USER MOD reduce.3.24.130724 H: found=0, std=0, add=840, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 839 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 132 ASN : amide:sc= 0.886 K(o=3.6,f=1.8) USER MOD Set 1.2: A 133 HIS : no HE2:sc= 0.659 K(o=3.6,f=-0.2) USER MOD Set 1.3: B 149 C O2' : rot 64:sc= 2.07 USER MOD Set 2.1: A 101 MET CE :methyl -176:sc= -5.06! (180deg=-5.58!) USER MOD Set 2.2: A 110 MET CE :methyl 179:sc= -0.569 (180deg=-0.573) USER MOD Set 3.1: A 87 ASN : amide:sc= 0.939 X(o=1.3,f=1.1) USER MOD Set 3.2: A 138 THR OG1 : rot 149:sc= 0.406 USER MOD Set 4.1: A 65 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00192) USER MOD Set 4.2: B 147 C O5' : rot 160:sc= 0 USER MOD Set 5.1: A 62 HIS : no HE2:sc= -1.99 K(o=2.2,f=-9.6!) USER MOD Set 5.2: A 94 LYS NZ :NH3+ 152:sc= 1.51 (180deg=0.875) USER MOD Set 5.3: A 96 GLN : amide:sc= 1.56 K(o=2.2,f=-8.7!) USER MOD Set 5.4: B 147 C O2' : rot 167:sc= 1.13 USER MOD Single : A 51 SER OG : rot 89:sc= 0.154 USER MOD Single : A 53 SER OG : rot -140:sc= 0.451 USER MOD Single : A 58 SER OG : rot 180:sc= 0.00889 USER MOD Single : A 71 THR OG1 : rot 100:sc= 0.612 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 MET CE :methyl 154:sc= 0 (180deg=-0.202) USER MOD Single : A 92 LYS NZ :NH3+ 177:sc= 2.26 (180deg=2.25) USER MOD Single : A 95 ASN : amide:sc= 0.666 K(o=0.67,f=-0.69) USER MOD Single : A 102 ASN :FLIP amide:sc= -1.81 F(o=-3.9,f=-1.8) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.63 USER MOD Single : A 108 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 ASN : amide:sc= 0.317 X(o=0.32,f=0) USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 TYR OH : rot 180:sc= -0.131 USER MOD Single : A 115 THR OG1 : rot 70:sc= 0.77 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 GLN : amide:sc= -0.0372 K(o=-0.037,f=-2.7!) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 1.87 K(o=1.9,f=-6.4!) USER MOD Single : A 131 SER OG : rot 43:sc= 1.72 USER MOD Single : A 134 LYS NZ :NH3+ 161:sc= 0.802 (180deg=0.574) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 ASN : amide:sc=-0.00542 X(o=-0.0054,f=-0.21) USER MOD Single : A 144 GLN : amide:sc= 0.938 K(o=0.94,f=-5.5!) USER MOD Single : B 148 U O2' : rot 15:sc= 0.0902 USER MOD Single : B 150 U O2' : rot 1:sc= 0.131 USER MOD Single : B 151 C O2' : rot -17:sc= 0.102 USER MOD Single : B 152 U O2' : rot 180:sc= 0 USER MOD Single : B 152 U O3' : rot 131:sc= 0.0325 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 49 -23.727 2.299 -2.024 1.00 0.00 N ATOM 2 CA GLY A 49 -23.405 1.107 -2.843 1.00 0.00 C ATOM 3 C GLY A 49 -22.288 0.303 -2.202 1.00 0.00 C ATOM 4 O GLY A 49 -22.241 0.177 -0.978 1.00 0.00 O ATOM 0 HA2 GLY A 49 -24.292 0.484 -2.952 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -23.108 1.417 -3.845 1.00 0.00 H new ATOM 8 N ASP A 50 -21.348 -0.213 -2.999 1.00 0.00 N ATOM 9 CA ASP A 50 -20.096 -0.850 -2.534 1.00 0.00 C ATOM 10 C ASP A 50 -19.045 0.203 -2.090 1.00 0.00 C ATOM 11 O ASP A 50 -17.887 0.201 -2.512 1.00 0.00 O ATOM 12 CB ASP A 50 -19.584 -1.803 -3.631 1.00 0.00 C ATOM 13 CG ASP A 50 -18.438 -2.710 -3.151 1.00 0.00 C ATOM 14 OD1 ASP A 50 -18.450 -3.159 -1.982 1.00 0.00 O ATOM 15 OD2 ASP A 50 -17.510 -3.001 -3.943 1.00 0.00 O ATOM 0 H ASP A 50 -21.432 -0.203 -4.015 1.00 0.00 H new ATOM 0 HA ASP A 50 -20.293 -1.442 -1.640 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -20.409 -2.423 -3.980 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -19.243 -1.217 -4.484 1.00 0.00 H new ATOM 20 N SER A 51 -19.479 1.149 -1.252 1.00 0.00 N ATOM 21 CA SER A 51 -18.836 2.432 -0.909 1.00 0.00 C ATOM 22 C SER A 51 -17.627 2.334 0.043 1.00 0.00 C ATOM 23 O SER A 51 -17.100 3.355 0.491 1.00 0.00 O ATOM 24 CB SER A 51 -19.908 3.358 -0.313 1.00 0.00 C ATOM 25 OG SER A 51 -21.013 3.484 -1.207 1.00 0.00 O ATOM 0 H SER A 51 -20.361 1.033 -0.752 1.00 0.00 H new ATOM 0 HA SER A 51 -18.418 2.828 -1.834 1.00 0.00 H new ATOM 0 HB2 SER A 51 -20.249 2.961 0.643 1.00 0.00 H new ATOM 0 HB3 SER A 51 -19.479 4.340 -0.115 1.00 0.00 H new ATOM 0 HG SER A 51 -21.667 2.779 -1.020 1.00 0.00 H new ATOM 31 N ARG A 52 -17.157 1.116 0.347 1.00 0.00 N ATOM 32 CA ARG A 52 -16.011 0.766 1.219 1.00 0.00 C ATOM 33 C ARG A 52 -14.638 1.351 0.825 1.00 0.00 C ATOM 34 O ARG A 52 -13.691 1.243 1.604 1.00 0.00 O ATOM 35 CB ARG A 52 -15.952 -0.774 1.378 1.00 0.00 C ATOM 36 CG ARG A 52 -16.102 -1.619 0.094 1.00 0.00 C ATOM 37 CD ARG A 52 -15.066 -1.317 -0.995 1.00 0.00 C ATOM 38 NE ARG A 52 -15.271 -2.149 -2.190 1.00 0.00 N ATOM 39 CZ ARG A 52 -14.376 -2.488 -3.094 1.00 0.00 C ATOM 40 NH1 ARG A 52 -13.141 -2.082 -3.062 1.00 0.00 N ATOM 41 NH2 ARG A 52 -14.727 -3.258 -4.077 1.00 0.00 N ATOM 0 H ARG A 52 -17.598 0.280 -0.037 1.00 0.00 H new ATOM 0 HA ARG A 52 -16.210 1.254 2.173 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -15.000 -1.030 1.842 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -16.736 -1.073 2.073 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -16.033 -2.674 0.359 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -17.099 -1.458 -0.317 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -15.125 -0.264 -1.271 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -14.064 -1.488 -0.601 1.00 0.00 H new ATOM 0 HE ARG A 52 -16.216 -2.505 -2.335 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -12.825 -1.470 -2.310 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -12.489 -2.376 -3.789 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -15.688 -3.594 -4.144 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -14.042 -3.527 -4.783 1.00 0.00 H new ATOM 55 N SER A 53 -14.523 1.977 -0.347 1.00 0.00 N ATOM 56 CA SER A 53 -13.297 2.545 -0.922 1.00 0.00 C ATOM 57 C SER A 53 -13.564 3.981 -1.411 1.00 0.00 C ATOM 58 O SER A 53 -14.088 4.170 -2.508 1.00 0.00 O ATOM 59 CB SER A 53 -12.778 1.653 -2.065 1.00 0.00 C ATOM 60 OG SER A 53 -12.424 0.364 -1.578 1.00 0.00 O ATOM 0 H SER A 53 -15.329 2.110 -0.958 1.00 0.00 H new ATOM 0 HA SER A 53 -12.525 2.584 -0.154 1.00 0.00 H new ATOM 0 HB2 SER A 53 -13.544 1.558 -2.835 1.00 0.00 H new ATOM 0 HB3 SER A 53 -11.912 2.121 -2.533 1.00 0.00 H new ATOM 0 HG SER A 53 -11.602 0.062 -2.019 1.00 0.00 H new ATOM 66 N ALA A 54 -13.264 5.030 -0.641 1.00 0.00 N ATOM 67 CA ALA A 54 -12.675 5.069 0.706 1.00 0.00 C ATOM 68 C ALA A 54 -13.263 6.219 1.566 1.00 0.00 C ATOM 69 O ALA A 54 -14.144 6.953 1.107 1.00 0.00 O ATOM 70 CB ALA A 54 -11.150 5.135 0.531 1.00 0.00 C ATOM 0 H ALA A 54 -13.446 5.975 -0.979 1.00 0.00 H new ATOM 0 HA ALA A 54 -12.928 4.171 1.270 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -10.672 5.166 1.510 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -10.808 4.254 -0.012 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -10.887 6.032 -0.029 1.00 0.00 H new ATOM 76 N GLY A 55 -12.824 6.363 2.827 1.00 0.00 N ATOM 77 CA GLY A 55 -13.463 7.215 3.844 1.00 0.00 C ATOM 78 C GLY A 55 -12.992 8.665 3.766 1.00 0.00 C ATOM 79 O GLY A 55 -13.789 9.564 3.487 1.00 0.00 O ATOM 0 H GLY A 55 -11.996 5.880 3.176 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -14.545 7.180 3.716 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -13.246 6.818 4.836 1.00 0.00 H new ATOM 83 N VAL A 56 -11.686 8.885 3.968 1.00 0.00 N ATOM 84 CA VAL A 56 -10.997 10.166 3.698 1.00 0.00 C ATOM 85 C VAL A 56 -9.666 9.914 2.960 1.00 0.00 C ATOM 86 O VAL A 56 -8.586 9.961 3.555 1.00 0.00 O ATOM 87 CB VAL A 56 -10.809 10.989 4.979 1.00 0.00 C ATOM 88 CG1 VAL A 56 -10.333 12.416 4.652 1.00 0.00 C ATOM 89 CG2 VAL A 56 -12.090 11.139 5.815 1.00 0.00 C ATOM 0 H VAL A 56 -11.061 8.166 4.331 1.00 0.00 H new ATOM 0 HA VAL A 56 -11.629 10.765 3.042 1.00 0.00 H new ATOM 0 HB VAL A 56 -10.070 10.431 5.554 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -10.207 12.979 5.577 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -9.381 12.370 4.123 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -11.073 12.911 4.024 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -11.877 11.733 6.704 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -12.856 11.637 5.221 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -12.447 10.153 6.114 1.00 0.00 H new ATOM 99 N PRO A 57 -9.741 9.574 1.664 1.00 0.00 N ATOM 100 CA PRO A 57 -8.628 9.068 0.861 1.00 0.00 C ATOM 101 C PRO A 57 -7.937 10.154 0.008 1.00 0.00 C ATOM 102 O PRO A 57 -8.317 11.329 0.025 1.00 0.00 O ATOM 103 CB PRO A 57 -9.331 7.982 0.052 1.00 0.00 C ATOM 104 CG PRO A 57 -10.648 8.652 -0.341 1.00 0.00 C ATOM 105 CD PRO A 57 -10.991 9.403 0.935 1.00 0.00 C ATOM 0 HA PRO A 57 -7.783 8.700 1.443 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -8.750 7.689 -0.822 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -9.496 7.081 0.642 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -10.531 9.321 -1.193 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -11.415 7.926 -0.609 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -11.442 10.369 0.707 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -11.714 8.846 1.531 1.00 0.00 H new ATOM 113 N SER A 58 -6.891 9.763 -0.726 1.00 0.00 N ATOM 114 CA SER A 58 -6.074 10.608 -1.620 1.00 0.00 C ATOM 115 C SER A 58 -5.475 9.772 -2.765 1.00 0.00 C ATOM 116 O SER A 58 -5.771 8.584 -2.873 1.00 0.00 O ATOM 117 CB SER A 58 -4.973 11.283 -0.795 1.00 0.00 C ATOM 118 OG SER A 58 -4.250 12.249 -1.538 1.00 0.00 O ATOM 0 H SER A 58 -6.569 8.795 -0.716 1.00 0.00 H new ATOM 0 HA SER A 58 -6.703 11.374 -2.074 1.00 0.00 H new ATOM 0 HB2 SER A 58 -5.419 11.760 0.078 1.00 0.00 H new ATOM 0 HB3 SER A 58 -4.284 10.524 -0.426 1.00 0.00 H new ATOM 0 HG SER A 58 -3.562 12.652 -0.968 1.00 0.00 H new ATOM 124 N ARG A 59 -4.621 10.351 -3.624 1.00 0.00 N ATOM 125 CA ARG A 59 -3.992 9.624 -4.750 1.00 0.00 C ATOM 126 C ARG A 59 -2.946 8.586 -4.329 1.00 0.00 C ATOM 127 O ARG A 59 -2.479 7.854 -5.202 1.00 0.00 O ATOM 128 CB ARG A 59 -3.348 10.552 -5.794 1.00 0.00 C ATOM 129 CG ARG A 59 -4.122 11.798 -6.259 1.00 0.00 C ATOM 130 CD ARG A 59 -3.867 13.059 -5.419 1.00 0.00 C ATOM 131 NE ARG A 59 -2.426 13.342 -5.277 1.00 0.00 N ATOM 132 CZ ARG A 59 -1.848 14.434 -4.833 1.00 0.00 C ATOM 133 NH1 ARG A 59 -2.487 15.531 -4.555 1.00 0.00 N ATOM 134 NH2 ARG A 59 -0.571 14.434 -4.623 1.00 0.00 N ATOM 0 H ARG A 59 -4.345 11.331 -3.563 1.00 0.00 H new ATOM 0 HA ARG A 59 -4.839 9.102 -5.196 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -2.393 10.889 -5.391 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -3.128 9.952 -6.677 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -3.858 12.008 -7.295 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -5.189 11.575 -6.241 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -4.360 13.912 -5.885 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -4.312 12.934 -4.432 1.00 0.00 H new ATOM 0 HE ARG A 59 -1.797 12.591 -5.561 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -3.498 15.577 -4.679 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -1.977 16.346 -4.213 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -0.025 13.592 -4.802 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -0.111 15.276 -4.278 1.00 0.00 H new ATOM 148 N VAL A 60 -2.560 8.499 -3.046 1.00 0.00 N ATOM 149 CA VAL A 60 -1.840 7.319 -2.546 1.00 0.00 C ATOM 150 C VAL A 60 -2.786 6.151 -2.252 1.00 0.00 C ATOM 151 O VAL A 60 -3.756 6.269 -1.507 1.00 0.00 O ATOM 152 CB VAL A 60 -0.801 7.582 -1.443 1.00 0.00 C ATOM 153 CG1 VAL A 60 -1.217 8.279 -0.150 1.00 0.00 C ATOM 154 CG2 VAL A 60 -0.074 6.282 -1.131 1.00 0.00 C ATOM 0 H VAL A 60 -2.732 9.221 -2.346 1.00 0.00 H new ATOM 0 HA VAL A 60 -1.208 7.010 -3.379 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.168 8.347 -1.893 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -0.352 8.376 0.506 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.611 9.269 -0.381 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -1.986 7.690 0.350 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.666 6.457 -0.350 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -0.792 5.536 -0.790 1.00 0.00 H new ATOM 0 HG23 VAL A 60 0.426 5.920 -2.029 1.00 0.00 H new ATOM 164 N ILE A 61 -2.473 5.003 -2.843 1.00 0.00 N ATOM 165 CA ILE A 61 -3.049 3.677 -2.604 1.00 0.00 C ATOM 166 C ILE A 61 -2.017 2.835 -1.848 1.00 0.00 C ATOM 167 O ILE A 61 -0.821 3.081 -1.971 1.00 0.00 O ATOM 168 CB ILE A 61 -3.430 3.088 -3.979 1.00 0.00 C ATOM 169 CG1 ILE A 61 -4.604 3.881 -4.597 1.00 0.00 C ATOM 170 CG2 ILE A 61 -3.768 1.592 -3.966 1.00 0.00 C ATOM 171 CD1 ILE A 61 -4.541 3.855 -6.124 1.00 0.00 C ATOM 0 H ILE A 61 -1.750 4.969 -3.562 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.949 3.706 -1.989 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.533 3.187 -4.590 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.550 3.457 -4.262 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.575 4.913 -4.246 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -4.023 1.268 -4.975 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -2.906 1.027 -3.610 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.615 1.416 -3.303 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.379 4.420 -6.532 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.604 4.302 -6.457 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.595 2.824 -6.473 1.00 0.00 H new ATOM 183 N HIS A 62 -2.449 1.834 -1.089 1.00 0.00 N ATOM 184 CA HIS A 62 -1.604 0.881 -0.366 1.00 0.00 C ATOM 185 C HIS A 62 -1.918 -0.564 -0.793 1.00 0.00 C ATOM 186 O HIS A 62 -3.074 -0.914 -1.053 1.00 0.00 O ATOM 187 CB HIS A 62 -1.754 1.120 1.146 1.00 0.00 C ATOM 188 CG HIS A 62 -1.304 -0.024 2.036 1.00 0.00 C ATOM 189 ND1 HIS A 62 -1.885 -1.271 2.129 1.00 0.00 N ATOM 190 CD2 HIS A 62 -0.316 0.028 2.983 1.00 0.00 C ATOM 191 CE1 HIS A 62 -1.229 -1.967 3.074 1.00 0.00 C ATOM 192 NE2 HIS A 62 -0.252 -1.219 3.615 1.00 0.00 N ATOM 0 H HIS A 62 -3.444 1.654 -0.952 1.00 0.00 H new ATOM 0 HA HIS A 62 -0.556 1.039 -0.619 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -1.186 2.011 1.414 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -2.801 1.334 1.360 1.00 0.00 H new ATOM 0 HD1 HIS A 62 -2.674 -1.607 1.577 1.00 0.00 H new ATOM 0 HD2 HIS A 62 0.306 0.883 3.204 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -1.455 -2.984 3.358 1.00 0.00 H new ATOM 200 N ILE A 63 -0.880 -1.405 -0.815 1.00 0.00 N ATOM 201 CA ILE A 63 -0.855 -2.785 -1.335 1.00 0.00 C ATOM 202 C ILE A 63 -0.338 -3.754 -0.246 1.00 0.00 C ATOM 203 O ILE A 63 0.580 -3.388 0.489 1.00 0.00 O ATOM 204 CB ILE A 63 0.043 -2.876 -2.604 1.00 0.00 C ATOM 205 CG1 ILE A 63 -0.036 -1.623 -3.517 1.00 0.00 C ATOM 206 CG2 ILE A 63 -0.294 -4.155 -3.394 1.00 0.00 C ATOM 207 CD1 ILE A 63 0.821 -1.686 -4.788 1.00 0.00 C ATOM 0 H ILE A 63 0.029 -1.126 -0.446 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.871 -3.070 -1.610 1.00 0.00 H new ATOM 0 HB ILE A 63 1.075 -2.919 -2.255 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -1.076 -1.469 -3.806 1.00 0.00 H new ATOM 0 HG13 ILE A 63 0.266 -0.751 -2.937 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.338 -4.212 -4.280 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.118 -5.028 -2.766 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.341 -4.131 -3.696 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.696 -0.765 -5.357 1.00 0.00 H new ATOM 0 HD12 ILE A 63 1.869 -1.805 -4.514 1.00 0.00 H new ATOM 0 HD13 ILE A 63 0.507 -2.534 -5.397 1.00 0.00 H new ATOM 219 N ARG A 64 -0.863 -4.991 -0.159 1.00 0.00 N ATOM 220 CA ARG A 64 -0.334 -6.103 0.668 1.00 0.00 C ATOM 221 C ARG A 64 0.313 -7.185 -0.210 1.00 0.00 C ATOM 222 O ARG A 64 0.058 -7.220 -1.409 1.00 0.00 O ATOM 223 CB ARG A 64 -1.457 -6.752 1.519 1.00 0.00 C ATOM 224 CG ARG A 64 -2.385 -5.765 2.244 1.00 0.00 C ATOM 225 CD ARG A 64 -3.353 -6.430 3.243 1.00 0.00 C ATOM 226 NE ARG A 64 -4.765 -6.438 2.807 1.00 0.00 N ATOM 227 CZ ARG A 64 -5.574 -5.411 2.608 1.00 0.00 C ATOM 228 NH1 ARG A 64 -5.192 -4.174 2.733 1.00 0.00 N ATOM 229 NH2 ARG A 64 -6.811 -5.587 2.261 1.00 0.00 N ATOM 0 H ARG A 64 -1.698 -5.258 -0.680 1.00 0.00 H new ATOM 0 HA ARG A 64 0.419 -5.677 1.331 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -2.062 -7.385 0.870 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -0.997 -7.405 2.261 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -1.776 -5.034 2.776 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -2.965 -5.217 1.502 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -3.032 -7.458 3.413 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -3.283 -5.911 4.199 1.00 0.00 H new ATOM 0 HE ARG A 64 -5.170 -7.359 2.637 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -4.230 -3.962 2.996 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -5.855 -3.416 2.568 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -7.176 -6.531 2.137 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -7.419 -4.781 2.112 1.00 0.00 H new ATOM 243 N LYS A 65 1.014 -8.157 0.396 1.00 0.00 N ATOM 244 CA LYS A 65 1.272 -9.513 -0.167 1.00 0.00 C ATOM 245 C LYS A 65 1.951 -9.538 -1.538 1.00 0.00 C ATOM 246 O LYS A 65 1.757 -10.439 -2.357 1.00 0.00 O ATOM 247 CB LYS A 65 -0.041 -10.290 -0.198 1.00 0.00 C ATOM 248 CG LYS A 65 -0.560 -10.501 1.219 1.00 0.00 C ATOM 249 CD LYS A 65 -2.020 -10.871 1.126 1.00 0.00 C ATOM 250 CE LYS A 65 -2.323 -12.298 0.643 1.00 0.00 C ATOM 251 NZ LYS A 65 -1.879 -13.339 1.611 1.00 0.00 N ATOM 0 H LYS A 65 1.433 -8.028 1.317 1.00 0.00 H new ATOM 0 HA LYS A 65 1.997 -9.985 0.495 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -0.780 -9.747 -0.787 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.109 -11.253 -0.685 1.00 0.00 H new ATOM 0 HG2 LYS A 65 0.003 -11.290 1.718 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -0.433 -9.595 1.811 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -2.472 -10.738 2.109 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -2.510 -10.169 0.452 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -3.395 -12.400 0.473 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -1.831 -12.465 -0.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -2.123 -14.281 1.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -0.849 -13.274 1.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -2.355 -13.190 2.524 1.00 0.00 H new ATOM 265 N LEU A 66 2.791 -8.543 -1.758 1.00 0.00 N ATOM 266 CA LEU A 66 3.765 -8.503 -2.841 1.00 0.00 C ATOM 267 C LEU A 66 4.815 -9.616 -2.671 1.00 0.00 C ATOM 268 O LEU A 66 4.868 -10.270 -1.624 1.00 0.00 O ATOM 269 CB LEU A 66 4.401 -7.098 -2.858 1.00 0.00 C ATOM 270 CG LEU A 66 3.528 -6.105 -3.650 1.00 0.00 C ATOM 271 CD1 LEU A 66 3.277 -4.825 -2.873 1.00 0.00 C ATOM 272 CD2 LEU A 66 4.234 -5.674 -4.926 1.00 0.00 C ATOM 0 H LEU A 66 2.817 -7.711 -1.169 1.00 0.00 H new ATOM 0 HA LEU A 66 3.280 -8.686 -3.800 1.00 0.00 H new ATOM 0 HB2 LEU A 66 4.529 -6.741 -1.836 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.394 -7.150 -3.304 1.00 0.00 H new ATOM 0 HG LEU A 66 2.592 -6.626 -3.852 1.00 0.00 H new ATOM 0 HD11 LEU A 66 2.658 -4.154 -3.468 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.764 -5.060 -1.940 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.228 -4.341 -2.652 1.00 0.00 H new ATOM 0 HD21 LEU A 66 3.603 -4.973 -5.472 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.178 -5.191 -4.674 1.00 0.00 H new ATOM 0 HD23 LEU A 66 4.428 -6.548 -5.548 1.00 0.00 H new ATOM 284 N PRO A 67 5.686 -9.828 -3.669 1.00 0.00 N ATOM 285 CA PRO A 67 6.988 -10.460 -3.499 1.00 0.00 C ATOM 286 C PRO A 67 7.855 -9.834 -2.393 1.00 0.00 C ATOM 287 O PRO A 67 7.540 -8.804 -1.796 1.00 0.00 O ATOM 288 CB PRO A 67 7.666 -10.353 -4.872 1.00 0.00 C ATOM 289 CG PRO A 67 6.479 -10.342 -5.825 1.00 0.00 C ATOM 290 CD PRO A 67 5.451 -9.511 -5.060 1.00 0.00 C ATOM 0 HA PRO A 67 6.861 -11.491 -3.168 1.00 0.00 H new ATOM 0 HB2 PRO A 67 8.265 -9.447 -4.959 1.00 0.00 H new ATOM 0 HB3 PRO A 67 8.332 -11.195 -5.063 1.00 0.00 H new ATOM 0 HG2 PRO A 67 6.733 -9.891 -6.784 1.00 0.00 H new ATOM 0 HG3 PRO A 67 6.115 -11.348 -6.032 1.00 0.00 H new ATOM 0 HD2 PRO A 67 5.581 -8.446 -5.251 1.00 0.00 H new ATOM 0 HD3 PRO A 67 4.434 -9.766 -5.358 1.00 0.00 H new ATOM 298 N ILE A 68 8.994 -10.482 -2.151 1.00 0.00 N ATOM 299 CA ILE A 68 9.921 -10.242 -1.023 1.00 0.00 C ATOM 300 C ILE A 68 10.568 -8.854 -1.064 1.00 0.00 C ATOM 301 O ILE A 68 10.772 -8.207 -0.035 1.00 0.00 O ATOM 302 CB ILE A 68 10.986 -11.363 -0.960 1.00 0.00 C ATOM 303 CG1 ILE A 68 11.779 -11.531 -2.282 1.00 0.00 C ATOM 304 CG2 ILE A 68 10.272 -12.670 -0.584 1.00 0.00 C ATOM 305 CD1 ILE A 68 12.891 -12.584 -2.226 1.00 0.00 C ATOM 0 H ILE A 68 9.321 -11.230 -2.763 1.00 0.00 H new ATOM 0 HA ILE A 68 9.329 -10.266 -0.108 1.00 0.00 H new ATOM 0 HB ILE A 68 11.728 -11.091 -0.210 1.00 0.00 H new ATOM 0 HG12 ILE A 68 11.083 -11.798 -3.077 1.00 0.00 H new ATOM 0 HG13 ILE A 68 12.218 -10.571 -2.552 1.00 0.00 H new ATOM 0 HG21 ILE A 68 10.999 -13.480 -0.532 1.00 0.00 H new ATOM 0 HG22 ILE A 68 9.788 -12.554 0.386 1.00 0.00 H new ATOM 0 HG23 ILE A 68 9.521 -12.905 -1.339 1.00 0.00 H new ATOM 0 HD11 ILE A 68 13.393 -12.635 -3.192 1.00 0.00 H new ATOM 0 HD12 ILE A 68 13.613 -12.311 -1.456 1.00 0.00 H new ATOM 0 HD13 ILE A 68 12.459 -13.557 -1.990 1.00 0.00 H new ATOM 317 N ASP A 69 10.858 -8.385 -2.276 1.00 0.00 N ATOM 318 CA ASP A 69 11.317 -7.023 -2.585 1.00 0.00 C ATOM 319 C ASP A 69 10.747 -6.467 -3.908 1.00 0.00 C ATOM 320 O ASP A 69 10.863 -5.272 -4.174 1.00 0.00 O ATOM 321 CB ASP A 69 12.854 -7.010 -2.589 1.00 0.00 C ATOM 322 CG ASP A 69 13.420 -5.602 -2.342 1.00 0.00 C ATOM 323 OD1 ASP A 69 13.200 -5.076 -1.224 1.00 0.00 O ATOM 324 OD2 ASP A 69 14.134 -5.060 -3.217 1.00 0.00 O ATOM 0 H ASP A 69 10.777 -8.966 -3.110 1.00 0.00 H new ATOM 0 HA ASP A 69 10.937 -6.357 -1.810 1.00 0.00 H new ATOM 0 HB2 ASP A 69 13.224 -7.689 -1.821 1.00 0.00 H new ATOM 0 HB3 ASP A 69 13.217 -7.384 -3.546 1.00 0.00 H new ATOM 329 N VAL A 70 10.109 -7.333 -4.719 1.00 0.00 N ATOM 330 CA VAL A 70 9.608 -7.103 -6.090 1.00 0.00 C ATOM 331 C VAL A 70 10.616 -6.304 -6.951 1.00 0.00 C ATOM 332 O VAL A 70 11.829 -6.427 -6.744 1.00 0.00 O ATOM 333 CB VAL A 70 8.140 -6.608 -6.022 1.00 0.00 C ATOM 334 CG1 VAL A 70 7.957 -5.136 -5.643 1.00 0.00 C ATOM 335 CG2 VAL A 70 7.364 -6.895 -7.317 1.00 0.00 C ATOM 0 H VAL A 70 9.915 -8.285 -4.410 1.00 0.00 H new ATOM 0 HA VAL A 70 9.548 -8.032 -6.658 1.00 0.00 H new ATOM 0 HB VAL A 70 7.726 -7.193 -5.201 1.00 0.00 H new ATOM 0 HG11 VAL A 70 6.894 -4.894 -5.624 1.00 0.00 H new ATOM 0 HG12 VAL A 70 8.387 -4.958 -4.657 1.00 0.00 H new ATOM 0 HG13 VAL A 70 8.459 -4.506 -6.377 1.00 0.00 H new ATOM 0 HG21 VAL A 70 6.342 -6.529 -7.218 1.00 0.00 H new ATOM 0 HG22 VAL A 70 7.850 -6.391 -8.152 1.00 0.00 H new ATOM 0 HG23 VAL A 70 7.348 -7.969 -7.501 1.00 0.00 H new ATOM 345 N THR A 71 10.171 -5.524 -7.938 1.00 0.00 N ATOM 346 CA THR A 71 10.918 -4.349 -8.413 1.00 0.00 C ATOM 347 C THR A 71 10.002 -3.134 -8.451 1.00 0.00 C ATOM 348 O THR A 71 8.804 -3.235 -8.747 1.00 0.00 O ATOM 349 CB THR A 71 11.644 -4.556 -9.765 1.00 0.00 C ATOM 350 OG1 THR A 71 10.831 -4.207 -10.863 1.00 0.00 O ATOM 351 CG2 THR A 71 12.133 -5.979 -10.036 1.00 0.00 C ATOM 0 H THR A 71 9.291 -5.683 -8.429 1.00 0.00 H new ATOM 0 HA THR A 71 11.719 -4.181 -7.694 1.00 0.00 H new ATOM 0 HB THR A 71 12.509 -3.901 -9.666 1.00 0.00 H new ATOM 0 HG1 THR A 71 11.074 -3.312 -11.179 1.00 0.00 H new ATOM 0 HG21 THR A 71 12.627 -6.015 -11.007 1.00 0.00 H new ATOM 0 HG22 THR A 71 12.838 -6.276 -9.259 1.00 0.00 H new ATOM 0 HG23 THR A 71 11.284 -6.662 -10.035 1.00 0.00 H new ATOM 359 N GLU A 72 10.561 -1.959 -8.151 1.00 0.00 N ATOM 360 CA GLU A 72 9.811 -0.714 -8.293 1.00 0.00 C ATOM 361 C GLU A 72 9.363 -0.515 -9.750 1.00 0.00 C ATOM 362 O GLU A 72 8.226 -0.125 -9.994 1.00 0.00 O ATOM 363 CB GLU A 72 10.606 0.471 -7.705 1.00 0.00 C ATOM 364 CG GLU A 72 10.582 1.786 -8.505 1.00 0.00 C ATOM 365 CD GLU A 72 11.559 1.839 -9.704 1.00 0.00 C ATOM 366 OE1 GLU A 72 12.549 1.068 -9.751 1.00 0.00 O ATOM 367 OE2 GLU A 72 11.362 2.692 -10.602 1.00 0.00 O ATOM 0 H GLU A 72 11.517 -1.846 -7.813 1.00 0.00 H new ATOM 0 HA GLU A 72 8.893 -0.770 -7.708 1.00 0.00 H new ATOM 0 HB2 GLU A 72 10.223 0.674 -6.705 1.00 0.00 H new ATOM 0 HB3 GLU A 72 11.645 0.161 -7.592 1.00 0.00 H new ATOM 0 HG2 GLU A 72 9.569 1.952 -8.873 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.814 2.609 -7.829 1.00 0.00 H new ATOM 374 N GLY A 73 10.221 -0.872 -10.710 1.00 0.00 N ATOM 375 CA GLY A 73 9.944 -0.867 -12.146 1.00 0.00 C ATOM 376 C GLY A 73 8.691 -1.668 -12.509 1.00 0.00 C ATOM 377 O GLY A 73 7.884 -1.212 -13.309 1.00 0.00 O ATOM 0 H GLY A 73 11.168 -1.186 -10.496 1.00 0.00 H new ATOM 0 HA2 GLY A 73 9.823 0.162 -12.485 1.00 0.00 H new ATOM 0 HA3 GLY A 73 10.801 -1.280 -12.679 1.00 0.00 H new ATOM 381 N GLU A 74 8.491 -2.832 -11.889 1.00 0.00 N ATOM 382 CA GLU A 74 7.267 -3.630 -12.013 1.00 0.00 C ATOM 383 C GLU A 74 6.047 -2.883 -11.467 1.00 0.00 C ATOM 384 O GLU A 74 5.064 -2.702 -12.187 1.00 0.00 O ATOM 385 CB GLU A 74 7.441 -5.013 -11.352 1.00 0.00 C ATOM 386 CG GLU A 74 7.986 -6.024 -12.367 1.00 0.00 C ATOM 387 CD GLU A 74 7.895 -7.466 -11.834 1.00 0.00 C ATOM 388 OE1 GLU A 74 8.707 -7.859 -10.962 1.00 0.00 O ATOM 389 OE2 GLU A 74 7.012 -8.225 -12.306 1.00 0.00 O ATOM 0 H GLU A 74 9.187 -3.256 -11.275 1.00 0.00 H new ATOM 0 HA GLU A 74 7.083 -3.795 -13.075 1.00 0.00 H new ATOM 0 HB2 GLU A 74 8.122 -4.935 -10.505 1.00 0.00 H new ATOM 0 HB3 GLU A 74 6.484 -5.360 -10.961 1.00 0.00 H new ATOM 0 HG2 GLU A 74 7.426 -5.944 -13.299 1.00 0.00 H new ATOM 0 HG3 GLU A 74 9.024 -5.785 -12.598 1.00 0.00 H new ATOM 396 N VAL A 75 6.114 -2.406 -10.221 1.00 0.00 N ATOM 397 CA VAL A 75 4.997 -1.705 -9.560 1.00 0.00 C ATOM 398 C VAL A 75 4.564 -0.436 -10.320 1.00 0.00 C ATOM 399 O VAL A 75 3.378 -0.238 -10.605 1.00 0.00 O ATOM 400 CB VAL A 75 5.348 -1.420 -8.089 1.00 0.00 C ATOM 401 CG1 VAL A 75 4.220 -0.692 -7.348 1.00 0.00 C ATOM 402 CG2 VAL A 75 5.610 -2.749 -7.366 1.00 0.00 C ATOM 0 H VAL A 75 6.945 -2.493 -9.636 1.00 0.00 H new ATOM 0 HA VAL A 75 4.128 -2.363 -9.578 1.00 0.00 H new ATOM 0 HB VAL A 75 6.230 -0.779 -8.087 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.518 -0.515 -6.315 1.00 0.00 H new ATOM 0 HG12 VAL A 75 4.020 0.262 -7.836 1.00 0.00 H new ATOM 0 HG13 VAL A 75 3.319 -1.305 -7.365 1.00 0.00 H new ATOM 0 HG21 VAL A 75 5.859 -2.553 -6.323 1.00 0.00 H new ATOM 0 HG22 VAL A 75 4.717 -3.372 -7.415 1.00 0.00 H new ATOM 0 HG23 VAL A 75 6.440 -3.267 -7.846 1.00 0.00 H new ATOM 412 N ILE A 76 5.504 0.420 -10.711 1.00 0.00 N ATOM 413 CA ILE A 76 5.202 1.656 -11.445 1.00 0.00 C ATOM 414 C ILE A 76 4.820 1.401 -12.902 1.00 0.00 C ATOM 415 O ILE A 76 3.948 2.098 -13.413 1.00 0.00 O ATOM 416 CB ILE A 76 6.342 2.683 -11.321 1.00 0.00 C ATOM 417 CG1 ILE A 76 7.638 2.308 -12.064 1.00 0.00 C ATOM 418 CG2 ILE A 76 6.646 2.898 -9.841 1.00 0.00 C ATOM 419 CD1 ILE A 76 7.685 2.910 -13.463 1.00 0.00 C ATOM 0 H ILE A 76 6.498 0.281 -10.530 1.00 0.00 H new ATOM 0 HA ILE A 76 4.320 2.088 -10.972 1.00 0.00 H new ATOM 0 HB ILE A 76 5.987 3.594 -11.803 1.00 0.00 H new ATOM 0 HG12 ILE A 76 8.498 2.654 -11.491 1.00 0.00 H new ATOM 0 HG13 ILE A 76 7.716 1.223 -12.133 1.00 0.00 H new ATOM 0 HG21 ILE A 76 7.452 3.624 -9.737 1.00 0.00 H new ATOM 0 HG22 ILE A 76 5.755 3.271 -9.337 1.00 0.00 H new ATOM 0 HG23 ILE A 76 6.948 1.953 -9.391 1.00 0.00 H new ATOM 0 HD11 ILE A 76 8.615 2.621 -13.952 1.00 0.00 H new ATOM 0 HD12 ILE A 76 6.840 2.544 -14.045 1.00 0.00 H new ATOM 0 HD13 ILE A 76 7.634 3.997 -13.393 1.00 0.00 H new ATOM 431 N SER A 77 5.381 0.378 -13.562 1.00 0.00 N ATOM 432 CA SER A 77 4.920 -0.035 -14.901 1.00 0.00 C ATOM 433 C SER A 77 3.480 -0.529 -14.848 1.00 0.00 C ATOM 434 O SER A 77 2.697 -0.296 -15.773 1.00 0.00 O ATOM 435 CB SER A 77 5.839 -1.110 -15.495 1.00 0.00 C ATOM 436 OG SER A 77 5.455 -1.442 -16.821 1.00 0.00 O ATOM 0 H SER A 77 6.152 -0.179 -13.194 1.00 0.00 H new ATOM 0 HA SER A 77 4.959 0.838 -15.552 1.00 0.00 H new ATOM 0 HB2 SER A 77 6.869 -0.754 -15.491 1.00 0.00 H new ATOM 0 HB3 SER A 77 5.808 -2.003 -14.871 1.00 0.00 H new ATOM 0 HG SER A 77 6.059 -2.128 -17.174 1.00 0.00 H new ATOM 442 N LEU A 78 3.098 -1.106 -13.710 1.00 0.00 N ATOM 443 CA LEU A 78 1.729 -1.509 -13.451 1.00 0.00 C ATOM 444 C LEU A 78 0.786 -0.345 -13.109 1.00 0.00 C ATOM 445 O LEU A 78 -0.419 -0.487 -13.311 1.00 0.00 O ATOM 446 CB LEU A 78 1.716 -2.589 -12.358 1.00 0.00 C ATOM 447 CG LEU A 78 1.935 -3.999 -12.917 1.00 0.00 C ATOM 448 CD1 LEU A 78 2.356 -4.951 -11.798 1.00 0.00 C ATOM 449 CD2 LEU A 78 0.640 -4.505 -13.558 1.00 0.00 C ATOM 0 H LEU A 78 3.738 -1.305 -12.941 1.00 0.00 H new ATOM 0 HA LEU A 78 1.333 -1.918 -14.380 1.00 0.00 H new ATOM 0 HB2 LEU A 78 2.493 -2.368 -11.626 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.762 -2.556 -11.831 1.00 0.00 H new ATOM 0 HG LEU A 78 2.724 -3.962 -13.668 1.00 0.00 H new ATOM 0 HD11 LEU A 78 2.508 -5.949 -12.208 1.00 0.00 H new ATOM 0 HD12 LEU A 78 3.284 -4.597 -11.349 1.00 0.00 H new ATOM 0 HD13 LEU A 78 1.576 -4.986 -11.038 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.798 -5.508 -13.955 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.151 -4.532 -12.808 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.349 -3.836 -14.368 1.00 0.00 H new ATOM 461 N GLY A 79 1.308 0.809 -12.673 1.00 0.00 N ATOM 462 CA GLY A 79 0.520 2.028 -12.469 1.00 0.00 C ATOM 463 C GLY A 79 0.548 3.032 -13.631 1.00 0.00 C ATOM 464 O GLY A 79 -0.297 3.924 -13.686 1.00 0.00 O ATOM 0 H GLY A 79 2.297 0.922 -12.451 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -0.515 1.744 -12.281 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.881 2.528 -11.570 1.00 0.00 H new ATOM 468 N LEU A 80 1.505 2.937 -14.554 1.00 0.00 N ATOM 469 CA LEU A 80 1.753 3.951 -15.582 1.00 0.00 C ATOM 470 C LEU A 80 0.596 4.236 -16.558 1.00 0.00 C ATOM 471 O LEU A 80 0.238 5.411 -16.678 1.00 0.00 O ATOM 472 CB LEU A 80 3.080 3.657 -16.314 1.00 0.00 C ATOM 473 CG LEU A 80 4.249 4.499 -15.775 1.00 0.00 C ATOM 474 CD1 LEU A 80 5.548 4.077 -16.455 1.00 0.00 C ATOM 475 CD2 LEU A 80 4.022 5.986 -16.048 1.00 0.00 C ATOM 0 H LEU A 80 2.140 2.141 -14.610 1.00 0.00 H new ATOM 0 HA LEU A 80 1.835 4.890 -15.035 1.00 0.00 H new ATOM 0 HB2 LEU A 80 3.321 2.599 -16.212 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.955 3.854 -17.379 1.00 0.00 H new ATOM 0 HG LEU A 80 4.312 4.335 -14.699 1.00 0.00 H new ATOM 0 HD11 LEU A 80 6.372 4.677 -16.069 1.00 0.00 H new ATOM 0 HD12 LEU A 80 5.740 3.023 -16.251 1.00 0.00 H new ATOM 0 HD13 LEU A 80 5.461 4.229 -17.531 1.00 0.00 H new ATOM 0 HD21 LEU A 80 4.862 6.560 -15.657 1.00 0.00 H new ATOM 0 HD22 LEU A 80 3.939 6.150 -17.122 1.00 0.00 H new ATOM 0 HD23 LEU A 80 3.103 6.310 -15.559 1.00 0.00 H new ATOM 487 N PRO A 81 -0.014 3.247 -17.247 1.00 0.00 N ATOM 488 CA PRO A 81 -1.111 3.467 -18.204 1.00 0.00 C ATOM 489 C PRO A 81 -2.469 3.747 -17.529 1.00 0.00 C ATOM 490 O PRO A 81 -3.523 3.277 -17.967 1.00 0.00 O ATOM 491 CB PRO A 81 -1.077 2.236 -19.120 1.00 0.00 C ATOM 492 CG PRO A 81 -0.632 1.124 -18.172 1.00 0.00 C ATOM 493 CD PRO A 81 0.353 1.832 -17.242 1.00 0.00 C ATOM 0 HA PRO A 81 -0.977 4.379 -18.786 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -2.054 2.029 -19.557 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -0.379 2.366 -19.947 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -1.474 0.703 -17.622 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -0.159 0.302 -18.709 1.00 0.00 H new ATOM 0 HD2 PRO A 81 0.299 1.421 -16.234 1.00 0.00 H new ATOM 0 HD3 PRO A 81 1.378 1.696 -17.587 1.00 0.00 H new ATOM 501 N PHE A 82 -2.438 4.572 -16.481 1.00 0.00 N ATOM 502 CA PHE A 82 -3.578 5.026 -15.695 1.00 0.00 C ATOM 503 C PHE A 82 -3.576 6.549 -15.546 1.00 0.00 C ATOM 504 O PHE A 82 -4.619 7.184 -15.718 1.00 0.00 O ATOM 505 CB PHE A 82 -3.588 4.332 -14.321 1.00 0.00 C ATOM 506 CG PHE A 82 -3.698 2.822 -14.410 1.00 0.00 C ATOM 507 CD1 PHE A 82 -2.619 2.022 -14.842 1.00 0.00 C ATOM 508 CD2 PHE A 82 -4.935 2.223 -14.139 1.00 0.00 C ATOM 509 CE1 PHE A 82 -2.805 0.641 -15.049 1.00 0.00 C ATOM 510 CE2 PHE A 82 -5.133 0.859 -14.389 1.00 0.00 C ATOM 511 CZ PHE A 82 -4.067 0.064 -14.839 1.00 0.00 C ATOM 0 H PHE A 82 -1.560 4.963 -16.140 1.00 0.00 H new ATOM 0 HA PHE A 82 -4.491 4.752 -16.224 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -2.675 4.591 -13.784 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -4.423 4.716 -13.734 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -1.651 2.468 -15.014 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -5.741 2.817 -13.735 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -1.977 0.026 -15.369 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -6.107 0.418 -14.235 1.00 0.00 H new ATOM 0 HZ PHE A 82 -4.218 -0.989 -15.023 1.00 0.00 H new ATOM 521 N GLY A 83 -2.402 7.147 -15.301 1.00 0.00 N ATOM 522 CA GLY A 83 -2.175 8.578 -15.477 1.00 0.00 C ATOM 523 C GLY A 83 -0.695 8.906 -15.653 1.00 0.00 C ATOM 524 O GLY A 83 -0.103 8.704 -16.712 1.00 0.00 O ATOM 0 H GLY A 83 -1.579 6.642 -14.972 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -2.730 8.928 -16.347 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -2.565 9.116 -14.613 1.00 0.00 H new ATOM 528 N LYS A 84 -0.103 9.380 -14.560 1.00 0.00 N ATOM 529 CA LYS A 84 1.313 9.552 -14.259 1.00 0.00 C ATOM 530 C LYS A 84 1.426 9.221 -12.779 1.00 0.00 C ATOM 531 O LYS A 84 0.520 9.599 -12.032 1.00 0.00 O ATOM 532 CB LYS A 84 1.698 11.023 -14.533 1.00 0.00 C ATOM 533 CG LYS A 84 3.159 11.250 -14.949 1.00 0.00 C ATOM 534 CD LYS A 84 3.551 10.574 -16.275 1.00 0.00 C ATOM 535 CE LYS A 84 5.023 10.817 -16.649 1.00 0.00 C ATOM 536 NZ LYS A 84 5.296 12.232 -17.018 1.00 0.00 N ATOM 0 H LYS A 84 -0.673 9.689 -13.773 1.00 0.00 H new ATOM 0 HA LYS A 84 1.972 8.925 -14.859 1.00 0.00 H new ATOM 0 HB2 LYS A 84 1.049 11.412 -15.318 1.00 0.00 H new ATOM 0 HB3 LYS A 84 1.498 11.608 -13.635 1.00 0.00 H new ATOM 0 HG2 LYS A 84 3.338 12.322 -15.034 1.00 0.00 H new ATOM 0 HG3 LYS A 84 3.812 10.879 -14.159 1.00 0.00 H new ATOM 0 HD2 LYS A 84 3.371 9.502 -16.199 1.00 0.00 H new ATOM 0 HD3 LYS A 84 2.910 10.949 -17.073 1.00 0.00 H new ATOM 0 HE2 LYS A 84 5.658 10.536 -15.809 1.00 0.00 H new ATOM 0 HE3 LYS A 84 5.293 10.170 -17.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 6.302 12.340 -17.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 4.712 12.496 -17.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 5.066 12.851 -16.215 1.00 0.00 H new ATOM 550 N VAL A 85 2.451 8.508 -12.331 1.00 0.00 N ATOM 551 CA VAL A 85 2.476 7.985 -10.951 1.00 0.00 C ATOM 552 C VAL A 85 3.733 8.488 -10.242 1.00 0.00 C ATOM 553 O VAL A 85 4.850 8.041 -10.495 1.00 0.00 O ATOM 554 CB VAL A 85 2.221 6.470 -10.872 1.00 0.00 C ATOM 555 CG1 VAL A 85 1.844 5.920 -9.493 1.00 0.00 C ATOM 556 CG2 VAL A 85 1.608 5.837 -12.119 1.00 0.00 C ATOM 0 H VAL A 85 3.273 8.275 -12.888 1.00 0.00 H new ATOM 0 HA VAL A 85 1.628 8.384 -10.395 1.00 0.00 H new ATOM 0 HB VAL A 85 3.217 6.033 -10.939 1.00 0.00 H new ATOM 0 HG11 VAL A 85 1.689 4.843 -9.561 1.00 0.00 H new ATOM 0 HG12 VAL A 85 2.648 6.127 -8.787 1.00 0.00 H new ATOM 0 HG13 VAL A 85 0.927 6.398 -9.149 1.00 0.00 H new ATOM 0 HG21 VAL A 85 1.471 4.768 -11.955 1.00 0.00 H new ATOM 0 HG22 VAL A 85 0.642 6.299 -12.324 1.00 0.00 H new ATOM 0 HG23 VAL A 85 2.272 5.991 -12.969 1.00 0.00 H new ATOM 566 N THR A 86 3.520 9.537 -9.449 1.00 0.00 N ATOM 567 CA THR A 86 4.490 10.495 -8.918 1.00 0.00 C ATOM 568 C THR A 86 5.478 9.845 -7.960 1.00 0.00 C ATOM 569 O THR A 86 6.664 10.182 -7.979 1.00 0.00 O ATOM 570 CB THR A 86 3.718 11.600 -8.181 1.00 0.00 C ATOM 571 OG1 THR A 86 2.657 12.073 -8.987 1.00 0.00 O ATOM 572 CG2 THR A 86 4.577 12.806 -7.812 1.00 0.00 C ATOM 0 H THR A 86 2.576 9.759 -9.132 1.00 0.00 H new ATOM 0 HA THR A 86 5.066 10.899 -9.750 1.00 0.00 H new ATOM 0 HB THR A 86 3.359 11.138 -7.261 1.00 0.00 H new ATOM 0 HG1 THR A 86 2.170 12.776 -8.508 1.00 0.00 H new ATOM 0 HG21 THR A 86 3.964 13.544 -7.295 1.00 0.00 H new ATOM 0 HG22 THR A 86 5.390 12.488 -7.159 1.00 0.00 H new ATOM 0 HG23 THR A 86 4.991 13.249 -8.718 1.00 0.00 H new ATOM 580 N ASN A 87 5.005 8.903 -7.136 1.00 0.00 N ATOM 581 CA ASN A 87 5.855 8.164 -6.211 1.00 0.00 C ATOM 582 C ASN A 87 5.338 6.746 -5.916 1.00 0.00 C ATOM 583 O ASN A 87 4.151 6.455 -6.047 1.00 0.00 O ATOM 584 CB ASN A 87 5.974 8.989 -4.904 1.00 0.00 C ATOM 585 CG ASN A 87 7.398 9.187 -4.410 1.00 0.00 C ATOM 586 OD1 ASN A 87 8.008 10.227 -4.618 1.00 0.00 O ATOM 587 ND2 ASN A 87 7.969 8.235 -3.708 1.00 0.00 N ATOM 0 H ASN A 87 4.021 8.636 -7.096 1.00 0.00 H new ATOM 0 HA ASN A 87 6.832 8.028 -6.675 1.00 0.00 H new ATOM 0 HB2 ASN A 87 5.519 9.967 -5.064 1.00 0.00 H new ATOM 0 HB3 ASN A 87 5.398 8.493 -4.123 1.00 0.00 H new ATOM 0 HD21 ASN A 87 8.912 8.367 -3.342 1.00 0.00 H new ATOM 0 HD22 ASN A 87 7.469 7.364 -3.529 1.00 0.00 H new ATOM 594 N LEU A 88 6.215 5.884 -5.406 1.00 0.00 N ATOM 595 CA LEU A 88 5.846 4.705 -4.624 1.00 0.00 C ATOM 596 C LEU A 88 6.711 4.589 -3.360 1.00 0.00 C ATOM 597 O LEU A 88 7.623 5.391 -3.149 1.00 0.00 O ATOM 598 CB LEU A 88 5.886 3.462 -5.528 1.00 0.00 C ATOM 599 CG LEU A 88 7.251 2.763 -5.649 1.00 0.00 C ATOM 600 CD1 LEU A 88 7.023 1.489 -6.441 1.00 0.00 C ATOM 601 CD2 LEU A 88 8.324 3.595 -6.347 1.00 0.00 C ATOM 0 H LEU A 88 7.223 5.987 -5.527 1.00 0.00 H new ATOM 0 HA LEU A 88 4.823 4.799 -4.259 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.162 2.740 -5.152 1.00 0.00 H new ATOM 0 HB3 LEU A 88 5.558 3.752 -6.526 1.00 0.00 H new ATOM 0 HG LEU A 88 7.626 2.584 -4.641 1.00 0.00 H new ATOM 0 HD11 LEU A 88 7.967 0.956 -6.553 1.00 0.00 H new ATOM 0 HD12 LEU A 88 6.310 0.856 -5.914 1.00 0.00 H new ATOM 0 HD13 LEU A 88 6.628 1.739 -7.426 1.00 0.00 H new ATOM 0 HD21 LEU A 88 9.254 3.028 -6.390 1.00 0.00 H new ATOM 0 HD22 LEU A 88 7.998 3.834 -7.359 1.00 0.00 H new ATOM 0 HD23 LEU A 88 8.487 4.518 -5.791 1.00 0.00 H new ATOM 613 N LEU A 89 6.404 3.613 -2.513 1.00 0.00 N ATOM 614 CA LEU A 89 7.108 3.304 -1.265 1.00 0.00 C ATOM 615 C LEU A 89 6.990 1.809 -0.976 1.00 0.00 C ATOM 616 O LEU A 89 6.019 1.182 -1.397 1.00 0.00 O ATOM 617 CB LEU A 89 6.571 4.259 -0.182 1.00 0.00 C ATOM 618 CG LEU A 89 6.388 3.788 1.260 1.00 0.00 C ATOM 619 CD1 LEU A 89 5.790 4.989 1.986 1.00 0.00 C ATOM 620 CD2 LEU A 89 5.420 2.656 1.502 1.00 0.00 C ATOM 0 H LEU A 89 5.620 2.983 -2.682 1.00 0.00 H new ATOM 0 HA LEU A 89 8.183 3.480 -1.313 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.240 5.119 -0.155 1.00 0.00 H new ATOM 0 HB3 LEU A 89 5.602 4.619 -0.526 1.00 0.00 H new ATOM 0 HG LEU A 89 7.361 3.420 1.587 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.626 4.736 3.033 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.477 5.833 1.920 1.00 0.00 H new ATOM 0 HD13 LEU A 89 4.840 5.257 1.524 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.389 2.425 2.567 1.00 0.00 H new ATOM 0 HD22 LEU A 89 4.426 2.949 1.165 1.00 0.00 H new ATOM 0 HD23 LEU A 89 5.745 1.775 0.949 1.00 0.00 H new ATOM 632 N MET A 90 7.947 1.245 -0.233 1.00 0.00 N ATOM 633 CA MET A 90 7.995 -0.181 0.113 1.00 0.00 C ATOM 634 C MET A 90 8.203 -0.381 1.616 1.00 0.00 C ATOM 635 O MET A 90 9.263 -0.061 2.158 1.00 0.00 O ATOM 636 CB MET A 90 9.056 -0.906 -0.730 1.00 0.00 C ATOM 637 CG MET A 90 8.736 -0.676 -2.206 1.00 0.00 C ATOM 638 SD MET A 90 9.240 -1.950 -3.377 1.00 0.00 S ATOM 639 CE MET A 90 7.900 -1.600 -4.536 1.00 0.00 C ATOM 0 H MET A 90 8.727 1.777 0.153 1.00 0.00 H new ATOM 0 HA MET A 90 7.031 -0.629 -0.127 1.00 0.00 H new ATOM 0 HB2 MET A 90 10.051 -0.529 -0.494 1.00 0.00 H new ATOM 0 HB3 MET A 90 9.057 -1.972 -0.504 1.00 0.00 H new ATOM 0 HG2 MET A 90 7.658 -0.541 -2.299 1.00 0.00 H new ATOM 0 HG3 MET A 90 9.202 0.262 -2.509 1.00 0.00 H new ATOM 0 HE1 MET A 90 8.200 -1.898 -5.540 1.00 0.00 H new ATOM 0 HE2 MET A 90 7.010 -2.157 -4.243 1.00 0.00 H new ATOM 0 HE3 MET A 90 7.679 -0.533 -4.525 1.00 0.00 H new ATOM 649 N LEU A 91 7.172 -0.888 2.291 1.00 0.00 N ATOM 650 CA LEU A 91 7.226 -1.248 3.712 1.00 0.00 C ATOM 651 C LEU A 91 8.031 -2.547 3.900 1.00 0.00 C ATOM 652 O LEU A 91 7.470 -3.648 3.943 1.00 0.00 O ATOM 653 CB LEU A 91 5.813 -1.387 4.314 1.00 0.00 C ATOM 654 CG LEU A 91 4.878 -0.161 4.410 1.00 0.00 C ATOM 655 CD1 LEU A 91 5.610 1.097 4.860 1.00 0.00 C ATOM 656 CD2 LEU A 91 4.074 0.096 3.139 1.00 0.00 C ATOM 0 H LEU A 91 6.263 -1.063 1.863 1.00 0.00 H new ATOM 0 HA LEU A 91 7.730 -0.442 4.246 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.289 -2.146 3.734 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.931 -1.782 5.323 1.00 0.00 H new ATOM 0 HG LEU A 91 4.156 -0.420 5.185 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.907 1.928 4.911 1.00 0.00 H new ATOM 0 HD12 LEU A 91 6.047 0.931 5.844 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.400 1.333 4.147 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.440 0.972 3.280 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.755 0.272 2.307 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.451 -0.771 2.921 1.00 0.00 H new ATOM 668 N LYS A 92 9.357 -2.410 4.016 1.00 0.00 N ATOM 669 CA LYS A 92 10.313 -3.486 4.321 1.00 0.00 C ATOM 670 C LYS A 92 10.046 -4.062 5.723 1.00 0.00 C ATOM 671 O LYS A 92 10.559 -3.570 6.730 1.00 0.00 O ATOM 672 CB LYS A 92 11.744 -2.947 4.132 1.00 0.00 C ATOM 673 CG LYS A 92 12.859 -4.007 4.228 1.00 0.00 C ATOM 674 CD LYS A 92 13.226 -4.693 2.900 1.00 0.00 C ATOM 675 CE LYS A 92 12.130 -5.623 2.362 1.00 0.00 C ATOM 676 NZ LYS A 92 12.596 -6.373 1.170 1.00 0.00 N ATOM 0 H LYS A 92 9.815 -1.507 3.895 1.00 0.00 H new ATOM 0 HA LYS A 92 10.188 -4.323 3.633 1.00 0.00 H new ATOM 0 HB2 LYS A 92 11.808 -2.462 3.158 1.00 0.00 H new ATOM 0 HB3 LYS A 92 11.929 -2.179 4.883 1.00 0.00 H new ATOM 0 HG2 LYS A 92 13.754 -3.535 4.634 1.00 0.00 H new ATOM 0 HG3 LYS A 92 12.551 -4.772 4.941 1.00 0.00 H new ATOM 0 HD2 LYS A 92 13.440 -3.928 2.153 1.00 0.00 H new ATOM 0 HD3 LYS A 92 14.142 -5.268 3.039 1.00 0.00 H new ATOM 0 HE2 LYS A 92 11.830 -6.324 3.141 1.00 0.00 H new ATOM 0 HE3 LYS A 92 11.248 -5.037 2.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 11.852 -7.030 0.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 12.811 -5.706 0.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 13.453 -6.910 1.411 1.00 0.00 H new ATOM 690 N GLY A 93 9.178 -5.068 5.783 1.00 0.00 N ATOM 691 CA GLY A 93 8.560 -5.583 7.008 1.00 0.00 C ATOM 692 C GLY A 93 7.599 -6.744 6.743 1.00 0.00 C ATOM 693 O GLY A 93 7.806 -7.853 7.235 1.00 0.00 O ATOM 0 H GLY A 93 8.872 -5.569 4.949 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.341 -5.913 7.693 1.00 0.00 H new ATOM 0 HA3 GLY A 93 8.020 -4.776 7.504 1.00 0.00 H new ATOM 697 N LYS A 94 6.537 -6.469 5.973 1.00 0.00 N ATOM 698 CA LYS A 94 5.367 -7.352 5.765 1.00 0.00 C ATOM 699 C LYS A 94 4.934 -7.490 4.290 1.00 0.00 C ATOM 700 O LYS A 94 3.785 -7.833 4.011 1.00 0.00 O ATOM 701 CB LYS A 94 4.204 -6.846 6.639 1.00 0.00 C ATOM 702 CG LYS A 94 4.367 -6.994 8.165 1.00 0.00 C ATOM 703 CD LYS A 94 4.955 -5.786 8.922 1.00 0.00 C ATOM 704 CE LYS A 94 4.300 -4.432 8.613 1.00 0.00 C ATOM 705 NZ LYS A 94 2.816 -4.485 8.711 1.00 0.00 N ATOM 0 H LYS A 94 6.461 -5.593 5.456 1.00 0.00 H new ATOM 0 HA LYS A 94 5.662 -8.358 6.063 1.00 0.00 H new ATOM 0 HB2 LYS A 94 4.044 -5.791 6.415 1.00 0.00 H new ATOM 0 HB3 LYS A 94 3.299 -7.376 6.341 1.00 0.00 H new ATOM 0 HG2 LYS A 94 3.389 -7.218 8.591 1.00 0.00 H new ATOM 0 HG3 LYS A 94 5.004 -7.858 8.356 1.00 0.00 H new ATOM 0 HD2 LYS A 94 4.872 -5.974 9.992 1.00 0.00 H new ATOM 0 HD3 LYS A 94 6.018 -5.717 8.692 1.00 0.00 H new ATOM 0 HE2 LYS A 94 4.681 -3.681 9.305 1.00 0.00 H new ATOM 0 HE3 LYS A 94 4.584 -4.114 7.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 2.451 -3.545 8.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 2.418 -4.773 7.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 2.541 -5.174 9.440 1.00 0.00 H new ATOM 719 N ASN A 95 5.828 -7.197 3.340 1.00 0.00 N ATOM 720 CA ASN A 95 5.563 -7.147 1.889 1.00 0.00 C ATOM 721 C ASN A 95 4.426 -6.180 1.505 1.00 0.00 C ATOM 722 O ASN A 95 3.579 -6.495 0.662 1.00 0.00 O ATOM 723 CB ASN A 95 5.311 -8.559 1.330 1.00 0.00 C ATOM 724 CG ASN A 95 6.509 -9.487 1.349 1.00 0.00 C ATOM 725 OD1 ASN A 95 7.532 -9.274 1.985 1.00 0.00 O ATOM 726 ND2 ASN A 95 6.386 -10.580 0.639 1.00 0.00 N ATOM 0 H ASN A 95 6.798 -6.978 3.565 1.00 0.00 H new ATOM 0 HA ASN A 95 6.464 -6.743 1.426 1.00 0.00 H new ATOM 0 HB2 ASN A 95 4.506 -9.020 1.902 1.00 0.00 H new ATOM 0 HB3 ASN A 95 4.959 -8.468 0.302 1.00 0.00 H new ATOM 0 HD21 ASN A 95 7.146 -11.260 0.614 1.00 0.00 H new ATOM 0 HD22 ASN A 95 5.530 -10.752 0.111 1.00 0.00 H new ATOM 733 N GLN A 96 4.402 -4.996 2.119 1.00 0.00 N ATOM 734 CA GLN A 96 3.438 -3.950 1.786 1.00 0.00 C ATOM 735 C GLN A 96 4.099 -2.797 1.001 1.00 0.00 C ATOM 736 O GLN A 96 5.325 -2.663 0.987 1.00 0.00 O ATOM 737 CB GLN A 96 2.753 -3.460 3.053 1.00 0.00 C ATOM 738 CG GLN A 96 1.900 -4.530 3.744 1.00 0.00 C ATOM 739 CD GLN A 96 1.671 -4.127 5.188 1.00 0.00 C ATOM 740 OE1 GLN A 96 1.783 -4.898 6.126 1.00 0.00 O ATOM 741 NE2 GLN A 96 1.381 -2.879 5.439 1.00 0.00 N ATOM 0 H GLN A 96 5.051 -4.737 2.861 1.00 0.00 H new ATOM 0 HA GLN A 96 2.678 -4.371 1.128 1.00 0.00 H new ATOM 0 HB2 GLN A 96 3.511 -3.105 3.751 1.00 0.00 H new ATOM 0 HB3 GLN A 96 2.121 -2.607 2.807 1.00 0.00 H new ATOM 0 HG2 GLN A 96 0.946 -4.641 3.229 1.00 0.00 H new ATOM 0 HG3 GLN A 96 2.401 -5.497 3.699 1.00 0.00 H new ATOM 0 HE21 GLN A 96 1.282 -2.214 4.672 1.00 0.00 H new ATOM 0 HE22 GLN A 96 1.254 -2.569 6.402 1.00 0.00 H new ATOM 750 N ALA A 97 3.299 -1.933 0.377 1.00 0.00 N ATOM 751 CA ALA A 97 3.763 -0.775 -0.400 1.00 0.00 C ATOM 752 C ALA A 97 2.702 0.336 -0.437 1.00 0.00 C ATOM 753 O ALA A 97 1.529 0.093 -0.149 1.00 0.00 O ATOM 754 CB ALA A 97 4.048 -1.278 -1.828 1.00 0.00 C ATOM 0 H ALA A 97 2.283 -2.018 0.396 1.00 0.00 H new ATOM 0 HA ALA A 97 4.655 -0.350 0.059 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.397 -0.448 -2.443 1.00 0.00 H new ATOM 0 HB2 ALA A 97 4.815 -2.052 -1.795 1.00 0.00 H new ATOM 0 HB3 ALA A 97 3.135 -1.690 -2.258 1.00 0.00 H new ATOM 760 N PHE A 98 3.113 1.535 -0.851 1.00 0.00 N ATOM 761 CA PHE A 98 2.242 2.636 -1.289 1.00 0.00 C ATOM 762 C PHE A 98 2.461 2.869 -2.792 1.00 0.00 C ATOM 763 O PHE A 98 3.565 2.630 -3.285 1.00 0.00 O ATOM 764 CB PHE A 98 2.600 3.965 -0.609 1.00 0.00 C ATOM 765 CG PHE A 98 2.193 4.234 0.829 1.00 0.00 C ATOM 766 CD1 PHE A 98 1.812 3.208 1.716 1.00 0.00 C ATOM 767 CD2 PHE A 98 2.227 5.561 1.300 1.00 0.00 C ATOM 768 CE1 PHE A 98 1.481 3.517 3.042 1.00 0.00 C ATOM 769 CE2 PHE A 98 1.861 5.883 2.601 1.00 0.00 C ATOM 770 CZ PHE A 98 1.496 4.852 3.462 1.00 0.00 C ATOM 0 H PHE A 98 4.102 1.780 -0.894 1.00 0.00 H new ATOM 0 HA PHE A 98 1.220 2.352 -1.038 1.00 0.00 H new ATOM 0 HB2 PHE A 98 3.684 4.070 -0.661 1.00 0.00 H new ATOM 0 HB3 PHE A 98 2.173 4.762 -1.218 1.00 0.00 H new ATOM 0 HD1 PHE A 98 1.775 2.184 1.374 1.00 0.00 H new ATOM 0 HD2 PHE A 98 2.546 6.348 0.633 1.00 0.00 H new ATOM 0 HE1 PHE A 98 1.216 2.731 3.734 1.00 0.00 H new ATOM 0 HE2 PHE A 98 1.860 6.910 2.937 1.00 0.00 H new ATOM 0 HZ PHE A 98 1.218 5.088 4.479 1.00 0.00 H new ATOM 780 N ILE A 99 1.491 3.456 -3.496 1.00 0.00 N ATOM 781 CA ILE A 99 1.636 3.995 -4.849 1.00 0.00 C ATOM 782 C ILE A 99 0.820 5.302 -4.977 1.00 0.00 C ATOM 783 O ILE A 99 -0.407 5.296 -4.904 1.00 0.00 O ATOM 784 CB ILE A 99 1.346 2.880 -5.883 1.00 0.00 C ATOM 785 CG1 ILE A 99 1.600 3.419 -7.300 1.00 0.00 C ATOM 786 CG2 ILE A 99 -0.040 2.230 -5.741 1.00 0.00 C ATOM 787 CD1 ILE A 99 1.558 2.353 -8.406 1.00 0.00 C ATOM 0 H ILE A 99 0.548 3.573 -3.125 1.00 0.00 H new ATOM 0 HA ILE A 99 2.659 4.301 -5.067 1.00 0.00 H new ATOM 0 HB ILE A 99 2.038 2.063 -5.679 1.00 0.00 H new ATOM 0 HG12 ILE A 99 0.856 4.184 -7.522 1.00 0.00 H new ATOM 0 HG13 ILE A 99 2.575 3.907 -7.320 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.161 1.460 -6.503 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -0.131 1.779 -4.753 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -0.812 2.989 -5.866 1.00 0.00 H new ATOM 0 HD11 ILE A 99 1.748 2.823 -9.371 1.00 0.00 H new ATOM 0 HD12 ILE A 99 2.321 1.599 -8.213 1.00 0.00 H new ATOM 0 HD13 ILE A 99 0.576 1.881 -8.419 1.00 0.00 H new ATOM 799 N GLU A 100 1.522 6.438 -5.058 1.00 0.00 N ATOM 800 CA GLU A 100 1.036 7.832 -5.101 1.00 0.00 C ATOM 801 C GLU A 100 1.039 8.375 -6.525 1.00 0.00 C ATOM 802 O GLU A 100 2.095 8.450 -7.157 1.00 0.00 O ATOM 803 CB GLU A 100 1.964 8.704 -4.242 1.00 0.00 C ATOM 804 CG GLU A 100 1.873 10.237 -4.413 1.00 0.00 C ATOM 805 CD GLU A 100 0.571 10.863 -3.892 1.00 0.00 C ATOM 806 OE1 GLU A 100 0.174 10.552 -2.747 1.00 0.00 O ATOM 807 OE2 GLU A 100 -0.010 11.725 -4.592 1.00 0.00 O ATOM 0 H GLU A 100 2.541 6.408 -5.099 1.00 0.00 H new ATOM 0 HA GLU A 100 0.014 7.854 -4.723 1.00 0.00 H new ATOM 0 HB2 GLU A 100 1.768 8.471 -3.195 1.00 0.00 H new ATOM 0 HB3 GLU A 100 2.991 8.404 -4.448 1.00 0.00 H new ATOM 0 HG2 GLU A 100 2.714 10.698 -3.895 1.00 0.00 H new ATOM 0 HG3 GLU A 100 1.979 10.478 -5.471 1.00 0.00 H new ATOM 814 N MET A 101 -0.120 8.810 -7.016 1.00 0.00 N ATOM 815 CA MET A 101 -0.252 9.227 -8.425 1.00 0.00 C ATOM 816 C MET A 101 -0.727 10.666 -8.668 1.00 0.00 C ATOM 817 O MET A 101 -1.246 11.349 -7.790 1.00 0.00 O ATOM 818 CB MET A 101 -0.961 8.103 -9.187 1.00 0.00 C ATOM 819 CG MET A 101 -1.995 8.408 -10.258 1.00 0.00 C ATOM 820 SD MET A 101 -2.778 6.850 -10.719 1.00 0.00 S ATOM 821 CE MET A 101 -1.434 5.897 -11.442 1.00 0.00 C ATOM 0 H MET A 101 -0.979 8.885 -6.471 1.00 0.00 H new ATOM 0 HA MET A 101 0.741 9.342 -8.860 1.00 0.00 H new ATOM 0 HB2 MET A 101 -0.185 7.498 -9.657 1.00 0.00 H new ATOM 0 HB3 MET A 101 -1.449 7.473 -8.443 1.00 0.00 H new ATOM 0 HG2 MET A 101 -2.737 9.114 -9.884 1.00 0.00 H new ATOM 0 HG3 MET A 101 -1.523 8.871 -11.125 1.00 0.00 H new ATOM 0 HE1 MET A 101 -1.822 4.952 -11.822 1.00 0.00 H new ATOM 0 HE2 MET A 101 -0.987 6.461 -12.260 1.00 0.00 H new ATOM 0 HE3 MET A 101 -0.678 5.699 -10.682 1.00 0.00 H new ATOM 831 N ASN A 102 -0.463 11.157 -9.882 1.00 0.00 N ATOM 832 CA ASN A 102 -0.491 12.583 -10.220 1.00 0.00 C ATOM 833 C ASN A 102 -1.919 13.156 -10.370 1.00 0.00 C ATOM 834 O ASN A 102 -2.088 14.378 -10.394 1.00 0.00 O ATOM 835 CB ASN A 102 0.379 12.782 -11.482 1.00 0.00 C ATOM 836 CG ASN A 102 -0.398 12.941 -12.768 1.00 0.00 C ATOM 837 OD1 ASN A 102 -0.984 11.867 -13.216 1.00 0.00 O flip ATOM 838 ND2 ASN A 102 -0.461 13.997 -13.381 1.00 0.00 N flip ATOM 0 H ASN A 102 -0.219 10.562 -10.674 1.00 0.00 H new ATOM 0 HA ASN A 102 -0.076 13.157 -9.392 1.00 0.00 H new ATOM 0 HB2 ASN A 102 1.004 13.664 -11.340 1.00 0.00 H new ATOM 0 HB3 ASN A 102 1.050 11.929 -11.582 1.00 0.00 H new ATOM 0 HD21 ASN A 102 0.004 14.828 -13.015 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -0.979 14.047 -14.258 1.00 0.00 H new ATOM 845 N THR A 103 -2.943 12.295 -10.469 1.00 0.00 N ATOM 846 CA THR A 103 -4.365 12.687 -10.566 1.00 0.00 C ATOM 847 C THR A 103 -5.250 11.768 -9.725 1.00 0.00 C ATOM 848 O THR A 103 -5.007 10.563 -9.598 1.00 0.00 O ATOM 849 CB THR A 103 -4.906 12.821 -12.018 1.00 0.00 C ATOM 850 OG1 THR A 103 -5.973 11.942 -12.308 1.00 0.00 O ATOM 851 CG2 THR A 103 -3.879 12.581 -13.123 1.00 0.00 C ATOM 0 H THR A 103 -2.807 11.284 -10.485 1.00 0.00 H new ATOM 0 HA THR A 103 -4.410 13.696 -10.155 1.00 0.00 H new ATOM 0 HB THR A 103 -5.225 13.863 -12.024 1.00 0.00 H new ATOM 0 HG1 THR A 103 -6.267 12.078 -13.233 1.00 0.00 H new ATOM 0 HG21 THR A 103 -4.357 12.698 -14.096 1.00 0.00 H new ATOM 0 HG22 THR A 103 -3.067 13.302 -13.028 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.479 11.571 -13.035 1.00 0.00 H new ATOM 859 N GLU A 104 -6.292 12.362 -9.147 1.00 0.00 N ATOM 860 CA GLU A 104 -7.314 11.667 -8.362 1.00 0.00 C ATOM 861 C GLU A 104 -8.100 10.663 -9.211 1.00 0.00 C ATOM 862 O GLU A 104 -8.441 9.590 -8.724 1.00 0.00 O ATOM 863 CB GLU A 104 -8.268 12.697 -7.740 1.00 0.00 C ATOM 864 CG GLU A 104 -7.544 13.705 -6.832 1.00 0.00 C ATOM 865 CD GLU A 104 -8.539 14.705 -6.214 1.00 0.00 C ATOM 866 OE1 GLU A 104 -9.080 14.433 -5.114 1.00 0.00 O ATOM 867 OE2 GLU A 104 -8.786 15.777 -6.817 1.00 0.00 O ATOM 0 H GLU A 104 -6.455 13.367 -9.213 1.00 0.00 H new ATOM 0 HA GLU A 104 -6.813 11.104 -7.575 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -8.783 13.236 -8.535 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -9.031 12.176 -7.162 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -7.018 13.173 -6.039 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -6.792 14.244 -7.408 1.00 0.00 H new ATOM 874 N GLU A 105 -8.356 10.979 -10.484 1.00 0.00 N ATOM 875 CA GLU A 105 -9.084 10.093 -11.396 1.00 0.00 C ATOM 876 C GLU A 105 -8.240 8.927 -11.899 1.00 0.00 C ATOM 877 O GLU A 105 -8.741 7.807 -11.973 1.00 0.00 O ATOM 878 CB GLU A 105 -9.610 10.865 -12.614 1.00 0.00 C ATOM 879 CG GLU A 105 -10.782 11.786 -12.258 1.00 0.00 C ATOM 880 CD GLU A 105 -11.351 12.471 -13.518 1.00 0.00 C ATOM 881 OE1 GLU A 105 -10.870 13.569 -13.890 1.00 0.00 O ATOM 882 OE2 GLU A 105 -12.295 11.924 -14.140 1.00 0.00 O ATOM 0 H GLU A 105 -8.064 11.858 -10.911 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.911 9.692 -10.810 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -8.802 11.458 -13.042 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -9.927 10.158 -13.381 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -11.566 11.209 -11.768 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -10.451 12.543 -11.547 1.00 0.00 H new ATOM 889 N ALA A 106 -6.967 9.161 -12.210 1.00 0.00 N ATOM 890 CA ALA A 106 -6.022 8.099 -12.511 1.00 0.00 C ATOM 891 C ALA A 106 -5.954 7.107 -11.353 1.00 0.00 C ATOM 892 O ALA A 106 -6.120 5.913 -11.560 1.00 0.00 O ATOM 893 CB ALA A 106 -4.657 8.698 -12.817 1.00 0.00 C ATOM 0 H ALA A 106 -6.565 10.097 -12.259 1.00 0.00 H new ATOM 0 HA ALA A 106 -6.358 7.552 -13.392 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -3.951 7.899 -13.042 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -4.736 9.365 -13.676 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -4.304 9.261 -11.952 1.00 0.00 H new ATOM 899 N ALA A 107 -5.763 7.570 -10.118 1.00 0.00 N ATOM 900 CA ALA A 107 -5.676 6.650 -8.997 1.00 0.00 C ATOM 901 C ALA A 107 -7.016 5.999 -8.641 1.00 0.00 C ATOM 902 O ALA A 107 -7.047 4.808 -8.353 1.00 0.00 O ATOM 903 CB ALA A 107 -5.110 7.421 -7.835 1.00 0.00 C ATOM 0 H ALA A 107 -5.668 8.556 -9.876 1.00 0.00 H new ATOM 0 HA ALA A 107 -5.029 5.815 -9.267 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -5.028 6.765 -6.969 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -4.123 7.802 -8.097 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -5.769 8.256 -7.597 1.00 0.00 H new ATOM 909 N ASN A 108 -8.137 6.724 -8.733 1.00 0.00 N ATOM 910 CA ASN A 108 -9.474 6.137 -8.631 1.00 0.00 C ATOM 911 C ASN A 108 -9.677 5.019 -9.668 1.00 0.00 C ATOM 912 O ASN A 108 -10.091 3.918 -9.305 1.00 0.00 O ATOM 913 CB ASN A 108 -10.512 7.257 -8.757 1.00 0.00 C ATOM 914 CG ASN A 108 -11.934 6.731 -8.747 1.00 0.00 C ATOM 915 OD1 ASN A 108 -12.541 6.489 -9.781 1.00 0.00 O ATOM 916 ND2 ASN A 108 -12.509 6.532 -7.583 1.00 0.00 N ATOM 0 H ASN A 108 -8.141 7.733 -8.880 1.00 0.00 H new ATOM 0 HA ASN A 108 -9.596 5.660 -7.659 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -10.383 7.962 -7.936 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -10.338 7.808 -9.681 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -13.464 6.175 -7.540 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -12.001 6.734 -6.722 1.00 0.00 H new ATOM 923 N THR A 109 -9.319 5.245 -10.932 1.00 0.00 N ATOM 924 CA THR A 109 -9.360 4.193 -11.948 1.00 0.00 C ATOM 925 C THR A 109 -8.355 3.089 -11.629 1.00 0.00 C ATOM 926 O THR A 109 -8.684 1.931 -11.845 1.00 0.00 O ATOM 927 CB THR A 109 -9.209 4.749 -13.379 1.00 0.00 C ATOM 928 OG1 THR A 109 -10.160 4.128 -14.223 1.00 0.00 O ATOM 929 CG2 THR A 109 -7.855 4.515 -14.048 1.00 0.00 C ATOM 0 H THR A 109 -8.997 6.149 -11.277 1.00 0.00 H new ATOM 0 HA THR A 109 -10.352 3.742 -11.917 1.00 0.00 H new ATOM 0 HB THR A 109 -9.340 5.824 -13.259 1.00 0.00 H new ATOM 0 HG1 THR A 109 -10.069 4.480 -15.133 1.00 0.00 H new ATOM 0 HG21 THR A 109 -7.864 4.948 -15.048 1.00 0.00 H new ATOM 0 HG22 THR A 109 -7.070 4.986 -13.456 1.00 0.00 H new ATOM 0 HG23 THR A 109 -7.664 3.444 -14.118 1.00 0.00 H new ATOM 937 N MET A 110 -7.187 3.402 -11.045 1.00 0.00 N ATOM 938 CA MET A 110 -6.159 2.425 -10.687 1.00 0.00 C ATOM 939 C MET A 110 -6.681 1.459 -9.618 1.00 0.00 C ATOM 940 O MET A 110 -6.649 0.241 -9.776 1.00 0.00 O ATOM 941 CB MET A 110 -4.830 3.094 -10.230 1.00 0.00 C ATOM 942 CG MET A 110 -3.694 2.112 -10.571 1.00 0.00 C ATOM 943 SD MET A 110 -1.989 2.597 -10.197 1.00 0.00 S ATOM 944 CE MET A 110 -2.202 3.493 -8.652 1.00 0.00 C ATOM 0 H MET A 110 -6.931 4.360 -10.806 1.00 0.00 H new ATOM 0 HA MET A 110 -5.930 1.859 -11.590 1.00 0.00 H new ATOM 0 HB2 MET A 110 -4.682 4.047 -10.739 1.00 0.00 H new ATOM 0 HB3 MET A 110 -4.851 3.304 -9.161 1.00 0.00 H new ATOM 0 HG2 MET A 110 -3.895 1.178 -10.047 1.00 0.00 H new ATOM 0 HG3 MET A 110 -3.751 1.897 -11.638 1.00 0.00 H new ATOM 0 HE1 MET A 110 -1.231 3.836 -8.293 1.00 0.00 H new ATOM 0 HE2 MET A 110 -2.852 4.352 -8.816 1.00 0.00 H new ATOM 0 HE3 MET A 110 -2.652 2.835 -7.909 1.00 0.00 H new ATOM 954 N VAL A 111 -7.214 2.004 -8.525 1.00 0.00 N ATOM 955 CA VAL A 111 -7.779 1.258 -7.397 1.00 0.00 C ATOM 956 C VAL A 111 -9.009 0.440 -7.804 1.00 0.00 C ATOM 957 O VAL A 111 -9.160 -0.699 -7.369 1.00 0.00 O ATOM 958 CB VAL A 111 -8.044 2.230 -6.229 1.00 0.00 C ATOM 959 CG1 VAL A 111 -9.456 2.779 -6.118 1.00 0.00 C ATOM 960 CG2 VAL A 111 -7.700 1.584 -4.893 1.00 0.00 C ATOM 0 H VAL A 111 -7.267 3.014 -8.394 1.00 0.00 H new ATOM 0 HA VAL A 111 -7.057 0.516 -7.056 1.00 0.00 H new ATOM 0 HB VAL A 111 -7.396 3.074 -6.464 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -9.519 3.449 -5.261 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -9.706 3.327 -7.026 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -10.157 1.955 -5.987 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -7.896 2.290 -4.086 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -8.312 0.693 -4.752 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.646 1.306 -4.884 1.00 0.00 H new ATOM 970 N ASN A 112 -9.860 0.976 -8.689 1.00 0.00 N ATOM 971 CA ASN A 112 -11.037 0.273 -9.207 1.00 0.00 C ATOM 972 C ASN A 112 -10.646 -0.848 -10.180 1.00 0.00 C ATOM 973 O ASN A 112 -11.107 -1.979 -10.034 1.00 0.00 O ATOM 974 CB ASN A 112 -12.014 1.281 -9.833 1.00 0.00 C ATOM 975 CG ASN A 112 -12.867 1.966 -8.776 1.00 0.00 C ATOM 976 OD1 ASN A 112 -14.052 1.698 -8.638 1.00 0.00 O ATOM 977 ND2 ASN A 112 -12.305 2.838 -7.970 1.00 0.00 N ATOM 0 H ASN A 112 -9.748 1.917 -9.067 1.00 0.00 H new ATOM 0 HA ASN A 112 -11.547 -0.216 -8.377 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -11.455 2.031 -10.392 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -12.660 0.768 -10.546 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -12.857 3.285 -7.237 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -11.317 3.068 -8.077 1.00 0.00 H new ATOM 984 N TYR A 113 -9.709 -0.590 -11.096 1.00 0.00 N ATOM 985 CA TYR A 113 -9.026 -1.617 -11.886 1.00 0.00 C ATOM 986 C TYR A 113 -8.484 -2.757 -11.007 1.00 0.00 C ATOM 987 O TYR A 113 -8.600 -3.921 -11.374 1.00 0.00 O ATOM 988 CB TYR A 113 -7.908 -0.961 -12.718 1.00 0.00 C ATOM 989 CG TYR A 113 -6.756 -1.871 -13.083 1.00 0.00 C ATOM 990 CD1 TYR A 113 -6.954 -2.908 -14.010 1.00 0.00 C ATOM 991 CD2 TYR A 113 -5.503 -1.696 -12.462 1.00 0.00 C ATOM 992 CE1 TYR A 113 -5.916 -3.822 -14.273 1.00 0.00 C ATOM 993 CE2 TYR A 113 -4.478 -2.637 -12.693 1.00 0.00 C ATOM 994 CZ TYR A 113 -4.681 -3.699 -13.599 1.00 0.00 C ATOM 995 OH TYR A 113 -3.692 -4.604 -13.834 1.00 0.00 O ATOM 0 H TYR A 113 -9.398 0.357 -11.313 1.00 0.00 H new ATOM 0 HA TYR A 113 -9.750 -2.074 -12.561 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -8.344 -0.568 -13.636 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -7.515 -0.110 -12.162 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -7.901 -3.004 -14.520 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -5.329 -0.849 -11.815 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -6.064 -4.616 -14.989 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -3.535 -2.544 -12.175 1.00 0.00 H new ATOM 0 HH TYR A 113 -2.907 -4.378 -13.293 1.00 0.00 H new ATOM 1005 N TYR A 114 -7.986 -2.474 -9.802 1.00 0.00 N ATOM 1006 CA TYR A 114 -7.401 -3.468 -8.925 1.00 0.00 C ATOM 1007 C TYR A 114 -8.421 -4.158 -8.038 1.00 0.00 C ATOM 1008 O TYR A 114 -8.163 -5.273 -7.581 1.00 0.00 O ATOM 1009 CB TYR A 114 -6.288 -2.844 -8.093 1.00 0.00 C ATOM 1010 CG TYR A 114 -4.971 -2.748 -8.818 1.00 0.00 C ATOM 1011 CD1 TYR A 114 -4.422 -3.895 -9.426 1.00 0.00 C ATOM 1012 CD2 TYR A 114 -4.251 -1.541 -8.788 1.00 0.00 C ATOM 1013 CE1 TYR A 114 -3.103 -3.849 -9.909 1.00 0.00 C ATOM 1014 CE2 TYR A 114 -2.933 -1.496 -9.270 1.00 0.00 C ATOM 1015 CZ TYR A 114 -2.347 -2.664 -9.793 1.00 0.00 C ATOM 1016 OH TYR A 114 -1.050 -2.643 -10.184 1.00 0.00 O ATOM 0 H TYR A 114 -7.982 -1.532 -9.410 1.00 0.00 H new ATOM 0 HA TYR A 114 -6.982 -4.246 -9.563 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -6.595 -1.845 -7.782 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -6.151 -3.432 -7.186 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -5.007 -4.798 -9.520 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -4.712 -0.647 -8.394 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -2.667 -4.723 -10.370 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -2.373 -0.573 -9.240 1.00 0.00 H new ATOM 0 HH TYR A 114 -0.678 -1.748 -10.037 1.00 0.00 H new ATOM 1026 N THR A 115 -9.599 -3.550 -7.871 1.00 0.00 N ATOM 1027 CA THR A 115 -10.720 -4.210 -7.208 1.00 0.00 C ATOM 1028 C THR A 115 -11.475 -5.129 -8.188 1.00 0.00 C ATOM 1029 O THR A 115 -12.239 -6.009 -7.790 1.00 0.00 O ATOM 1030 CB THR A 115 -11.583 -3.215 -6.406 1.00 0.00 C ATOM 1031 OG1 THR A 115 -12.098 -3.817 -5.236 1.00 0.00 O ATOM 1032 CG2 THR A 115 -12.800 -2.627 -7.117 1.00 0.00 C ATOM 0 H THR A 115 -9.798 -2.601 -8.187 1.00 0.00 H new ATOM 0 HA THR A 115 -10.341 -4.885 -6.441 1.00 0.00 H new ATOM 0 HB THR A 115 -10.875 -2.407 -6.221 1.00 0.00 H new ATOM 0 HG1 THR A 115 -11.369 -3.973 -4.600 1.00 0.00 H new ATOM 0 HG21 THR A 115 -13.319 -1.944 -6.445 1.00 0.00 H new ATOM 0 HG22 THR A 115 -12.476 -2.085 -8.005 1.00 0.00 H new ATOM 0 HG23 THR A 115 -13.475 -3.432 -7.409 1.00 0.00 H new ATOM 1040 N SER A 116 -11.167 -4.972 -9.482 1.00 0.00 N ATOM 1041 CA SER A 116 -11.520 -5.806 -10.629 1.00 0.00 C ATOM 1042 C SER A 116 -10.567 -7.000 -10.783 1.00 0.00 C ATOM 1043 O SER A 116 -10.989 -8.157 -10.785 1.00 0.00 O ATOM 1044 CB SER A 116 -11.406 -4.935 -11.893 1.00 0.00 C ATOM 1045 OG SER A 116 -12.610 -4.944 -12.641 1.00 0.00 O ATOM 0 H SER A 116 -10.606 -4.173 -9.777 1.00 0.00 H new ATOM 0 HA SER A 116 -12.528 -6.193 -10.482 1.00 0.00 H new ATOM 0 HB2 SER A 116 -11.160 -3.912 -11.610 1.00 0.00 H new ATOM 0 HB3 SER A 116 -10.588 -5.299 -12.514 1.00 0.00 H new ATOM 0 HG SER A 116 -12.505 -4.380 -13.436 1.00 0.00 H new ATOM 1051 N VAL A 117 -9.276 -6.704 -10.985 1.00 0.00 N ATOM 1052 CA VAL A 117 -8.315 -7.587 -11.661 1.00 0.00 C ATOM 1053 C VAL A 117 -7.800 -8.732 -10.773 1.00 0.00 C ATOM 1054 O VAL A 117 -7.715 -9.879 -11.211 1.00 0.00 O ATOM 1055 CB VAL A 117 -7.145 -6.736 -12.219 1.00 0.00 C ATOM 1056 CG1 VAL A 117 -6.123 -6.305 -11.201 1.00 0.00 C ATOM 1057 CG2 VAL A 117 -6.444 -7.446 -13.374 1.00 0.00 C ATOM 0 H VAL A 117 -8.861 -5.825 -10.676 1.00 0.00 H new ATOM 0 HA VAL A 117 -8.842 -8.077 -12.480 1.00 0.00 H new ATOM 0 HB VAL A 117 -7.626 -5.823 -12.569 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -5.348 -5.716 -11.691 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.607 -5.701 -10.433 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.674 -7.185 -10.741 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -5.629 -6.823 -13.743 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -6.044 -8.399 -13.027 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -7.158 -7.624 -14.179 1.00 0.00 H new ATOM 1067 N THR A 118 -7.463 -8.376 -9.529 1.00 0.00 N ATOM 1068 CA THR A 118 -6.319 -8.807 -8.697 1.00 0.00 C ATOM 1069 C THR A 118 -5.052 -9.247 -9.468 1.00 0.00 C ATOM 1070 O THR A 118 -5.103 -10.198 -10.250 1.00 0.00 O ATOM 1071 CB THR A 118 -6.681 -9.856 -7.633 1.00 0.00 C ATOM 1072 OG1 THR A 118 -7.986 -9.659 -7.126 1.00 0.00 O ATOM 1073 CG2 THR A 118 -5.722 -9.660 -6.458 1.00 0.00 C ATOM 0 H THR A 118 -8.042 -7.708 -9.020 1.00 0.00 H new ATOM 0 HA THR A 118 -6.058 -7.878 -8.190 1.00 0.00 H new ATOM 0 HB THR A 118 -6.618 -10.845 -8.086 1.00 0.00 H new ATOM 0 HG1 THR A 118 -8.183 -10.344 -6.454 1.00 0.00 H new ATOM 0 HG21 THR A 118 -5.947 -10.388 -5.679 1.00 0.00 H new ATOM 0 HG22 THR A 118 -4.696 -9.799 -6.799 1.00 0.00 H new ATOM 0 HG23 THR A 118 -5.838 -8.653 -6.058 1.00 0.00 H new ATOM 1081 N PRO A 119 -3.886 -8.586 -9.288 1.00 0.00 N ATOM 1082 CA PRO A 119 -2.741 -8.776 -10.183 1.00 0.00 C ATOM 1083 C PRO A 119 -1.941 -10.068 -9.988 1.00 0.00 C ATOM 1084 O PRO A 119 -1.148 -10.411 -10.862 1.00 0.00 O ATOM 1085 CB PRO A 119 -1.847 -7.541 -9.984 1.00 0.00 C ATOM 1086 CG PRO A 119 -2.176 -7.067 -8.571 1.00 0.00 C ATOM 1087 CD PRO A 119 -3.620 -7.506 -8.347 1.00 0.00 C ATOM 0 HA PRO A 119 -3.119 -8.881 -11.200 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -0.791 -7.793 -10.084 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -2.062 -6.770 -10.723 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -1.507 -7.515 -7.836 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -2.071 -5.986 -8.481 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -3.766 -7.843 -7.321 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -4.306 -6.675 -8.510 1.00 0.00 H new ATOM 1095 N VAL A 120 -2.161 -10.764 -8.866 1.00 0.00 N ATOM 1096 CA VAL A 120 -1.560 -12.033 -8.404 1.00 0.00 C ATOM 1097 C VAL A 120 -0.135 -12.261 -8.895 1.00 0.00 C ATOM 1098 O VAL A 120 0.161 -12.791 -9.965 1.00 0.00 O ATOM 1099 CB VAL A 120 -2.442 -13.249 -8.650 1.00 0.00 C ATOM 1100 CG1 VAL A 120 -1.963 -14.380 -7.741 1.00 0.00 C ATOM 1101 CG2 VAL A 120 -3.897 -12.918 -8.309 1.00 0.00 C ATOM 0 H VAL A 120 -2.836 -10.420 -8.183 1.00 0.00 H new ATOM 0 HA VAL A 120 -1.491 -11.911 -7.323 1.00 0.00 H new ATOM 0 HB VAL A 120 -2.380 -13.543 -9.698 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -2.582 -15.263 -7.901 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -0.925 -14.618 -7.973 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -2.040 -14.067 -6.700 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -4.521 -13.794 -8.488 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -3.968 -12.630 -7.260 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -4.239 -12.094 -8.936 1.00 0.00 H new ATOM 1111 N LEU A 121 0.770 -11.790 -8.058 1.00 0.00 N ATOM 1112 CA LEU A 121 1.917 -11.008 -8.487 1.00 0.00 C ATOM 1113 C LEU A 121 3.148 -11.876 -8.202 1.00 0.00 C ATOM 1114 O LEU A 121 3.783 -11.792 -7.150 1.00 0.00 O ATOM 1115 CB LEU A 121 1.737 -9.636 -7.803 1.00 0.00 C ATOM 1116 CG LEU A 121 2.613 -8.448 -8.252 1.00 0.00 C ATOM 1117 CD1 LEU A 121 2.391 -7.292 -7.274 1.00 0.00 C ATOM 1118 CD2 LEU A 121 4.105 -8.744 -8.377 1.00 0.00 C ATOM 0 H LEU A 121 0.730 -11.941 -7.050 1.00 0.00 H new ATOM 0 HA LEU A 121 2.035 -10.762 -9.542 1.00 0.00 H new ATOM 0 HB2 LEU A 121 0.695 -9.341 -7.929 1.00 0.00 H new ATOM 0 HB3 LEU A 121 1.901 -9.778 -6.735 1.00 0.00 H new ATOM 0 HG LEU A 121 2.297 -8.199 -9.265 1.00 0.00 H new ATOM 0 HD11 LEU A 121 3.002 -6.440 -7.573 1.00 0.00 H new ATOM 0 HD12 LEU A 121 1.339 -7.005 -7.282 1.00 0.00 H new ATOM 0 HD13 LEU A 121 2.674 -7.606 -6.269 1.00 0.00 H new ATOM 0 HD21 LEU A 121 4.629 -7.844 -8.698 1.00 0.00 H new ATOM 0 HD22 LEU A 121 4.494 -9.066 -7.411 1.00 0.00 H new ATOM 0 HD23 LEU A 121 4.259 -9.535 -9.112 1.00 0.00 H new ATOM 1130 N ARG A 122 3.316 -12.862 -9.097 1.00 0.00 N ATOM 1131 CA ARG A 122 3.974 -14.178 -8.947 1.00 0.00 C ATOM 1132 C ARG A 122 3.604 -15.001 -7.693 1.00 0.00 C ATOM 1133 O ARG A 122 4.282 -15.981 -7.389 1.00 0.00 O ATOM 1134 CB ARG A 122 5.479 -14.099 -9.299 1.00 0.00 C ATOM 1135 CG ARG A 122 6.451 -13.372 -8.353 1.00 0.00 C ATOM 1136 CD ARG A 122 6.663 -14.090 -7.014 1.00 0.00 C ATOM 1137 NE ARG A 122 7.928 -13.692 -6.366 1.00 0.00 N ATOM 1138 CZ ARG A 122 8.400 -14.154 -5.222 1.00 0.00 C ATOM 1139 NH1 ARG A 122 7.713 -14.957 -4.463 1.00 0.00 N ATOM 1140 NH2 ARG A 122 9.589 -13.814 -4.816 1.00 0.00 N ATOM 0 H ARG A 122 2.958 -12.749 -10.045 1.00 0.00 H new ATOM 0 HA ARG A 122 3.522 -14.818 -9.705 1.00 0.00 H new ATOM 0 HB2 ARG A 122 5.840 -15.121 -9.412 1.00 0.00 H new ATOM 0 HB3 ARG A 122 5.559 -13.622 -10.276 1.00 0.00 H new ATOM 0 HG2 ARG A 122 7.414 -13.261 -8.852 1.00 0.00 H new ATOM 0 HG3 ARG A 122 6.074 -12.368 -8.161 1.00 0.00 H new ATOM 0 HD2 ARG A 122 5.829 -13.868 -6.348 1.00 0.00 H new ATOM 0 HD3 ARG A 122 6.663 -15.168 -7.177 1.00 0.00 H new ATOM 0 HE ARG A 122 8.492 -12.992 -6.848 1.00 0.00 H new ATOM 0 HH11 ARG A 122 6.778 -15.250 -4.745 1.00 0.00 H new ATOM 0 HH12 ARG A 122 8.110 -15.294 -3.586 1.00 0.00 H new ATOM 0 HH21 ARG A 122 10.161 -13.188 -5.382 1.00 0.00 H new ATOM 0 HH22 ARG A 122 9.948 -14.174 -3.932 1.00 0.00 H new ATOM 1154 N GLY A 123 2.531 -14.639 -6.980 1.00 0.00 N ATOM 1155 CA GLY A 123 2.115 -15.254 -5.709 1.00 0.00 C ATOM 1156 C GLY A 123 0.672 -15.760 -5.642 1.00 0.00 C ATOM 1157 O GLY A 123 0.323 -16.746 -6.294 1.00 0.00 O ATOM 0 H GLY A 123 1.908 -13.888 -7.278 1.00 0.00 H new ATOM 0 HA2 GLY A 123 2.781 -16.091 -5.499 1.00 0.00 H new ATOM 0 HA3 GLY A 123 2.259 -14.524 -4.912 1.00 0.00 H new ATOM 1161 N GLN A 124 -0.149 -15.127 -4.803 1.00 0.00 N ATOM 1162 CA GLN A 124 -1.524 -15.467 -4.458 1.00 0.00 C ATOM 1163 C GLN A 124 -2.278 -14.154 -4.143 1.00 0.00 C ATOM 1164 O GLN A 124 -1.632 -13.107 -4.190 1.00 0.00 O ATOM 1165 CB GLN A 124 -1.508 -16.506 -3.315 1.00 0.00 C ATOM 1166 CG GLN A 124 -1.357 -15.975 -1.875 1.00 0.00 C ATOM 1167 CD GLN A 124 -0.066 -15.214 -1.586 1.00 0.00 C ATOM 1168 OE1 GLN A 124 -0.079 -14.094 -1.095 1.00 0.00 O ATOM 1169 NE2 GLN A 124 1.092 -15.787 -1.831 1.00 0.00 N ATOM 0 H GLN A 124 0.161 -14.292 -4.306 1.00 0.00 H new ATOM 0 HA GLN A 124 -2.064 -15.942 -5.277 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -2.434 -17.079 -3.367 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -0.691 -17.203 -3.504 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -2.201 -15.320 -1.658 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -1.423 -16.818 -1.187 1.00 0.00 H new ATOM 0 HE21 GLN A 124 1.123 -16.721 -2.240 1.00 0.00 H new ATOM 0 HE22 GLN A 124 1.960 -15.298 -1.612 1.00 0.00 H new ATOM 1178 N PRO A 125 -3.606 -14.145 -3.912 1.00 0.00 N ATOM 1179 CA PRO A 125 -4.429 -12.933 -3.947 1.00 0.00 C ATOM 1180 C PRO A 125 -3.854 -11.694 -3.234 1.00 0.00 C ATOM 1181 O PRO A 125 -3.832 -11.604 -2.005 1.00 0.00 O ATOM 1182 CB PRO A 125 -5.805 -13.345 -3.427 1.00 0.00 C ATOM 1183 CG PRO A 125 -5.909 -14.788 -3.914 1.00 0.00 C ATOM 1184 CD PRO A 125 -4.472 -15.307 -3.800 1.00 0.00 C ATOM 0 HA PRO A 125 -4.471 -12.570 -4.974 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -5.868 -13.275 -2.341 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -6.599 -12.719 -3.834 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -6.596 -15.370 -3.300 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -6.275 -14.840 -4.939 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -4.317 -15.816 -2.849 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -4.256 -16.029 -4.587 1.00 0.00 H new ATOM 1192 N ILE A 126 -3.376 -10.742 -4.043 1.00 0.00 N ATOM 1193 CA ILE A 126 -2.927 -9.407 -3.612 1.00 0.00 C ATOM 1194 C ILE A 126 -4.147 -8.617 -3.136 1.00 0.00 C ATOM 1195 O ILE A 126 -5.290 -8.924 -3.481 1.00 0.00 O ATOM 1196 CB ILE A 126 -2.195 -8.652 -4.761 1.00 0.00 C ATOM 1197 CG1 ILE A 126 -1.354 -9.554 -5.692 1.00 0.00 C ATOM 1198 CG2 ILE A 126 -1.262 -7.533 -4.272 1.00 0.00 C ATOM 1199 CD1 ILE A 126 -0.338 -10.444 -4.988 1.00 0.00 C ATOM 0 H ILE A 126 -3.287 -10.881 -5.050 1.00 0.00 H new ATOM 0 HA ILE A 126 -2.211 -9.515 -2.798 1.00 0.00 H new ATOM 0 HB ILE A 126 -3.033 -8.233 -5.319 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -2.030 -10.186 -6.267 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -0.826 -8.921 -6.405 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -0.788 -7.054 -5.129 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -1.840 -6.794 -3.716 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -0.495 -7.956 -3.623 1.00 0.00 H new ATOM 0 HD11 ILE A 126 0.200 -11.037 -5.727 1.00 0.00 H new ATOM 0 HD12 ILE A 126 0.368 -9.824 -4.436 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -0.855 -11.109 -4.296 1.00 0.00 H new ATOM 1211 N TYR A 127 -3.907 -7.553 -2.382 1.00 0.00 N ATOM 1212 CA TYR A 127 -4.959 -6.642 -1.957 1.00 0.00 C ATOM 1213 C TYR A 127 -4.538 -5.194 -2.140 1.00 0.00 C ATOM 1214 O TYR A 127 -3.368 -4.857 -1.947 1.00 0.00 O ATOM 1215 CB TYR A 127 -5.272 -6.891 -0.487 1.00 0.00 C ATOM 1216 CG TYR A 127 -5.598 -8.318 -0.099 1.00 0.00 C ATOM 1217 CD1 TYR A 127 -6.724 -8.972 -0.635 1.00 0.00 C ATOM 1218 CD2 TYR A 127 -4.787 -8.975 0.841 1.00 0.00 C ATOM 1219 CE1 TYR A 127 -7.074 -10.260 -0.188 1.00 0.00 C ATOM 1220 CE2 TYR A 127 -5.177 -10.226 1.349 1.00 0.00 C ATOM 1221 CZ TYR A 127 -6.317 -10.879 0.828 1.00 0.00 C ATOM 1222 OH TYR A 127 -6.681 -12.108 1.288 1.00 0.00 O ATOM 0 H TYR A 127 -2.978 -7.298 -2.048 1.00 0.00 H new ATOM 0 HA TYR A 127 -5.841 -6.824 -2.570 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -4.417 -6.563 0.104 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -6.115 -6.260 -0.206 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -7.321 -8.484 -1.391 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -3.866 -8.520 1.173 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -7.920 -10.773 -0.622 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -4.604 -10.689 2.139 1.00 0.00 H new ATOM 0 HH TYR A 127 -6.056 -12.394 1.986 1.00 0.00 H new ATOM 1232 N ILE A 128 -5.517 -4.347 -2.438 1.00 0.00 N ATOM 1233 CA ILE A 128 -5.370 -2.901 -2.530 1.00 0.00 C ATOM 1234 C ILE A 128 -6.509 -2.186 -1.787 1.00 0.00 C ATOM 1235 O ILE A 128 -7.654 -2.644 -1.803 1.00 0.00 O ATOM 1236 CB ILE A 128 -5.237 -2.504 -4.025 1.00 0.00 C ATOM 1237 CG1 ILE A 128 -3.814 -1.958 -4.240 1.00 0.00 C ATOM 1238 CG2 ILE A 128 -6.319 -1.523 -4.505 1.00 0.00 C ATOM 1239 CD1 ILE A 128 -3.488 -1.595 -5.690 1.00 0.00 C ATOM 0 H ILE A 128 -6.469 -4.661 -2.629 1.00 0.00 H new ATOM 0 HA ILE A 128 -4.459 -2.574 -2.029 1.00 0.00 H new ATOM 0 HB ILE A 128 -5.399 -3.390 -4.639 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -3.680 -1.073 -3.618 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -3.096 -2.702 -3.895 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -6.160 -1.293 -5.558 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -7.303 -1.975 -4.377 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -6.263 -0.605 -3.920 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -2.467 -1.219 -5.750 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -3.586 -2.481 -6.318 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -4.179 -0.826 -6.037 1.00 0.00 H new ATOM 1251 N GLN A 129 -6.197 -1.031 -1.191 1.00 0.00 N ATOM 1252 CA GLN A 129 -7.138 0.024 -0.780 1.00 0.00 C ATOM 1253 C GLN A 129 -6.447 1.386 -0.918 1.00 0.00 C ATOM 1254 O GLN A 129 -5.220 1.457 -0.867 1.00 0.00 O ATOM 1255 CB GLN A 129 -7.568 -0.182 0.689 1.00 0.00 C ATOM 1256 CG GLN A 129 -8.810 -1.084 0.864 1.00 0.00 C ATOM 1257 CD GLN A 129 -8.641 -2.186 1.911 1.00 0.00 C ATOM 1258 OE1 GLN A 129 -7.631 -2.870 1.996 1.00 0.00 O ATOM 1259 NE2 GLN A 129 -9.631 -2.431 2.744 1.00 0.00 N ATOM 0 H GLN A 129 -5.231 -0.791 -0.969 1.00 0.00 H new ATOM 0 HA GLN A 129 -8.023 -0.018 -1.415 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -6.736 -0.617 1.242 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -7.773 0.791 1.136 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -9.661 -0.462 1.142 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -9.050 -1.543 -0.095 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -10.486 -1.877 2.697 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -9.543 -3.175 3.436 1.00 0.00 H new ATOM 1268 N PHE A 130 -7.200 2.483 -1.019 1.00 0.00 N ATOM 1269 CA PHE A 130 -6.644 3.823 -0.797 1.00 0.00 C ATOM 1270 C PHE A 130 -5.931 3.922 0.569 1.00 0.00 C ATOM 1271 O PHE A 130 -6.318 3.276 1.548 1.00 0.00 O ATOM 1272 CB PHE A 130 -7.734 4.895 -0.915 1.00 0.00 C ATOM 1273 CG PHE A 130 -8.091 5.324 -2.328 1.00 0.00 C ATOM 1274 CD1 PHE A 130 -7.096 5.857 -3.167 1.00 0.00 C ATOM 1275 CD2 PHE A 130 -9.428 5.301 -2.775 1.00 0.00 C ATOM 1276 CE1 PHE A 130 -7.425 6.362 -4.436 1.00 0.00 C ATOM 1277 CE2 PHE A 130 -9.764 5.831 -4.034 1.00 0.00 C ATOM 1278 CZ PHE A 130 -8.761 6.361 -4.865 1.00 0.00 C ATOM 0 H PHE A 130 -8.193 2.472 -1.252 1.00 0.00 H new ATOM 0 HA PHE A 130 -5.901 4.000 -1.574 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -8.636 4.523 -0.430 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -7.413 5.776 -0.359 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -6.069 5.878 -2.833 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -10.197 4.875 -2.148 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -6.650 6.751 -5.081 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -10.793 5.831 -4.363 1.00 0.00 H new ATOM 0 HZ PHE A 130 -9.019 6.767 -5.832 1.00 0.00 H new ATOM 1288 N SER A 131 -4.873 4.731 0.625 1.00 0.00 N ATOM 1289 CA SER A 131 -4.063 4.935 1.825 1.00 0.00 C ATOM 1290 C SER A 131 -4.811 5.712 2.921 1.00 0.00 C ATOM 1291 O SER A 131 -5.726 6.497 2.648 1.00 0.00 O ATOM 1292 CB SER A 131 -2.759 5.638 1.432 1.00 0.00 C ATOM 1293 OG SER A 131 -1.979 6.024 2.543 1.00 0.00 O ATOM 0 H SER A 131 -4.550 5.272 -0.177 1.00 0.00 H new ATOM 0 HA SER A 131 -3.839 3.959 2.256 1.00 0.00 H new ATOM 0 HB2 SER A 131 -2.172 4.973 0.798 1.00 0.00 H new ATOM 0 HB3 SER A 131 -2.995 6.521 0.837 1.00 0.00 H new ATOM 0 HG SER A 131 -1.969 5.300 3.203 1.00 0.00 H new ATOM 1299 N ASN A 132 -4.389 5.532 4.175 1.00 0.00 N ATOM 1300 CA ASN A 132 -4.789 6.359 5.320 1.00 0.00 C ATOM 1301 C ASN A 132 -4.261 7.809 5.228 1.00 0.00 C ATOM 1302 O ASN A 132 -4.808 8.719 5.861 1.00 0.00 O ATOM 1303 CB ASN A 132 -4.276 5.689 6.610 1.00 0.00 C ATOM 1304 CG ASN A 132 -4.863 4.303 6.850 1.00 0.00 C ATOM 1305 OD1 ASN A 132 -6.039 4.044 6.643 1.00 0.00 O ATOM 1306 ND2 ASN A 132 -4.071 3.375 7.339 1.00 0.00 N ATOM 0 H ASN A 132 -3.741 4.787 4.431 1.00 0.00 H new ATOM 0 HA ASN A 132 -5.877 6.428 5.323 1.00 0.00 H new ATOM 0 HB2 ASN A 132 -3.190 5.612 6.563 1.00 0.00 H new ATOM 0 HB3 ASN A 132 -4.513 6.328 7.461 1.00 0.00 H new ATOM 0 HD21 ASN A 132 -4.439 2.446 7.543 1.00 0.00 H new ATOM 0 HD22 ASN A 132 -3.088 3.584 7.514 1.00 0.00 H new ATOM 1313 N HIS A 133 -3.212 8.038 4.434 1.00 0.00 N ATOM 1314 CA HIS A 133 -2.491 9.307 4.309 1.00 0.00 C ATOM 1315 C HIS A 133 -2.827 10.040 2.997 1.00 0.00 C ATOM 1316 O HIS A 133 -3.614 9.570 2.168 1.00 0.00 O ATOM 1317 CB HIS A 133 -0.979 9.059 4.433 1.00 0.00 C ATOM 1318 CG HIS A 133 -0.594 8.140 5.566 1.00 0.00 C ATOM 1319 ND1 HIS A 133 -0.393 8.468 6.890 1.00 0.00 N ATOM 1320 CD2 HIS A 133 -0.405 6.798 5.433 1.00 0.00 C ATOM 1321 CE1 HIS A 133 -0.071 7.333 7.541 1.00 0.00 C ATOM 1322 NE2 HIS A 133 -0.060 6.294 6.690 1.00 0.00 N ATOM 0 H HIS A 133 -2.825 7.310 3.833 1.00 0.00 H new ATOM 0 HA HIS A 133 -2.814 9.959 5.120 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -0.614 8.636 3.497 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -0.475 10.016 4.569 1.00 0.00 H new ATOM 0 HD1 HIS A 133 -0.473 9.398 7.301 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -0.504 6.227 4.522 1.00 0.00 H new ATOM 0 HE1 HIS A 133 0.147 7.268 8.597 1.00 0.00 H new ATOM 1330 N LYS A 134 -2.242 11.233 2.835 1.00 0.00 N ATOM 1331 CA LYS A 134 -2.470 12.167 1.729 1.00 0.00 C ATOM 1332 C LYS A 134 -1.133 12.738 1.253 1.00 0.00 C ATOM 1333 O LYS A 134 -0.450 13.399 2.031 1.00 0.00 O ATOM 1334 CB LYS A 134 -3.436 13.296 2.162 1.00 0.00 C ATOM 1335 CG LYS A 134 -4.820 12.823 2.652 1.00 0.00 C ATOM 1336 CD LYS A 134 -4.924 12.584 4.169 1.00 0.00 C ATOM 1337 CE LYS A 134 -6.251 11.882 4.490 1.00 0.00 C ATOM 1338 NZ LYS A 134 -6.261 11.283 5.853 1.00 0.00 N ATOM 0 H LYS A 134 -1.562 11.590 3.507 1.00 0.00 H new ATOM 0 HA LYS A 134 -2.935 11.634 0.900 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -2.963 13.871 2.958 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -3.578 13.974 1.320 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -5.564 13.565 2.364 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -5.076 11.898 2.135 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -4.087 11.975 4.510 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -4.865 13.533 4.702 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -7.068 12.599 4.405 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -6.434 11.101 3.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -7.243 11.111 6.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -5.741 10.383 5.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -5.806 11.936 6.523 1.00 0.00 H new ATOM 1352 N GLU A 135 -0.764 12.484 -0.005 1.00 0.00 N ATOM 1353 CA GLU A 135 0.446 13.014 -0.664 1.00 0.00 C ATOM 1354 C GLU A 135 1.758 12.423 -0.101 1.00 0.00 C ATOM 1355 O GLU A 135 2.413 13.007 0.767 1.00 0.00 O ATOM 1356 CB GLU A 135 0.465 14.558 -0.726 1.00 0.00 C ATOM 1357 CG GLU A 135 -0.864 15.164 -1.205 1.00 0.00 C ATOM 1358 CD GLU A 135 -0.657 16.588 -1.748 1.00 0.00 C ATOM 1359 OE1 GLU A 135 -0.654 17.560 -0.955 1.00 0.00 O ATOM 1360 OE2 GLU A 135 -0.505 16.732 -2.986 1.00 0.00 O ATOM 0 H GLU A 135 -1.314 11.884 -0.619 1.00 0.00 H new ATOM 0 HA GLU A 135 0.390 12.669 -1.696 1.00 0.00 H new ATOM 0 HB2 GLU A 135 0.700 14.951 0.263 1.00 0.00 H new ATOM 0 HB3 GLU A 135 1.264 14.878 -1.395 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -1.296 14.534 -1.982 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -1.576 15.186 -0.380 1.00 0.00 H new ATOM 1367 N LEU A 136 2.151 11.250 -0.610 1.00 0.00 N ATOM 1368 CA LEU A 136 3.394 10.540 -0.263 1.00 0.00 C ATOM 1369 C LEU A 136 4.654 11.391 -0.521 1.00 0.00 C ATOM 1370 O LEU A 136 4.870 11.866 -1.639 1.00 0.00 O ATOM 1371 CB LEU A 136 3.422 9.239 -1.081 1.00 0.00 C ATOM 1372 CG LEU A 136 4.700 8.393 -1.038 1.00 0.00 C ATOM 1373 CD1 LEU A 136 5.120 8.032 0.379 1.00 0.00 C ATOM 1374 CD2 LEU A 136 4.478 7.086 -1.801 1.00 0.00 C ATOM 0 H LEU A 136 1.594 10.748 -1.301 1.00 0.00 H new ATOM 0 HA LEU A 136 3.404 10.326 0.806 1.00 0.00 H new ATOM 0 HB2 LEU A 136 2.595 8.614 -0.744 1.00 0.00 H new ATOM 0 HB3 LEU A 136 3.224 9.494 -2.122 1.00 0.00 H new ATOM 0 HG LEU A 136 5.486 8.997 -1.491 1.00 0.00 H new ATOM 0 HD11 LEU A 136 6.030 7.433 0.347 1.00 0.00 H new ATOM 0 HD12 LEU A 136 5.305 8.944 0.947 1.00 0.00 H new ATOM 0 HD13 LEU A 136 4.326 7.460 0.859 1.00 0.00 H new ATOM 0 HD21 LEU A 136 5.388 6.487 -1.769 1.00 0.00 H new ATOM 0 HD22 LEU A 136 3.661 6.530 -1.341 1.00 0.00 H new ATOM 0 HD23 LEU A 136 4.227 7.308 -2.838 1.00 0.00 H new ATOM 1386 N LYS A 137 5.513 11.517 0.499 1.00 0.00 N ATOM 1387 CA LYS A 137 6.836 12.163 0.455 1.00 0.00 C ATOM 1388 C LYS A 137 7.911 11.228 1.019 1.00 0.00 C ATOM 1389 O LYS A 137 7.936 10.951 2.218 1.00 0.00 O ATOM 1390 CB LYS A 137 6.794 13.502 1.213 1.00 0.00 C ATOM 1391 CG LYS A 137 5.897 14.536 0.515 1.00 0.00 C ATOM 1392 CD LYS A 137 5.875 15.872 1.271 1.00 0.00 C ATOM 1393 CE LYS A 137 4.941 16.860 0.560 1.00 0.00 C ATOM 1394 NZ LYS A 137 4.892 18.165 1.269 1.00 0.00 N ATOM 0 H LYS A 137 5.295 11.153 1.426 1.00 0.00 H new ATOM 0 HA LYS A 137 7.097 12.371 -0.583 1.00 0.00 H new ATOM 0 HB2 LYS A 137 6.430 13.333 2.226 1.00 0.00 H new ATOM 0 HB3 LYS A 137 7.805 13.900 1.300 1.00 0.00 H new ATOM 0 HG2 LYS A 137 6.254 14.699 -0.502 1.00 0.00 H new ATOM 0 HG3 LYS A 137 4.883 14.145 0.438 1.00 0.00 H new ATOM 0 HD2 LYS A 137 5.539 15.714 2.296 1.00 0.00 H new ATOM 0 HD3 LYS A 137 6.882 16.285 1.326 1.00 0.00 H new ATOM 0 HE2 LYS A 137 5.282 17.013 -0.464 1.00 0.00 H new ATOM 0 HE3 LYS A 137 3.938 16.438 0.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 4.252 18.811 0.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 4.544 18.021 2.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 5.846 18.578 1.302 1.00 0.00 H new ATOM 1408 N THR A 138 8.784 10.709 0.154 1.00 0.00 N ATOM 1409 CA THR A 138 9.911 9.815 0.508 1.00 0.00 C ATOM 1410 C THR A 138 11.278 10.524 0.513 1.00 0.00 C ATOM 1411 O THR A 138 12.295 9.918 0.854 1.00 0.00 O ATOM 1412 CB THR A 138 9.968 8.601 -0.441 1.00 0.00 C ATOM 1413 OG1 THR A 138 10.057 9.019 -1.790 1.00 0.00 O ATOM 1414 CG2 THR A 138 8.718 7.726 -0.332 1.00 0.00 C ATOM 0 H THR A 138 8.733 10.900 -0.847 1.00 0.00 H new ATOM 0 HA THR A 138 9.715 9.484 1.528 1.00 0.00 H new ATOM 0 HB THR A 138 10.849 8.032 -0.144 1.00 0.00 H new ATOM 0 HG1 THR A 138 10.566 8.358 -2.304 1.00 0.00 H new ATOM 0 HG21 THR A 138 8.803 6.883 -1.018 1.00 0.00 H new ATOM 0 HG22 THR A 138 8.622 7.355 0.688 1.00 0.00 H new ATOM 0 HG23 THR A 138 7.838 8.316 -0.588 1.00 0.00 H new ATOM 1422 N ASP A 139 11.322 11.803 0.128 1.00 0.00 N ATOM 1423 CA ASP A 139 12.529 12.586 -0.183 1.00 0.00 C ATOM 1424 C ASP A 139 13.520 12.734 0.990 1.00 0.00 C ATOM 1425 O ASP A 139 14.736 12.710 0.790 1.00 0.00 O ATOM 1426 CB ASP A 139 12.101 13.983 -0.662 1.00 0.00 C ATOM 1427 CG ASP A 139 11.140 13.922 -1.859 1.00 0.00 C ATOM 1428 OD1 ASP A 139 9.929 13.677 -1.634 1.00 0.00 O ATOM 1429 OD2 ASP A 139 11.590 14.113 -3.015 1.00 0.00 O ATOM 0 H ASP A 139 10.470 12.354 0.018 1.00 0.00 H new ATOM 0 HA ASP A 139 13.063 12.033 -0.956 1.00 0.00 H new ATOM 0 HB2 ASP A 139 11.621 14.515 0.159 1.00 0.00 H new ATOM 0 HB3 ASP A 139 12.986 14.556 -0.939 1.00 0.00 H new ATOM 1434 N SER A 140 13.008 12.908 2.216 1.00 0.00 N ATOM 1435 CA SER A 140 13.795 13.098 3.436 1.00 0.00 C ATOM 1436 C SER A 140 14.347 11.765 3.970 1.00 0.00 C ATOM 1437 O SER A 140 13.641 11.002 4.639 1.00 0.00 O ATOM 1438 CB SER A 140 12.962 13.832 4.492 1.00 0.00 C ATOM 1439 OG SER A 140 13.801 14.311 5.530 1.00 0.00 O ATOM 0 H SER A 140 12.003 12.920 2.388 1.00 0.00 H new ATOM 0 HA SER A 140 14.659 13.717 3.193 1.00 0.00 H new ATOM 0 HB2 SER A 140 12.429 14.664 4.032 1.00 0.00 H new ATOM 0 HB3 SER A 140 12.209 13.160 4.904 1.00 0.00 H new ATOM 0 HG SER A 140 13.259 14.780 6.199 1.00 0.00 H new ATOM 1445 N SER A 141 15.604 11.449 3.639 1.00 0.00 N ATOM 1446 CA SER A 141 16.267 10.183 3.993 1.00 0.00 C ATOM 1447 C SER A 141 16.396 9.980 5.521 1.00 0.00 C ATOM 1448 O SER A 141 16.759 10.932 6.224 1.00 0.00 O ATOM 1449 CB SER A 141 17.664 10.121 3.362 1.00 0.00 C ATOM 1450 OG SER A 141 17.587 10.269 1.949 1.00 0.00 O ATOM 0 H SER A 141 16.204 12.078 3.106 1.00 0.00 H new ATOM 0 HA SER A 141 15.636 9.384 3.603 1.00 0.00 H new ATOM 0 HB2 SER A 141 18.292 10.907 3.781 1.00 0.00 H new ATOM 0 HB3 SER A 141 18.137 9.170 3.607 1.00 0.00 H new ATOM 0 HG SER A 141 18.488 10.228 1.566 1.00 0.00 H new ATOM 1456 N PRO A 142 16.167 8.761 6.062 1.00 0.00 N ATOM 1457 CA PRO A 142 16.231 8.466 7.503 1.00 0.00 C ATOM 1458 C PRO A 142 17.535 8.838 8.228 1.00 0.00 C ATOM 1459 O PRO A 142 17.522 9.067 9.439 1.00 0.00 O ATOM 1460 CB PRO A 142 15.991 6.957 7.620 1.00 0.00 C ATOM 1461 CG PRO A 142 15.133 6.639 6.405 1.00 0.00 C ATOM 1462 CD PRO A 142 15.676 7.589 5.343 1.00 0.00 C ATOM 0 HA PRO A 142 15.486 9.089 7.998 1.00 0.00 H new ATOM 0 HB2 PRO A 142 16.927 6.399 7.607 1.00 0.00 H new ATOM 0 HB3 PRO A 142 15.481 6.702 8.549 1.00 0.00 H new ATOM 0 HG2 PRO A 142 15.232 5.597 6.103 1.00 0.00 H new ATOM 0 HG3 PRO A 142 14.075 6.815 6.601 1.00 0.00 H new ATOM 0 HD2 PRO A 142 16.476 7.119 4.772 1.00 0.00 H new ATOM 0 HD3 PRO A 142 14.897 7.866 4.632 1.00 0.00 H new ATOM 1470 N ASN A 143 18.665 8.911 7.514 1.00 0.00 N ATOM 1471 CA ASN A 143 19.991 9.230 8.067 1.00 0.00 C ATOM 1472 C ASN A 143 20.183 10.698 8.527 1.00 0.00 C ATOM 1473 O ASN A 143 21.268 11.038 9.007 1.00 0.00 O ATOM 1474 CB ASN A 143 21.067 8.807 7.050 1.00 0.00 C ATOM 1475 CG ASN A 143 21.095 9.684 5.808 1.00 0.00 C ATOM 1476 OD1 ASN A 143 20.407 9.431 4.830 1.00 0.00 O ATOM 1477 ND2 ASN A 143 21.868 10.746 5.805 1.00 0.00 N ATOM 0 H ASN A 143 18.685 8.746 6.508 1.00 0.00 H new ATOM 0 HA ASN A 143 20.089 8.661 8.991 1.00 0.00 H new ATOM 0 HB2 ASN A 143 22.045 8.838 7.531 1.00 0.00 H new ATOM 0 HB3 ASN A 143 20.891 7.773 6.753 1.00 0.00 H new ATOM 0 HD21 ASN A 143 21.893 11.356 4.988 1.00 0.00 H new ATOM 0 HD22 ASN A 143 22.443 10.960 6.619 1.00 0.00 H new ATOM 1484 N GLN A 144 19.181 11.573 8.374 1.00 0.00 N ATOM 1485 CA GLN A 144 19.218 12.967 8.839 1.00 0.00 C ATOM 1486 C GLN A 144 19.233 13.068 10.383 1.00 0.00 C ATOM 1487 O GLN A 144 18.202 13.227 11.039 1.00 0.00 O ATOM 1488 CB GLN A 144 18.063 13.762 8.199 1.00 0.00 C ATOM 1489 CG GLN A 144 18.194 15.266 8.496 1.00 0.00 C ATOM 1490 CD GLN A 144 17.222 16.152 7.720 1.00 0.00 C ATOM 1491 OE1 GLN A 144 17.612 17.165 7.151 1.00 0.00 O ATOM 1492 NE2 GLN A 144 15.940 15.865 7.696 1.00 0.00 N ATOM 0 H GLN A 144 18.304 11.328 7.914 1.00 0.00 H new ATOM 0 HA GLN A 144 20.156 13.417 8.513 1.00 0.00 H new ATOM 0 HB2 GLN A 144 18.059 13.600 7.121 1.00 0.00 H new ATOM 0 HB3 GLN A 144 17.110 13.395 8.580 1.00 0.00 H new ATOM 0 HG2 GLN A 144 18.040 15.427 9.563 1.00 0.00 H new ATOM 0 HG3 GLN A 144 19.213 15.581 8.270 1.00 0.00 H new ATOM 0 HE21 GLN A 144 15.596 15.026 8.164 1.00 0.00 H new ATOM 0 HE22 GLN A 144 15.289 16.481 7.210 1.00 0.00 H new ATOM 1501 N ALA A 145 20.430 13.002 10.969 1.00 0.00 N ATOM 1502 CA ALA A 145 20.694 13.001 12.414 1.00 0.00 C ATOM 1503 C ALA A 145 20.147 14.236 13.160 1.00 0.00 C ATOM 1504 O ALA A 145 19.707 14.133 14.310 1.00 0.00 O ATOM 1505 CB ALA A 145 22.214 12.910 12.597 1.00 0.00 C ATOM 0 H ALA A 145 21.289 12.945 10.421 1.00 0.00 H new ATOM 0 HA ALA A 145 20.170 12.151 12.851 1.00 0.00 H new ATOM 0 HB1 ALA A 145 22.453 12.907 13.660 1.00 0.00 H new ATOM 0 HB2 ALA A 145 22.581 11.991 12.140 1.00 0.00 H new ATOM 0 HB3 ALA A 145 22.690 13.767 12.121 1.00 0.00 H new ATOM 1511 N ARG A 146 20.173 15.402 12.499 1.00 0.00 N ATOM 1512 CA ARG A 146 19.747 16.717 13.025 1.00 0.00 C ATOM 1513 C ARG A 146 18.230 16.889 13.221 1.00 0.00 C ATOM 1514 O ARG A 146 17.811 17.861 13.856 1.00 0.00 O ATOM 1515 CB ARG A 146 20.316 17.821 12.106 1.00 0.00 C ATOM 1516 CG ARG A 146 19.701 17.814 10.693 1.00 0.00 C ATOM 1517 CD ARG A 146 20.272 18.917 9.797 1.00 0.00 C ATOM 1518 NE ARG A 146 19.663 18.858 8.454 1.00 0.00 N ATOM 1519 CZ ARG A 146 20.012 19.515 7.367 1.00 0.00 C ATOM 1520 NH1 ARG A 146 20.980 20.387 7.354 1.00 0.00 N ATOM 1521 NH2 ARG A 146 19.369 19.292 6.259 1.00 0.00 N ATOM 1522 OXT ARG A 146 17.445 16.068 12.751 1.00 99.99 O ATOM 0 H ARG A 146 20.507 15.462 11.537 1.00 0.00 H new ATOM 0 HA ARG A 146 20.151 16.794 14.035 1.00 0.00 H new ATOM 0 HB2 ARG A 146 20.141 18.793 12.566 1.00 0.00 H new ATOM 0 HB3 ARG A 146 21.396 17.696 12.025 1.00 0.00 H new ATOM 0 HG2 ARG A 146 19.879 16.844 10.228 1.00 0.00 H new ATOM 0 HG3 ARG A 146 18.621 17.937 10.770 1.00 0.00 H new ATOM 0 HD2 ARG A 146 20.084 19.892 10.246 1.00 0.00 H new ATOM 0 HD3 ARG A 146 21.353 18.806 9.718 1.00 0.00 H new ATOM 0 HE ARG A 146 18.868 18.226 8.355 1.00 0.00 H new ATOM 0 HH11 ARG A 146 21.501 20.583 8.209 1.00 0.00 H new ATOM 0 HH12 ARG A 146 21.217 20.873 6.489 1.00 0.00 H new ATOM 0 HH21 ARG A 146 18.606 18.616 6.240 1.00 0.00 H new ATOM 0 HH22 ARG A 146 19.628 19.793 5.409 1.00 0.00 H new TER 1536 ARG A 146 ATOM 1537 O5' C B 147 -1.849 -12.549 5.118 1.00 0.00 O ATOM 1538 C5' C B 147 -1.609 -11.184 4.807 1.00 0.00 C ATOM 1539 C4' C B 147 -0.960 -10.423 5.973 1.00 0.00 C ATOM 1540 O4' C B 147 0.367 -10.906 6.180 1.00 0.00 O ATOM 1541 C3' C B 147 -0.823 -8.926 5.637 1.00 0.00 C ATOM 1542 O3' C B 147 -0.789 -8.150 6.830 1.00 0.00 O ATOM 1543 C2' C B 147 0.525 -8.917 4.927 1.00 0.00 C ATOM 1544 O2' C B 147 1.109 -7.635 4.777 1.00 0.00 O ATOM 1545 C1' C B 147 1.296 -9.887 5.825 1.00 0.00 C ATOM 1546 N1 C B 147 2.496 -10.487 5.181 1.00 0.00 N ATOM 1547 C2 C B 147 3.686 -10.586 5.912 1.00 0.00 C ATOM 1548 O2 C B 147 3.751 -10.253 7.097 1.00 0.00 O ATOM 1549 N3 C B 147 4.816 -11.061 5.327 1.00 0.00 N ATOM 1550 C4 C B 147 4.758 -11.441 4.068 1.00 0.00 C ATOM 1551 N4 C B 147 5.876 -11.879 3.564 1.00 0.00 N ATOM 1552 C5 C B 147 3.575 -11.393 3.281 1.00 0.00 C ATOM 1553 C6 C B 147 2.455 -10.915 3.878 1.00 0.00 C ATOM 0 H5' C B 147 -2.551 -10.703 4.543 1.00 0.00 H new ATOM 0 H5'' C B 147 -0.963 -11.122 3.932 1.00 0.00 H new ATOM 0 H4' C B 147 -1.589 -10.569 6.851 1.00 0.00 H new ATOM 0 H3' C B 147 -1.640 -8.507 5.049 1.00 0.00 H new ATOM 0 H2' C B 147 0.490 -9.211 3.878 1.00 0.00 H new ATOM 0 HO2' C B 147 2.047 -7.732 4.510 1.00 0.00 H new ATOM 0 HO5' C B 147 -2.528 -12.909 4.510 1.00 0.00 H new ATOM 0 H1' C B 147 1.687 -9.345 6.686 1.00 0.00 H new ATOM 0 H41 C B 147 5.910 -12.192 2.594 1.00 0.00 H new ATOM 0 H42 C B 147 6.718 -11.909 4.140 1.00 0.00 H new ATOM 0 H5 C B 147 3.568 -11.723 2.253 1.00 0.00 H new ATOM 0 H6 C B 147 1.528 -10.871 3.326 1.00 0.00 H new ATOM 1566 P U B 148 -2.113 -7.527 7.472 1.00 0.00 P ATOM 1567 OP1 U B 148 -1.800 -7.120 8.862 1.00 0.00 O ATOM 1568 OP2 U B 148 -3.237 -8.463 7.232 1.00 0.00 O ATOM 1569 O5' U B 148 -2.387 -6.195 6.617 1.00 0.00 O ATOM 1570 C5' U B 148 -1.339 -5.282 6.327 1.00 0.00 C ATOM 1571 C4' U B 148 -1.763 -3.814 6.471 1.00 0.00 C ATOM 1572 O4' U B 148 -2.885 -3.532 5.638 1.00 0.00 O ATOM 1573 C3' U B 148 -2.096 -3.426 7.919 1.00 0.00 C ATOM 1574 O3' U B 148 -1.660 -2.095 8.191 1.00 0.00 O ATOM 1575 C2' U B 148 -3.619 -3.496 7.905 1.00 0.00 C ATOM 1576 O2' U B 148 -4.234 -2.690 8.907 1.00 0.00 O ATOM 1577 C1' U B 148 -3.913 -3.025 6.478 1.00 0.00 C ATOM 1578 N1 U B 148 -5.242 -3.466 5.997 1.00 0.00 N ATOM 1579 C2 U B 148 -6.107 -2.505 5.469 1.00 0.00 C ATOM 1580 O2 U B 148 -5.792 -1.334 5.258 1.00 0.00 O ATOM 1581 N3 U B 148 -7.376 -2.925 5.139 1.00 0.00 N ATOM 1582 C4 U B 148 -7.837 -4.217 5.203 1.00 0.00 C ATOM 1583 O4 U B 148 -8.968 -4.474 4.807 1.00 0.00 O ATOM 1584 C5 U B 148 -6.875 -5.170 5.717 1.00 0.00 C ATOM 1585 C6 U B 148 -5.622 -4.787 6.091 1.00 0.00 C ATOM 0 H5' U B 148 -0.986 -5.454 5.310 1.00 0.00 H new ATOM 0 H5'' U B 148 -0.499 -5.479 6.993 1.00 0.00 H new ATOM 0 H4' U B 148 -0.906 -3.218 6.159 1.00 0.00 H new ATOM 0 H3' U B 148 -1.624 -4.055 8.674 1.00 0.00 H new ATOM 0 H2' U B 148 -4.022 -4.481 8.141 1.00 0.00 H new ATOM 0 HO2' U B 148 -3.578 -2.055 9.264 1.00 0.00 H new ATOM 0 H1' U B 148 -3.933 -1.935 6.460 1.00 0.00 H new ATOM 0 H3 U B 148 -8.032 -2.213 4.818 1.00 0.00 H new ATOM 0 H5 U B 148 -7.157 -6.209 5.806 1.00 0.00 H new ATOM 0 H6 U B 148 -4.924 -5.522 6.463 1.00 0.00 H new ATOM 1596 P C B 149 -0.209 -1.790 8.802 1.00 0.00 P ATOM 1597 OP1 C B 149 0.776 -2.697 8.170 1.00 0.00 O ATOM 1598 OP2 C B 149 -0.315 -1.757 10.278 1.00 0.00 O ATOM 1599 O5' C B 149 0.088 -0.304 8.278 1.00 0.00 O ATOM 1600 C5' C B 149 1.412 0.130 8.003 1.00 0.00 C ATOM 1601 C4' C B 149 1.470 1.574 7.478 1.00 0.00 C ATOM 1602 O4' C B 149 0.922 1.643 6.163 1.00 0.00 O ATOM 1603 C3' C B 149 0.726 2.580 8.378 1.00 0.00 C ATOM 1604 O3' C B 149 1.386 3.835 8.489 1.00 0.00 O ATOM 1605 C2' C B 149 -0.582 2.756 7.616 1.00 0.00 C ATOM 1606 O2' C B 149 -1.279 3.970 7.861 1.00 0.00 O ATOM 1607 C1' C B 149 -0.159 2.566 6.162 1.00 0.00 C ATOM 1608 N1 C B 149 -1.336 2.055 5.418 1.00 0.00 N ATOM 1609 C2 C B 149 -2.095 2.922 4.626 1.00 0.00 C ATOM 1610 O2 C B 149 -1.750 4.083 4.413 1.00 0.00 O ATOM 1611 N3 C B 149 -3.254 2.511 4.063 1.00 0.00 N ATOM 1612 C4 C B 149 -3.629 1.264 4.239 1.00 0.00 C ATOM 1613 N4 C B 149 -4.768 0.928 3.705 1.00 0.00 N ATOM 1614 C5 C B 149 -2.875 0.331 4.993 1.00 0.00 C ATOM 1615 C6 C B 149 -1.750 0.765 5.606 1.00 0.00 C ATOM 0 H5' C B 149 1.863 -0.537 7.268 1.00 0.00 H new ATOM 0 H5'' C B 149 2.010 0.054 8.911 1.00 0.00 H new ATOM 0 H4' C B 149 2.524 1.851 7.474 1.00 0.00 H new ATOM 0 H3' C B 149 0.636 2.227 9.405 1.00 0.00 H new ATOM 0 H2' C B 149 -1.335 2.039 7.943 1.00 0.00 H new ATOM 0 HO2' C B 149 -0.734 4.727 7.560 1.00 0.00 H new ATOM 0 H1' C B 149 0.170 3.488 5.683 1.00 0.00 H new ATOM 0 H41 C B 149 -5.117 -0.025 3.805 1.00 0.00 H new ATOM 0 H42 C B 149 -5.312 1.618 3.187 1.00 0.00 H new ATOM 0 H5 C B 149 -3.190 -0.699 5.076 1.00 0.00 H new ATOM 0 H6 C B 149 -1.183 0.098 6.239 1.00 0.00 H new ATOM 1627 P U B 150 2.675 4.038 9.419 1.00 0.00 P ATOM 1628 OP1 U B 150 2.635 3.049 10.521 1.00 0.00 O ATOM 1629 OP2 U B 150 2.786 5.479 9.749 1.00 0.00 O ATOM 1630 O5' U B 150 3.899 3.651 8.452 1.00 0.00 O ATOM 1631 C5' U B 150 4.102 4.330 7.222 1.00 0.00 C ATOM 1632 C4' U B 150 5.529 4.076 6.726 1.00 0.00 C ATOM 1633 O4' U B 150 5.646 4.457 5.367 1.00 0.00 O ATOM 1634 C3' U B 150 6.556 4.857 7.553 1.00 0.00 C ATOM 1635 O3' U B 150 7.335 3.979 8.356 1.00 0.00 O ATOM 1636 C2' U B 150 7.383 5.636 6.508 1.00 0.00 C ATOM 1637 O2' U B 150 8.725 5.180 6.345 1.00 0.00 O ATOM 1638 C1' U B 150 6.652 5.448 5.184 1.00 0.00 C ATOM 1639 N1 U B 150 6.123 6.758 4.688 1.00 0.00 N ATOM 1640 C2 U B 150 7.005 7.659 4.071 1.00 0.00 C ATOM 1641 O2 U B 150 8.210 7.451 3.929 1.00 0.00 O ATOM 1642 N3 U B 150 6.467 8.836 3.589 1.00 0.00 N ATOM 1643 C4 U B 150 5.132 9.161 3.580 1.00 0.00 C ATOM 1644 O4 U B 150 4.757 10.209 3.063 1.00 0.00 O ATOM 1645 C5 U B 150 4.273 8.171 4.194 1.00 0.00 C ATOM 1646 C6 U B 150 4.780 7.038 4.745 1.00 0.00 C ATOM 0 H5' U B 150 3.937 5.399 7.353 1.00 0.00 H new ATOM 0 H5'' U B 150 3.381 3.985 6.481 1.00 0.00 H new ATOM 0 H4' U B 150 5.731 3.010 6.835 1.00 0.00 H new ATOM 0 H3' U B 150 6.102 5.541 8.270 1.00 0.00 H new ATOM 0 H2' U B 150 7.465 6.670 6.842 1.00 0.00 H new ATOM 0 HO2' U B 150 8.884 4.414 6.935 1.00 0.00 H new ATOM 0 H1' U B 150 7.329 5.095 4.406 1.00 0.00 H new ATOM 0 H3 U B 150 7.117 9.523 3.207 1.00 0.00 H new ATOM 0 H5 U B 150 3.206 8.337 4.214 1.00 0.00 H new ATOM 0 H6 U B 150 4.114 6.344 5.237 1.00 0.00 H new ATOM 1657 P C B 151 8.157 4.510 9.626 1.00 0.00 P ATOM 1658 OP1 C B 151 8.609 5.898 9.361 1.00 0.00 O ATOM 1659 OP2 C B 151 9.174 3.483 9.964 1.00 0.00 O ATOM 1660 O5' C B 151 7.065 4.549 10.808 1.00 0.00 O ATOM 1661 C5' C B 151 6.511 3.349 11.335 1.00 0.00 C ATOM 1662 C4' C B 151 5.793 3.596 12.672 1.00 0.00 C ATOM 1663 O4' C B 151 5.454 2.341 13.261 1.00 0.00 O ATOM 1664 C3' C B 151 6.680 4.346 13.683 1.00 0.00 C ATOM 1665 O3' C B 151 6.234 5.671 13.965 1.00 0.00 O ATOM 1666 C2' C B 151 6.636 3.448 14.935 1.00 0.00 C ATOM 1667 O2' C B 151 5.559 3.765 15.818 1.00 0.00 O ATOM 1668 C1' C B 151 6.340 2.070 14.342 1.00 0.00 C ATOM 1669 N1 C B 151 7.509 1.250 13.874 1.00 0.00 N ATOM 1670 C2 C B 151 7.280 -0.110 13.605 1.00 0.00 C ATOM 1671 O2 C B 151 6.180 -0.637 13.782 1.00 0.00 O ATOM 1672 N3 C B 151 8.281 -0.913 13.158 1.00 0.00 N ATOM 1673 C4 C B 151 9.482 -0.398 13.010 1.00 0.00 C ATOM 1674 N4 C B 151 10.404 -1.216 12.582 1.00 0.00 N ATOM 1675 C5 C B 151 9.801 0.953 13.318 1.00 0.00 C ATOM 1676 C6 C B 151 8.792 1.750 13.753 1.00 0.00 C ATOM 0 H5' C B 151 7.303 2.614 11.477 1.00 0.00 H new ATOM 0 H5'' C B 151 5.809 2.926 10.617 1.00 0.00 H new ATOM 0 H4' C B 151 4.913 4.200 12.454 1.00 0.00 H new ATOM 0 H3' C B 151 7.687 4.500 13.295 1.00 0.00 H new ATOM 0 H2' C B 151 7.553 3.544 15.516 1.00 0.00 H new ATOM 0 HO2' C B 151 5.218 4.660 15.610 1.00 0.00 H new ATOM 0 H1' C B 151 5.936 1.438 15.133 1.00 0.00 H new ATOM 0 H41 C B 151 11.358 -0.882 12.445 1.00 0.00 H new ATOM 0 H42 C B 151 10.171 -2.189 12.385 1.00 0.00 H new ATOM 0 H5 C B 151 10.807 1.330 13.210 1.00 0.00 H new ATOM 0 H6 C B 151 8.993 2.781 14.006 1.00 0.00 H new ATOM 1688 P U B 152 7.144 6.707 14.786 1.00 0.00 P ATOM 1689 OP1 U B 152 8.509 6.145 14.936 1.00 0.00 O ATOM 1690 OP2 U B 152 6.390 7.091 16.000 1.00 0.00 O ATOM 1691 O5' U B 152 7.247 7.974 13.785 1.00 0.00 O ATOM 1692 C5' U B 152 6.110 8.760 13.439 1.00 0.00 C ATOM 1693 C4' U B 152 5.807 9.866 14.469 1.00 0.00 C ATOM 1694 O4' U B 152 6.758 10.930 14.351 1.00 0.00 O ATOM 1695 C3' U B 152 4.411 10.474 14.240 1.00 0.00 C ATOM 1696 O3' U B 152 3.834 10.843 15.492 1.00 0.00 O ATOM 1697 C2' U B 152 4.750 11.707 13.394 1.00 0.00 C ATOM 1698 O2' U B 152 3.748 12.726 13.417 1.00 0.00 O ATOM 1699 C1' U B 152 6.061 12.139 14.058 1.00 0.00 C ATOM 1700 N1 U B 152 6.839 13.100 13.225 1.00 0.00 N ATOM 1701 C2 U B 152 7.441 12.681 12.024 1.00 0.00 C ATOM 1702 O2 U B 152 7.352 11.545 11.550 1.00 0.00 O ATOM 1703 N3 U B 152 8.158 13.628 11.321 1.00 0.00 N ATOM 1704 C4 U B 152 8.305 14.951 11.667 1.00 0.00 C ATOM 1705 O4 U B 152 8.964 15.705 10.956 1.00 0.00 O ATOM 1706 C5 U B 152 7.632 15.324 12.894 1.00 0.00 C ATOM 1707 C6 U B 152 6.927 14.418 13.623 1.00 0.00 C ATOM 0 H5' U B 152 5.240 8.110 13.346 1.00 0.00 H new ATOM 0 H5'' U B 152 6.274 9.215 12.462 1.00 0.00 H new ATOM 0 H4' U B 152 5.857 9.405 15.455 1.00 0.00 H new ATOM 0 H3' U B 152 3.689 9.808 13.767 1.00 0.00 H new ATOM 0 H2' U B 152 4.821 11.503 12.326 1.00 0.00 H new ATOM 0 HO2' U B 152 4.034 13.479 12.858 1.00 0.00 H new ATOM 0 HO3' U B 152 3.490 11.759 15.436 1.00 0.00 H new ATOM 0 H1' U B 152 5.881 12.703 14.973 1.00 0.00 H new ATOM 0 H3 U B 152 8.621 13.318 10.467 1.00 0.00 H new ATOM 0 H5 U B 152 7.691 16.346 13.238 1.00 0.00 H new ATOM 0 H6 U B 152 6.429 14.735 14.527 1.00 0.00 H new TER 1719 U B 152