00 0.00 H new ATOM 0 HA ALA A 44 -10.411 8.398 -13.450 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -12.367 9.907 -13.490 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -12.614 8.480 -14.524 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -13.401 8.571 -12.930 1.00 0.00 H new ATOM 646 N VAL A 45 -10.045 8.164 -10.782 1.00 0.00 N ATOM 647 CA VAL A 45 -9.726 8.574 -9.420 1.00 0.00 C ATOM 648 C VAL A 45 -8.510 9.495 -9.393 1.00 0.00 C ATOM 649 O VAL A 45 -7.370 9.034 -9.332 1.00 0.00 O ATOM 650 CB VAL A 45 -9.457 7.357 -8.513 1.00 0.00 C ATOM 651 CG1 VAL A 45 -10.762 6.793 -7.972 1.00 0.00 C ATOM 652 CG2 VAL A 45 -8.676 6.288 -9.264 1.00 0.00 C ATOM 0 H VAL A 45 -9.416 7.460 -11.168 1.00 0.00 H new ATOM 0 HA VAL A 45 -10.594 9.113 -9.041 1.00 0.00 H new ATOM 0 HB VAL A 45 -8.853 7.687 -7.668 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -10.551 5.935 -7.334 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -11.276 7.559 -7.391 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -11.395 6.481 -8.802 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -8.497 5.438 -8.605 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -9.249 5.961 -10.131 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -7.722 6.699 -9.594 1.00 0.00 H new ATOM 662 N HIS A 46 -8.762 10.799 -9.435 1.00 0.00 N ATOM 663 CA HIS A 46 -7.689 11.787 -9.411 1.00 0.00 C ATOM 664 C HIS A 46 -7.256 12.083 -7.978 1.00 0.00 C ATOM 665 O HIS A 46 -7.803 11.523 -7.027 1.00 0.00 O ATOM 666 CB HIS A 46 -8.140 13.077 -10.099 1.00 0.00 C ATOM 667 CG HIS A 46 -7.580 13.249 -11.476 1.00 0.00 C ATOM 668 ND1 HIS A 46 -6.242 13.484 -11.683 1.00 0.00 N ATOM 669 CD2 HIS A 46 -8.214 13.214 -12.674 1.00 0.00 C ATOM 670 CE1 HIS A 46 -6.090 13.585 -12.992 1.00 0.00 C ATOM 671 NE2 HIS A 46 -7.257 13.427 -13.632 1.00 0.00 N ATOM 0 H HIS A 46 -9.700 11.197 -9.486 1.00 0.00 H new ATOM 0 HA HIS A 46 -6.836 11.376 -9.951 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -9.229 13.088 -10.155 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -7.844 13.928 -9.486 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -9.268 13.050 -12.841 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -5.146 13.771 -13.483 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -7.405 13.459 -14.641 1.00 0.00 H new ATOM 679 N VAL A 47 -6.271 12.965 -7.830 1.00 0.00 N ATOM 680 CA VAL A 47 -5.766 13.331 -6.511 1.00 0.00 C ATOM 681 C VAL A 47 -6.419 14.621 -6.013 1.00 0.00 C ATOM 682 O VAL A 47 -6.024 15.723 -6.396 1.00 0.00 O ATOM 683 CB VAL A 47 -4.230 13.494 -6.521 1.00 0.00 C ATOM 684 CG1 VAL A 47 -3.785 14.363 -7.687 1.00 0.00 C ATOM 685 CG2 VAL A 47 -3.736 14.064 -5.198 1.00 0.00 C ATOM 0 H VAL A 47 -5.808 13.438 -8.606 1.00 0.00 H new ATOM 0 HA VAL A 47 -6.023 12.519 -5.831 1.00 0.00 H new ATOM 0 HB VAL A 47 -3.786 12.507 -6.649 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -2.700 14.463 -7.673 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -4.094 13.901 -8.624 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -4.241 15.349 -7.601 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -2.652 14.169 -5.230 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -4.191 15.040 -5.030 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -4.012 13.391 -4.386 1.00 0.00 H new ATOM 695 N GLN A 48 -7.430 14.471 -5.162 1.00 0.00 N ATOM 696 CA GLN A 48 -8.143 15.619 -4.610 1.00 0.00 C ATOM 697 C GLN A 48 -7.627 15.960 -3.215 1.00 0.00 C ATOM 698 O GLN A 48 -7.622 17.124 -2.812 1.00 0.00 O ATOM 699 CB GLN A 48 -9.645 15.334 -4.557 1.00 0.00 C ATOM 700 CG GLN A 48 -10.493 16.576 -4.327 1.00 0.00 C ATOM 701 CD GLN A 48 -11.393 16.453 -3.113 1.00 0.00 C ATOM 702 OE1 GLN A 48 -11.048 15.789 -2.134 1.00 0.00 O ATOM 703 NE2 GLN A 48 -12.555 17.094 -3.169 1.00 0.00 N ATOM 0 H GLN A 48 -7.774 13.566 -4.840 1.00 0.00 H new ATOM 0 HA GLN A 48 -7.966 16.475 -5.262 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -9.950 14.864 -5.492 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -9.842 14.617 -3.760 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -9.839 17.440 -4.204 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -11.104 16.762 -5.210 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -12.801 17.633 -4.000 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -13.201 17.048 -2.381 1.00 0.00 H new ATOM 712 N GLY A 49 -7.194 14.937 -2.484 1.00 0.00 N ATOM 713 CA GLY A 49 -6.680 15.147 -1.143 1.00 0.00 C ATOM 714 C GLY A 49 -5.233 15.598 -1.139 1.00 0.00 C ATOM 715 O GLY A 49 -4.701 16.010 -2.170 1.00 0.00 O ATOM 0 H GLY A 49 -7.190 13.966 -2.797 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -7.291 15.894 -0.636 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -6.770 14.222 -0.574 1.00 0.00 H new ATOM 719 N GLN A 50 -4.595 15.519 0.025 1.00 0.00 N ATOM 720 CA GLN A 50 -3.200 15.920 0.162 1.00 0.00 C ATOM 721 C GLN A 50 -2.278 14.706 0.119 1.00 0.00 C ATOM 722 O GLN A 50 -2.736 13.574 -0.044 1.00 0.00 O ATOM 723 CB GLN A 50 -2.996 16.684 1.472 1.00 0.00 C ATOM 724 CG GLN A 50 -3.463 18.129 1.415 1.00 0.00 C ATOM 725 CD GLN A 50 -2.595 19.057 2.240 1.00 0.00 C ATOM 726 OE1 GLN A 50 -2.820 19.236 3.437 1.00 0.00 O ATOM 727 NE2 GLN A 50 -1.593 19.653 1.603 1.00 0.00 N ATOM 0 H GLN A 50 -5.023 15.181 0.887 1.00 0.00 H new ATOM 0 HA GLN A 50 -2.950 16.572 -0.675 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -3.532 16.169 2.270 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -1.938 16.663 1.734 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -3.464 18.465 0.378 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -4.492 18.188 1.771 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -1.443 19.476 0.610 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -0.974 20.288 2.107 1.00 0.00 H new ATOM 736 N GLU A 51 -0.979 14.948 0.266 1.00 0.00 N ATOM 737 CA GLU A 51 0.007 13.871 0.244 1.00 0.00 C ATOM 738 C GLU A 51 -0.202 12.912 1.415 1.00 0.00 C ATOM 739 O GLU A 51 -0.303 13.340 2.566 1.00 0.00 O ATOM 740 CB GLU A 51 1.426 14.445 0.287 1.00 0.00 C ATOM 741 CG GLU A 51 1.571 15.655 1.196 1.00 0.00 C ATOM 742 CD GLU A 51 1.948 15.278 2.615 1.00 0.00 C ATOM 743 OE1 GLU A 51 3.017 14.659 2.801 1.00 0.00 O ATOM 744 OE2 GLU A 51 1.176 15.603 3.542 1.00 0.00 O ATOM 0 H GLU A 51 -0.584 15.879 0.401 1.00 0.00 H new ATOM 0 HA GLU A 51 -0.125 13.315 -0.684 1.00 0.00 H new ATOM 0 HB2 GLU A 51 2.113 13.667 0.621 1.00 0.00 H new ATOM 0 HB3 GLU A 51 1.726 14.723 -0.723 1.00 0.00 H new ATOM 0 HG2 GLU A 51 2.330 16.322 0.788 1.00 0.00 H new ATOM 0 HG3 GLU A 51 0.633 16.209 1.209 1.00 0.00 H new ATOM 751 N PRO A 52 -0.270 11.595 1.139 1.00 0.00 N ATOM 752 CA PRO A 52 -0.470 10.582 2.180 1.00 0.00 C ATOM 753 C PRO A 52 0.799 10.314 2.982 1.00 0.00 C ATOM 754 O PRO A 52 1.848 10.902 2.718 1.00 0.00 O ATOM 755 CB PRO A 52 -0.867 9.341 1.382 1.00 0.00 C ATOM 756 CG PRO A 52 -0.184 9.509 0.070 1.00 0.00 C ATOM 757 CD PRO A 52 -0.165 10.990 -0.205 1.00 0.00 C ATOM 0 HA PRO A 52 -1.210 10.892 2.918 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -0.546 8.427 1.883 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -1.948 9.275 1.261 1.00 0.00 H new ATOM 0 HG2 PRO A 52 0.828 9.106 0.103 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -0.715 8.973 -0.717 1.00 0.00 H new ATOM 0 HD2 PRO A 52 0.753 11.292 -0.710 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -0.995 11.289 -0.845 1.00 0.00 H new ATOM 765 N LEU A 53 0.693 9.421 3.959 1.00 0.00 N ATOM 766 CA LEU A 53 1.826 9.065 4.807 1.00 0.00 C ATOM 767 C LEU A 53 2.562 7.851 4.248 1.00 0.00 C ATOM 768 O LEU A 53 1.941 6.895 3.785 1.00 0.00 O ATOM 769 CB LEU A 53 1.341 8.756 6.224 1.00 0.00 C ATOM 770 CG LEU A 53 2.060 9.484 7.370 1.00 0.00 C ATOM 771 CD1 LEU A 53 3.337 8.754 7.748 1.00 0.00 C ATOM 772 CD2 LEU A 53 2.358 10.931 7.015 1.00 0.00 C ATOM 0 H LEU A 53 -0.171 8.927 4.185 1.00 0.00 H new ATOM 0 HA LEU A 53 2.512 9.911 4.830 1.00 0.00 H new ATOM 0 HB2 LEU A 53 0.279 8.996 6.281 1.00 0.00 H new ATOM 0 HB3 LEU A 53 1.435 7.683 6.390 1.00 0.00 H new ATOM 0 HG LEU A 53 1.390 9.487 8.230 1.00 0.00 H new ATOM 0 HD11 LEU A 53 3.832 9.285 8.561 1.00 0.00 H new ATOM 0 HD12 LEU A 53 3.095 7.741 8.070 1.00 0.00 H new ATOM 0 HD13 LEU A 53 4.001 8.712 6.885 1.00 0.00 H new ATOM 0 HD21 LEU A 53 2.867 11.413 7.850 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.997 10.965 6.132 1.00 0.00 H new ATOM 0 HD23 LEU A 53 1.425 11.454 6.808 1.00 0.00 H new ATOM 784 N THR A 54 3.890 7.902 4.294 1.00 0.00 N ATOM 785 CA THR A 54 4.730 6.803 3.819 1.00 0.00 C ATOM 786 C THR A 54 6.196 7.078 4.131 1.00 0.00 C ATOM 787 O THR A 54 6.513 7.946 4.944 1.00 0.00 O ATOM 788 CB THR A 54 4.558 6.577 2.311 1.00 0.00 C ATOM 789 OG1 THR A 54 3.612 7.479 1.763 1.00 0.00 O ATOM 790 CG2 THR A 54 4.113 5.170 1.966 1.00 0.00 C ATOM 0 H THR A 54 4.413 8.699 4.658 1.00 0.00 H new ATOM 0 HA THR A 54 4.413 5.900 4.341 1.00 0.00 H new ATOM 0 HB THR A 54 5.546 6.745 1.882 1.00 0.00 H new ATOM 0 HG1 THR A 54 3.522 7.315 0.801 1.00 0.00 H new ATOM 0 HG21 THR A 54 4.010 5.076 0.885 1.00 0.00 H new ATOM 0 HG22 THR A 54 4.855 4.456 2.323 1.00 0.00 H new ATOM 0 HG23 THR A 54 3.154 4.965 2.441 1.00 0.00 H new ATOM 798 N ALA A 55 7.087 6.342 3.473 1.00 0.00 N ATOM 799 CA ALA A 55 8.520 6.498 3.689 1.00 0.00 C ATOM 800 C ALA A 55 8.977 7.924 3.400 1.00 0.00 C ATOM 801 O ALA A 55 9.763 8.494 4.155 1.00 0.00 O ATOM 802 CB ALA A 55 9.293 5.510 2.835 1.00 0.00 C ATOM 0 H ALA A 55 6.840 5.631 2.785 1.00 0.00 H new ATOM 0 HA ALA A 55 8.723 6.291 4.740 1.00 0.00 H new ATOM 0 HB1 ALA A 55 10.362 5.639 3.007 1.00 0.00 H new ATOM 0 HB2 ALA A 55 9.002 4.494 3.101 1.00 0.00 H new ATOM 0 HB3 ALA A 55 9.071 5.687 1.783 1.00 0.00 H new ATOM 808 N SER A 56 8.488 8.491 2.300 1.00 0.00 N ATOM 809 CA SER A 56 8.849 9.854 1.924 1.00 0.00 C ATOM 810 C SER A 56 8.514 10.825 3.051 1.00 0.00 C ATOM 811 O SER A 56 9.325 11.680 3.410 1.00 0.00 O ATOM 812 CB SER A 56 8.121 10.266 0.644 1.00 0.00 C ATOM 813 OG SER A 56 8.386 9.356 -0.410 1.00 0.00 O ATOM 0 H SER A 56 7.844 8.030 1.657 1.00 0.00 H new ATOM 0 HA SER A 56 9.923 9.886 1.742 1.00 0.00 H new ATOM 0 HB2 SER A 56 7.048 10.309 0.830 1.00 0.00 H new ATOM 0 HB3 SER A 56 8.434 11.268 0.351 1.00 0.00 H new ATOM 0 HG SER A 56 7.908 9.641 -1.216 1.00 0.00 H new ATOM 819 N MET A 57 7.320 10.673 3.614 1.00 0.00 N ATOM 820 CA MET A 57 6.881 11.517 4.718 1.00 0.00 C ATOM 821 C MET A 57 7.803 11.347 5.918 1.00 0.00 C ATOM 822 O MET A 57 8.142 12.312 6.600 1.00 0.00 O ATOM 823 CB MET A 57 5.447 11.163 5.115 1.00 0.00 C ATOM 824 CG MET A 57 4.381 11.736 4.189 1.00 0.00 C ATOM 825 SD MET A 57 5.045 12.348 2.626 1.00 0.00 S ATOM 826 CE MET A 57 4.740 10.943 1.558 1.00 0.00 C ATOM 0 H MET A 57 6.639 9.972 3.323 1.00 0.00 H new ATOM 0 HA MET A 57 6.916 12.556 4.391 1.00 0.00 H new ATOM 0 HB2 MET A 57 5.346 10.078 5.139 1.00 0.00 H new ATOM 0 HB3 MET A 57 5.263 11.522 6.128 1.00 0.00 H new ATOM 0 HG2 MET A 57 3.637 10.966 3.983 1.00 0.00 H new ATOM 0 HG3 MET A 57 3.865 12.549 4.700 1.00 0.00 H new ATOM 0 HE1 MET A 57 5.334 11.041 0.650 1.00 0.00 H new ATOM 0 HE2 MET A 57 5.018 10.025 2.076 1.00 0.00 H new ATOM 0 HE3 MET A 57 3.682 10.907 1.297 1.00 0.00 H new ATOM 836 N LEU A 58 8.202 10.104 6.165 1.00 0.00 N ATOM 837 CA LEU A 58 9.094 9.788 7.273 1.00 0.00 C ATOM 838 C LEU A 58 10.425 10.510 7.108 1.00 0.00 C ATOM 839 O LEU A 58 10.949 11.098 8.055 1.00 0.00 O ATOM 840 CB LEU A 58 9.335 8.275 7.334 1.00 0.00 C ATOM 841 CG LEU A 58 8.187 7.417 7.891 1.00 0.00 C ATOM 842 CD1 LEU A 58 6.911 8.230 8.087 1.00 0.00 C ATOM 843 CD2 LEU A 58 7.928 6.236 6.968 1.00 0.00 C ATOM 0 H LEU A 58 7.920 9.296 5.610 1.00 0.00 H new ATOM 0 HA LEU A 58 8.626 10.119 8.200 1.00 0.00 H new ATOM 0 HB2 LEU A 58 9.564 7.926 6.327 1.00 0.00 H new ATOM 0 HB3 LEU A 58 10.221 8.095 7.943 1.00 0.00 H new ATOM 0 HG LEU A 58 8.490 7.050 8.872 1.00 0.00 H new ATOM 0 HD11 LEU A 58 6.126 7.585 8.482 1.00 0.00 H new ATOM 0 HD12 LEU A 58 7.101 9.042 8.789 1.00 0.00 H new ATOM 0 HD13 LEU A 58 6.593 8.645 7.130 1.00 0.00 H new ATOM 0 HD21 LEU A 58 7.114 5.633 7.369 1.00 0.00 H new ATOM 0 HD22 LEU A 58 7.656 6.601 5.978 1.00 0.00 H new ATOM 0 HD23 LEU A 58 8.829 5.627 6.895 1.00 0.00 H new ATOM 855 N ALA A 59 10.961 10.463 5.894 1.00 0.00 N ATOM 856 CA ALA A 59 12.233 11.108 5.586 1.00 0.00 C ATOM 857 C ALA A 59 12.099 12.627 5.615 1.00 0.00 C ATOM 858 O ALA A 59 13.093 13.349 5.541 1.00 0.00 O ATOM 859 CB ALA A 59 12.742 10.646 4.229 1.00 0.00 C ATOM 0 H ALA A 59 10.532 9.983 5.103 1.00 0.00 H new ATOM 0 HA ALA A 59 12.955 10.819 6.350 1.00 0.00 H new ATOM 0 HB1 ALA A 59 13.692 11.135 4.011 1.00 0.00 H new ATOM 0 HB2 ALA A 59 12.885 9.565 4.242 1.00 0.00 H new ATOM 0 HB3 ALA A 59 12.015 10.906 3.460 1.00 0.00 H new ATOM 865 N SER A 60 10.862 13.104 5.718 1.00 0.00 N ATOM 866 CA SER A 60 10.596 14.538 5.757 1.00 0.00 C ATOM 867 C SER A 60 10.792 15.089 7.167 1.00 0.00 C ATOM 868 O SER A 60 10.777 16.303 7.376 1.00 0.00 O ATOM 869 CB SER A 60 9.173 14.828 5.276 1.00 0.00 C ATOM 870 OG SER A 60 8.975 16.217 5.073 1.00 0.00 O ATOM 0 H SER A 60 10.029 12.519 5.776 1.00 0.00 H new ATOM 0 HA SER A 60 11.304 15.032 5.091 1.00 0.00 H new ATOM 0 HB2 SER A 60 8.984 14.291 4.347 1.00 0.00 H new ATOM 0 HB3 SER A 60 8.456 14.459 6.009 1.00 0.00 H new ATOM 0 HG SER A 60 9.431 16.719 5.780 1.00 0.00 H new ATOM 876 N ALA A 61 10.981 14.190 8.127 1.00 0.00 N ATOM 877 CA ALA A 61 11.187 14.585 9.518 1.00 0.00 C ATOM 878 C ALA A 61 12.362 13.826 10.140 1.00 0.00 C ATOM 879 O ALA A 61 12.199 13.149 11.156 1.00 0.00 O ATOM 880 CB ALA A 61 9.917 14.348 10.323 1.00 0.00 C ATOM 0 H ALA A 61 10.996 13.182 7.969 1.00 0.00 H new ATOM 0 HA ALA A 61 11.427 15.648 9.538 1.00 0.00 H new ATOM 0 HB1 ALA A 61 10.082 14.646 11.359 1.00 0.00 H new ATOM 0 HB2 ALA A 61 9.103 14.938 9.901 1.00 0.00 H new ATOM 0 HB3 ALA A 61 9.655 13.290 10.287 1.00 0.00 H new ATOM 886 N PRO A 62 13.570 13.933 9.547 1.00 0.00 N ATOM 887 CA PRO A 62 14.758 13.232 10.050 1.00 0.00 C ATOM 888 C PRO A 62 15.048 13.522 11.530 1.00 0.00 C ATOM 889 O PRO A 62 15.204 12.590 12.318 1.00 0.00 O ATOM 890 CB PRO A 62 15.892 13.738 9.153 1.00 0.00 C ATOM 891 CG PRO A 62 15.215 14.187 7.903 1.00 0.00 C ATOM 892 CD PRO A 62 13.867 14.705 8.323 1.00 0.00 C ATOM 0 HA PRO A 62 14.628 12.150 10.011 1.00 0.00 H new ATOM 0 HB2 PRO A 62 16.435 14.557 9.625 1.00 0.00 H new ATOM 0 HB3 PRO A 62 16.617 12.950 8.949 1.00 0.00 H new ATOM 0 HG2 PRO A 62 15.793 14.965 7.404 1.00 0.00 H new ATOM 0 HG3 PRO A 62 15.113 13.363 7.197 1.00 0.00 H new ATOM 0 HD2 PRO A 62 13.892 15.777 8.520 1.00 0.00 H new ATOM 0 HD3 PRO A 62 13.115 14.540 7.551 1.00 0.00 H new ATOM 900 N PRO A 63 15.112 14.808 11.945 1.00 0.00 N ATOM 901 CA PRO A 63 15.387 15.169 13.328 1.00 0.00 C ATOM 902 C PRO A 63 14.114 15.396 14.136 1.00 0.00 C ATOM 903 O PRO A 63 14.149 15.991 15.214 1.00 0.00 O ATOM 904 CB PRO A 63 16.152 16.477 13.165 1.00 0.00 C ATOM 905 CG PRO A 63 15.531 17.125 11.968 1.00 0.00 C ATOM 906 CD PRO A 63 14.952 16.017 11.114 1.00 0.00 C ATOM 0 HA PRO A 63 15.923 14.389 13.869 1.00 0.00 H new ATOM 0 HB2 PRO A 63 16.058 17.105 14.051 1.00 0.00 H new ATOM 0 HB3 PRO A 63 17.216 16.298 13.013 1.00 0.00 H new ATOM 0 HG2 PRO A 63 14.753 17.826 12.270 1.00 0.00 H new ATOM 0 HG3 PRO A 63 16.274 17.694 11.409 1.00 0.00 H new ATOM 0 HD2 PRO A 63 13.905 16.202 10.876 1.00 0.00 H new ATOM 0 HD3 PRO A 63 15.483 15.924 10.167 1.00 0.00 H new ATOM 914 N GLN A 64 12.986 14.934 13.601 1.00 0.00 N ATOM 915 CA GLN A 64 11.702 15.113 14.266 1.00 0.00 C ATOM 916 C GLN A 64 10.989 13.780 14.477 1.00 0.00 C ATOM 917 O GLN A 64 11.267 13.064 15.440 1.00 0.00 O ATOM 918 CB GLN A 64 10.812 16.055 13.450 1.00 0.00 C ATOM 919 CG GLN A 64 11.021 17.521 13.779 1.00 0.00 C ATOM 920 CD GLN A 64 11.030 18.400 12.543 1.00 0.00 C ATOM 921 OE1 GLN A 64 11.978 18.377 11.758 1.00 0.00 O ATOM 922 NE2 GLN A 64 9.970 19.180 12.363 1.00 0.00 N ATOM 0 H GLN A 64 12.937 14.435 12.713 1.00 0.00 H new ATOM 0 HA GLN A 64 11.894 15.551 15.245 1.00 0.00 H new ATOM 0 HB2 GLN A 64 11.006 15.898 12.389 1.00 0.00 H new ATOM 0 HB3 GLN A 64 9.767 15.797 13.624 1.00 0.00 H new ATOM 0 HG2 GLN A 64 10.231 17.855 14.452 1.00 0.00 H new ATOM 0 HG3 GLN A 64 11.965 17.639 14.311 1.00 0.00 H new ATOM 0 HE21 GLN A 64 9.207 19.167 13.039 1.00 0.00 H new ATOM 0 HE22 GLN A 64 9.919 19.792 11.548 1.00 0.00 H new ATOM 931 N GLU A 65 10.048 13.469 13.591 1.00 0.00 N ATOM 932 CA GLU A 65 9.264 12.245 13.702 1.00 0.00 C ATOM 933 C GLU A 65 9.677 11.219 12.650 1.00 0.00 C ATOM 934 O GLU A 65 8.827 10.624 11.984 1.00 0.00 O ATOM 935 CB GLU A 65 7.774 12.564 13.562 1.00 0.00 C ATOM 936 CG GLU A 65 7.429 14.020 13.827 1.00 0.00 C ATOM 937 CD GLU A 65 6.509 14.193 15.020 1.00 0.00 C ATOM 938 OE1 GLU A 65 5.285 13.999 14.858 1.00 0.00 O ATOM 939 OE2 GLU A 65 7.010 14.519 16.116 1.00 0.00 O ATOM 0 H GLU A 65 9.810 14.049 12.787 1.00 0.00 H new ATOM 0 HA GLU A 65 9.454 11.814 14.685 1.00 0.00 H new ATOM 0 HB2 GLU A 65 7.449 12.301 12.555 1.00 0.00 H new ATOM 0 HB3 GLU A 65 7.211 11.936 14.253 1.00 0.00 H new ATOM 0 HG2 GLU A 65 8.347 14.582 13.996 1.00 0.00 H new ATOM 0 HG3 GLU A 65 6.954 14.444 12.942 1.00 0.00 H new ATOM 946 N GLN A 66 10.979 11.005 12.511 1.00 0.00 N ATOM 947 CA GLN A 66 11.494 10.036 11.550 1.00 0.00 C ATOM 948 C GLN A 66 11.135 8.619 11.968 1.00 0.00 C ATOM 949 O GLN A 66 11.080 7.708 11.142 1.00 0.00 O ATOM 950 CB GLN A 66 13.008 10.159 11.430 1.00 0.00 C ATOM 951 CG GLN A 66 13.503 10.054 10.001 1.00 0.00 C ATOM 952 CD GLN A 66 14.911 9.499 9.908 1.00 0.00 C ATOM 953 OE1 GLN A 66 15.783 10.091 9.271 1.00 0.00 O ATOM 954 NE2 GLN A 66 15.138 8.355 10.541 1.00 0.00 N ATOM 0 H GLN A 66 11.697 11.488 13.050 1.00 0.00 H new ATOM 0 HA GLN A 66 11.037 10.247 10.583 1.00 0.00 H new ATOM 0 HB2 GLN A 66 13.323 11.115 11.848 1.00 0.00 H new ATOM 0 HB3 GLN A 66 13.478 9.379 12.029 1.00 0.00 H new ATOM 0 HG2 GLN A 66 12.827 9.415 9.433 1.00 0.00 H new ATOM 0 HG3 GLN A 66 13.474 11.040 9.538 1.00 0.00 H new ATOM 0 HE21 GLN A 66 14.385 7.899 11.057 1.00 0.00 H new ATOM 0 HE22 GLN A 66 16.065 7.931 10.512 1.00 0.00 H new ATOM 963 N LYS A 67 10.919 8.443 13.264 1.00 0.00 N ATOM 964 CA LYS A 67 10.562 7.141 13.820 1.00 0.00 C ATOM 965 C LYS A 67 9.262 7.235 14.614 1.00 0.00 C ATOM 966 O LYS A 67 9.092 6.558 15.628 1.00 0.00 O ATOM 967 CB LYS A 67 11.687 6.616 14.719 1.00 0.00 C ATOM 968 CG LYS A 67 13.067 7.135 14.343 1.00 0.00 C ATOM 969 CD LYS A 67 13.962 6.018 13.833 1.00 0.00 C ATOM 970 CE LYS A 67 15.417 6.456 13.766 1.00 0.00 C ATOM 971 NZ LYS A 67 16.287 5.407 13.165 1.00 0.00 N ATOM 0 H LYS A 67 10.985 9.190 13.956 1.00 0.00 H new ATOM 0 HA LYS A 67 10.418 6.445 12.993 1.00 0.00 H new ATOM 0 HB2 LYS A 67 11.474 6.893 15.751 1.00 0.00 H new ATOM 0 HB3 LYS A 67 11.695 5.527 14.677 1.00 0.00 H new ATOM 0 HG2 LYS A 67 12.971 7.904 13.577 1.00 0.00 H new ATOM 0 HG3 LYS A 67 13.529 7.605 15.211 1.00 0.00 H new ATOM 0 HD2 LYS A 67 13.872 5.151 14.487 1.00 0.00 H new ATOM 0 HD3 LYS A 67 13.629 5.707 12.843 1.00 0.00 H new ATOM 0 HE2 LYS A 67 15.494 7.371 13.179 1.00 0.00 H new ATOM 0 HE3 LYS A 67 15.772 6.690 14.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 17.270 5.745 13.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 16.234 4.541 13.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 15.965 5.201 12.198 1.00 0.00 H new ATOM 985 N GLN A 68 8.344 8.080 14.144 1.00 0.00 N ATOM 986 CA GLN A 68 7.072 8.281 14.833 1.00 0.00 C ATOM 987 C GLN A 68 5.875 8.168 13.888 1.00 0.00 C ATOM 988 O GLN A 68 5.010 7.313 14.073 1.00 0.00 O ATOM 989 CB GLN A 68 7.059 9.649 15.516 1.00 0.00 C ATOM 990 CG GLN A 68 5.825 9.894 16.368 1.00 0.00 C ATOM 991 CD GLN A 68 6.133 10.661 17.638 1.00 0.00 C ATOM 992 OE1 GLN A 68 6.196 10.086 18.725 1.00 0.00 O ATOM 993 NE2 GLN A 68 6.329 11.968 17.509 1.00 0.00 N ATOM 0 H GLN A 68 8.457 8.633 13.294 1.00 0.00 H new ATOM 0 HA GLN A 68 6.980 7.490 15.577 1.00 0.00 H new ATOM 0 HB2 GLN A 68 7.946 9.741 16.142 1.00 0.00 H new ATOM 0 HB3 GLN A 68 7.124 10.426 14.755 1.00 0.00 H new ATOM 0 HG2 GLN A 68 5.089 10.447 15.784 1.00 0.00 H new ATOM 0 HG3 GLN A 68 5.372 8.937 16.627 1.00 0.00 H new ATOM 0 HE21 GLN A 68 6.268 12.405 16.589 1.00 0.00 H new ATOM 0 HE22 GLN A 68 6.541 12.535 18.330 1.00 0.00 H new ATOM 1002 N MET A 69 5.813 9.056 12.896 1.00 0.00 N ATOM 1003 CA MET A 69 4.688 9.089 11.957 1.00 0.00 C ATOM 1004 C MET A 69 4.520 7.768 11.211 1.00 0.00 C ATOM 1005 O MET A 69 3.538 7.573 10.495 1.00 0.00 O ATOM 1006 CB MET A 69 4.876 10.217 10.942 1.00 0.00 C ATOM 1007 CG MET A 69 5.353 11.524 11.553 1.00 0.00 C ATOM 1008 SD MET A 69 5.478 12.849 10.338 1.00 0.00 S ATOM 1009 CE MET A 69 6.976 12.366 9.487 1.00 0.00 C ATOM 0 H MET A 69 6.527 9.763 12.720 1.00 0.00 H new ATOM 0 HA MET A 69 3.788 9.262 12.547 1.00 0.00 H new ATOM 0 HB2 MET A 69 5.594 9.897 10.187 1.00 0.00 H new ATOM 0 HB3 MET A 69 3.930 10.391 10.428 1.00 0.00 H new ATOM 0 HG2 MET A 69 4.665 11.824 12.344 1.00 0.00 H new ATOM 0 HG3 MET A 69 6.326 11.370 12.019 1.00 0.00 H new ATOM 0 HE1 MET A 69 7.371 13.218 8.934 1.00 0.00 H new ATOM 0 HE2 MET A 69 7.716 12.031 10.214 1.00 0.00 H new ATOM 0 HE3 MET A 69 6.755 11.555 8.794 1.00 0.00 H new ATOM 1019 N LEU A 70 5.487 6.878 11.357 1.00 0.00 N ATOM 1020 CA LEU A 70 5.451 5.588 10.673 1.00 0.00 C ATOM 1021 C LEU A 70 4.369 4.698 11.257 1.00 0.00 C ATOM 1022 O LEU A 70 3.833 3.824 10.577 1.00 0.00 O ATOM 1023 CB LEU A 70 6.805 4.880 10.779 1.00 0.00 C ATOM 1024 CG LEU A 70 7.750 5.441 11.840 1.00 0.00 C ATOM 1025 CD1 LEU A 70 8.834 4.431 12.179 1.00 0.00 C ATOM 1026 CD2 LEU A 70 8.352 6.749 11.360 1.00 0.00 C ATOM 0 H LEU A 70 6.309 7.022 11.943 1.00 0.00 H new ATOM 0 HA LEU A 70 5.228 5.776 9.623 1.00 0.00 H new ATOM 0 HB2 LEU A 70 6.630 3.825 10.992 1.00 0.00 H new ATOM 0 HB3 LEU A 70 7.301 4.931 9.810 1.00 0.00 H new ATOM 0 HG LEU A 70 7.183 5.637 12.750 1.00 0.00 H new ATOM 0 HD11 LEU A 70 9.497 4.849 12.936 1.00 0.00 H new ATOM 0 HD12 LEU A 70 8.375 3.519 12.562 1.00 0.00 H new ATOM 0 HD13 LEU A 70 9.408 4.199 11.282 1.00 0.00 H new ATOM 0 HD21 LEU A 70 9.024 7.142 12.123 1.00 0.00 H new ATOM 0 HD22 LEU A 70 8.909 6.577 10.439 1.00 0.00 H new ATOM 0 HD23 LEU A 70 7.555 7.469 11.173 1.00 0.00 H new ATOM 1038 N GLY A 71 4.071 4.908 12.530 1.00 0.00 N ATOM 1039 CA GLY A 71 3.058 4.114 13.184 1.00 0.00 C ATOM 1040 C GLY A 71 2.291 4.900 14.226 1.00 0.00 C ATOM 1041 O GLY A 71 1.510 4.329 14.988 1.00 0.00 O ATOM 0 H GLY A 71 4.513 5.613 13.119 1.00 0.00 H new ATOM 0 HA2 GLY A 71 2.362 3.731 12.437 1.00 0.00 H new ATOM 0 HA3 GLY A 71 3.526 3.250 13.656 1.00 0.00 H new ATOM 1045 N GLU A 72 2.497 6.215 14.253 1.00 0.00 N ATOM 1046 CA GLU A 72 1.815 7.062 15.226 1.00 0.00 C ATOM 1047 C GLU A 72 1.073 8.217 14.558 1.00 0.00 C ATOM 1048 O GLU A 72 0.294 8.917 15.206 1.00 0.00 O ATOM 1049 CB GLU A 72 2.817 7.610 16.245 1.00 0.00 C ATOM 1050 CG GLU A 72 3.652 6.533 16.917 1.00 0.00 C ATOM 1051 CD GLU A 72 3.365 6.413 18.400 1.00 0.00 C ATOM 1052 OE1 GLU A 72 2.307 5.853 18.756 1.00 0.00 O ATOM 1053 OE2 GLU A 72 4.197 6.879 19.207 1.00 0.00 O ATOM 0 H GLU A 72 3.123 6.712 13.620 1.00 0.00 H new ATOM 0 HA GLU A 72 1.077 6.442 15.735 1.00 0.00 H new ATOM 0 HB2 GLU A 72 3.482 8.315 15.745 1.00 0.00 H new ATOM 0 HB3 GLU A 72 2.277 8.169 17.009 1.00 0.00 H new ATOM 0 HG2 GLU A 72 3.459 5.575 16.435 1.00 0.00 H new ATOM 0 HG3 GLU A 72 4.709 6.755 16.772 1.00 0.00 H new ATOM 1060 N ARG A 73 1.305 8.407 13.264 1.00 0.00 N ATOM 1061 CA ARG A 73 0.643 9.474 12.523 1.00 0.00 C ATOM 1062 C ARG A 73 -0.037 8.918 11.279 1.00 0.00 C ATOM 1063 O ARG A 73 -0.855 9.591 10.651 1.00 0.00 O ATOM 1064 CB ARG A 73 1.652 10.552 12.128 1.00 0.00 C ATOM 1065 CG ARG A 73 1.075 11.959 12.132 1.00 0.00 C ATOM 1066 CD ARG A 73 0.454 12.315 10.791 1.00 0.00 C ATOM 1067 NE ARG A 73 0.254 13.754 10.642 1.00 0.00 N ATOM 1068 CZ ARG A 73 -0.942 14.327 10.538 1.00 0.00 C ATOM 1069 NH1 ARG A 73 -2.041 13.585 10.567 1.00 0.00 N ATOM 1070 NH2 ARG A 73 -1.039 15.641 10.403 1.00 0.00 N ATOM 0 H ARG A 73 1.944 7.838 12.708 1.00 0.00 H new ATOM 0 HA ARG A 73 -0.115 9.919 13.167 1.00 0.00 H new ATOM 0 HB2 ARG A 73 2.498 10.514 12.814 1.00 0.00 H new ATOM 0 HB3 ARG A 73 2.037 10.330 11.133 1.00 0.00 H new ATOM 0 HG2 ARG A 73 0.322 12.041 12.915 1.00 0.00 H new ATOM 0 HG3 ARG A 73 1.862 12.675 12.370 1.00 0.00 H new ATOM 0 HD2 ARG A 73 1.096 11.954 9.988 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -0.503 11.804 10.688 1.00 0.00 H new ATOM 0 HE ARG A 73 1.079 14.354 10.616 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -1.970 12.573 10.669 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -2.957 14.027 10.487 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -0.196 16.215 10.379 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -1.957 16.079 10.323 1.00 0.00 H new ATOM 1084 N LEU A 74 0.294 7.678 10.943 1.00 0.00 N ATOM 1085 CA LEU A 74 -0.267 7.026 9.770 1.00 0.00 C ATOM 1086 C LEU A 74 -1.683 6.537 10.016 1.00 0.00 C ATOM 1087 O LEU A 74 -2.395 6.199 9.074 1.00 0.00 O ATOM 1088 CB LEU A 74 0.593 5.837 9.377 1.00 0.00 C ATOM 1089 CG LEU A 74 1.409 6.033 8.119 1.00 0.00 C ATOM 1090 CD1 LEU A 74 2.758 5.363 8.275 1.00 0.00 C ATOM 1091 CD2 LEU A 74 0.655 5.500 6.913 1.00 0.00 C ATOM 0 H LEU A 74 0.951 7.103 11.470 1.00 0.00 H new ATOM 0 HA LEU A 74 -0.288 7.766 8.970 1.00 0.00 H new ATOM 0 HB2 LEU A 74 1.270 5.608 10.200 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -0.052 4.968 9.243 1.00 0.00 H new ATOM 0 HG LEU A 74 1.576 7.098 7.956 1.00 0.00 H new ATOM 0 HD11 LEU A 74 3.343 5.507 7.366 1.00 0.00 H new ATOM 0 HD12 LEU A 74 3.287 5.803 9.120 1.00 0.00 H new ATOM 0 HD13 LEU A 74 2.616 4.297 8.451 1.00 0.00 H new ATOM 0 HD21 LEU A 74 1.254 5.648 6.015 1.00 0.00 H new ATOM 0 HD22 LEU A 74 0.459 4.436 7.047 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -0.290 6.033 6.810 1.00 0.00 H new ATOM 1103 N PHE A 75 -2.064 6.441 11.281 1.00 0.00 N ATOM 1104 CA PHE A 75 -3.384 5.933 11.638 1.00 0.00 C ATOM 1105 C PHE A 75 -4.493 6.580 10.797 1.00 0.00 C ATOM 1106 O PHE A 75 -5.276 5.873 10.163 1.00 0.00 O ATOM 1107 CB PHE A 75 -3.658 6.133 13.133 1.00 0.00 C ATOM 1108 CG PHE A 75 -5.057 5.763 13.540 1.00 0.00 C ATOM 1109 CD1 PHE A 75 -5.672 4.634 13.017 1.00 0.00 C ATOM 1110 CD2 PHE A 75 -5.760 6.549 14.438 1.00 0.00 C ATOM 1111 CE1 PHE A 75 -6.964 4.305 13.378 1.00 0.00 C ATOM 1112 CE2 PHE A 75 -7.050 6.219 14.809 1.00 0.00 C ATOM 1113 CZ PHE A 75 -7.651 5.093 14.281 1.00 0.00 C ATOM 0 H PHE A 75 -1.482 6.706 12.076 1.00 0.00 H new ATOM 0 HA PHE A 75 -3.388 4.865 11.421 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -2.951 5.535 13.707 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -3.477 7.176 13.391 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -5.135 4.007 12.321 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -5.295 7.431 14.853 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -7.437 3.432 12.954 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -7.587 6.840 15.510 1.00 0.00 H new ATOM 0 HZ PHE A 75 -8.657 4.829 14.574 1.00 0.00 H new ATOM 1123 N PRO A 76 -4.585 7.927 10.766 1.00 0.00 N ATOM 1124 CA PRO A 76 -5.619 8.621 9.990 1.00 0.00 C ATOM 1125 C PRO A 76 -5.456 8.406 8.488 1.00 0.00 C ATOM 1126 O PRO A 76 -6.326 8.775 7.700 1.00 0.00 O ATOM 1127 CB PRO A 76 -5.417 10.102 10.336 1.00 0.00 C ATOM 1128 CG PRO A 76 -4.565 10.109 11.562 1.00 0.00 C ATOM 1129 CD PRO A 76 -3.714 8.876 11.479 1.00 0.00 C ATOM 0 HA PRO A 76 -6.615 8.250 10.233 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -4.932 10.634 9.518 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -6.371 10.597 10.517 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -3.948 11.007 11.604 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -5.178 10.101 12.463 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -2.787 9.060 10.937 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -3.438 8.508 12.467 1.00 0.00 H new ATOM 1137 N LEU A 77 -4.333 7.809 8.101 1.00 0.00 N ATOM 1138 CA LEU A 77 -4.043 7.565 6.693 1.00 0.00 C ATOM 1139 C LEU A 77 -4.432 6.150 6.271 1.00 0.00 C ATOM 1140 O LEU A 77 -4.927 5.947 5.163 1.00 0.00 O ATOM 1141 CB LEU A 77 -2.555 7.800 6.408 1.00 0.00 C ATOM 1142 CG LEU A 77 -2.111 9.267 6.338 1.00 0.00 C ATOM 1143 CD1 LEU A 77 -3.196 10.150 5.734 1.00 0.00 C ATOM 1144 CD2 LEU A 77 -1.724 9.759 7.718 1.00 0.00 C ATOM 0 H LEU A 77 -3.609 7.485 8.743 1.00 0.00 H new ATOM 0 HA LEU A 77 -4.641 8.266 6.111 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.973 7.301 7.183 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -2.305 7.319 5.462 1.00 0.00 H new ATOM 0 HG LEU A 77 -1.241 9.328 5.685 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -2.848 11.182 5.700 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -3.422 9.809 4.723 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -4.096 10.091 6.346 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -1.410 10.801 7.658 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.580 9.676 8.387 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -0.903 9.154 8.103 1.00 0.00 H new ATOM 1156 N ILE A 78 -4.195 5.168 7.142 1.00 0.00 N ATOM 1157 CA ILE A 78 -4.527 3.782 6.818 1.00 0.00 C ATOM 1158 C ILE A 78 -6.015 3.630 6.553 1.00 0.00 C ATOM 1159 O ILE A 78 -6.420 2.910 5.644 1.00 0.00 O ATOM 1160 CB ILE A 78 -4.145 2.793 7.928 1.00 0.00 C ATOM 1161 CG1 ILE A 78 -2.853 3.219 8.630 1.00 0.00 C ATOM 1162 CG2 ILE A 78 -4.020 1.395 7.339 1.00 0.00 C ATOM 1163 CD1 ILE A 78 -1.620 3.096 7.767 1.00 0.00 C ATOM 0 H ILE A 78 -3.780 5.304 8.064 1.00 0.00 H new ATOM 0 HA ILE A 78 -3.945 3.546 5.927 1.00 0.00 H new ATOM 0 HB ILE A 78 -4.930 2.788 8.684 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -2.953 4.254 8.958 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -2.720 2.612 9.525 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -3.749 0.691 8.126 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -4.973 1.099 6.900 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -3.249 1.392 6.569 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -0.746 3.416 8.334 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -1.493 2.058 7.460 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -1.730 3.725 6.884 1.00 0.00 H new ATOM 1175 N GLN A 79 -6.824 4.294 7.374 1.00 0.00 N ATOM 1176 CA GLN A 79 -8.276 4.242 7.235 1.00 0.00 C ATOM 1177 C GLN A 79 -8.687 4.493 5.786 1.00 0.00 C ATOM 1178 O GLN A 79 -9.789 4.142 5.365 1.00 0.00 O ATOM 1179 CB GLN A 79 -8.927 5.284 8.146 1.00 0.00 C ATOM 1180 CG GLN A 79 -9.407 4.720 9.473 1.00 0.00 C ATOM 1181 CD GLN A 79 -9.585 5.789 10.531 1.00 0.00 C ATOM 1182 OE1 GLN A 79 -10.670 5.951 11.091 1.00 0.00 O ATOM 1183 NE2 GLN A 79 -8.518 6.528 10.811 1.00 0.00 N ATOM 0 H GLN A 79 -6.497 4.876 8.145 1.00 0.00 H new ATOM 0 HA GLN A 79 -8.615 3.248 7.526 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -8.211 6.083 8.339 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -9.773 5.732 7.624 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -10.354 4.202 9.322 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -8.692 3.978 9.828 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -7.638 6.359 10.323 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -8.578 7.264 11.514 1.00 0.00 H new ATOM 1192 N ALA A 80 -7.781 5.107 5.034 1.00 0.00 N ATOM 1193 CA ALA A 80 -8.005 5.395 3.623 1.00 0.00 C ATOM 1194 C ALA A 80 -7.690 4.175 2.763 1.00 0.00 C ATOM 1195 O ALA A 80 -8.426 3.851 1.831 1.00 0.00 O ATOM 1196 CB ALA A 80 -7.147 6.573 3.188 1.00 0.00 C ATOM 0 H ALA A 80 -6.875 5.418 5.383 1.00 0.00 H new ATOM 0 HA ALA A 80 -9.057 5.648 3.488 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -7.322 6.780 2.132 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -7.409 7.451 3.778 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -6.095 6.333 3.341 1.00 0.00 H new ATOM 1202 N MET A 81 -6.576 3.518 3.075 1.00 0.00 N ATOM 1203 CA MET A 81 -6.154 2.327 2.343 1.00 0.00 C ATOM 1204 C MET A 81 -7.115 1.177 2.598 1.00 0.00 C ATOM 1205 O MET A 81 -7.438 0.401 1.698 1.00 0.00 O ATOM 1206 CB MET A 81 -4.746 1.913 2.783 1.00 0.00 C ATOM 1207 CG MET A 81 -3.826 3.089 3.057 1.00 0.00 C ATOM 1208 SD MET A 81 -2.253 2.954 2.190 1.00 0.00 S ATOM 1209 CE MET A 81 -1.265 2.140 3.439 1.00 0.00 C ATOM 0 H MET A 81 -5.948 3.791 3.831 1.00 0.00 H new ATOM 0 HA MET A 81 -6.152 2.562 1.279 1.00 0.00 H new ATOM 0 HB2 MET A 81 -4.820 1.303 3.683 1.00 0.00 H new ATOM 0 HB3 MET A 81 -4.302 1.287 2.009 1.00 0.00 H new ATOM 0 HG2 MET A 81 -4.323 4.012 2.758 1.00 0.00 H new ATOM 0 HG3 MET A 81 -3.641 3.159 4.129 1.00 0.00 H new ATOM 0 HE1 MET A 81 -0.263 2.568 3.446 1.00 0.00 H new ATOM 0 HE2 MET A 81 -1.727 2.280 4.416 1.00 0.00 H new ATOM 0 HE3 MET A 81 -1.203 1.075 3.217 1.00 0.00 H new ATOM 1219 N HIS A 82 -7.533 1.060 3.850 1.00 0.00 N ATOM 1220 CA HIS A 82 -8.409 -0.014 4.285 1.00 0.00 C ATOM 1221 C HIS A 82 -9.675 0.551 4.916 1.00 0.00 C ATOM 1222 O HIS A 82 -9.626 1.585 5.578 1.00 0.00 O ATOM 1223 CB HIS A 82 -7.659 -0.881 5.299 1.00 0.00 C ATOM 1224 CG HIS A 82 -6.236 -1.129 4.923 1.00 0.00 C ATOM 1225 ND1 HIS A 82 -5.247 -1.139 5.864 1.00 0.00 N ATOM 1226 CD2 HIS A 82 -5.695 -1.380 3.709 1.00 0.00 C ATOM 1227 CE1 HIS A 82 -4.128 -1.361 5.207 1.00 0.00 C ATOM 1228 NE2 HIS A 82 -4.352 -1.536 3.901 1.00 0.00 N ATOM 0 H HIS A 82 -7.273 1.709 4.593 1.00 0.00 H new ATOM 0 HA HIS A 82 -8.699 -0.616 3.424 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -7.691 -0.397 6.275 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -8.173 -1.837 5.400 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -6.223 -1.445 2.769 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -3.151 -1.397 5.666 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -3.655 -1.745 3.186 1.00 0.00 H new ATOM 1236 N PRO A 83 -10.833 -0.109 4.712 1.00 0.00 N ATOM 1237 CA PRO A 83 -12.109 0.343 5.281 1.00 0.00 C ATOM 1238 C PRO A 83 -12.030 0.491 6.796 1.00 0.00 C ATOM 1239 O PRO A 83 -12.430 -0.408 7.537 1.00 0.00 O ATOM 1240 CB PRO A 83 -13.092 -0.767 4.898 1.00 0.00 C ATOM 1241 CG PRO A 83 -12.470 -1.443 3.725 1.00 0.00 C ATOM 1242 CD PRO A 83 -10.986 -1.352 3.935 1.00 0.00 C ATOM 0 HA PRO A 83 -12.402 1.324 4.907 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -13.241 -1.464 5.722 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -14.070 -0.358 4.645 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -12.792 -2.482 3.658 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -12.763 -0.958 2.794 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -10.602 -2.216 4.477 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -10.447 -1.305 2.989 1.00 0.00 H new ATOM 1250 N THR A 84 -11.488 1.627 7.242 1.00 0.00 N ATOM 1251 CA THR A 84 -11.300 1.909 8.665 1.00 0.00 C ATOM 1252 C THR A 84 -10.800 0.672 9.415 1.00 0.00 C ATOM 1253 O THR A 84 -11.075 0.496 10.602 1.00 0.00 O ATOM 1254 CB THR A 84 -12.599 2.432 9.293 1.00 0.00 C ATOM 1255 OG1 THR A 84 -12.347 2.978 10.576 1.00 0.00 O ATOM 1256 CG2 THR A 84 -13.678 1.381 9.446 1.00 0.00 C ATOM 0 H THR A 84 -11.168 2.375 6.627 1.00 0.00 H new ATOM 0 HA THR A 84 -10.539 2.684 8.751 1.00 0.00 H new ATOM 0 HB THR A 84 -12.962 3.189 8.597 1.00 0.00 H new ATOM 0 HG1 THR A 84 -11.785 2.361 11.089 1.00 0.00 H new ATOM 0 HG21 THR A 84 -14.563 1.831 9.897 1.00 0.00 H new ATOM 0 HG22 THR A 84 -13.935 0.978 8.466 1.00 0.00 H new ATOM 0 HG23 THR A 84 -13.314 0.576 10.085 1.00 0.00 H new ATOM 1264 N LEU A 85 -10.050 -0.172 8.709 1.00 0.00 N ATOM 1265 CA LEU A 85 -9.511 -1.395 9.294 1.00 0.00 C ATOM 1266 C LEU A 85 -8.258 -1.106 10.109 1.00 0.00 C ATOM 1267 O LEU A 85 -7.650 -2.016 10.674 1.00 0.00 O ATOM 1268 CB LEU A 85 -9.192 -2.408 8.195 1.00 0.00 C ATOM 1269 CG LEU A 85 -10.024 -3.693 8.232 1.00 0.00 C ATOM 1270 CD1 LEU A 85 -11.489 -3.390 7.959 1.00 0.00 C ATOM 1271 CD2 LEU A 85 -9.488 -4.702 7.228 1.00 0.00 C ATOM 0 H LEU A 85 -9.802 -0.030 7.730 1.00 0.00 H new ATOM 0 HA LEU A 85 -10.266 -1.811 9.961 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -9.337 -1.928 7.227 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.137 -2.675 8.264 1.00 0.00 H new ATOM 0 HG LEU A 85 -9.946 -4.126 9.229 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -12.064 -4.316 7.990 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -11.866 -2.704 8.717 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -11.589 -2.933 6.974 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -10.091 -5.609 7.267 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -9.536 -4.278 6.225 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -8.453 -4.943 7.471 1.00 0.00 H new ATOM 1283 N ALA A 86 -7.876 0.165 10.162 1.00 0.00 N ATOM 1284 CA ALA A 86 -6.699 0.583 10.917 1.00 0.00 C ATOM 1285 C ALA A 86 -6.921 0.380 12.417 1.00 0.00 C ATOM 1286 O ALA A 86 -7.484 -0.630 12.837 1.00 0.00 O ATOM 1287 CB ALA A 86 -6.367 2.036 10.605 1.00 0.00 C ATOM 0 H ALA A 86 -8.365 0.926 9.690 1.00 0.00 H new ATOM 0 HA ALA A 86 -5.852 -0.035 10.619 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -5.487 2.338 11.173 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -6.165 2.142 9.539 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -7.211 2.669 10.879 1.00 0.00 H new ATOM 1293 N GLY A 87 -6.479 1.343 13.222 1.00 0.00 N ATOM 1294 CA GLY A 87 -6.631 1.229 14.660 1.00 0.00 C ATOM 1295 C GLY A 87 -5.573 0.336 15.269 1.00 0.00 C ATOM 1296 O GLY A 87 -5.446 0.251 16.492 1.00 0.00 O ATOM 0 H GLY A 87 -6.020 2.197 12.904 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -6.574 2.220 15.111 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -7.619 0.831 14.890 1.00 0.00 H new ATOM 1300 N LYS A 88 -4.811 -0.325 14.407 1.00 0.00 N ATOM 1301 CA LYS A 88 -3.747 -1.217 14.850 1.00 0.00 C ATOM 1302 C LYS A 88 -2.744 -1.490 13.732 1.00 0.00 C ATOM 1303 O LYS A 88 -1.592 -1.817 14.002 1.00 0.00 O ATOM 1304 CB LYS A 88 -4.330 -2.540 15.351 1.00 0.00 C ATOM 1305 CG LYS A 88 -3.276 -3.596 15.648 1.00 0.00 C ATOM 1306 CD LYS A 88 -2.457 -3.239 16.879 1.00 0.00 C ATOM 1307 CE LYS A 88 -0.965 -3.287 16.589 1.00 0.00 C ATOM 1308 NZ LYS A 88 -0.162 -3.468 17.830 1.00 0.00 N ATOM 0 H LYS A 88 -4.910 -0.260 13.394 1.00 0.00 H new ATOM 0 HA LYS A 88 -3.224 -0.720 15.667 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -4.910 -2.353 16.255 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -5.022 -2.929 14.604 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -3.760 -4.561 15.799 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -2.614 -3.702 14.788 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -2.730 -2.241 17.222 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -2.694 -3.930 17.688 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -0.756 -4.105 15.899 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -0.662 -2.365 16.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 0.698 -2.886 17.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -0.725 -3.175 18.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 0.103 -4.469 17.929 1.00 0.00 H new ATOM 1322 N ILE A 89 -3.184 -1.375 12.478 1.00 0.00 N ATOM 1323 CA ILE A 89 -2.317 -1.653 11.344 1.00 0.00 C ATOM 1324 C ILE A 89 -0.976 -0.934 11.470 1.00 0.00 C ATOM 1325 O ILE A 89 0.020 -1.537 11.862 1.00 0.00 O ATOM 1326 CB ILE A 89 -2.980 -1.267 10.011 1.00 0.00 C ATOM 1327 CG1 ILE A 89 -4.325 -1.988 9.869 1.00 0.00 C ATOM 1328 CG2 ILE A 89 -2.054 -1.611 8.856 1.00 0.00 C ATOM 1329 CD1 ILE A 89 -5.205 -1.439 8.767 1.00 0.00 C ATOM 0 H ILE A 89 -4.132 -1.092 12.228 1.00 0.00 H new ATOM 0 HA ILE A 89 -2.142 -2.729 11.349 1.00 0.00 H new ATOM 0 HB ILE A 89 -3.165 -0.193 9.995 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -4.140 -3.045 9.680 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -4.862 -1.923 10.815 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -2.529 -1.335 7.914 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -1.118 -1.063 8.964 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -1.850 -2.682 8.860 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -6.137 -2.002 8.731 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -5.423 -0.389 8.964 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -4.690 -1.529 7.811 1.00 0.00 H new ATOM 1341 N THR A 90 -0.954 0.351 11.133 1.00 0.00 N ATOM 1342 CA THR A 90 0.269 1.146 11.209 1.00 0.00 C ATOM 1343 C THR A 90 0.853 1.114 12.617 1.00 0.00 C ATOM 1344 O THR A 90 2.071 1.051 12.789 1.00 0.00 O ATOM 1345 CB THR A 90 -0.029 2.581 10.767 1.00 0.00 C ATOM 1346 OG1 THR A 90 0.769 2.926 9.649 1.00 0.00 O ATOM 1347 CG2 THR A 90 0.191 3.632 11.835 1.00 0.00 C ATOM 0 H THR A 90 -1.770 0.866 10.804 1.00 0.00 H new ATOM 0 HA THR A 90 1.015 0.718 10.539 1.00 0.00 H new ATOM 0 HB THR A 90 -1.092 2.581 10.526 1.00 0.00 H new ATOM 0 HG1 THR A 90 1.706 2.997 9.926 1.00 0.00 H new ATOM 0 HG21 THR A 90 -0.045 4.616 11.431 1.00 0.00 H new ATOM 0 HG22 THR A 90 -0.456 3.425 12.688 1.00 0.00 H new ATOM 0 HG23 THR A 90 1.232 3.612 12.156 1.00 0.00 H new ATOM 1355 N GLY A 91 -0.017 1.149 13.622 1.00 0.00 N ATOM 1356 CA GLY A 91 0.448 1.060 14.992 1.00 0.00 C ATOM 1357 C GLY A 91 1.252 -0.203 15.199 1.00 0.00 C ATOM 1358 O GLY A 91 2.171 -0.250 16.018 1.00 0.00 O ATOM 0 H GLY A 91 -1.027 1.237 13.513 1.00 0.00 H new ATOM 0 HA2 GLY A 91 1.059 1.930 15.232 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -0.403 1.071 15.672 1.00 0.00 H new ATOM 1362 N MET A 92 0.920 -1.220 14.411 1.00 0.00 N ATOM 1363 CA MET A 92 1.635 -2.487 14.446 1.00 0.00 C ATOM 1364 C MET A 92 2.950 -2.355 13.708 1.00 0.00 C ATOM 1365 O MET A 92 3.949 -2.964 14.076 1.00 0.00 O ATOM 1366 CB MET A 92 0.811 -3.593 13.788 1.00 0.00 C ATOM 1367 CG MET A 92 1.002 -4.951 14.440 1.00 0.00 C ATOM 1368 SD MET A 92 -0.489 -5.961 14.409 1.00 0.00 S ATOM 1369 CE MET A 92 -0.813 -6.023 12.649 1.00 0.00 C ATOM 0 H MET A 92 0.155 -1.189 13.737 1.00 0.00 H new ATOM 0 HA MET A 92 1.814 -2.746 15.489 1.00 0.00 H new ATOM 0 HB2 MET A 92 -0.244 -3.323 13.828 1.00 0.00 H new ATOM 0 HB3 MET A 92 1.083 -3.662 12.735 1.00 0.00 H new ATOM 0 HG2 MET A 92 1.805 -5.483 13.931 1.00 0.00 H new ATOM 0 HG3 MET A 92 1.318 -4.811 15.474 1.00 0.00 H new ATOM 0 HE1 MET A 92 -1.310 -6.961 12.403 1.00 0.00 H new ATOM 0 HE2 MET A 92 -1.455 -5.188 12.368 1.00 0.00 H new ATOM 0 HE3 MET A 92 0.128 -5.957 12.103 1.00 0.00 H new ATOM 1379 N LEU A 93 2.923 -1.545 12.661 1.00 0.00 N ATOM 1380 CA LEU A 93 4.084 -1.326 11.816 1.00 0.00 C ATOM 1381 C LEU A 93 5.263 -0.780 12.610 1.00 0.00 C ATOM 1382 O LEU A 93 6.377 -0.675 12.095 1.00 0.00 O ATOM 1383 CB LEU A 93 3.711 -0.375 10.692 1.00 0.00 C ATOM 1384 CG LEU A 93 3.138 -1.052 9.443 1.00 0.00 C ATOM 1385 CD1 LEU A 93 4.202 -1.908 8.774 1.00 0.00 C ATOM 1386 CD2 LEU A 93 1.918 -1.891 9.799 1.00 0.00 C ATOM 0 H LEU A 93 2.096 -1.022 12.374 1.00 0.00 H new ATOM 0 HA LEU A 93 4.395 -2.284 11.399 1.00 0.00 H new ATOM 0 HB2 LEU A 93 2.980 0.341 11.068 1.00 0.00 H new ATOM 0 HB3 LEU A 93 4.596 0.193 10.407 1.00 0.00 H new ATOM 0 HG LEU A 93 2.824 -0.279 8.742 1.00 0.00 H new ATOM 0 HD11 LEU A 93 3.782 -2.384 7.888 1.00 0.00 H new ATOM 0 HD12 LEU A 93 5.045 -1.280 8.484 1.00 0.00 H new ATOM 0 HD13 LEU A 93 4.543 -2.674 9.470 1.00 0.00 H new ATOM 0 HD21 LEU A 93 1.526 -2.363 8.898 1.00 0.00 H new ATOM 0 HD22 LEU A 93 2.202 -2.660 10.518 1.00 0.00 H new ATOM 0 HD23 LEU A 93 1.151 -1.251 10.236 1.00 0.00 H new ATOM 1398 N LEU A 94 5.016 -0.439 13.867 1.00 0.00 N ATOM 1399 CA LEU A 94 6.070 0.024 14.749 1.00 0.00 C ATOM 1400 C LEU A 94 6.371 -1.061 15.771 1.00 0.00 C ATOM 1401 O LEU A 94 6.786 -0.783 16.896 1.00 0.00 O ATOM 1402 CB LEU A 94 5.652 1.319 15.444 1.00 0.00 C ATOM 1403 CG LEU A 94 6.237 2.600 14.836 1.00 0.00 C ATOM 1404 CD1 LEU A 94 6.002 2.638 13.332 1.00 0.00 C ATOM 1405 CD2 LEU A 94 5.637 3.827 15.506 1.00 0.00 C ATOM 0 H LEU A 94 4.092 -0.476 14.297 1.00 0.00 H new ATOM 0 HA LEU A 94 6.969 0.231 14.168 1.00 0.00 H new ATOM 0 HB2 LEU A 94 4.564 1.389 15.424 1.00 0.00 H new ATOM 0 HB3 LEU A 94 5.949 1.264 16.491 1.00 0.00 H new ATOM 0 HG LEU A 94 7.313 2.604 15.011 1.00 0.00 H new ATOM 0 HD11 LEU A 94 6.425 3.555 12.921 1.00 0.00 H new ATOM 0 HD12 LEU A 94 6.482 1.777 12.867 1.00 0.00 H new ATOM 0 HD13 LEU A 94 4.931 2.610 13.130 1.00 0.00 H new ATOM 0 HD21 LEU A 94 6.062 4.728 15.063 1.00 0.00 H new ATOM 0 HD22 LEU A 94 4.556 3.828 15.363 1.00 0.00 H new ATOM 0 HD23 LEU A 94 5.862 3.806 16.572 1.00 0.00 H new ATOM 1417 N GLU A 95 6.122 -2.305 15.365 1.00 0.00 N ATOM 1418 CA GLU A 95 6.328 -3.458 16.233 1.00 0.00 C ATOM 1419 C GLU A 95 6.168 -4.773 15.467 1.00 0.00 C ATOM 1420 O GLU A 95 6.276 -5.851 16.053 1.00 0.00 O ATOM 1421 CB GLU A 95 5.341 -3.418 17.405 1.00 0.00 C ATOM 1422 CG GLU A 95 3.931 -3.854 17.035 1.00 0.00 C ATOM 1423 CD GLU A 95 3.059 -4.101 18.251 1.00 0.00 C ATOM 1424 OE1 GLU A 95 2.801 -3.137 19.003 1.00 0.00 O ATOM 1425 OE2 GLU A 95 2.635 -5.259 18.451 1.00 0.00 O ATOM 0 H GLU A 95 5.775 -2.538 14.435 1.00 0.00 H new ATOM 0 HA GLU A 95 7.348 -3.409 16.613 1.00 0.00 H new ATOM 0 HB2 GLU A 95 5.713 -4.061 18.203 1.00 0.00 H new ATOM 0 HB3 GLU A 95 5.305 -2.404 17.803 1.00 0.00 H new ATOM 0 HG2 GLU A 95 3.470 -3.088 16.411 1.00 0.00 H new ATOM 0 HG3 GLU A 95 3.981 -4.764 16.437 1.00 0.00 H new ATOM 1432 N ILE A 96 5.941 -4.683 14.155 1.00 0.00 N ATOM 1433 CA ILE A 96 5.762 -5.883 13.328 1.00 0.00 C ATOM 1434 C ILE A 96 7.018 -6.755 13.311 1.00 0.00 C ATOM 1435 O ILE A 96 7.825 -6.733 14.240 1.00 0.00 O ATOM 1436 CB ILE A 96 5.418 -5.546 11.856 1.00 0.00 C ATOM 1437 CG1 ILE A 96 6.575 -4.808 11.174 1.00 0.00 C ATOM 1438 CG2 ILE A 96 4.130 -4.752 11.747 1.00 0.00 C ATOM 1439 CD1 ILE A 96 6.933 -3.490 11.813 1.00 0.00 C ATOM 0 H ILE A 96 5.877 -3.802 13.644 1.00 0.00 H new ATOM 0 HA ILE A 96 4.931 -6.418 13.787 1.00 0.00 H new ATOM 0 HB ILE A 96 5.264 -6.491 11.336 1.00 0.00 H new ATOM 0 HG12 ILE A 96 7.455 -5.452 11.179 1.00 0.00 H new ATOM 0 HG13 ILE A 96 6.314 -4.633 10.130 1.00 0.00 H new ATOM 0 HG21 ILE A 96 3.924 -4.536 10.699 1.00 0.00 H new ATOM 0 HG22 ILE A 96 3.308 -5.332 12.166 1.00 0.00 H new ATOM 0 HG23 ILE A 96 4.231 -3.817 12.297 1.00 0.00 H new ATOM 0 HD11 ILE A 96 7.760 -3.035 11.269 1.00 0.00 H new ATOM 0 HD12 ILE A 96 6.070 -2.825 11.784 1.00 0.00 H new ATOM 0 HD13 ILE A 96 7.228 -3.656 12.849 1.00 0.00 H new ATOM 1451 N ASP A 97 7.181 -7.500 12.217 1.00 0.00 N ATOM 1452 CA ASP A 97 8.335 -8.364 12.017 1.00 0.00 C ATOM 1453 C ASP A 97 9.638 -7.567 12.043 1.00 0.00 C ATOM 1454 O ASP A 97 10.723 -8.135 11.913 1.00 0.00 O ATOM 1455 CB ASP A 97 8.195 -9.087 10.678 1.00 0.00 C ATOM 1456 CG ASP A 97 8.862 -10.448 10.677 1.00 0.00 C ATOM 1457 OD1 ASP A 97 8.408 -11.332 11.433 1.00 0.00 O ATOM 1458 OD2 ASP A 97 9.838 -10.631 9.919 1.00 0.00 O ATOM 0 H ASP A 97 6.513 -7.518 11.446 1.00 0.00 H new ATOM 0 HA ASP A 97 8.371 -9.088 12.831 1.00 0.00 H new ATOM 0 HB2 ASP A 97 7.137 -9.205 10.442 1.00 0.00 H new ATOM 0 HB3 ASP A 97 8.631 -8.472 9.890 1.00 0.00 H new ATOM 1463 N ASN A 98 9.508 -6.247 12.187 1.00 0.00 N ATOM 1464 CA ASN A 98 10.649 -5.334 12.235 1.00 0.00 C ATOM 1465 C ASN A 98 11.205 -5.065 10.843 1.00 0.00 C ATOM 1466 O ASN A 98 11.731 -3.985 10.575 1.00 0.00 O ATOM 1467 CB ASN A 98 11.753 -5.869 13.155 1.00 0.00 C ATOM 1468 CG ASN A 98 11.675 -5.284 14.551 1.00 0.00 C ATOM 1469 OD1 ASN A 98 11.515 -4.077 14.724 1.00 0.00 O ATOM 1470 ND2 ASN A 98 11.788 -6.143 15.558 1.00 0.00 N ATOM 0 H ASN A 98 8.605 -5.781 12.274 1.00 0.00 H new ATOM 0 HA ASN A 98 10.288 -4.391 12.646 1.00 0.00 H new ATOM 0 HB2 ASN A 98 11.678 -6.955 13.214 1.00 0.00 H new ATOM 0 HB3 ASN A 98 12.726 -5.640 12.722 1.00 0.00 H new ATOM 0 HD21 ASN A 98 11.743 -5.809 16.521 1.00 0.00 H new ATOM 0 HD22 ASN A 98 11.920 -7.137 15.368 1.00 0.00 H new ATOM 1477 N SER A 99 11.076 -6.043 9.955 1.00 0.00 N ATOM 1478 CA SER A 99 11.532 -5.883 8.581 1.00 0.00 C ATOM 1479 C SER A 99 10.590 -4.951 7.829 1.00 0.00 C ATOM 1480 O SER A 99 11.007 -4.206 6.944 1.00 0.00 O ATOM 1481 CB SER A 99 11.609 -7.235 7.873 1.00 0.00 C ATOM 1482 OG SER A 99 12.088 -8.243 8.746 1.00 0.00 O ATOM 0 H SER A 99 10.661 -6.952 10.161 1.00 0.00 H new ATOM 0 HA SER A 99 12.532 -5.449 8.596 1.00 0.00 H new ATOM 0 HB2 SER A 99 10.622 -7.511 7.501 1.00 0.00 H new ATOM 0 HB3 SER A 99 12.266 -7.158 7.007 1.00 0.00 H new ATOM 0 HG SER A 99 12.126 -9.098 8.269 1.00 0.00 H new ATOM 1488 N GLU A 100 9.318 -4.991 8.211 1.00 0.00 N ATOM 1489 CA GLU A 100 8.310 -4.121 7.622 1.00 0.00 C ATOM 1490 C GLU A 100 8.450 -2.718 8.185 1.00 0.00 C ATOM 1491 O GLU A 100 8.052 -1.743 7.554 1.00 0.00 O ATOM 1492 CB GLU A 100 6.912 -4.675 7.884 1.00 0.00 C ATOM 1493 CG GLU A 100 6.868 -6.193 7.911 1.00 0.00 C ATOM 1494 CD GLU A 100 5.818 -6.765 6.977 1.00 0.00 C ATOM 1495 OE1 GLU A 100 4.764 -6.120 6.803 1.00 0.00 O ATOM 1496 OE2 GLU A 100 6.052 -7.859 6.422 1.00 0.00 O ATOM 0 H GLU A 100 8.961 -5.620 8.930 1.00 0.00 H new ATOM 0 HA GLU A 100 8.460 -4.080 6.543 1.00 0.00 H new ATOM 0 HB2 GLU A 100 6.548 -4.290 8.836 1.00 0.00 H new ATOM 0 HB3 GLU A 100 6.233 -4.311 7.113 1.00 0.00 H new ATOM 0 HG2 GLU A 100 7.847 -6.586 7.635 1.00 0.00 H new ATOM 0 HG3 GLU A 100 6.665 -6.529 8.928 1.00 0.00 H new ATOM 1503 N LEU A 101 9.050 -2.628 9.370 1.00 0.00 N ATOM 1504 CA LEU A 101 9.307 -1.342 10.002 1.00 0.00 C ATOM 1505 C LEU A 101 10.478 -0.648 9.317 1.00 0.00 C ATOM 1506 O LEU A 101 10.609 0.571 9.374 1.00 0.00 O ATOM 1507 CB LEU A 101 9.610 -1.532 11.493 1.00 0.00 C ATOM 1508 CG LEU A 101 10.218 -0.316 12.198 1.00 0.00 C ATOM 1509 CD1 LEU A 101 9.243 0.251 13.218 1.00 0.00 C ATOM 1510 CD2 LEU A 101 11.533 -0.690 12.864 1.00 0.00 C ATOM 0 H LEU A 101 9.367 -3.433 9.910 1.00 0.00 H new ATOM 0 HA LEU A 101 8.417 -0.720 9.902 1.00 0.00 H new ATOM 0 HB2 LEU A 101 8.685 -1.802 12.003 1.00 0.00 H new ATOM 0 HB3 LEU A 101 10.293 -2.374 11.604 1.00 0.00 H new ATOM 0 HG LEU A 101 10.418 0.452 11.451 1.00 0.00 H new ATOM 0 HD11 LEU A 101 9.692 1.114 13.709 1.00 0.00 H new ATOM 0 HD12 LEU A 101 8.326 0.556 12.714 1.00 0.00 H new ATOM 0 HD13 LEU A 101 9.012 -0.511 13.963 1.00 0.00 H new ATOM 0 HD21 LEU A 101 11.951 0.186 13.360 1.00 0.00 H new ATOM 0 HD22 LEU A 101 11.358 -1.475 13.600 1.00 0.00 H new ATOM 0 HD23 LEU A 101 12.233 -1.049 12.110 1.00 0.00 H new ATOM 1522 N LEU A 102 11.331 -1.442 8.677 1.00 0.00 N ATOM 1523 CA LEU A 102 12.505 -0.917 7.989 1.00 0.00 C ATOM 1524 C LEU A 102 12.197 -0.601 6.533 1.00 0.00 C ATOM 1525 O LEU A 102 12.591 0.445 6.019 1.00 0.00 O ATOM 1526 CB LEU A 102 13.650 -1.927 8.057 1.00 0.00 C ATOM 1527 CG LEU A 102 14.730 -1.617 9.097 1.00 0.00 C ATOM 1528 CD1 LEU A 102 14.213 -1.890 10.502 1.00 0.00 C ATOM 1529 CD2 LEU A 102 15.984 -2.432 8.820 1.00 0.00 C ATOM 0 H LEU A 102 11.230 -2.455 8.621 1.00 0.00 H new ATOM 0 HA LEU A 102 12.798 0.006 8.489 1.00 0.00 H new ATOM 0 HB2 LEU A 102 13.233 -2.911 8.271 1.00 0.00 H new ATOM 0 HB3 LEU A 102 14.120 -1.987 7.075 1.00 0.00 H new ATOM 0 HG LEU A 102 14.984 -0.559 9.026 1.00 0.00 H new ATOM 0 HD11 LEU A 102 14.994 -1.664 11.228 1.00 0.00 H new ATOM 0 HD12 LEU A 102 13.343 -1.263 10.698 1.00 0.00 H new ATOM 0 HD13 LEU A 102 13.930 -2.939 10.588 1.00 0.00 H new ATOM 0 HD21 LEU A 102 16.742 -2.200 9.568 1.00 0.00 H new ATOM 0 HD22 LEU A 102 15.744 -3.494 8.864 1.00 0.00 H new ATOM 0 HD23 LEU A 102 16.366 -2.187 7.829 1.00 0.00 H new ATOM 1541 N HIS A 103 11.519 -1.526 5.865 1.00 0.00 N ATOM 1542 CA HIS A 103 11.180 -1.354 4.463 1.00 0.00 C ATOM 1543 C HIS A 103 10.213 -0.191 4.272 1.00 0.00 C ATOM 1544 O HIS A 103 10.338 0.583 3.322 1.00 0.00 O ATOM 1545 CB HIS A 103 10.569 -2.647 3.920 1.00 0.00 C ATOM 1546 CG HIS A 103 11.108 -3.066 2.586 1.00 0.00 C ATOM 1547 ND1 HIS A 103 10.486 -4.036 1.836 1.00 0.00 N ATOM 1548 CD2 HIS A 103 12.206 -2.628 1.921 1.00 0.00 C ATOM 1549 CE1 HIS A 103 11.209 -4.165 0.738 1.00 0.00 C ATOM 1550 NE2 HIS A 103 12.259 -3.332 0.745 1.00 0.00 N ATOM 0 H HIS A 103 11.194 -2.402 6.274 1.00 0.00 H new ATOM 0 HA HIS A 103 12.092 -1.125 3.911 1.00 0.00 H new ATOM 0 HB2 HIS A 103 10.744 -3.448 4.638 1.00 0.00 H new ATOM 0 HB3 HIS A 103 9.489 -2.520 3.840 1.00 0.00 H new ATOM 0 HD2 HIS A 103 12.903 -1.872 2.253 1.00 0.00 H new ATOM 0 HE1 HIS A 103 10.983 -4.854 -0.063 1.00 0.00 H new ATOM 0 HE2 HIS A 103 12.964 -3.239 0.014 1.00 0.00 H new ATOM 1558 N MET A 104 9.260 -0.067 5.189 1.00 0.00 N ATOM 1559 CA MET A 104 8.261 0.995 5.125 1.00 0.00 C ATOM 1560 C MET A 104 8.910 2.377 5.167 1.00 0.00 C ATOM 1561 O MET A 104 8.394 3.325 4.579 1.00 0.00 O ATOM 1562 CB MET A 104 7.284 0.856 6.287 1.00 0.00 C ATOM 1563 CG MET A 104 7.924 1.141 7.629 1.00 0.00 C ATOM 1564 SD MET A 104 6.900 2.182 8.682 1.00 0.00 S ATOM 1565 CE MET A 104 5.310 1.398 8.458 1.00 0.00 C ATOM 0 H MET A 104 9.158 -0.691 5.989 1.00 0.00 H new ATOM 0 HA MET A 104 7.729 0.897 4.179 1.00 0.00 H new ATOM 0 HB2 MET A 104 6.448 1.539 6.136 1.00 0.00 H new ATOM 0 HB3 MET A 104 6.874 -0.154 6.292 1.00 0.00 H new ATOM 0 HG2 MET A 104 8.122 0.199 8.140 1.00 0.00 H new ATOM 0 HG3 MET A 104 8.887 1.627 7.472 1.00 0.00 H new ATOM 0 HE1 MET A 104 4.533 2.160 8.403 1.00 0.00 H new ATOM 0 HE2 MET A 104 5.317 0.819 7.534 1.00 0.00 H new ATOM 0 HE3 MET A 104 5.109 0.735 9.300 1.00 0.00 H new ATOM 1575 N LEU A 105 10.022 2.494 5.890 1.00 0.00 N ATOM 1576 CA LEU A 105 10.722 3.769 6.009 1.00 0.00 C ATOM 1577 C LEU A 105 11.678 3.974 4.847 1.00 0.00 C ATOM 1578 O LEU A 105 12.211 5.067 4.656 1.00 0.00 O ATOM 1579 CB LEU A 105 11.513 3.839 7.319 1.00 0.00 C ATOM 1580 CG LEU A 105 10.779 3.346 8.563 1.00 0.00 C ATOM 1581 CD1 LEU A 105 11.724 3.302 9.755 1.00 0.00 C ATOM 1582 CD2 LEU A 105 9.586 4.234 8.863 1.00 0.00 C ATOM 0 H LEU A 105 10.455 1.724 6.400 1.00 0.00 H new ATOM 0 HA LEU A 105 9.967 4.555 5.999 1.00 0.00 H new ATOM 0 HB2 LEU A 105 12.426 3.254 7.203 1.00 0.00 H new ATOM 0 HB3 LEU A 105 11.816 4.873 7.484 1.00 0.00 H new ATOM 0 HG LEU A 105 10.417 2.336 8.372 1.00 0.00 H new ATOM 0 HD11 LEU A 105 11.185 2.948 10.634 1.00 0.00 H new ATOM 0 HD12 LEU A 105 12.550 2.625 9.539 1.00 0.00 H new ATOM 0 HD13 LEU A 105 12.115 4.301 9.947 1.00 0.00 H new ATOM 0 HD21 LEU A 105 9.074 3.868 9.753 1.00 0.00 H new ATOM 0 HD22 LEU A 105 9.927 5.255 9.035 1.00 0.00 H new ATOM 0 HD23 LEU A 105 8.899 4.218 8.017 1.00 0.00 H new ATOM 1594 N GLU A 106 11.916 2.912 4.088 1.00 0.00 N ATOM 1595 CA GLU A 106 12.867 2.976 2.992 1.00 0.00 C ATOM 1596 C GLU A 106 12.181 3.011 1.626 1.00 0.00 C ATOM 1597 O GLU A 106 12.836 3.229 0.608 1.00 0.00 O ATOM 1598 CB GLU A 106 13.834 1.785 3.075 1.00 0.00 C ATOM 1599 CG GLU A 106 13.455 0.611 2.184 1.00 0.00 C ATOM 1600 CD GLU A 106 14.318 0.518 0.942 1.00 0.00 C ATOM 1601 OE1 GLU A 106 15.532 0.257 1.080 1.00 0.00 O ATOM 1602 OE2 GLU A 106 13.780 0.704 -0.170 1.00 0.00 O ATOM 0 H GLU A 106 11.467 2.005 4.211 1.00 0.00 H new ATOM 0 HA GLU A 106 13.422 3.909 3.091 1.00 0.00 H new ATOM 0 HB2 GLU A 106 14.834 2.124 2.805 1.00 0.00 H new ATOM 0 HB3 GLU A 106 13.882 1.442 4.108 1.00 0.00 H new ATOM 0 HG2 GLU A 106 13.543 -0.315 2.753 1.00 0.00 H new ATOM 0 HG3 GLU A 106 12.410 0.706 1.889 1.00 0.00 H new ATOM 1609 N SER A 107 10.867 2.803 1.599 1.00 0.00 N ATOM 1610 CA SER A 107 10.137 2.799 0.335 1.00 0.00 C ATOM 1611 C SER A 107 8.755 3.435 0.474 1.00 0.00 C ATOM 1612 O SER A 107 7.999 3.104 1.389 1.00 0.00 O ATOM 1613 CB SER A 107 9.996 1.368 -0.180 1.00 0.00 C ATOM 1614 OG SER A 107 10.062 1.322 -1.595 1.00 0.00 O ATOM 0 H SER A 107 10.293 2.637 2.426 1.00 0.00 H new ATOM 0 HA SER A 107 10.708 3.394 -0.377 1.00 0.00 H new ATOM 0 HB2 SER A 107 10.785 0.747 0.244 1.00 0.00 H new ATOM 0 HB3 SER A 107 9.047 0.950 0.156 1.00 0.00 H new ATOM 0 HG SER A 107 9.971 0.394 -1.897 1.00 0.00 H new ATOM 1620 N PRO A 108 8.392 4.344 -0.454 1.00 0.00 N ATOM 1621 CA PRO A 108 7.088 5.017 -0.443 1.00 0.00 C ATOM 1622 C PRO A 108 5.951 4.061 -0.790 1.00 0.00 C ATOM 1623 O PRO A 108 4.788 4.460 -0.867 1.00 0.00 O ATOM 1624 CB PRO A 108 7.217 6.101 -1.525 1.00 0.00 C ATOM 1625 CG PRO A 108 8.671 6.164 -1.862 1.00 0.00 C ATOM 1626 CD PRO A 108 9.220 4.796 -1.582 1.00 0.00 C ATOM 0 HA PRO A 108 6.849 5.416 0.543 1.00 0.00 H new ATOM 0 HB2 PRO A 108 6.622 5.850 -2.403 1.00 0.00 H new ATOM 0 HB3 PRO A 108 6.857 7.063 -1.160 1.00 0.00 H new ATOM 0 HG2 PRO A 108 8.818 6.437 -2.907 1.00 0.00 H new ATOM 0 HG3 PRO A 108 9.178 6.919 -1.261 1.00 0.00 H new ATOM 0 HD2 PRO A 108 9.125 4.137 -2.445 1.00 0.00 H new ATOM 0 HD3 PRO A 108 10.278 4.829 -1.321 1.00 0.00 H new ATOM 1634 N GLU A 109 6.301 2.799 -1.008 1.00 0.00 N ATOM 1635 CA GLU A 109 5.323 1.771 -1.342 1.00 0.00 C ATOM 1636 C GLU A 109 5.349 0.663 -0.304 1.00 0.00 C ATOM 1637 O GLU A 109 4.351 -0.020 -0.088 1.00 0.00 O ATOM 1638 CB GLU A 109 5.621 1.202 -2.734 1.00 0.00 C ATOM 1639 CG GLU A 109 5.372 -0.294 -2.867 1.00 0.00 C ATOM 1640 CD GLU A 109 5.420 -0.770 -4.306 1.00 0.00 C ATOM 1641 OE1 GLU A 109 6.182 -0.180 -5.101 1.00 0.00 O ATOM 1642 OE2 GLU A 109 4.694 -1.730 -4.638 1.00 0.00 O ATOM 0 H GLU A 109 7.262 2.461 -0.959 1.00 0.00 H new ATOM 0 HA GLU A 109 4.328 2.217 -1.347 1.00 0.00 H new ATOM 0 HB2 GLU A 109 5.008 1.727 -3.467 1.00 0.00 H new ATOM 0 HB3 GLU A 109 6.662 1.409 -2.983 1.00 0.00 H new ATOM 0 HG2 GLU A 109 6.118 -0.835 -2.285 1.00 0.00 H new ATOM 0 HG3 GLU A 109 4.398 -0.535 -2.441 1.00 0.00 H new ATOM 1649 N SER A 110 6.498 0.494 0.339 1.00 0.00 N ATOM 1650 CA SER A 110 6.649 -0.536 1.350 1.00 0.00 C ATOM 1651 C SER A 110 5.739 -0.274 2.526 1.00 0.00 C ATOM 1652 O SER A 110 5.074 -1.175 3.016 1.00 0.00 O ATOM 1653 CB SER A 110 8.094 -0.614 1.833 1.00 0.00 C ATOM 1654 OG SER A 110 8.722 -1.795 1.369 1.00 0.00 O ATOM 0 H SER A 110 7.334 1.056 0.177 1.00 0.00 H new ATOM 0 HA SER A 110 6.374 -1.487 0.894 1.00 0.00 H new ATOM 0 HB2 SER A 110 8.646 0.258 1.481 1.00 0.00 H new ATOM 0 HB3 SER A 110 8.119 -0.589 2.922 1.00 0.00 H new ATOM 0 HG SER A 110 9.497 -1.558 0.818 1.00 0.00 H new ATOM 1660 N LEU A 111 5.709 0.963 2.974 1.00 0.00 N ATOM 1661 CA LEU A 111 4.867 1.325 4.092 1.00 0.00 C ATOM 1662 C LEU A 111 3.411 0.986 3.812 1.00 0.00 C ATOM 1663 O LEU A 111 2.631 0.749 4.730 1.00 0.00 O ATOM 1664 CB LEU A 111 5.004 2.808 4.390 1.00 0.00 C ATOM 1665 CG LEU A 111 4.286 3.254 5.652 1.00 0.00 C ATOM 1666 CD1 LEU A 111 5.178 4.175 6.457 1.00 0.00 C ATOM 1667 CD2 LEU A 111 2.969 3.924 5.305 1.00 0.00 C ATOM 0 H LEU A 111 6.255 1.731 2.583 1.00 0.00 H new ATOM 0 HA LEU A 111 5.192 0.751 4.960 1.00 0.00 H new ATOM 0 HB2 LEU A 111 6.062 3.054 4.480 1.00 0.00 H new ATOM 0 HB3 LEU A 111 4.616 3.375 3.544 1.00 0.00 H new ATOM 0 HG LEU A 111 4.061 2.379 6.262 1.00 0.00 H new ATOM 0 HD11 LEU A 111 4.655 4.490 7.360 1.00 0.00 H new ATOM 0 HD12 LEU A 111 6.092 3.648 6.732 1.00 0.00 H new ATOM 0 HD13 LEU A 111 5.430 5.051 5.860 1.00 0.00 H new ATOM 0 HD21 LEU A 111 2.468 4.237 6.221 1.00 0.00 H new ATOM 0 HD22 LEU A 111 3.158 4.796 4.678 1.00 0.00 H new ATOM 0 HD23 LEU A 111 2.334 3.221 4.766 1.00 0.00 H new ATOM 1679 N ARG A 112 3.055 0.957 2.534 1.00 0.00 N ATOM 1680 CA ARG A 112 1.690 0.655 2.129 1.00 0.00 C ATOM 1681 C ARG A 112 1.483 -0.850 1.957 1.00 0.00 C ATOM 1682 O ARG A 112 0.481 -1.402 2.411 1.00 0.00 O ATOM 1683 CB ARG A 112 1.355 1.388 0.826 1.00 0.00 C ATOM 1684 CG ARG A 112 0.588 0.538 -0.170 1.00 0.00 C ATOM 1685 CD ARG A 112 0.110 1.358 -1.357 1.00 0.00 C ATOM 1686 NE ARG A 112 -0.530 0.528 -2.374 1.00 0.00 N ATOM 1687 CZ ARG A 112 -1.584 0.913 -3.087 1.00 0.00 C ATOM 1688 NH1 ARG A 112 -2.117 2.112 -2.897 1.00 0.00 N ATOM 1689 NH2 ARG A 112 -2.107 0.097 -3.992 1.00 0.00 N ATOM 0 H ARG A 112 3.694 1.139 1.760 1.00 0.00 H new ATOM 0 HA ARG A 112 1.019 0.998 2.916 1.00 0.00 H new ATOM 0 HB2 ARG A 112 0.769 2.277 1.059 1.00 0.00 H new ATOM 0 HB3 ARG A 112 2.281 1.729 0.363 1.00 0.00 H new ATOM 0 HG2 ARG A 112 1.224 -0.274 -0.521 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -0.269 0.081 0.325 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -0.593 2.117 -1.014 1.00 0.00 H new ATOM 0 HD3 ARG A 112 0.956 1.884 -1.799 1.00 0.00 H new ATOM 0 HE ARG A 112 -0.146 -0.401 -2.547 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -1.718 2.743 -2.202 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -2.926 2.403 -3.446 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -1.701 -0.827 -4.141 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -2.916 0.393 -4.539 1.00 0.00 H new ATOM 1703 N SER A 113 2.415 -1.500 1.269 1.00 0.00 N ATOM 1704 CA SER A 113 2.325 -2.935 1.025 1.00 0.00 C ATOM 1705 C SER A 113 2.527 -3.714 2.316 1.00 0.00 C ATOM 1706 O SER A 113 1.949 -4.784 2.505 1.00 0.00 O ATOM 1707 CB SER A 113 3.366 -3.363 -0.013 1.00 0.00 C ATOM 1708 OG SER A 113 3.244 -4.741 -0.320 1.00 0.00 O ATOM 0 H SER A 113 3.242 -1.056 0.870 1.00 0.00 H new ATOM 0 HA SER A 113 1.329 -3.154 0.640 1.00 0.00 H new ATOM 0 HB2 SER A 113 3.243 -2.773 -0.921 1.00 0.00 H new ATOM 0 HB3 SER A 113 4.367 -3.159 0.366 1.00 0.00 H new ATOM 0 HG SER A 113 3.919 -4.989 -0.986 1.00 0.00 H new ATOM 1714 N LYS A 114 3.368 -3.180 3.192 1.00 0.00 N ATOM 1715 CA LYS A 114 3.630 -3.805 4.479 1.00 0.00 C ATOM 1716 C LYS A 114 2.497 -3.507 5.447 1.00 0.00 C ATOM 1717 O LYS A 114 2.224 -4.293 6.353 1.00 0.00 O ATOM 1718 CB LYS A 114 4.965 -3.329 5.057 1.00 0.00 C ATOM 1719 CG LYS A 114 6.154 -3.620 4.156 1.00 0.00 C ATOM 1720 CD LYS A 114 6.386 -5.116 3.996 1.00 0.00 C ATOM 1721 CE LYS A 114 6.923 -5.453 2.614 1.00 0.00 C ATOM 1722 NZ LYS A 114 6.037 -6.406 1.889 1.00 0.00 N ATOM 0 H LYS A 114 3.881 -2.313 3.033 1.00 0.00 H new ATOM 0 HA LYS A 114 3.692 -4.883 4.330 1.00 0.00 H new ATOM 0 HB2 LYS A 114 4.911 -2.256 5.239 1.00 0.00 H new ATOM 0 HB3 LYS A 114 5.125 -3.808 6.023 1.00 0.00 H new ATOM 0 HG2 LYS A 114 5.987 -3.171 3.177 1.00 0.00 H new ATOM 0 HG3 LYS A 114 7.048 -3.155 4.572 1.00 0.00 H new ATOM 0 HD2 LYS A 114 7.090 -5.459 4.754 1.00 0.00 H new ATOM 0 HD3 LYS A 114 5.451 -5.650 4.164 1.00 0.00 H new ATOM 0 HE2 LYS A 114 7.025 -4.537 2.031 1.00 0.00 H new ATOM 0 HE3 LYS A 114 7.920 -5.884 2.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 6.439 -6.609 0.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 5.960 -7.290 2.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 5.093 -5.985 1.777 1.00 0.00 H new ATOM 1736 N VAL A 115 1.829 -2.372 5.245 1.00 0.00 N ATOM 1737 CA VAL A 115 0.687 -2.022 6.082 1.00 0.00 C ATOM 1738 C VAL A 115 -0.494 -2.922 5.721 1.00 0.00 C ATOM 1739 O VAL A 115 -0.988 -3.667 6.565 1.00 0.00 O ATOM 1740 CB VAL A 115 0.303 -0.523 5.968 1.00 0.00 C ATOM 1741 CG1 VAL A 115 -1.208 -0.329 5.958 1.00 0.00 C ATOM 1742 CG2 VAL A 115 0.919 0.268 7.111 1.00 0.00 C ATOM 0 H VAL A 115 2.055 -1.690 4.521 1.00 0.00 H new ATOM 0 HA VAL A 115 0.967 -2.184 7.123 1.00 0.00 H new ATOM 0 HB VAL A 115 0.696 -0.154 5.020 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -1.438 0.733 5.877 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -1.637 -0.859 5.108 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -1.631 -0.722 6.882 1.00 0.00 H new ATOM 0 HG21 VAL A 115 0.641 1.318 7.018 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.554 -0.121 8.061 1.00 0.00 H new ATOM 0 HG23 VAL A 115 2.004 0.175 7.074 1.00 0.00 H new ATOM 1752 N ASP A 116 -0.872 -2.921 4.441 1.00 0.00 N ATOM 1753 CA ASP A 116 -1.950 -3.780 3.955 1.00 0.00 C ATOM 1754 C ASP A 116 -1.701 -5.235 4.345 1.00 0.00 C ATOM 1755 O ASP A 116 -2.629 -5.959 4.709 1.00 0.00 O ATOM 1756 CB ASP A 116 -2.076 -3.662 2.434 1.00 0.00 C ATOM 1757 CG ASP A 116 -3.437 -4.105 1.929 1.00 0.00 C ATOM 1758 OD1 ASP A 116 -4.100 -4.902 2.626 1.00 0.00 O ATOM 1759 OD2 ASP A 116 -3.840 -3.653 0.837 1.00 0.00 O ATOM 0 H ASP A 116 -0.446 -2.334 3.723 1.00 0.00 H new ATOM 0 HA ASP A 116 -2.881 -3.452 4.417 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -1.900 -2.628 2.137 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -1.302 -4.266 1.960 1.00 0.00 H new ATOM 1764 N GLU A 117 -0.442 -5.658 4.274 1.00 0.00 N ATOM 1765 CA GLU A 117 -0.071 -7.019 4.644 1.00 0.00 C ATOM 1766 C GLU A 117 -0.192 -7.212 6.149 1.00 0.00 C ATOM 1767 O GLU A 117 -0.652 -8.254 6.616 1.00 0.00 O ATOM 1768 CB GLU A 117 1.358 -7.325 4.187 1.00 0.00 C ATOM 1769 CG GLU A 117 1.452 -7.907 2.782 1.00 0.00 C ATOM 1770 CD GLU A 117 0.227 -7.619 1.933 1.00 0.00 C ATOM 1771 OE1 GLU A 117 0.143 -6.508 1.368 1.00 0.00 O ATOM 1772 OE2 GLU A 117 -0.646 -8.507 1.830 1.00 0.00 O ATOM 0 H GLU A 117 0.337 -5.078 3.964 1.00 0.00 H new ATOM 0 HA GLU A 117 -0.753 -7.709 4.147 1.00 0.00 H new ATOM 0 HB2 GLU A 117 1.945 -6.408 4.228 1.00 0.00 H new ATOM 0 HB3 GLU A 117 1.810 -8.025 4.889 1.00 0.00 H new ATOM 0 HG2 GLU A 117 2.334 -7.501 2.286 1.00 0.00 H new ATOM 0 HG3 GLU A 117 1.593 -8.986 2.851 1.00 0.00 H new ATOM 1779 N ALA A 118 0.209 -6.193 6.906 1.00 0.00 N ATOM 1780 CA ALA A 118 0.101 -6.241 8.357 1.00 0.00 C ATOM 1781 C ALA A 118 -1.361 -6.297 8.769 1.00 0.00 C ATOM 1782 O ALA A 118 -1.694 -6.750 9.860 1.00 0.00 O ATOM 1783 CB ALA A 118 0.792 -5.047 8.994 1.00 0.00 C ATOM 0 H ALA A 118 0.609 -5.330 6.539 1.00 0.00 H new ATOM 0 HA ALA A 118 0.600 -7.143 8.711 1.00 0.00 H new ATOM 0 HB1 ALA A 118 0.697 -5.107 10.078 1.00 0.00 H new ATOM 0 HB2 ALA A 118 1.848 -5.050 8.722 1.00 0.00 H new ATOM 0 HB3 ALA A 118 0.328 -4.126 8.639 1.00 0.00 H new ATOM 1789 N VAL A 119 -2.227 -5.844 7.869 1.00 0.00 N ATOM 1790 CA VAL A 119 -3.662 -5.878 8.096 1.00 0.00 C ATOM 1791 C VAL A 119 -4.138 -7.311 8.173 1.00 0.00 C ATOM 1792 O VAL A 119 -4.908 -7.684 9.055 1.00 0.00 O ATOM 1793 CB VAL A 119 -4.396 -5.161 6.969 1.00 0.00 C ATOM 1794 CG1 VAL A 119 -5.896 -5.136 7.199 1.00 0.00 C ATOM 1795 CG2 VAL A 119 -3.851 -3.767 6.858 1.00 0.00 C ATOM 0 H VAL A 119 -1.955 -5.447 6.970 1.00 0.00 H new ATOM 0 HA VAL A 119 -3.875 -5.372 9.038 1.00 0.00 H new ATOM 0 HB VAL A 119 -4.232 -5.702 6.037 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -6.382 -4.616 6.373 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -6.272 -6.157 7.257 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -6.112 -4.617 8.133 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -4.365 -3.238 6.055 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -4.007 -3.239 7.799 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -2.784 -3.810 6.639 1.00 0.00 H new ATOM 1805 N ALA A 120 -3.648 -8.114 7.240 1.00 0.00 N ATOM 1806 CA ALA A 120 -3.949 -9.529 7.212 1.00 0.00 C ATOM 1807 C ALA A 120 -3.466 -10.177 8.502 1.00 0.00 C ATOM 1808 O ALA A 120 -4.000 -11.191 8.952 1.00 0.00 O ATOM 1809 CB ALA A 120 -3.283 -10.165 6.003 1.00 0.00 C ATOM 0 H ALA A 120 -3.035 -7.801 6.487 1.00 0.00 H new ATOM 0 HA ALA A 120 -5.026 -9.678 7.132 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.510 -11.231 5.982 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -3.657 -9.696 5.093 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -2.204 -10.025 6.066 1.00 0.00 H new ATOM 1815 N VAL A 121 -2.459 -9.549 9.101 1.00 0.00 N ATOM 1816 CA VAL A 121 -1.880 -10.016 10.348 1.00 0.00 C ATOM 1817 C VAL A 121 -2.643 -9.454 11.546 1.00 0.00 C ATOM 1818 O VAL A 121 -2.740 -10.098 12.592 1.00 0.00 O ATOM 1819 CB VAL A 121 -0.395 -9.607 10.430 1.00 0.00 C ATOM 1820 CG1 VAL A 121 0.110 -9.637 11.863 1.00 0.00 C ATOM 1821 CG2 VAL A 121 0.449 -10.507 9.541 1.00 0.00 C ATOM 0 H VAL A 121 -2.024 -8.703 8.733 1.00 0.00 H new ATOM 0 HA VAL A 121 -1.953 -11.103 10.372 1.00 0.00 H new ATOM 0 HB VAL A 121 -0.307 -8.581 10.073 1.00 0.00 H new ATOM 0 HG11 VAL A 121 1.160 -9.344 11.885 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -0.473 -8.944 12.469 1.00 0.00 H new ATOM 0 HG13 VAL A 121 0.007 -10.645 12.264 1.00 0.00 H new ATOM 0 HG21 VAL A 121 1.495 -10.207 9.608 1.00 0.00 H new ATOM 0 HG22 VAL A 121 0.346 -11.542 9.868 1.00 0.00 H new ATOM 0 HG23 VAL A 121 0.112 -10.418 8.508 1.00 0.00 H new ATOM 1831 N LEU A 122 -3.187 -8.251 11.384 1.00 0.00 N ATOM 1832 CA LEU A 122 -3.955 -7.612 12.444 1.00 0.00 C ATOM 1833 C LEU A 122 -5.297 -8.312 12.609 1.00 0.00 C ATOM 1834 O LEU A 122 -5.764 -8.531 13.726 1.00 0.00 O ATOM 1835 CB LEU A 122 -4.148 -6.117 12.137 1.00 0.00 C ATOM 1836 CG LEU A 122 -5.603 -5.644 12.002 1.00 0.00 C ATOM 1837 CD1 LEU A 122 -5.965 -4.703 13.141 1.00 0.00 C ATOM 1838 CD2 LEU A 122 -5.820 -4.965 10.660 1.00 0.00 C ATOM 0 H LEU A 122 -3.109 -7.701 10.529 1.00 0.00 H new ATOM 0 HA LEU A 122 -3.406 -7.696 13.382 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -3.670 -5.539 12.927 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -3.623 -5.885 11.210 1.00 0.00 H new ATOM 0 HG LEU A 122 -6.255 -6.516 12.055 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -6.999 -4.378 13.029 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -5.848 -5.222 14.093 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -5.307 -3.834 13.118 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -6.856 -4.636 10.582 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -5.159 -4.103 10.577 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -5.601 -5.668 9.857 1.00 0.00 H new ATOM 1850 N GLN A 123 -5.904 -8.671 11.483 1.00 0.00 N ATOM 1851 CA GLN A 123 -7.178 -9.369 11.488 1.00 0.00 C ATOM 1852 C GLN A 123 -7.003 -10.776 12.041 1.00 0.00 C ATOM 1853 O GLN A 123 -7.900 -11.316 12.687 1.00 0.00 O ATOM 1854 CB GLN A 123 -7.755 -9.423 10.072 1.00 0.00 C ATOM 1855 CG GLN A 123 -8.383 -8.114 9.622 1.00 0.00 C ATOM 1856 CD GLN A 123 -9.609 -7.745 10.434 1.00 0.00 C ATOM 1857 OE1 GLN A 123 -10.420 -8.604 10.780 1.00 0.00 O ATOM 1858 NE2 GLN A 123 -9.750 -6.461 10.741 1.00 0.00 N ATOM 0 H GLN A 123 -5.529 -8.487 10.552 1.00 0.00 H new ATOM 0 HA GLN A 123 -7.874 -8.827 12.128 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -6.962 -9.695 9.375 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -8.505 -10.212 10.024 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -7.645 -7.315 9.702 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -8.658 -8.190 8.570 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -9.053 -5.783 10.433 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -10.556 -6.152 11.285 1.00 0.00 H new ATOM 1867 N ALA A 124 -5.829 -11.353 11.798 1.00 0.00 N ATOM 1868 CA ALA A 124 -5.511 -12.691 12.283 1.00 0.00 C ATOM 1869 C ALA A 124 -5.131 -12.659 13.759 1.00 0.00 C ATOM 1870 O ALA A 124 -5.024 -13.701 14.406 1.00 0.00 O ATOM 1871 CB ALA A 124 -4.383 -13.293 11.460 1.00 0.00 C ATOM 0 H ALA A 124 -5.080 -10.911 11.265 1.00 0.00 H new ATOM 0 HA ALA A 124 -6.399 -13.314 12.175 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -4.155 -14.292 11.832 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -4.688 -13.355 10.415 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -3.497 -12.664 11.542 1.00 0.00 H new ATOM 1877 N HIS A 125 -4.929 -11.455 14.285 1.00 0.00 N ATOM 1878 CA HIS A 125 -4.554 -11.284 15.683 1.00 0.00 C ATOM 1879 C HIS A 125 -5.618 -10.503 16.445 1.00 0.00 C ATOM 1880 O HIS A 125 -5.481 -10.257 17.644 1.00 0.00 O ATOM 1881 CB HIS A 125 -3.212 -10.556 15.779 1.00 0.00 C ATOM 1882 CG HIS A 125 -2.297 -11.115 16.822 1.00 0.00 C ATOM 1883 ND1 HIS A 125 -1.410 -12.126 16.532 1.00 0.00 N ATOM 1884 CD2 HIS A 125 -2.167 -10.773 18.127 1.00 0.00 C ATOM 1885 CE1 HIS A 125 -0.766 -12.376 17.658 1.00 0.00 C ATOM 1886 NE2 HIS A 125 -1.191 -11.581 18.650 1.00 0.00 N ATOM 0 H HIS A 125 -5.019 -10.583 13.763 1.00 0.00 H new ATOM 0 HA HIS A 125 -4.465 -12.273 16.133 1.00 0.00 H new ATOM 0 HB2 HIS A 125 -2.714 -10.601 14.810 1.00 0.00 H new ATOM 0 HB3 HIS A 125 -3.395 -9.503 15.995 1.00 0.00 H new ATOM 0 HD2 HIS A 125 -2.724 -10.012 18.653 1.00 0.00 H new ATOM 0 HE1 HIS A 125 0.004 -13.125 17.766 1.00 0.00 H new ATOM 0 HE2 HIS A 125 -0.852 -11.578 19.612 1.00 0.00 H new ATOM 1894 N GLN A 126 -6.677 -10.114 15.744 1.00 0.00 N ATOM 1895 CA GLN A 126 -7.753 -9.341 16.352 1.00 0.00 C ATOM 1896 C GLN A 126 -8.731 -10.243 17.107 1.00 0.00 C ATOM 1897 O GLN A 126 -8.508 -10.571 18.272 1.00 0.00 O ATOM 1898 CB GLN A 126 -8.493 -8.531 15.285 1.00 0.00 C ATOM 1899 CG GLN A 126 -8.017 -7.090 15.179 1.00 0.00 C ATOM 1900 CD GLN A 126 -9.138 -6.130 14.837 1.00 0.00 C ATOM 1901 OE1 GLN A 126 -9.162 -5.547 13.752 1.00 0.00 O ATOM 1902 NE2 GLN A 126 -10.076 -5.961 15.761 1.00 0.00 N ATOM 0 H GLN A 126 -6.813 -10.321 14.755 1.00 0.00 H new ATOM 0 HA GLN A 126 -7.307 -8.656 17.072 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -8.368 -9.019 14.318 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -9.560 -8.537 15.510 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -7.563 -6.791 16.124 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -7.241 -7.023 14.417 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -10.017 -6.464 16.646 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -10.856 -5.328 15.586 1.00 0.00 H new ATOM 1911 N ALA A 127 -9.820 -10.629 16.443 1.00 0.00 N ATOM 1912 CA ALA A 127 -10.839 -11.466 17.069 1.00 0.00 C ATOM 1913 C ALA A 127 -10.624 -12.945 16.761 1.00 0.00 C ATOM 1914 O ALA A 127 -11.552 -13.748 16.856 1.00 0.00 O ATOM 1915 CB ALA A 127 -12.225 -11.029 16.618 1.00 0.00 C ATOM 0 H ALA A 127 -10.018 -10.376 15.475 1.00 0.00 H new ATOM 0 HA ALA A 127 -10.755 -11.340 18.148 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -12.977 -11.660 17.091 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -12.390 -9.990 16.905 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -12.302 -11.123 15.535 1.00 0.00 H new ATOM 1921 N LYS A 128 -9.394 -13.303 16.404 1.00 0.00 N ATOM 1922 CA LYS A 128 -9.065 -14.688 16.089 1.00 0.00 C ATOM 1923 C LYS A 128 -8.649 -15.451 17.341 1.00 0.00 C ATOM 1924 O LYS A 128 -9.043 -15.102 18.453 1.00 0.00 O ATOM 1925 CB LYS A 128 -7.940 -14.744 15.056 1.00 0.00 C ATOM 1926 CG LYS A 128 -8.265 -14.020 13.765 1.00 0.00 C ATOM 1927 CD LYS A 128 -8.211 -14.961 12.573 1.00 0.00 C ATOM 1928 CE LYS A 128 -8.647 -14.268 11.293 1.00 0.00 C ATOM 1929 NZ LYS A 128 -9.031 -15.246 10.238 1.00 0.00 N ATOM 0 H LYS A 128 -8.611 -12.654 16.326 1.00 0.00 H new ATOM 0 HA LYS A 128 -9.958 -15.158 15.677 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -7.039 -14.310 15.489 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -7.716 -15.787 14.831 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -9.258 -13.576 13.835 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -7.560 -13.202 13.617 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -7.196 -15.341 12.454 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -8.854 -15.822 12.759 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -9.491 -13.611 11.504 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -7.837 -13.638 10.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -9.322 -14.735 9.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -8.218 -15.856 10.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -9.821 -15.831 10.578 1.00 0.00 H new ATOM 1943 N GLU A 129 -7.851 -16.497 17.148 1.00 0.00 N ATOM 1944 CA GLU A 129 -7.357 -17.297 18.262 1.00 0.00 C ATOM 1945 C GLU A 129 -6.083 -16.683 18.824 1.00 0.00 C ATOM 1946 O GLU A 129 -5.502 -17.193 19.782 1.00 0.00 O ATOM 1947 CB GLU A 129 -7.092 -18.735 17.811 1.00 0.00 C ATOM 1948 CG GLU A 129 -7.818 -19.779 18.644 1.00 0.00 C ATOM 1949 CD GLU A 129 -6.868 -20.658 19.435 1.00 0.00 C ATOM 1950 OE1 GLU A 129 -6.432 -21.696 18.895 1.00 0.00 O ATOM 1951 OE2 GLU A 129 -6.564 -20.309 20.595 1.00 0.00 O ATOM 0 H GLU A 129 -7.533 -16.810 16.231 1.00 0.00 H new ATOM 0 HA GLU A 129 -8.117 -17.311 19.043 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -7.393 -18.841 16.769 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -6.020 -18.929 17.855 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -8.502 -19.279 19.330 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -8.425 -20.404 17.988 1.00 0.00 H new ATOM 1958 N ALA A 130 -5.659 -15.582 18.215 1.00 0.00 N ATOM 1959 CA ALA A 130 -4.454 -14.883 18.638 1.00 0.00 C ATOM 1960 C ALA A 130 -4.764 -13.872 19.737 1.00 0.00 C ATOM 1961 O ALA A 130 -3.997 -12.936 19.968 1.00 0.00 O ATOM 1962 CB ALA A 130 -3.808 -14.192 17.446 1.00 0.00 C ATOM 0 H ALA A 130 -6.136 -15.153 17.422 1.00 0.00 H new ATOM 0 HA ALA A 130 -3.757 -15.615 19.044 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -2.907 -13.672 17.771 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -3.546 -14.935 16.693 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -4.508 -13.474 17.019 1.00 0.00 H new ATOM 1968 N ALA A 131 -5.892 -14.069 20.413 1.00 0.00 N ATOM 1969 CA ALA A 131 -6.306 -13.176 21.488 1.00 0.00 C ATOM 1970 C ALA A 131 -5.282 -13.166 22.617 1.00 0.00 C ATOM 1971 O ALA A 131 -4.939 -14.213 23.166 1.00 0.00 O ATOM 1972 CB ALA A 131 -7.673 -13.585 22.015 1.00 0.00 C ATOM 0 H ALA A 131 -6.536 -14.840 20.234 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.372 -12.166 21.084 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -7.970 -12.910 22.817 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -8.404 -13.534 21.208 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -7.625 -14.605 22.398 1.00 0.00 H new ATOM 1978 N GLN A 132 -4.797 -11.976 22.958 1.00 0.00 N ATOM 1979 CA GLN A 132 -3.810 -11.828 24.021 1.00 0.00 C ATOM 1980 C GLN A 132 -4.488 -11.669 25.378 1.00 0.00 C ATOM 1981 O GLN A 132 -5.487 -10.961 25.505 1.00 0.00 O ATOM 1982 CB GLN A 132 -2.908 -10.624 23.744 1.00 0.00 C ATOM 1983 CG GLN A 132 -3.664 -9.310 23.629 1.00 0.00 C ATOM 1984 CD GLN A 132 -3.101 -8.405 22.552 1.00 0.00 C ATOM 1985 OE1 GLN A 132 -3.671 -8.282 21.468 1.00 0.00 O ATOM 1986 NE2 GLN A 132 -1.974 -7.765 22.845 1.00 0.00 N ATOM 0 H GLN A 132 -5.072 -11.100 22.513 1.00 0.00 H new ATOM 0 HA GLN A 132 -3.201 -12.732 24.044 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -2.172 -10.541 24.543 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -2.357 -10.798 22.820 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -4.712 -9.516 23.413 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -3.632 -8.792 24.587 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -1.535 -7.896 23.756 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -1.548 -7.142 22.159 1.00 0.00 H new ATOM 1995 N LYS A 133 -3.936 -12.332 26.389 1.00 0.00 N ATOM 1996 CA LYS A 133 -4.483 -12.262 27.739 1.00 0.00 C ATOM 1997 C LYS A 133 -3.871 -11.098 28.510 1.00 0.00 C ATOM 1998 O LYS A 133 -4.486 -10.556 29.429 1.00 0.00 O ATOM 1999 CB LYS A 133 -4.233 -13.572 28.492 1.00 0.00 C ATOM 2000 CG LYS A 133 -3.947 -14.758 27.584 1.00 0.00 C ATOM 2001 CD LYS A 133 -2.534 -15.281 27.780 1.00 0.00 C ATOM 2002 CE LYS A 133 -2.370 -16.676 27.199 1.00 0.00 C ATOM 2003 NZ LYS A 133 -0.942 -17.001 26.930 1.00 0.00 N ATOM 0 H LYS A 133 -3.110 -12.924 26.299 1.00 0.00 H new ATOM 0 HA LYS A 133 -5.558 -12.102 27.657 1.00 0.00 H new ATOM 0 HB2 LYS A 133 -3.391 -13.435 29.171 1.00 0.00 H new ATOM 0 HB3 LYS A 133 -5.104 -13.799 29.106 1.00 0.00 H new ATOM 0 HG2 LYS A 133 -4.663 -15.555 27.788 1.00 0.00 H new ATOM 0 HG3 LYS A 133 -4.086 -14.463 26.544 1.00 0.00 H new ATOM 0 HD2 LYS A 133 -1.825 -14.603 27.306 1.00 0.00 H new ATOM 0 HD3 LYS A 133 -2.296 -15.298 28.844 1.00 0.00 H new ATOM 0 HE2 LYS A 133 -2.785 -17.409 27.891 1.00 0.00 H new ATOM 0 HE3 LYS A 133 -2.940 -16.753 26.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 -0.873 -17.960 26.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 -0.553 -16.317 26.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 -0.402 -16.953 27.817 1.00 0.00 H new ATOM 2017 N ALA A 134 -2.654 -10.719 28.129 1.00 0.00 N ATOM 2018 CA ALA A 134 -1.954 -9.620 28.783 1.00 0.00 C ATOM 2019 C ALA A 134 -2.618 -8.284 28.466 1.00 0.00 C ATOM 2020 O ALA A 134 -2.542 -7.792 27.341 1.00 0.00 O ATOM 2021 CB ALA A 134 -0.493 -9.598 28.361 1.00 0.00 C ATOM 0 H ALA A 134 -2.133 -11.158 27.370 1.00 0.00 H new ATOM 0 HA ALA A 134 -2.006 -9.778 29.860 1.00 0.00 H new ATOM 0 HB1 ALA A 134 0.017 -8.772 28.857 1.00 0.00 H new ATOM 0 HB2 ALA A 134 -0.019 -10.538 28.642 1.00 0.00 H new ATOM 0 HB3 ALA A 134 -0.428 -9.468 27.281 1.00 0.00 H new ATOM 2027 N VAL A 135 -3.272 -7.703 29.468 1.00 0.00 N ATOM 2028 CA VAL A 135 -3.951 -6.424 29.299 1.00 0.00 C ATOM 2029 C VAL A 135 -3.153 -5.291 29.935 1.00 0.00 C ATOM 2030 O VAL A 135 -3.555 -4.129 29.885 1.00 0.00 O ATOM 2031 CB VAL A 135 -5.364 -6.450 29.910 1.00 0.00 C ATOM 2032 CG1 VAL A 135 -6.291 -7.321 29.076 1.00 0.00 C ATOM 2033 CG2 VAL A 135 -5.315 -6.937 31.351 1.00 0.00 C ATOM 0 H VAL A 135 -3.346 -8.099 30.405 1.00 0.00 H new ATOM 0 HA VAL A 135 -4.033 -6.250 28.226 1.00 0.00 H new ATOM 0 HB VAL A 135 -5.759 -5.434 29.908 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -7.285 -7.327 29.523 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -6.351 -6.922 28.063 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -5.902 -8.339 29.043 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -6.323 -6.948 31.766 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -4.899 -7.944 31.381 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -4.688 -6.268 31.940 1.00 0.00 H new ATOM 2043 N ASN A 136 -2.017 -5.639 30.534 1.00 0.00 N ATOM 2044 CA ASN A 136 -1.159 -4.653 31.181 1.00 0.00 C ATOM 2045 C ASN A 136 -0.136 -4.095 30.199 1.00 0.00 C ATOM 2046 O ASN A 136 0.502 -3.076 30.463 1.00 0.00 O ATOM 2047 CB ASN A 136 -0.444 -5.279 32.378 1.00 0.00 C ATOM 2048 CG ASN A 136 -1.363 -6.158 33.205 1.00 0.00 C ATOM 2049 OD1 ASN A 136 -2.564 -5.903 33.301 1.00 0.00 O ATOM 2050 ND2 ASN A 136 -0.802 -7.200 33.806 1.00 0.00 N ATOM 0 H ASN A 136 -1.670 -6.597 30.584 1.00 0.00 H new ATOM 0 HA ASN A 136 -1.787 -3.833 31.529 1.00 0.00 H new ATOM 0 HB2 ASN A 136 0.400 -5.871 32.025 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -0.037 -4.489 33.009 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -1.370 -7.827 34.375 1.00 0.00 H new ATOM 0 HD22 ASN A 136 0.197 -7.373 33.699 1.00 0.00 H new ATOM 2057 N SER A 137 0.013 -4.769 29.063 1.00 0.00 N ATOM 2058 CA SER A 137 0.955 -4.339 28.038 1.00 0.00 C ATOM 2059 C SER A 137 0.330 -3.281 27.136 1.00 0.00 C ATOM 2060 O SER A 137 0.999 -2.712 26.273 1.00 0.00 O ATOM 2061 CB SER A 137 1.407 -5.536 27.199 1.00 0.00 C ATOM 2062 OG SER A 137 0.343 -6.037 26.409 1.00 0.00 O ATOM 0 H SER A 137 -0.507 -5.615 28.830 1.00 0.00 H new ATOM 0 HA SER A 137 1.821 -3.903 28.535 1.00 0.00 H new ATOM 0 HB2 SER A 137 2.235 -5.240 26.554 1.00 0.00 H new ATOM 0 HB3 SER A 137 1.779 -6.323 27.854 1.00 0.00 H new ATOM 0 HG SER A 137 0.659 -6.800 25.881 1.00 0.00 H new ATOM 2068 N ALA A 138 -0.959 -3.022 27.342 1.00 0.00 N ATOM 2069 CA ALA A 138 -1.677 -2.032 26.547 1.00 0.00 C ATOM 2070 C ALA A 138 -1.418 -0.620 27.062 1.00 0.00 C ATOM 2071 O ALA A 138 -0.610 -0.418 27.969 1.00 0.00 O ATOM 2072 CB ALA A 138 -3.168 -2.333 26.552 1.00 0.00 C ATOM 0 H ALA A 138 -1.526 -3.484 28.052 1.00 0.00 H new ATOM 0 HA ALA A 138 -1.309 -2.089 25.523 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -3.692 -1.587 25.955 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -3.341 -3.323 26.129 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -3.541 -2.306 27.576 1.00 0.00 H new ATOM 2078 N THR A 139 -2.110 0.353 26.477 1.00 0.00 N ATOM 2079 CA THR A 139 -1.955 1.748 26.876 1.00 0.00 C ATOM 2080 C THR A 139 -2.992 2.133 27.925 1.00 0.00 C ATOM 2081 O THR A 139 -4.065 1.535 28.000 1.00 0.00 O ATOM 2082 CB THR A 139 -2.082 2.665 25.657 1.00 0.00 C ATOM 2083 OG1 THR A 139 -3.435 2.773 25.252 1.00 0.00 O ATOM 2084 CG2 THR A 139 -1.280 2.192 24.464 1.00 0.00 C ATOM 0 H THR A 139 -2.783 0.201 25.726 1.00 0.00 H new ATOM 0 HA THR A 139 -0.963 1.867 27.312 1.00 0.00 H new ATOM 0 HB THR A 139 -1.687 3.629 25.978 1.00 0.00 H new ATOM 0 HG1 THR A 139 -3.497 3.364 24.473 1.00 0.00 H new ATOM 0 HG21 THR A 139 -1.415 2.888 23.636 1.00 0.00 H new ATOM 0 HG22 THR A 139 -0.224 2.146 24.731 1.00 0.00 H new ATOM 0 HG23 THR A 139 -1.622 1.201 24.165 1.00 0.00 H new ATOM 2092 N GLY A 140 -2.664 3.139 28.731 1.00 0.00 N ATOM 2093 CA GLY A 140 -3.578 3.589 29.766 1.00 0.00 C ATOM 2094 C GLY A 140 -4.337 4.839 29.366 1.00 0.00 C ATOM 2095 O GLY A 140 -5.460 4.759 28.867 1.00 0.00 O ATOM 0 H GLY A 140 -1.782 3.650 28.686 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -4.288 2.793 29.991 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -3.018 3.785 30.681 1.00 0.00 H new ATOM 2099 N VAL A 141 -3.723 5.998 29.584 1.00 0.00 N ATOM 2100 CA VAL A 141 -4.346 7.272 29.243 1.00 0.00 C ATOM 2101 C VAL A 141 -3.855 7.780 27.888 1.00 0.00 C ATOM 2102 O VAL A 141 -2.717 8.236 27.767 1.00 0.00 O ATOM 2103 CB VAL A 141 -4.064 8.346 30.312 1.00 0.00 C ATOM 2104 CG1 VAL A 141 -5.079 9.475 30.215 1.00 0.00 C ATOM 2105 CG2 VAL A 141 -4.068 7.733 31.705 1.00 0.00 C ATOM 0 H VAL A 141 -2.793 6.081 29.996 1.00 0.00 H new ATOM 0 HA VAL A 141 -5.420 7.092 29.196 1.00 0.00 H new ATOM 0 HB VAL A 141 -3.073 8.761 30.128 1.00 0.00 H new ATOM 0 HG11 VAL A 141 -4.864 10.224 30.977 1.00 0.00 H new ATOM 0 HG12 VAL A 141 -5.019 9.934 29.228 1.00 0.00 H new ATOM 0 HG13 VAL A 141 -6.082 9.077 30.370 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -3.867 8.508 32.444 1.00 0.00 H new ATOM 0 HG22 VAL A 141 -5.042 7.287 31.903 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -3.297 6.964 31.767 1.00 0.00 H new ATOM 2115 N PRO A 142 -4.707 7.710 26.848 1.00 0.00 N ATOM 2116 CA PRO A 142 -4.349 8.166 25.499 1.00 0.00 C ATOM 2117 C PRO A 142 -3.878 9.617 25.483 1.00 0.00 C ATOM 2118 O PRO A 142 -4.579 10.512 25.954 1.00 0.00 O ATOM 2119 CB PRO A 142 -5.653 8.022 24.709 1.00 0.00 C ATOM 2120 CG PRO A 142 -6.436 6.996 25.451 1.00 0.00 C ATOM 2121 CD PRO A 142 -6.082 7.176 26.899 1.00 0.00 C ATOM 0 HA PRO A 142 -3.521 7.590 25.086 1.00 0.00 H new ATOM 0 HB2 PRO A 142 -6.191 8.969 24.657 1.00 0.00 H new ATOM 0 HB3 PRO A 142 -5.461 7.708 23.683 1.00 0.00 H new ATOM 0 HG2 PRO A 142 -7.506 7.130 25.291 1.00 0.00 H new ATOM 0 HG3 PRO A 142 -6.186 5.991 25.110 1.00 0.00 H new ATOM 0 HD2 PRO A 142 -6.763 7.866 27.397 1.00 0.00 H new ATOM 0 HD3 PRO A 142 -6.128 6.233 27.445 1.00 0.00 H new ATOM 2129 N THR A 143 -2.688 9.841 24.934 1.00 0.00 N ATOM 2130 CA THR A 143 -2.126 11.185 24.850 1.00 0.00 C ATOM 2131 C THR A 143 -2.658 11.919 23.625 1.00 0.00 C ATOM 2132 O THR A 143 -3.348 11.334 22.790 1.00 0.00 O ATOM 2133 CB THR A 143 -0.598 11.119 24.799 1.00 0.00 C ATOM 2134 OG1 THR A 143 -0.164 10.488 23.607 1.00 0.00 O ATOM 2135 CG2 THR A 143 0.009 10.369 25.965 1.00 0.00 C ATOM 0 H THR A 143 -2.095 9.110 24.541 1.00 0.00 H new ATOM 0 HA THR A 143 -2.428 11.736 25.741 1.00 0.00 H new ATOM 0 HB THR A 143 -0.262 12.155 24.842 1.00 0.00 H new ATOM 0 HG1 THR A 143 0.815 10.457 23.591 1.00 0.00 H new ATOM 0 HG21 THR A 143 1.094 10.360 25.866 1.00 0.00 H new ATOM 0 HG22 THR A 143 -0.267 10.861 26.898 1.00 0.00 H new ATOM 0 HG23 THR A 143 -0.363 9.344 25.972 1.00 0.00 H new ATOM 2143 N VAL A 144 -2.336 13.206 23.524 1.00 0.00 N ATOM 2144 CA VAL A 144 -2.785 14.019 22.400 1.00 0.00 C ATOM 2145 C VAL A 144 -1.694 14.990 21.957 1.00 0.00 C ATOM 2146 O VAL A 144 -1.625 15.290 20.747 1.00 0.00 O ATOM 2147 CB VAL A 144 -4.062 14.810 22.752 1.00 0.00 C ATOM 2148 CG1 VAL A 144 -3.786 15.808 23.866 1.00 0.00 C ATOM 2149 CG2 VAL A 144 -4.614 15.510 21.519 1.00 0.00 C ATOM 2150 OXT VAL A 144 -0.915 15.441 22.824 1.00 0.00 O ATOM 0 H VAL A 144 -1.767 13.707 24.206 1.00 0.00 H new ATOM 0 HA VAL A 144 -3.010 13.336 21.581 1.00 0.00 H new ATOM 0 HB VAL A 144 -4.815 14.107 23.109 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -4.699 16.355 24.099 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -3.445 15.276 24.754 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -3.015 16.509 23.544 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -5.514 16.063 21.787 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -3.867 16.201 21.128 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -4.856 14.769 20.758 1.00 0.00 H new TER 2160 VAL A 144