USER MOD reduce.3.24.130724 H: found=0, std=0, add=975, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 973 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 135 ASN : amide:sc= 1.14 K(o=-1.4,f=-2.2) USER MOD Set 1.2: A 146 HIS : no HE2:sc= -2.5! K(o=-1.4!,f=-2.6) USER MOD Set 2.1: A 132 LYS NZ :NH3+ -157:sc= 0.955 (180deg=0.656) USER MOD Set 2.2: A 150 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 96 THR OG1 : rot -110:sc= 0.661 USER MOD Set 3.2: A 114 HIS : no HD1:sc= 0.417 K(o=1.1,f=-2.6) USER MOD Set 4.1: A 83 TYR OH : rot 165:sc= 0.00433 USER MOD Set 4.2: A 128 LYS NZ :NH3+ 150:sc= 0.00403 (180deg=0) USER MOD Set 5.1: A 79 ASN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Set 5.2: A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 39:sc= 0.295 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot -82:sc= 0.824 USER MOD Single : A 52 CYS SG : rot -150:sc= -0.798 USER MOD Single : A 55 SER OG : rot -103:sc= 1.07 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= -0.105 K(o=-0.11,f=-1.6!) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 TYR OH : rot -120:sc= 1.14 USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -1.45 X(o=-1.4,f=-1.1!) USER MOD Single : A 68 CYS SG : rot 36:sc= -0.193 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 ASN : amide:sc= -0.4 K(o=-0.4,f=-1.3) USER MOD Single : A 72 GLN : amide:sc= 0.0672 K(o=0.067,f=-4.1!) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -0.0116 X(o=-0.012,f=0) USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 ASN : amide:sc= -3.26! C(o=-3.3!,f=-7.6!) USER MOD Single : A 86 GLN : amide:sc= -1.34 K(o=-1.3,f=-5.2!) USER MOD Single : A 89 GLN : amide:sc= -2.65 K(o=-2.6,f=-4!) USER MOD Single : A 91 SER OG : rot -51:sc= 0.181 USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 97 CYS SG : rot 180:sc= 0 USER MOD Single : A 99 ASN : amide:sc= -0.0868 X(o=-0.087,f=0) USER MOD Single : A 109 GLN : amide:sc= -0.0951 X(o=-0.095,f=-0.095) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 ASN :FLIP amide:sc= 0 F(o=-1.3,f=0) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0.00258 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 LYS NZ :NH3+ 166:sc=-0.000304 (180deg=-0.14) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 THR OG1 : rot -170:sc= 1.34 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 ASN : amide:sc= -1.44 K(o=-1.4,f=-6.7!) USER MOD Single : A 142 HIS :FLIP no HD1:sc= -7.04! C(o=-8!,f=-7!) USER MOD Single : A 145 SER OG : rot 40:sc= 0.918 USER MOD Single : A 149 LYS NZ :NH3+ -175:sc= 1.21 (180deg=1.12) USER MOD Single : A 151 THR OG1 : rot 180:sc= -0.145 USER MOD Single : A 156 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 34 -18.561 7.787 -30.723 1.00 0.00 N ATOM 2 CA GLY A 34 -17.530 8.782 -30.498 1.00 0.00 C ATOM 3 C GLY A 34 -16.194 8.378 -31.091 1.00 0.00 C ATOM 4 O GLY A 34 -16.056 7.285 -31.639 1.00 0.00 O ATOM 0 HA2 GLY A 34 -17.845 9.731 -30.932 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -17.414 8.945 -29.426 1.00 0.00 H new ATOM 8 N SER A 35 -15.208 9.263 -30.982 1.00 0.00 N ATOM 9 CA SER A 35 -13.879 8.995 -31.517 1.00 0.00 C ATOM 10 C SER A 35 -12.876 10.036 -31.026 1.00 0.00 C ATOM 11 O SER A 35 -13.253 11.140 -30.633 1.00 0.00 O ATOM 12 CB SER A 35 -13.913 8.985 -33.046 1.00 0.00 C ATOM 13 OG SER A 35 -14.136 10.287 -33.560 1.00 0.00 O ATOM 0 H SER A 35 -15.305 10.171 -30.528 1.00 0.00 H new ATOM 0 HA SER A 35 -13.563 8.014 -31.162 1.00 0.00 H new ATOM 0 HB2 SER A 35 -12.971 8.595 -33.431 1.00 0.00 H new ATOM 0 HB3 SER A 35 -14.700 8.315 -33.391 1.00 0.00 H new ATOM 0 HG SER A 35 -14.152 10.254 -34.539 1.00 0.00 H new ATOM 19 N SER A 36 -11.597 9.675 -31.052 1.00 0.00 N ATOM 20 CA SER A 36 -10.540 10.574 -30.607 1.00 0.00 C ATOM 21 C SER A 36 -9.164 9.991 -30.916 1.00 0.00 C ATOM 22 O SER A 36 -8.931 8.796 -30.741 1.00 0.00 O ATOM 23 CB SER A 36 -10.667 10.842 -29.106 1.00 0.00 C ATOM 24 OG SER A 36 -10.342 9.687 -28.352 1.00 0.00 O ATOM 0 H SER A 36 -11.268 8.766 -31.377 1.00 0.00 H new ATOM 0 HA SER A 36 -10.647 11.515 -31.147 1.00 0.00 H new ATOM 0 HB2 SER A 36 -10.007 11.662 -28.823 1.00 0.00 H new ATOM 0 HB3 SER A 36 -11.685 11.157 -28.874 1.00 0.00 H new ATOM 0 HG SER A 36 -10.429 9.885 -27.396 1.00 0.00 H new ATOM 30 N GLY A 37 -8.256 10.845 -31.377 1.00 0.00 N ATOM 31 CA GLY A 37 -6.915 10.397 -31.704 1.00 0.00 C ATOM 32 C GLY A 37 -5.984 10.432 -30.508 1.00 0.00 C ATOM 33 O GLY A 37 -6.021 9.543 -29.658 1.00 0.00 O ATOM 0 H GLY A 37 -8.425 11.839 -31.530 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -6.960 9.381 -32.096 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -6.508 11.026 -32.496 1.00 0.00 H new ATOM 37 N SER A 38 -5.146 11.462 -30.442 1.00 0.00 N ATOM 38 CA SER A 38 -4.198 11.607 -29.344 1.00 0.00 C ATOM 39 C SER A 38 -3.791 13.066 -29.166 1.00 0.00 C ATOM 40 O SER A 38 -3.213 13.675 -30.066 1.00 0.00 O ATOM 41 CB SER A 38 -2.958 10.747 -29.596 1.00 0.00 C ATOM 42 OG SER A 38 -2.389 11.032 -30.862 1.00 0.00 O ATOM 0 H SER A 38 -5.105 12.208 -31.136 1.00 0.00 H new ATOM 0 HA SER A 38 -4.686 11.270 -28.429 1.00 0.00 H new ATOM 0 HB2 SER A 38 -2.221 10.928 -28.813 1.00 0.00 H new ATOM 0 HB3 SER A 38 -3.226 9.692 -29.544 1.00 0.00 H new ATOM 0 HG SER A 38 -2.432 11.996 -31.030 1.00 0.00 H new ATOM 48 N SER A 39 -4.098 13.622 -27.998 1.00 0.00 N ATOM 49 CA SER A 39 -3.768 15.011 -27.702 1.00 0.00 C ATOM 50 C SER A 39 -2.805 15.101 -26.522 1.00 0.00 C ATOM 51 O SER A 39 -1.727 15.683 -26.629 1.00 0.00 O ATOM 52 CB SER A 39 -5.040 15.806 -27.399 1.00 0.00 C ATOM 53 OG SER A 39 -5.619 16.314 -28.589 1.00 0.00 O ATOM 0 H SER A 39 -4.575 13.132 -27.241 1.00 0.00 H new ATOM 0 HA SER A 39 -3.281 15.438 -28.579 1.00 0.00 H new ATOM 0 HB2 SER A 39 -5.758 15.167 -26.885 1.00 0.00 H new ATOM 0 HB3 SER A 39 -4.806 16.629 -26.724 1.00 0.00 H new ATOM 0 HG SER A 39 -6.431 16.817 -28.369 1.00 0.00 H new ATOM 59 N GLY A 40 -3.204 14.520 -25.395 1.00 0.00 N ATOM 60 CA GLY A 40 -2.367 14.546 -24.210 1.00 0.00 C ATOM 61 C GLY A 40 -3.153 14.294 -22.938 1.00 0.00 C ATOM 62 O GLY A 40 -3.516 15.231 -22.229 1.00 0.00 O ATOM 0 H GLY A 40 -4.092 14.032 -25.281 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -1.585 13.793 -24.305 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -1.871 15.514 -24.141 1.00 0.00 H new ATOM 66 N ALA A 41 -3.418 13.023 -22.651 1.00 0.00 N ATOM 67 CA ALA A 41 -4.165 12.651 -21.457 1.00 0.00 C ATOM 68 C ALA A 41 -3.935 11.186 -21.100 1.00 0.00 C ATOM 69 O ALA A 41 -4.034 10.307 -21.955 1.00 0.00 O ATOM 70 CB ALA A 41 -5.649 12.920 -21.657 1.00 0.00 C ATOM 0 H ALA A 41 -3.126 12.235 -23.229 1.00 0.00 H new ATOM 0 HA ALA A 41 -3.805 13.261 -20.629 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -6.195 12.637 -20.757 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -5.803 13.980 -21.857 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -6.014 12.335 -22.501 1.00 0.00 H new ATOM 76 N GLU A 42 -3.628 10.932 -19.832 1.00 0.00 N ATOM 77 CA GLU A 42 -3.382 9.573 -19.363 1.00 0.00 C ATOM 78 C GLU A 42 -4.079 9.323 -18.029 1.00 0.00 C ATOM 79 O GLU A 42 -4.010 10.146 -17.116 1.00 0.00 O ATOM 80 CB GLU A 42 -1.879 9.322 -19.222 1.00 0.00 C ATOM 81 CG GLU A 42 -1.158 9.180 -20.551 1.00 0.00 C ATOM 82 CD GLU A 42 -1.184 10.457 -21.369 1.00 0.00 C ATOM 83 OE1 GLU A 42 -0.983 11.541 -20.782 1.00 0.00 O ATOM 84 OE2 GLU A 42 -1.405 10.372 -22.595 1.00 0.00 O ATOM 0 H GLU A 42 -3.544 11.649 -19.111 1.00 0.00 H new ATOM 0 HA GLU A 42 -3.790 8.882 -20.101 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -1.433 10.144 -18.662 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -1.724 8.416 -18.636 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -0.123 8.890 -20.369 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -1.618 8.376 -21.125 1.00 0.00 H new ATOM 91 N LYS A 43 -4.750 8.181 -17.924 1.00 0.00 N ATOM 92 CA LYS A 43 -5.459 7.820 -16.702 1.00 0.00 C ATOM 93 C LYS A 43 -4.570 6.990 -15.781 1.00 0.00 C ATOM 94 O LYS A 43 -4.179 5.874 -16.122 1.00 0.00 O ATOM 95 CB LYS A 43 -6.732 7.039 -17.039 1.00 0.00 C ATOM 96 CG LYS A 43 -7.841 7.903 -17.615 1.00 0.00 C ATOM 97 CD LYS A 43 -9.210 7.297 -17.358 1.00 0.00 C ATOM 98 CE LYS A 43 -10.307 8.349 -17.425 1.00 0.00 C ATOM 99 NZ LYS A 43 -11.546 7.903 -16.731 1.00 0.00 N ATOM 0 H LYS A 43 -4.818 7.489 -18.671 1.00 0.00 H new ATOM 0 HA LYS A 43 -5.730 8.740 -16.184 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -6.487 6.253 -17.753 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -7.097 6.548 -16.137 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -7.794 8.899 -17.174 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -7.690 8.022 -18.688 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -9.407 6.517 -18.093 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -9.220 6.821 -16.377 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -9.951 9.275 -16.973 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -10.535 8.571 -18.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -12.269 8.647 -16.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -11.901 7.034 -17.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -11.335 7.716 -15.730 1.00 0.00 H new ATOM 113 N ARG A 44 -4.256 7.543 -14.614 1.00 0.00 N ATOM 114 CA ARG A 44 -3.413 6.853 -13.645 1.00 0.00 C ATOM 115 C ARG A 44 -3.997 5.488 -13.291 1.00 0.00 C ATOM 116 O ARG A 44 -5.197 5.360 -13.045 1.00 0.00 O ATOM 117 CB ARG A 44 -3.260 7.698 -12.379 1.00 0.00 C ATOM 118 CG ARG A 44 -2.092 7.275 -11.502 1.00 0.00 C ATOM 119 CD ARG A 44 -1.630 8.412 -10.604 1.00 0.00 C ATOM 120 NE ARG A 44 -0.705 9.310 -11.290 1.00 0.00 N ATOM 121 CZ ARG A 44 -1.085 10.420 -11.913 1.00 0.00 C ATOM 122 NH1 ARG A 44 -2.365 10.767 -11.935 1.00 0.00 N ATOM 123 NH2 ARG A 44 -0.185 11.187 -12.515 1.00 0.00 N ATOM 0 H ARG A 44 -4.572 8.466 -14.317 1.00 0.00 H new ATOM 0 HA ARG A 44 -2.432 6.703 -14.095 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -3.131 8.742 -12.663 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -4.180 7.637 -11.798 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -2.385 6.422 -10.890 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -1.264 6.946 -12.130 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -2.496 8.977 -10.260 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -1.146 8.001 -9.718 1.00 0.00 H new ATOM 0 HE ARG A 44 0.287 9.072 -11.291 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -3.060 10.181 -11.473 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -2.654 11.620 -12.414 1.00 0.00 H new ATOM 0 HH21 ARG A 44 0.801 10.925 -12.500 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -0.479 12.039 -12.993 1.00 0.00 H new ATOM 137 N ILE A 45 -3.140 4.473 -13.267 1.00 0.00 N ATOM 138 CA ILE A 45 -3.571 3.119 -12.942 1.00 0.00 C ATOM 139 C ILE A 45 -2.812 2.574 -11.737 1.00 0.00 C ATOM 140 O ILE A 45 -1.607 2.789 -11.601 1.00 0.00 O ATOM 141 CB ILE A 45 -3.371 2.164 -14.134 1.00 0.00 C ATOM 142 CG1 ILE A 45 -3.957 2.775 -15.409 1.00 0.00 C ATOM 143 CG2 ILE A 45 -4.011 0.814 -13.845 1.00 0.00 C ATOM 144 CD1 ILE A 45 -5.443 3.042 -15.323 1.00 0.00 C ATOM 0 H ILE A 45 -2.144 4.562 -13.469 1.00 0.00 H new ATOM 0 HA ILE A 45 -4.633 3.175 -12.704 1.00 0.00 H new ATOM 0 HB ILE A 45 -2.302 2.013 -14.284 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -3.440 3.710 -15.625 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -3.764 2.104 -16.246 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -3.861 0.150 -14.697 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -3.552 0.376 -12.959 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -5.079 0.947 -13.672 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -5.790 3.475 -16.261 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -5.971 2.106 -15.138 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -5.641 3.738 -14.508 1.00 0.00 H new ATOM 156 N ILE A 46 -3.524 1.869 -10.865 1.00 0.00 N ATOM 157 CA ILE A 46 -2.917 1.291 -9.673 1.00 0.00 C ATOM 158 C ILE A 46 -3.037 -0.229 -9.676 1.00 0.00 C ATOM 159 O ILE A 46 -4.033 -0.782 -10.143 1.00 0.00 O ATOM 160 CB ILE A 46 -3.564 1.843 -8.388 1.00 0.00 C ATOM 161 CG1 ILE A 46 -3.554 3.373 -8.403 1.00 0.00 C ATOM 162 CG2 ILE A 46 -2.837 1.315 -7.161 1.00 0.00 C ATOM 163 CD1 ILE A 46 -2.166 3.969 -8.334 1.00 0.00 C ATOM 0 H ILE A 46 -4.522 1.684 -10.962 1.00 0.00 H new ATOM 0 HA ILE A 46 -1.863 1.570 -9.689 1.00 0.00 H new ATOM 0 HB ILE A 46 -4.600 1.506 -8.346 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -4.046 3.723 -9.311 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -4.141 3.740 -7.561 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -3.305 1.714 -6.261 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -2.891 0.226 -7.147 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -1.793 1.626 -7.195 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -2.236 5.057 -8.349 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -1.678 3.649 -7.413 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -1.582 3.631 -9.190 1.00 0.00 H new ATOM 175 N ARG A 47 -2.016 -0.899 -9.151 1.00 0.00 N ATOM 176 CA ARG A 47 -2.007 -2.355 -9.093 1.00 0.00 C ATOM 177 C ARG A 47 -1.643 -2.841 -7.693 1.00 0.00 C ATOM 178 O ARG A 47 -0.514 -2.663 -7.237 1.00 0.00 O ATOM 179 CB ARG A 47 -1.018 -2.921 -10.114 1.00 0.00 C ATOM 180 CG ARG A 47 -1.291 -2.472 -11.540 1.00 0.00 C ATOM 181 CD ARG A 47 -2.598 -3.045 -12.064 1.00 0.00 C ATOM 182 NE ARG A 47 -3.030 -2.387 -13.294 1.00 0.00 N ATOM 183 CZ ARG A 47 -2.557 -2.694 -14.497 1.00 0.00 C ATOM 184 NH1 ARG A 47 -1.642 -3.644 -14.630 1.00 0.00 N ATOM 185 NH2 ARG A 47 -2.999 -2.050 -15.570 1.00 0.00 N ATOM 0 H ARG A 47 -1.185 -0.456 -8.760 1.00 0.00 H new ATOM 0 HA ARG A 47 -3.009 -2.710 -9.333 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -0.008 -2.620 -9.834 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -1.049 -4.010 -10.073 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -1.328 -1.383 -11.579 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -0.470 -2.786 -12.185 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -2.478 -4.113 -12.247 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -3.372 -2.937 -11.304 1.00 0.00 H new ATOM 0 HE ARG A 47 -3.733 -1.651 -13.226 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -1.300 -4.141 -13.808 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -1.280 -3.878 -15.555 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -3.703 -1.318 -15.472 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -2.635 -2.287 -16.493 1.00 0.00 H new ATOM 199 N VAL A 48 -2.608 -3.456 -7.016 1.00 0.00 N ATOM 200 CA VAL A 48 -2.390 -3.968 -5.669 1.00 0.00 C ATOM 201 C VAL A 48 -1.043 -4.672 -5.560 1.00 0.00 C ATOM 202 O VAL A 48 -0.806 -5.687 -6.217 1.00 0.00 O ATOM 203 CB VAL A 48 -3.504 -4.947 -5.253 1.00 0.00 C ATOM 204 CG1 VAL A 48 -3.228 -5.514 -3.869 1.00 0.00 C ATOM 205 CG2 VAL A 48 -4.861 -4.259 -5.296 1.00 0.00 C ATOM 0 H VAL A 48 -3.548 -3.611 -7.379 1.00 0.00 H new ATOM 0 HA VAL A 48 -2.403 -3.109 -4.998 1.00 0.00 H new ATOM 0 HB VAL A 48 -3.519 -5.775 -5.962 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -4.026 -6.203 -3.593 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -2.276 -6.045 -3.876 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -3.184 -4.701 -3.145 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -5.637 -4.965 -4.999 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -4.861 -3.411 -4.611 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -5.059 -3.907 -6.309 1.00 0.00 H new ATOM 215 N ASP A 49 -0.163 -4.129 -4.727 1.00 0.00 N ATOM 216 CA ASP A 49 1.162 -4.706 -4.530 1.00 0.00 C ATOM 217 C ASP A 49 1.087 -6.229 -4.464 1.00 0.00 C ATOM 218 O ASP A 49 0.149 -6.805 -3.913 1.00 0.00 O ATOM 219 CB ASP A 49 1.796 -4.159 -3.251 1.00 0.00 C ATOM 220 CG ASP A 49 3.297 -3.988 -3.375 1.00 0.00 C ATOM 221 OD1 ASP A 49 3.733 -3.155 -4.196 1.00 0.00 O ATOM 222 OD2 ASP A 49 4.036 -4.689 -2.652 1.00 0.00 O ATOM 0 H ASP A 49 -0.343 -3.289 -4.177 1.00 0.00 H new ATOM 0 HA ASP A 49 1.783 -4.427 -5.381 1.00 0.00 H new ATOM 0 HB2 ASP A 49 1.343 -3.198 -3.007 1.00 0.00 H new ATOM 0 HB3 ASP A 49 1.577 -4.834 -2.423 1.00 0.00 H new ATOM 227 N PRO A 50 2.097 -6.897 -5.039 1.00 0.00 N ATOM 228 CA PRO A 50 2.168 -8.361 -5.059 1.00 0.00 C ATOM 229 C PRO A 50 2.438 -8.947 -3.678 1.00 0.00 C ATOM 230 O PRO A 50 1.799 -9.917 -3.267 1.00 0.00 O ATOM 231 CB PRO A 50 3.342 -8.647 -5.999 1.00 0.00 C ATOM 232 CG PRO A 50 4.193 -7.426 -5.924 1.00 0.00 C ATOM 233 CD PRO A 50 3.249 -6.275 -5.714 1.00 0.00 C ATOM 0 HA PRO A 50 1.228 -8.810 -5.380 1.00 0.00 H new ATOM 0 HB2 PRO A 50 3.893 -9.534 -5.686 1.00 0.00 H new ATOM 0 HB3 PRO A 50 2.999 -8.828 -7.017 1.00 0.00 H new ATOM 0 HG2 PRO A 50 4.908 -7.499 -5.105 1.00 0.00 H new ATOM 0 HG3 PRO A 50 4.770 -7.296 -6.840 1.00 0.00 H new ATOM 0 HD2 PRO A 50 3.699 -5.493 -5.102 1.00 0.00 H new ATOM 0 HD3 PRO A 50 2.960 -5.814 -6.659 1.00 0.00 H new ATOM 241 N THR A 51 3.387 -8.352 -2.962 1.00 0.00 N ATOM 242 CA THR A 51 3.741 -8.816 -1.627 1.00 0.00 C ATOM 243 C THR A 51 2.518 -8.864 -0.719 1.00 0.00 C ATOM 244 O THR A 51 2.453 -9.672 0.209 1.00 0.00 O ATOM 245 CB THR A 51 4.809 -7.911 -0.983 1.00 0.00 C ATOM 246 OG1 THR A 51 4.432 -6.537 -1.117 1.00 0.00 O ATOM 247 CG2 THR A 51 6.168 -8.135 -1.628 1.00 0.00 C ATOM 0 H THR A 51 3.924 -7.547 -3.285 1.00 0.00 H new ATOM 0 HA THR A 51 4.146 -9.822 -1.739 1.00 0.00 H new ATOM 0 HB THR A 51 4.880 -8.166 0.074 1.00 0.00 H new ATOM 0 HG1 THR A 51 4.681 -6.215 -2.009 1.00 0.00 H new ATOM 0 HG21 THR A 51 6.906 -7.485 -1.157 1.00 0.00 H new ATOM 0 HG22 THR A 51 6.465 -9.176 -1.498 1.00 0.00 H new ATOM 0 HG23 THR A 51 6.108 -7.905 -2.692 1.00 0.00 H new ATOM 255 N CYS A 52 1.551 -7.995 -0.991 1.00 0.00 N ATOM 256 CA CYS A 52 0.328 -7.939 -0.198 1.00 0.00 C ATOM 257 C CYS A 52 -0.512 -9.195 -0.404 1.00 0.00 C ATOM 258 O CYS A 52 -0.695 -9.673 -1.524 1.00 0.00 O ATOM 259 CB CYS A 52 -0.488 -6.699 -0.567 1.00 0.00 C ATOM 260 SG CYS A 52 -2.237 -6.808 -0.125 1.00 0.00 S ATOM 0 H CYS A 52 1.590 -7.320 -1.754 1.00 0.00 H new ATOM 0 HA CYS A 52 0.609 -7.880 0.854 1.00 0.00 H new ATOM 0 HB2 CYS A 52 -0.053 -5.831 -0.073 1.00 0.00 H new ATOM 0 HB3 CYS A 52 -0.406 -6.529 -1.641 1.00 0.00 H new ATOM 0 HG CYS A 52 -2.941 -6.106 -0.962 1.00 0.00 H new ATOM 266 N PRO A 53 -1.036 -9.745 0.702 1.00 0.00 N ATOM 267 CA PRO A 53 -1.865 -10.954 0.668 1.00 0.00 C ATOM 268 C PRO A 53 -3.226 -10.706 0.028 1.00 0.00 C ATOM 269 O PRO A 53 -3.644 -11.437 -0.870 1.00 0.00 O ATOM 270 CB PRO A 53 -2.026 -11.314 2.147 1.00 0.00 C ATOM 271 CG PRO A 53 -1.852 -10.025 2.872 1.00 0.00 C ATOM 272 CD PRO A 53 -0.860 -9.229 2.069 1.00 0.00 C ATOM 0 HA PRO A 53 -1.411 -11.744 0.070 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -3.006 -11.750 2.344 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -1.282 -12.047 2.459 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -2.800 -9.494 2.958 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -1.488 -10.193 3.886 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -1.064 -8.160 2.124 1.00 0.00 H new ATOM 0 HD3 PRO A 53 0.159 -9.378 2.427 1.00 0.00 H new ATOM 280 N LEU A 54 -3.915 -9.671 0.496 1.00 0.00 N ATOM 281 CA LEU A 54 -5.230 -9.325 -0.031 1.00 0.00 C ATOM 282 C LEU A 54 -5.252 -9.432 -1.552 1.00 0.00 C ATOM 283 O LEU A 54 -6.250 -9.849 -2.141 1.00 0.00 O ATOM 284 CB LEU A 54 -5.618 -7.909 0.398 1.00 0.00 C ATOM 285 CG LEU A 54 -5.684 -7.658 1.905 1.00 0.00 C ATOM 286 CD1 LEU A 54 -6.038 -6.207 2.189 1.00 0.00 C ATOM 287 CD2 LEU A 54 -6.693 -8.593 2.557 1.00 0.00 C ATOM 0 H LEU A 54 -3.584 -9.057 1.240 1.00 0.00 H new ATOM 0 HA LEU A 54 -5.954 -10.031 0.375 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.902 -7.211 -0.035 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -6.592 -7.675 -0.032 1.00 0.00 H new ATOM 0 HG LEU A 54 -4.702 -7.861 2.332 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -6.080 -6.047 3.266 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.279 -5.556 1.755 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -7.008 -5.977 1.749 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -6.727 -8.401 3.629 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -7.679 -8.421 2.126 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -6.396 -9.627 2.383 1.00 0.00 H new ATOM 299 N SER A 55 -4.145 -9.055 -2.183 1.00 0.00 N ATOM 300 CA SER A 55 -4.038 -9.107 -3.637 1.00 0.00 C ATOM 301 C SER A 55 -4.667 -10.386 -4.182 1.00 0.00 C ATOM 302 O SER A 55 -5.420 -10.354 -5.155 1.00 0.00 O ATOM 303 CB SER A 55 -2.571 -9.025 -4.064 1.00 0.00 C ATOM 304 OG SER A 55 -1.905 -10.256 -3.844 1.00 0.00 O ATOM 0 H SER A 55 -3.309 -8.710 -1.711 1.00 0.00 H new ATOM 0 HA SER A 55 -4.577 -8.253 -4.048 1.00 0.00 H new ATOM 0 HB2 SER A 55 -2.511 -8.759 -5.119 1.00 0.00 H new ATOM 0 HB3 SER A 55 -2.071 -8.233 -3.507 1.00 0.00 H new ATOM 0 HG SER A 55 -1.347 -10.187 -3.041 1.00 0.00 H new ATOM 310 N SER A 56 -4.351 -11.511 -3.548 1.00 0.00 N ATOM 311 CA SER A 56 -4.881 -12.801 -3.971 1.00 0.00 C ATOM 312 C SER A 56 -6.406 -12.778 -4.004 1.00 0.00 C ATOM 313 O SER A 56 -7.024 -13.218 -4.973 1.00 0.00 O ATOM 314 CB SER A 56 -4.397 -13.908 -3.032 1.00 0.00 C ATOM 315 OG SER A 56 -2.984 -13.908 -2.930 1.00 0.00 O ATOM 0 H SER A 56 -3.731 -11.555 -2.740 1.00 0.00 H new ATOM 0 HA SER A 56 -4.516 -13.003 -4.978 1.00 0.00 H new ATOM 0 HB2 SER A 56 -4.836 -13.769 -2.044 1.00 0.00 H new ATOM 0 HB3 SER A 56 -4.738 -14.876 -3.399 1.00 0.00 H new ATOM 0 HG SER A 56 -2.700 -14.623 -2.323 1.00 0.00 H new ATOM 321 N ASN A 57 -7.007 -12.259 -2.938 1.00 0.00 N ATOM 322 CA ASN A 57 -8.460 -12.178 -2.843 1.00 0.00 C ATOM 323 C ASN A 57 -9.036 -11.368 -4.001 1.00 0.00 C ATOM 324 O ASN A 57 -8.628 -10.236 -4.262 1.00 0.00 O ATOM 325 CB ASN A 57 -8.871 -11.548 -1.511 1.00 0.00 C ATOM 326 CG ASN A 57 -8.921 -12.560 -0.383 1.00 0.00 C ATOM 327 OD1 ASN A 57 -8.640 -13.742 -0.583 1.00 0.00 O ATOM 328 ND2 ASN A 57 -9.281 -12.100 0.809 1.00 0.00 N ATOM 0 H ASN A 57 -6.510 -11.888 -2.128 1.00 0.00 H new ATOM 0 HA ASN A 57 -8.860 -13.191 -2.896 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -8.167 -10.756 -1.254 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -9.850 -11.081 -1.620 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -9.334 -12.734 1.606 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -9.505 -11.112 0.928 1.00 0.00 H new ATOM 335 N PRO A 58 -10.008 -11.960 -4.711 1.00 0.00 N ATOM 336 CA PRO A 58 -10.662 -11.311 -5.852 1.00 0.00 C ATOM 337 C PRO A 58 -11.548 -10.146 -5.426 1.00 0.00 C ATOM 338 O PRO A 58 -12.320 -10.256 -4.474 1.00 0.00 O ATOM 339 CB PRO A 58 -11.508 -12.432 -6.460 1.00 0.00 C ATOM 340 CG PRO A 58 -11.765 -13.369 -5.330 1.00 0.00 C ATOM 341 CD PRO A 58 -10.543 -13.308 -4.456 1.00 0.00 C ATOM 0 HA PRO A 58 -9.940 -10.880 -6.545 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -12.440 -12.045 -6.873 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -10.980 -12.929 -7.274 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -12.657 -13.076 -4.775 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -11.934 -14.382 -5.694 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -10.794 -13.449 -3.405 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -9.822 -14.083 -4.718 1.00 0.00 H new ATOM 349 N GLY A 59 -11.433 -9.029 -6.138 1.00 0.00 N ATOM 350 CA GLY A 59 -12.230 -7.859 -5.818 1.00 0.00 C ATOM 351 C GLY A 59 -11.436 -6.800 -5.079 1.00 0.00 C ATOM 352 O GLY A 59 -11.713 -5.607 -5.202 1.00 0.00 O ATOM 0 H GLY A 59 -10.802 -8.913 -6.931 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -12.629 -7.433 -6.738 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -13.083 -8.160 -5.209 1.00 0.00 H new ATOM 356 N THR A 60 -10.445 -7.236 -4.308 1.00 0.00 N ATOM 357 CA THR A 60 -9.610 -6.318 -3.544 1.00 0.00 C ATOM 358 C THR A 60 -8.852 -5.369 -4.466 1.00 0.00 C ATOM 359 O THR A 60 -7.943 -5.782 -5.185 1.00 0.00 O ATOM 360 CB THR A 60 -8.599 -7.077 -2.664 1.00 0.00 C ATOM 361 OG1 THR A 60 -9.292 -7.889 -1.710 1.00 0.00 O ATOM 362 CG2 THR A 60 -7.678 -6.108 -1.939 1.00 0.00 C ATOM 0 H THR A 60 -10.201 -8.220 -4.196 1.00 0.00 H new ATOM 0 HA THR A 60 -10.278 -5.743 -2.903 1.00 0.00 H new ATOM 0 HB THR A 60 -7.994 -7.713 -3.310 1.00 0.00 H new ATOM 0 HG1 THR A 60 -8.642 -8.369 -1.156 1.00 0.00 H new ATOM 0 HG21 THR A 60 -6.973 -6.667 -1.324 1.00 0.00 H new ATOM 0 HG22 THR A 60 -7.130 -5.512 -2.669 1.00 0.00 H new ATOM 0 HG23 THR A 60 -8.270 -5.449 -1.304 1.00 0.00 H new ATOM 370 N GLN A 61 -9.232 -4.095 -4.438 1.00 0.00 N ATOM 371 CA GLN A 61 -8.587 -3.088 -5.271 1.00 0.00 C ATOM 372 C GLN A 61 -8.107 -1.910 -4.429 1.00 0.00 C ATOM 373 O GLN A 61 -8.666 -1.622 -3.371 1.00 0.00 O ATOM 374 CB GLN A 61 -9.552 -2.597 -6.353 1.00 0.00 C ATOM 375 CG GLN A 61 -10.692 -1.750 -5.812 1.00 0.00 C ATOM 376 CD GLN A 61 -11.843 -1.627 -6.791 1.00 0.00 C ATOM 377 OE1 GLN A 61 -12.559 -2.595 -7.049 1.00 0.00 O ATOM 378 NE2 GLN A 61 -12.027 -0.433 -7.342 1.00 0.00 N ATOM 0 H GLN A 61 -9.983 -3.737 -3.848 1.00 0.00 H new ATOM 0 HA GLN A 61 -7.721 -3.547 -5.747 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -8.995 -2.015 -7.088 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -9.967 -3.458 -6.876 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -11.056 -2.188 -4.883 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -10.318 -0.755 -5.570 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -11.409 0.341 -7.099 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -12.786 -0.290 -8.008 1.00 0.00 H new ATOM 387 N VAL A 62 -7.067 -1.234 -4.906 1.00 0.00 N ATOM 388 CA VAL A 62 -6.512 -0.087 -4.197 1.00 0.00 C ATOM 389 C VAL A 62 -7.476 1.093 -4.220 1.00 0.00 C ATOM 390 O VAL A 62 -7.754 1.661 -5.277 1.00 0.00 O ATOM 391 CB VAL A 62 -5.167 0.352 -4.806 1.00 0.00 C ATOM 392 CG1 VAL A 62 -4.654 1.608 -4.120 1.00 0.00 C ATOM 393 CG2 VAL A 62 -4.147 -0.772 -4.710 1.00 0.00 C ATOM 0 H VAL A 62 -6.592 -1.460 -5.780 1.00 0.00 H new ATOM 0 HA VAL A 62 -6.351 -0.401 -3.166 1.00 0.00 H new ATOM 0 HB VAL A 62 -5.323 0.581 -5.860 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -3.703 1.902 -4.564 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.378 2.413 -4.246 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -4.513 1.410 -3.057 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -3.203 -0.445 -5.145 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -3.993 -1.035 -3.663 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -4.514 -1.643 -5.253 1.00 0.00 H new ATOM 403 N TYR A 63 -7.984 1.458 -3.048 1.00 0.00 N ATOM 404 CA TYR A 63 -8.920 2.570 -2.933 1.00 0.00 C ATOM 405 C TYR A 63 -8.353 3.829 -3.582 1.00 0.00 C ATOM 406 O TYR A 63 -7.373 4.399 -3.104 1.00 0.00 O ATOM 407 CB TYR A 63 -9.243 2.842 -1.463 1.00 0.00 C ATOM 408 CG TYR A 63 -9.932 4.168 -1.230 1.00 0.00 C ATOM 409 CD1 TYR A 63 -11.286 4.326 -1.500 1.00 0.00 C ATOM 410 CD2 TYR A 63 -9.229 5.262 -0.741 1.00 0.00 C ATOM 411 CE1 TYR A 63 -11.920 5.535 -1.289 1.00 0.00 C ATOM 412 CE2 TYR A 63 -9.855 6.474 -0.525 1.00 0.00 C ATOM 413 CZ TYR A 63 -11.200 6.606 -0.801 1.00 0.00 C ATOM 414 OH TYR A 63 -11.827 7.813 -0.589 1.00 0.00 O ATOM 0 H TYR A 63 -7.763 1.000 -2.164 1.00 0.00 H new ATOM 0 HA TYR A 63 -9.837 2.295 -3.455 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -9.878 2.041 -1.085 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -8.319 2.816 -0.886 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -11.852 3.489 -1.881 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -8.175 5.163 -0.526 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -12.973 5.641 -1.505 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -9.294 7.314 -0.142 1.00 0.00 H new ATOM 0 HH TYR A 63 -11.399 8.505 -1.136 1.00 0.00 H new ATOM 424 N GLU A 64 -8.978 4.256 -4.675 1.00 0.00 N ATOM 425 CA GLU A 64 -8.536 5.447 -5.391 1.00 0.00 C ATOM 426 C GLU A 64 -7.091 5.296 -5.857 1.00 0.00 C ATOM 427 O GLU A 64 -6.672 4.218 -6.280 1.00 0.00 O ATOM 428 CB GLU A 64 -8.670 6.683 -4.500 1.00 0.00 C ATOM 429 CG GLU A 64 -10.003 6.770 -3.776 1.00 0.00 C ATOM 430 CD GLU A 64 -10.388 8.196 -3.432 1.00 0.00 C ATOM 431 OE1 GLU A 64 -11.020 8.862 -4.278 1.00 0.00 O ATOM 432 OE2 GLU A 64 -10.056 8.646 -2.315 1.00 0.00 O ATOM 0 H GLU A 64 -9.791 3.795 -5.084 1.00 0.00 H new ATOM 0 HA GLU A 64 -9.171 5.570 -6.268 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -7.866 6.679 -3.764 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -8.539 7.576 -5.110 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -10.780 6.328 -4.399 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -9.954 6.180 -2.861 1.00 0.00 H new ATOM 439 N ASP A 65 -6.333 6.385 -5.777 1.00 0.00 N ATOM 440 CA ASP A 65 -4.935 6.375 -6.190 1.00 0.00 C ATOM 441 C ASP A 65 -4.010 6.477 -4.980 1.00 0.00 C ATOM 442 O ASP A 65 -3.026 7.216 -4.999 1.00 0.00 O ATOM 443 CB ASP A 65 -4.658 7.527 -7.157 1.00 0.00 C ATOM 444 CG ASP A 65 -5.109 8.866 -6.607 1.00 0.00 C ATOM 445 OD1 ASP A 65 -5.201 8.997 -5.368 1.00 0.00 O ATOM 446 OD2 ASP A 65 -5.369 9.782 -7.414 1.00 0.00 O ATOM 0 H ASP A 65 -6.664 7.285 -5.430 1.00 0.00 H new ATOM 0 HA ASP A 65 -4.739 5.430 -6.697 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -3.590 7.567 -7.373 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -5.167 7.335 -8.101 1.00 0.00 H new ATOM 451 N TYR A 66 -4.335 5.731 -3.930 1.00 0.00 N ATOM 452 CA TYR A 66 -3.536 5.740 -2.710 1.00 0.00 C ATOM 453 C TYR A 66 -2.418 4.705 -2.784 1.00 0.00 C ATOM 454 O TYR A 66 -2.537 3.607 -2.242 1.00 0.00 O ATOM 455 CB TYR A 66 -4.421 5.466 -1.494 1.00 0.00 C ATOM 456 CG TYR A 66 -5.042 6.711 -0.903 1.00 0.00 C ATOM 457 CD1 TYR A 66 -6.028 7.412 -1.588 1.00 0.00 C ATOM 458 CD2 TYR A 66 -4.644 7.187 0.340 1.00 0.00 C ATOM 459 CE1 TYR A 66 -6.597 8.551 -1.052 1.00 0.00 C ATOM 460 CE2 TYR A 66 -5.210 8.325 0.884 1.00 0.00 C ATOM 461 CZ TYR A 66 -6.185 9.003 0.184 1.00 0.00 C ATOM 462 OH TYR A 66 -6.751 10.136 0.721 1.00 0.00 O ATOM 0 H TYR A 66 -5.146 5.113 -3.899 1.00 0.00 H new ATOM 0 HA TYR A 66 -3.086 6.727 -2.608 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -5.214 4.776 -1.781 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -3.827 4.968 -0.728 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -6.355 7.060 -2.555 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -3.879 6.659 0.891 1.00 0.00 H new ATOM 0 HE1 TYR A 66 -7.361 9.085 -1.598 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -4.890 8.681 1.852 1.00 0.00 H new ATOM 0 HH TYR A 66 -6.351 10.318 1.597 1.00 0.00 H new ATOM 472 N ASN A 67 -1.330 5.065 -3.458 1.00 0.00 N ATOM 473 CA ASN A 67 -0.189 4.168 -3.604 1.00 0.00 C ATOM 474 C ASN A 67 1.060 4.940 -4.019 1.00 0.00 C ATOM 475 O ASN A 67 1.075 5.603 -5.056 1.00 0.00 O ATOM 476 CB ASN A 67 -0.497 3.081 -4.635 1.00 0.00 C ATOM 477 CG ASN A 67 0.756 2.537 -5.293 1.00 0.00 C ATOM 478 OD1 ASN A 67 1.761 2.286 -4.627 1.00 0.00 O ATOM 479 ND2 ASN A 67 0.702 2.351 -6.606 1.00 0.00 N ATOM 0 H ASN A 67 -1.215 5.971 -3.911 1.00 0.00 H new ATOM 0 HA ASN A 67 -0.001 3.700 -2.638 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -1.033 2.265 -4.150 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -1.159 3.487 -5.400 1.00 0.00 H new ATOM 0 HD21 ASN A 67 1.514 1.986 -7.103 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -0.152 2.573 -7.118 1.00 0.00 H new ATOM 486 N CYS A 68 2.104 4.848 -3.203 1.00 0.00 N ATOM 487 CA CYS A 68 3.358 5.537 -3.485 1.00 0.00 C ATOM 488 C CYS A 68 4.506 4.926 -2.688 1.00 0.00 C ATOM 489 O CYS A 68 4.292 4.308 -1.644 1.00 0.00 O ATOM 490 CB CYS A 68 3.230 7.026 -3.159 1.00 0.00 C ATOM 491 SG CYS A 68 2.403 7.994 -4.443 1.00 0.00 S ATOM 0 H CYS A 68 2.107 4.303 -2.341 1.00 0.00 H new ATOM 0 HA CYS A 68 3.576 5.422 -4.547 1.00 0.00 H new ATOM 0 HB2 CYS A 68 2.680 7.136 -2.225 1.00 0.00 H new ATOM 0 HB3 CYS A 68 4.226 7.438 -2.993 1.00 0.00 H new ATOM 0 HG CYS A 68 1.458 7.282 -4.982 1.00 0.00 H new ATOM 497 N THR A 69 5.725 5.101 -3.187 1.00 0.00 N ATOM 498 CA THR A 69 6.907 4.565 -2.524 1.00 0.00 C ATOM 499 C THR A 69 7.706 5.672 -1.846 1.00 0.00 C ATOM 500 O THR A 69 7.785 6.793 -2.350 1.00 0.00 O ATOM 501 CB THR A 69 7.820 3.822 -3.517 1.00 0.00 C ATOM 502 OG1 THR A 69 7.141 2.678 -4.046 1.00 0.00 O ATOM 503 CG2 THR A 69 9.111 3.384 -2.841 1.00 0.00 C ATOM 0 H THR A 69 5.920 5.610 -4.049 1.00 0.00 H new ATOM 0 HA THR A 69 6.555 3.861 -1.770 1.00 0.00 H new ATOM 0 HB THR A 69 8.067 4.505 -4.330 1.00 0.00 H new ATOM 0 HG1 THR A 69 7.728 2.212 -4.678 1.00 0.00 H new ATOM 0 HG21 THR A 69 9.740 2.861 -3.562 1.00 0.00 H new ATOM 0 HG22 THR A 69 9.640 4.260 -2.465 1.00 0.00 H new ATOM 0 HG23 THR A 69 8.879 2.717 -2.011 1.00 0.00 H new ATOM 511 N LEU A 70 8.299 5.351 -0.701 1.00 0.00 N ATOM 512 CA LEU A 70 9.094 6.318 0.047 1.00 0.00 C ATOM 513 C LEU A 70 10.521 5.816 0.242 1.00 0.00 C ATOM 514 O LEU A 70 10.745 4.627 0.464 1.00 0.00 O ATOM 515 CB LEU A 70 8.449 6.598 1.405 1.00 0.00 C ATOM 516 CG LEU A 70 7.014 7.126 1.371 1.00 0.00 C ATOM 517 CD1 LEU A 70 6.525 7.434 2.778 1.00 0.00 C ATOM 518 CD2 LEU A 70 6.923 8.364 0.490 1.00 0.00 C ATOM 0 H LEU A 70 8.244 4.428 -0.271 1.00 0.00 H new ATOM 0 HA LEU A 70 9.130 7.243 -0.528 1.00 0.00 H new ATOM 0 HB2 LEU A 70 8.462 5.677 1.988 1.00 0.00 H new ATOM 0 HB3 LEU A 70 9.068 7.321 1.937 1.00 0.00 H new ATOM 0 HG LEU A 70 6.372 6.354 0.947 1.00 0.00 H new ATOM 0 HD11 LEU A 70 5.502 7.809 2.734 1.00 0.00 H new ATOM 0 HD12 LEU A 70 6.553 6.526 3.380 1.00 0.00 H new ATOM 0 HD13 LEU A 70 7.169 8.189 3.230 1.00 0.00 H new ATOM 0 HD21 LEU A 70 5.895 8.727 0.477 1.00 0.00 H new ATOM 0 HD22 LEU A 70 7.577 9.141 0.886 1.00 0.00 H new ATOM 0 HD23 LEU A 70 7.232 8.112 -0.525 1.00 0.00 H new ATOM 530 N ASN A 71 11.482 6.730 0.161 1.00 0.00 N ATOM 531 CA ASN A 71 12.887 6.380 0.330 1.00 0.00 C ATOM 532 C ASN A 71 13.529 7.222 1.428 1.00 0.00 C ATOM 533 O ASN A 71 13.201 8.397 1.593 1.00 0.00 O ATOM 534 CB ASN A 71 13.645 6.572 -0.985 1.00 0.00 C ATOM 535 CG ASN A 71 13.633 5.325 -1.847 1.00 0.00 C ATOM 536 OD1 ASN A 71 13.324 5.382 -3.037 1.00 0.00 O ATOM 537 ND2 ASN A 71 13.970 4.189 -1.248 1.00 0.00 N ATOM 0 H ASN A 71 11.313 7.719 -0.021 1.00 0.00 H new ATOM 0 HA ASN A 71 12.941 5.331 0.622 1.00 0.00 H new ATOM 0 HB2 ASN A 71 13.201 7.398 -1.540 1.00 0.00 H new ATOM 0 HB3 ASN A 71 14.676 6.851 -0.769 1.00 0.00 H new ATOM 0 HD21 ASN A 71 13.980 3.317 -1.777 1.00 0.00 H new ATOM 0 HD22 ASN A 71 14.219 4.188 -0.259 1.00 0.00 H new ATOM 544 N GLN A 72 14.445 6.614 2.175 1.00 0.00 N ATOM 545 CA GLN A 72 15.133 7.308 3.257 1.00 0.00 C ATOM 546 C GLN A 72 16.568 6.811 3.397 1.00 0.00 C ATOM 547 O GLN A 72 16.804 5.658 3.758 1.00 0.00 O ATOM 548 CB GLN A 72 14.381 7.114 4.575 1.00 0.00 C ATOM 549 CG GLN A 72 15.103 7.698 5.779 1.00 0.00 C ATOM 550 CD GLN A 72 14.893 9.193 5.916 1.00 0.00 C ATOM 551 OE1 GLN A 72 14.870 9.922 4.924 1.00 0.00 O ATOM 552 NE2 GLN A 72 14.739 9.658 7.150 1.00 0.00 N ATOM 0 H GLN A 72 14.728 5.642 2.051 1.00 0.00 H new ATOM 0 HA GLN A 72 15.159 8.371 3.015 1.00 0.00 H new ATOM 0 HB2 GLN A 72 13.397 7.575 4.493 1.00 0.00 H new ATOM 0 HB3 GLN A 72 14.221 6.048 4.739 1.00 0.00 H new ATOM 0 HG2 GLN A 72 14.753 7.201 6.684 1.00 0.00 H new ATOM 0 HG3 GLN A 72 16.170 7.491 5.694 1.00 0.00 H new ATOM 0 HE21 GLN A 72 14.765 9.017 7.943 1.00 0.00 H new ATOM 0 HE22 GLN A 72 14.595 10.656 7.305 1.00 0.00 H new ATOM 561 N THR A 73 17.524 7.689 3.110 1.00 0.00 N ATOM 562 CA THR A 73 18.935 7.339 3.202 1.00 0.00 C ATOM 563 C THR A 73 19.644 8.188 4.252 1.00 0.00 C ATOM 564 O THR A 73 19.188 9.278 4.594 1.00 0.00 O ATOM 565 CB THR A 73 19.648 7.516 1.848 1.00 0.00 C ATOM 566 OG1 THR A 73 19.255 8.755 1.246 1.00 0.00 O ATOM 567 CG2 THR A 73 19.321 6.364 0.910 1.00 0.00 C ATOM 0 H THR A 73 17.346 8.648 2.812 1.00 0.00 H new ATOM 0 HA THR A 73 18.982 6.290 3.494 1.00 0.00 H new ATOM 0 HB THR A 73 20.723 7.524 2.026 1.00 0.00 H new ATOM 0 HG1 THR A 73 19.714 8.861 0.387 1.00 0.00 H new ATOM 0 HG21 THR A 73 19.836 6.511 -0.040 1.00 0.00 H new ATOM 0 HG22 THR A 73 19.648 5.426 1.358 1.00 0.00 H new ATOM 0 HG23 THR A 73 18.245 6.329 0.738 1.00 0.00 H new ATOM 575 N ASN A 74 20.763 7.681 4.759 1.00 0.00 N ATOM 576 CA ASN A 74 21.536 8.393 5.770 1.00 0.00 C ATOM 577 C ASN A 74 23.022 8.071 5.646 1.00 0.00 C ATOM 578 O ASN A 74 23.397 6.966 5.253 1.00 0.00 O ATOM 579 CB ASN A 74 21.039 8.031 7.171 1.00 0.00 C ATOM 580 CG ASN A 74 19.940 8.959 7.653 1.00 0.00 C ATOM 581 OD1 ASN A 74 20.210 9.997 8.257 1.00 0.00 O ATOM 582 ND2 ASN A 74 18.693 8.587 7.387 1.00 0.00 N ATOM 0 H ASN A 74 21.155 6.780 4.486 1.00 0.00 H new ATOM 0 HA ASN A 74 21.400 9.462 5.609 1.00 0.00 H new ATOM 0 HB2 ASN A 74 20.670 7.005 7.169 1.00 0.00 H new ATOM 0 HB3 ASN A 74 21.874 8.067 7.870 1.00 0.00 H new ATOM 0 HD21 ASN A 74 17.912 9.171 7.686 1.00 0.00 H new ATOM 0 HD22 ASN A 74 18.517 7.718 6.883 1.00 0.00 H new ATOM 589 N ILE A 75 23.862 9.043 5.985 1.00 0.00 N ATOM 590 CA ILE A 75 25.307 8.862 5.914 1.00 0.00 C ATOM 591 C ILE A 75 25.811 8.004 7.069 1.00 0.00 C ATOM 592 O ILE A 75 26.749 8.381 7.771 1.00 0.00 O ATOM 593 CB ILE A 75 26.045 10.213 5.932 1.00 0.00 C ATOM 594 CG1 ILE A 75 27.544 10.004 5.704 1.00 0.00 C ATOM 595 CG2 ILE A 75 25.800 10.933 7.251 1.00 0.00 C ATOM 596 CD1 ILE A 75 28.220 11.173 5.024 1.00 0.00 C ATOM 0 H ILE A 75 23.567 9.963 6.311 1.00 0.00 H new ATOM 0 HA ILE A 75 25.516 8.356 4.971 1.00 0.00 H new ATOM 0 HB ILE A 75 25.657 10.833 5.124 1.00 0.00 H new ATOM 0 HG12 ILE A 75 28.028 9.823 6.664 1.00 0.00 H new ATOM 0 HG13 ILE A 75 27.690 9.109 5.100 1.00 0.00 H new ATOM 0 HG21 ILE A 75 26.328 11.886 7.249 1.00 0.00 H new ATOM 0 HG22 ILE A 75 24.732 11.110 7.376 1.00 0.00 H new ATOM 0 HG23 ILE A 75 26.164 10.318 8.074 1.00 0.00 H new ATOM 0 HD11 ILE A 75 29.280 10.955 4.895 1.00 0.00 H new ATOM 0 HD12 ILE A 75 27.763 11.341 4.049 1.00 0.00 H new ATOM 0 HD13 ILE A 75 28.105 12.067 5.637 1.00 0.00 H new ATOM 608 N GLU A 76 25.183 6.848 7.259 1.00 0.00 N ATOM 609 CA GLU A 76 25.570 5.936 8.329 1.00 0.00 C ATOM 610 C GLU A 76 25.663 4.502 7.814 1.00 0.00 C ATOM 611 O GLU A 76 24.650 3.872 7.514 1.00 0.00 O ATOM 612 CB GLU A 76 24.566 6.011 9.481 1.00 0.00 C ATOM 613 CG GLU A 76 24.763 7.218 10.383 1.00 0.00 C ATOM 614 CD GLU A 76 23.694 7.329 11.452 1.00 0.00 C ATOM 615 OE1 GLU A 76 23.586 6.402 12.282 1.00 0.00 O ATOM 616 OE2 GLU A 76 22.966 8.343 11.459 1.00 0.00 O ATOM 0 H GLU A 76 24.405 6.521 6.686 1.00 0.00 H new ATOM 0 HA GLU A 76 26.552 6.238 8.692 1.00 0.00 H new ATOM 0 HB2 GLU A 76 23.556 6.036 9.071 1.00 0.00 H new ATOM 0 HB3 GLU A 76 24.645 5.104 10.080 1.00 0.00 H new ATOM 0 HG2 GLU A 76 25.742 7.155 10.859 1.00 0.00 H new ATOM 0 HG3 GLU A 76 24.761 8.124 9.777 1.00 0.00 H new ATOM 623 N ASN A 77 26.887 3.994 7.715 1.00 0.00 N ATOM 624 CA ASN A 77 27.115 2.636 7.236 1.00 0.00 C ATOM 625 C ASN A 77 26.226 2.326 6.035 1.00 0.00 C ATOM 626 O ASN A 77 25.673 1.233 5.924 1.00 0.00 O ATOM 627 CB ASN A 77 26.848 1.627 8.355 1.00 0.00 C ATOM 628 CG ASN A 77 27.681 1.902 9.592 1.00 0.00 C ATOM 629 OD1 ASN A 77 28.911 1.886 9.543 1.00 0.00 O ATOM 630 ND2 ASN A 77 27.012 2.157 10.710 1.00 0.00 N ATOM 0 H ASN A 77 27.736 4.503 7.960 1.00 0.00 H new ATOM 0 HA ASN A 77 28.157 2.557 6.925 1.00 0.00 H new ATOM 0 HB2 ASN A 77 25.791 1.653 8.619 1.00 0.00 H new ATOM 0 HB3 ASN A 77 27.062 0.621 7.993 1.00 0.00 H new ATOM 0 HD21 ASN A 77 27.518 2.350 11.574 1.00 0.00 H new ATOM 0 HD22 ASN A 77 25.992 2.160 10.705 1.00 0.00 H new ATOM 637 N ASN A 78 26.094 3.298 5.138 1.00 0.00 N ATOM 638 CA ASN A 78 25.272 3.130 3.945 1.00 0.00 C ATOM 639 C ASN A 78 23.898 2.572 4.304 1.00 0.00 C ATOM 640 O ASN A 78 23.476 1.546 3.772 1.00 0.00 O ATOM 641 CB ASN A 78 25.968 2.201 2.948 1.00 0.00 C ATOM 642 CG ASN A 78 27.009 2.923 2.115 1.00 0.00 C ATOM 643 OD1 ASN A 78 26.683 3.584 1.129 1.00 0.00 O ATOM 644 ND2 ASN A 78 28.271 2.799 2.508 1.00 0.00 N ATOM 0 H ASN A 78 26.545 4.209 5.215 1.00 0.00 H new ATOM 0 HA ASN A 78 25.137 4.110 3.486 1.00 0.00 H new ATOM 0 HB2 ASN A 78 26.443 1.383 3.489 1.00 0.00 H new ATOM 0 HB3 ASN A 78 25.223 1.757 2.288 1.00 0.00 H new ATOM 0 HD21 ASN A 78 29.015 3.262 1.986 1.00 0.00 H new ATOM 0 HD22 ASN A 78 28.496 2.241 3.332 1.00 0.00 H new ATOM 651 N ASN A 79 23.206 3.255 5.210 1.00 0.00 N ATOM 652 CA ASN A 79 21.880 2.828 5.641 1.00 0.00 C ATOM 653 C ASN A 79 20.811 3.299 4.660 1.00 0.00 C ATOM 654 O ASN A 79 20.552 4.495 4.536 1.00 0.00 O ATOM 655 CB ASN A 79 21.577 3.367 7.040 1.00 0.00 C ATOM 656 CG ASN A 79 20.620 2.477 7.808 1.00 0.00 C ATOM 657 OD1 ASN A 79 19.557 2.111 7.306 1.00 0.00 O ATOM 658 ND2 ASN A 79 20.993 2.124 9.033 1.00 0.00 N ATOM 0 H ASN A 79 23.542 4.107 5.660 1.00 0.00 H new ATOM 0 HA ASN A 79 21.868 1.738 5.668 1.00 0.00 H new ATOM 0 HB2 ASN A 79 22.508 3.462 7.599 1.00 0.00 H new ATOM 0 HB3 ASN A 79 21.151 4.367 6.957 1.00 0.00 H new ATOM 0 HD21 ASN A 79 20.389 1.526 9.598 1.00 0.00 H new ATOM 0 HD22 ASN A 79 21.883 2.451 9.409 1.00 0.00 H new ATOM 665 N ASN A 80 20.194 2.349 3.965 1.00 0.00 N ATOM 666 CA ASN A 80 19.153 2.666 2.994 1.00 0.00 C ATOM 667 C ASN A 80 17.927 1.782 3.203 1.00 0.00 C ATOM 668 O ASN A 80 18.022 0.555 3.186 1.00 0.00 O ATOM 669 CB ASN A 80 19.684 2.493 1.570 1.00 0.00 C ATOM 670 CG ASN A 80 21.072 3.079 1.395 1.00 0.00 C ATOM 671 OD1 ASN A 80 21.561 3.813 2.254 1.00 0.00 O ATOM 672 ND2 ASN A 80 21.713 2.758 0.277 1.00 0.00 N ATOM 0 H ASN A 80 20.397 1.354 4.056 1.00 0.00 H new ATOM 0 HA ASN A 80 18.859 3.705 3.140 1.00 0.00 H new ATOM 0 HB2 ASN A 80 19.706 1.432 1.320 1.00 0.00 H new ATOM 0 HB3 ASN A 80 19.000 2.971 0.869 1.00 0.00 H new ATOM 0 HD21 ASN A 80 22.649 3.123 0.103 1.00 0.00 H new ATOM 0 HD22 ASN A 80 21.269 2.146 -0.408 1.00 0.00 H new ATOM 679 N LYS A 81 16.775 2.415 3.398 1.00 0.00 N ATOM 680 CA LYS A 81 15.528 1.688 3.608 1.00 0.00 C ATOM 681 C LYS A 81 14.413 2.256 2.736 1.00 0.00 C ATOM 682 O LYS A 81 14.582 3.293 2.094 1.00 0.00 O ATOM 683 CB LYS A 81 15.120 1.750 5.082 1.00 0.00 C ATOM 684 CG LYS A 81 16.158 1.168 6.026 1.00 0.00 C ATOM 685 CD LYS A 81 16.157 1.884 7.366 1.00 0.00 C ATOM 686 CE LYS A 81 16.517 0.940 8.503 1.00 0.00 C ATOM 687 NZ LYS A 81 17.200 1.650 9.619 1.00 0.00 N ATOM 0 H LYS A 81 16.679 3.430 3.415 1.00 0.00 H new ATOM 0 HA LYS A 81 15.691 0.648 3.326 1.00 0.00 H new ATOM 0 HB2 LYS A 81 14.934 2.789 5.355 1.00 0.00 H new ATOM 0 HB3 LYS A 81 14.180 1.213 5.213 1.00 0.00 H new ATOM 0 HG2 LYS A 81 15.958 0.108 6.179 1.00 0.00 H new ATOM 0 HG3 LYS A 81 17.146 1.244 5.573 1.00 0.00 H new ATOM 0 HD2 LYS A 81 16.868 2.710 7.339 1.00 0.00 H new ATOM 0 HD3 LYS A 81 15.173 2.316 7.548 1.00 0.00 H new ATOM 0 HE2 LYS A 81 15.612 0.461 8.877 1.00 0.00 H new ATOM 0 HE3 LYS A 81 17.164 0.148 8.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 17.429 0.972 10.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 18.077 2.086 9.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 16.573 2.389 9.996 1.00 0.00 H new ATOM 701 N PHE A 82 13.274 1.572 2.720 1.00 0.00 N ATOM 702 CA PHE A 82 12.131 2.010 1.927 1.00 0.00 C ATOM 703 C PHE A 82 10.828 1.812 2.696 1.00 0.00 C ATOM 704 O PHE A 82 10.723 0.924 3.542 1.00 0.00 O ATOM 705 CB PHE A 82 12.077 1.243 0.604 1.00 0.00 C ATOM 706 CG PHE A 82 11.811 -0.226 0.773 1.00 0.00 C ATOM 707 CD1 PHE A 82 12.751 -1.050 1.371 1.00 0.00 C ATOM 708 CD2 PHE A 82 10.620 -0.782 0.334 1.00 0.00 C ATOM 709 CE1 PHE A 82 12.509 -2.401 1.529 1.00 0.00 C ATOM 710 CE2 PHE A 82 10.373 -2.133 0.489 1.00 0.00 C ATOM 711 CZ PHE A 82 11.318 -2.944 1.086 1.00 0.00 C ATOM 0 H PHE A 82 13.118 0.713 3.247 1.00 0.00 H new ATOM 0 HA PHE A 82 12.251 3.073 1.718 1.00 0.00 H new ATOM 0 HB2 PHE A 82 11.299 1.675 -0.026 1.00 0.00 H new ATOM 0 HB3 PHE A 82 13.023 1.375 0.078 1.00 0.00 H new ATOM 0 HD1 PHE A 82 13.684 -0.631 1.718 1.00 0.00 H new ATOM 0 HD2 PHE A 82 9.877 -0.153 -0.134 1.00 0.00 H new ATOM 0 HE1 PHE A 82 13.250 -3.032 1.998 1.00 0.00 H new ATOM 0 HE2 PHE A 82 9.441 -2.555 0.143 1.00 0.00 H new ATOM 0 HZ PHE A 82 11.127 -4.000 1.206 1.00 0.00 H new ATOM 721 N TYR A 83 9.839 2.646 2.396 1.00 0.00 N ATOM 722 CA TYR A 83 8.544 2.566 3.061 1.00 0.00 C ATOM 723 C TYR A 83 7.406 2.639 2.047 1.00 0.00 C ATOM 724 O TYR A 83 7.374 3.529 1.197 1.00 0.00 O ATOM 725 CB TYR A 83 8.402 3.693 4.085 1.00 0.00 C ATOM 726 CG TYR A 83 7.448 3.369 5.213 1.00 0.00 C ATOM 727 CD1 TYR A 83 6.100 3.139 4.965 1.00 0.00 C ATOM 728 CD2 TYR A 83 7.894 3.293 6.527 1.00 0.00 C ATOM 729 CE1 TYR A 83 5.225 2.844 5.992 1.00 0.00 C ATOM 730 CE2 TYR A 83 7.027 2.997 7.560 1.00 0.00 C ATOM 731 CZ TYR A 83 5.693 2.774 7.288 1.00 0.00 C ATOM 732 OH TYR A 83 4.825 2.479 8.314 1.00 0.00 O ATOM 0 H TYR A 83 9.909 3.385 1.697 1.00 0.00 H new ATOM 0 HA TYR A 83 8.487 1.607 3.576 1.00 0.00 H new ATOM 0 HB2 TYR A 83 9.383 3.918 4.503 1.00 0.00 H new ATOM 0 HB3 TYR A 83 8.058 4.594 3.576 1.00 0.00 H new ATOM 0 HD1 TYR A 83 5.730 3.192 3.952 1.00 0.00 H new ATOM 0 HD2 TYR A 83 8.937 3.469 6.744 1.00 0.00 H new ATOM 0 HE1 TYR A 83 4.180 2.669 5.782 1.00 0.00 H new ATOM 0 HE2 TYR A 83 7.391 2.940 8.575 1.00 0.00 H new ATOM 0 HH TYR A 83 5.335 2.232 9.113 1.00 0.00 H new ATOM 742 N ILE A 84 6.474 1.697 2.145 1.00 0.00 N ATOM 743 CA ILE A 84 5.333 1.654 1.238 1.00 0.00 C ATOM 744 C ILE A 84 4.026 1.882 1.989 1.00 0.00 C ATOM 745 O ILE A 84 3.842 1.385 3.101 1.00 0.00 O ATOM 746 CB ILE A 84 5.256 0.309 0.493 1.00 0.00 C ATOM 747 CG1 ILE A 84 6.606 -0.021 -0.149 1.00 0.00 C ATOM 748 CG2 ILE A 84 4.159 0.349 -0.560 1.00 0.00 C ATOM 749 CD1 ILE A 84 6.831 -1.503 -0.354 1.00 0.00 C ATOM 0 H ILE A 84 6.486 0.953 2.843 1.00 0.00 H new ATOM 0 HA ILE A 84 5.477 2.454 0.512 1.00 0.00 H new ATOM 0 HB ILE A 84 5.015 -0.474 1.211 1.00 0.00 H new ATOM 0 HG12 ILE A 84 6.675 0.485 -1.112 1.00 0.00 H new ATOM 0 HG13 ILE A 84 7.404 0.376 0.478 1.00 0.00 H new ATOM 0 HG21 ILE A 84 4.117 -0.609 -1.078 1.00 0.00 H new ATOM 0 HG22 ILE A 84 3.200 0.544 -0.079 1.00 0.00 H new ATOM 0 HG23 ILE A 84 4.373 1.141 -1.278 1.00 0.00 H new ATOM 0 HD11 ILE A 84 7.807 -1.663 -0.813 1.00 0.00 H new ATOM 0 HD12 ILE A 84 6.795 -2.013 0.609 1.00 0.00 H new ATOM 0 HD13 ILE A 84 6.054 -1.902 -1.006 1.00 0.00 H new ATOM 761 N ILE A 85 3.119 2.634 1.374 1.00 0.00 N ATOM 762 CA ILE A 85 1.828 2.925 1.983 1.00 0.00 C ATOM 763 C ILE A 85 0.717 2.938 0.938 1.00 0.00 C ATOM 764 O ILE A 85 0.644 3.844 0.109 1.00 0.00 O ATOM 765 CB ILE A 85 1.843 4.279 2.716 1.00 0.00 C ATOM 766 CG1 ILE A 85 2.959 4.304 3.763 1.00 0.00 C ATOM 767 CG2 ILE A 85 0.493 4.544 3.367 1.00 0.00 C ATOM 768 CD1 ILE A 85 3.404 5.701 4.137 1.00 0.00 C ATOM 0 H ILE A 85 3.255 3.053 0.454 1.00 0.00 H new ATOM 0 HA ILE A 85 1.635 2.132 2.706 1.00 0.00 H new ATOM 0 HB ILE A 85 2.035 5.068 1.988 1.00 0.00 H new ATOM 0 HG12 ILE A 85 2.617 3.788 4.660 1.00 0.00 H new ATOM 0 HG13 ILE A 85 3.816 3.748 3.383 1.00 0.00 H new ATOM 0 HG21 ILE A 85 0.519 5.505 3.881 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -0.283 4.563 2.601 1.00 0.00 H new ATOM 0 HG23 ILE A 85 0.274 3.754 4.085 1.00 0.00 H new ATOM 0 HD11 ILE A 85 4.197 5.643 4.883 1.00 0.00 H new ATOM 0 HD12 ILE A 85 3.777 6.214 3.250 1.00 0.00 H new ATOM 0 HD13 ILE A 85 2.559 6.254 4.547 1.00 0.00 H new ATOM 780 N GLN A 86 -0.145 1.927 0.985 1.00 0.00 N ATOM 781 CA GLN A 86 -1.252 1.823 0.042 1.00 0.00 C ATOM 782 C GLN A 86 -2.568 1.575 0.773 1.00 0.00 C ATOM 783 O GLN A 86 -2.602 0.892 1.797 1.00 0.00 O ATOM 784 CB GLN A 86 -0.992 0.698 -0.960 1.00 0.00 C ATOM 785 CG GLN A 86 0.289 0.878 -1.758 1.00 0.00 C ATOM 786 CD GLN A 86 0.630 -0.337 -2.598 1.00 0.00 C ATOM 787 OE1 GLN A 86 1.467 -1.155 -2.216 1.00 0.00 O ATOM 788 NE2 GLN A 86 -0.020 -0.463 -3.749 1.00 0.00 N ATOM 0 H GLN A 86 -0.098 1.169 1.666 1.00 0.00 H new ATOM 0 HA GLN A 86 -1.328 2.768 -0.496 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -0.947 -0.251 -0.425 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -1.834 0.635 -1.649 1.00 0.00 H new ATOM 0 HG2 GLN A 86 0.188 1.747 -2.408 1.00 0.00 H new ATOM 0 HG3 GLN A 86 1.112 1.085 -1.074 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -0.706 0.239 -4.027 1.00 0.00 H new ATOM 0 HE22 GLN A 86 0.167 -1.262 -4.355 1.00 0.00 H new ATOM 797 N LEU A 87 -3.649 2.135 0.241 1.00 0.00 N ATOM 798 CA LEU A 87 -4.968 1.974 0.843 1.00 0.00 C ATOM 799 C LEU A 87 -5.820 1.000 0.036 1.00 0.00 C ATOM 800 O LEU A 87 -6.157 1.262 -1.119 1.00 0.00 O ATOM 801 CB LEU A 87 -5.674 3.328 0.939 1.00 0.00 C ATOM 802 CG LEU A 87 -6.689 3.477 2.072 1.00 0.00 C ATOM 803 CD1 LEU A 87 -6.756 4.921 2.543 1.00 0.00 C ATOM 804 CD2 LEU A 87 -8.062 2.995 1.625 1.00 0.00 C ATOM 0 H LEU A 87 -3.638 2.704 -0.605 1.00 0.00 H new ATOM 0 HA LEU A 87 -4.836 1.567 1.846 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.916 4.103 1.053 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -6.184 3.517 -0.006 1.00 0.00 H new ATOM 0 HG LEU A 87 -6.364 2.859 2.909 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -7.484 5.007 3.350 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -5.776 5.232 2.904 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -7.057 5.561 1.713 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -8.772 3.108 2.444 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -8.395 3.586 0.772 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -8.003 1.945 1.338 1.00 0.00 H new ATOM 816 N LEU A 88 -6.166 -0.125 0.653 1.00 0.00 N ATOM 817 CA LEU A 88 -6.981 -1.140 -0.007 1.00 0.00 C ATOM 818 C LEU A 88 -8.404 -1.135 0.541 1.00 0.00 C ATOM 819 O LEU A 88 -8.660 -0.610 1.624 1.00 0.00 O ATOM 820 CB LEU A 88 -6.355 -2.523 0.177 1.00 0.00 C ATOM 821 CG LEU A 88 -4.863 -2.632 -0.136 1.00 0.00 C ATOM 822 CD1 LEU A 88 -4.320 -3.981 0.310 1.00 0.00 C ATOM 823 CD2 LEU A 88 -4.613 -2.421 -1.622 1.00 0.00 C ATOM 0 H LEU A 88 -5.895 -0.357 1.609 1.00 0.00 H new ATOM 0 HA LEU A 88 -7.020 -0.905 -1.071 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -6.513 -2.837 1.209 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -6.891 -3.229 -0.457 1.00 0.00 H new ATOM 0 HG LEU A 88 -4.339 -1.852 0.416 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -3.256 -4.040 0.079 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.464 -4.094 1.384 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -4.849 -4.777 -0.213 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -3.545 -2.502 -1.826 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -5.150 -3.179 -2.193 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -4.964 -1.431 -1.913 1.00 0.00 H new ATOM 835 N GLN A 89 -9.325 -1.726 -0.213 1.00 0.00 N ATOM 836 CA GLN A 89 -10.722 -1.791 0.198 1.00 0.00 C ATOM 837 C GLN A 89 -11.360 -3.103 -0.247 1.00 0.00 C ATOM 838 O GLN A 89 -11.271 -3.483 -1.415 1.00 0.00 O ATOM 839 CB GLN A 89 -11.502 -0.609 -0.380 1.00 0.00 C ATOM 840 CG GLN A 89 -12.991 -0.657 -0.080 1.00 0.00 C ATOM 841 CD GLN A 89 -13.778 -1.392 -1.147 1.00 0.00 C ATOM 842 OE1 GLN A 89 -13.203 -2.027 -2.032 1.00 0.00 O ATOM 843 NE2 GLN A 89 -15.101 -1.308 -1.071 1.00 0.00 N ATOM 0 H GLN A 89 -9.129 -2.167 -1.112 1.00 0.00 H new ATOM 0 HA GLN A 89 -10.756 -1.742 1.286 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -11.089 0.318 0.019 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -11.358 -0.583 -1.460 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -13.148 -1.144 0.882 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -13.372 0.360 0.011 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -15.536 -0.771 -0.321 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -15.683 -1.781 -1.763 1.00 0.00 H new ATOM 852 N ASP A 90 -12.004 -3.790 0.690 1.00 0.00 N ATOM 853 CA ASP A 90 -12.658 -5.059 0.394 1.00 0.00 C ATOM 854 C ASP A 90 -14.143 -4.852 0.110 1.00 0.00 C ATOM 855 O ASP A 90 -14.674 -3.759 0.299 1.00 0.00 O ATOM 856 CB ASP A 90 -12.480 -6.033 1.559 1.00 0.00 C ATOM 857 CG ASP A 90 -12.513 -7.482 1.113 1.00 0.00 C ATOM 858 OD1 ASP A 90 -11.482 -7.971 0.606 1.00 0.00 O ATOM 859 OD2 ASP A 90 -13.570 -8.127 1.273 1.00 0.00 O ATOM 0 H ASP A 90 -12.087 -3.489 1.661 1.00 0.00 H new ATOM 0 HA ASP A 90 -12.192 -5.481 -0.496 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -11.531 -5.831 2.056 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -13.267 -5.864 2.294 1.00 0.00 H new ATOM 864 N SER A 91 -14.806 -5.910 -0.346 1.00 0.00 N ATOM 865 CA SER A 91 -16.228 -5.843 -0.661 1.00 0.00 C ATOM 866 C SER A 91 -17.072 -6.047 0.593 1.00 0.00 C ATOM 867 O SER A 91 -18.200 -6.532 0.523 1.00 0.00 O ATOM 868 CB SER A 91 -16.590 -6.897 -1.710 1.00 0.00 C ATOM 869 OG SER A 91 -17.835 -6.603 -2.320 1.00 0.00 O ATOM 0 H SER A 91 -14.381 -6.824 -0.505 1.00 0.00 H new ATOM 0 HA SER A 91 -16.440 -4.852 -1.063 1.00 0.00 H new ATOM 0 HB2 SER A 91 -15.810 -6.941 -2.470 1.00 0.00 H new ATOM 0 HB3 SER A 91 -16.634 -7.880 -1.242 1.00 0.00 H new ATOM 0 HG SER A 91 -18.511 -6.450 -1.627 1.00 0.00 H new ATOM 875 N ASN A 92 -16.516 -5.673 1.741 1.00 0.00 N ATOM 876 CA ASN A 92 -17.216 -5.814 3.012 1.00 0.00 C ATOM 877 C ASN A 92 -17.331 -4.469 3.723 1.00 0.00 C ATOM 878 O ASN A 92 -17.482 -4.411 4.943 1.00 0.00 O ATOM 879 CB ASN A 92 -16.489 -6.817 3.910 1.00 0.00 C ATOM 880 CG ASN A 92 -17.437 -7.565 4.828 1.00 0.00 C ATOM 881 OD1 ASN A 92 -18.487 -7.048 5.208 1.00 0.00 O ATOM 882 ND2 ASN A 92 -17.068 -8.789 5.188 1.00 0.00 N ATOM 0 H ASN A 92 -15.582 -5.270 1.817 1.00 0.00 H new ATOM 0 HA ASN A 92 -18.221 -6.183 2.805 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -15.949 -7.532 3.289 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -15.746 -6.291 4.510 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -17.665 -9.341 5.804 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -16.188 -9.177 4.848 1.00 0.00 H new ATOM 889 N ARG A 93 -17.260 -3.390 2.950 1.00 0.00 N ATOM 890 CA ARG A 93 -17.356 -2.045 3.505 1.00 0.00 C ATOM 891 C ARG A 93 -16.246 -1.796 4.521 1.00 0.00 C ATOM 892 O ARG A 93 -16.384 -0.961 5.415 1.00 0.00 O ATOM 893 CB ARG A 93 -18.721 -1.839 4.164 1.00 0.00 C ATOM 894 CG ARG A 93 -19.893 -2.132 3.242 1.00 0.00 C ATOM 895 CD ARG A 93 -21.112 -2.598 4.022 1.00 0.00 C ATOM 896 NE ARG A 93 -21.938 -1.479 4.468 1.00 0.00 N ATOM 897 CZ ARG A 93 -22.703 -0.760 3.654 1.00 0.00 C ATOM 898 NH1 ARG A 93 -22.747 -1.042 2.359 1.00 0.00 N ATOM 899 NH2 ARG A 93 -23.426 0.243 4.135 1.00 0.00 N ATOM 0 H ARG A 93 -17.136 -3.421 1.938 1.00 0.00 H new ATOM 0 HA ARG A 93 -17.243 -1.333 2.688 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -18.791 -2.481 5.042 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -18.794 -0.810 4.515 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -20.144 -1.236 2.674 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -19.607 -2.897 2.520 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -21.709 -3.263 3.398 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -20.789 -3.177 4.887 1.00 0.00 H new ATOM 0 HE ARG A 93 -21.927 -1.236 5.459 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -22.193 -1.813 1.986 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -23.335 -0.488 1.736 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -23.395 0.463 5.131 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -24.013 0.795 3.509 1.00 0.00 H new ATOM 913 N PHE A 94 -15.145 -2.527 4.378 1.00 0.00 N ATOM 914 CA PHE A 94 -14.011 -2.387 5.285 1.00 0.00 C ATOM 915 C PHE A 94 -12.720 -2.145 4.508 1.00 0.00 C ATOM 916 O PHE A 94 -12.421 -2.851 3.544 1.00 0.00 O ATOM 917 CB PHE A 94 -13.869 -3.637 6.155 1.00 0.00 C ATOM 918 CG PHE A 94 -15.087 -3.933 6.983 1.00 0.00 C ATOM 919 CD1 PHE A 94 -15.703 -2.931 7.716 1.00 0.00 C ATOM 920 CD2 PHE A 94 -15.616 -5.213 7.028 1.00 0.00 C ATOM 921 CE1 PHE A 94 -16.824 -3.200 8.478 1.00 0.00 C ATOM 922 CE2 PHE A 94 -16.737 -5.487 7.788 1.00 0.00 C ATOM 923 CZ PHE A 94 -17.341 -4.480 8.515 1.00 0.00 C ATOM 0 H PHE A 94 -15.014 -3.222 3.643 1.00 0.00 H new ATOM 0 HA PHE A 94 -14.195 -1.525 5.927 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -13.658 -4.493 5.515 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -13.011 -3.514 6.816 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -15.302 -1.928 7.691 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -15.147 -6.005 6.463 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -17.295 -2.410 9.044 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -17.141 -6.488 7.813 1.00 0.00 H new ATOM 0 HZ PHE A 94 -18.216 -4.693 9.111 1.00 0.00 H new ATOM 933 N PHE A 95 -11.960 -1.142 4.933 1.00 0.00 N ATOM 934 CA PHE A 95 -10.702 -0.805 4.277 1.00 0.00 C ATOM 935 C PHE A 95 -9.514 -1.351 5.065 1.00 0.00 C ATOM 936 O PHE A 95 -9.597 -1.550 6.278 1.00 0.00 O ATOM 937 CB PHE A 95 -10.572 0.712 4.124 1.00 0.00 C ATOM 938 CG PHE A 95 -11.665 1.326 3.296 1.00 0.00 C ATOM 939 CD1 PHE A 95 -12.926 1.531 3.832 1.00 0.00 C ATOM 940 CD2 PHE A 95 -11.431 1.698 1.982 1.00 0.00 C ATOM 941 CE1 PHE A 95 -13.934 2.096 3.073 1.00 0.00 C ATOM 942 CE2 PHE A 95 -12.435 2.263 1.219 1.00 0.00 C ATOM 943 CZ PHE A 95 -13.688 2.462 1.765 1.00 0.00 C ATOM 0 H PHE A 95 -12.193 -0.548 5.729 1.00 0.00 H new ATOM 0 HA PHE A 95 -10.703 -1.264 3.289 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -10.575 1.171 5.113 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -9.609 0.942 3.669 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -13.124 1.246 4.855 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -10.453 1.545 1.549 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -14.913 2.251 3.503 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -12.240 2.549 0.196 1.00 0.00 H new ATOM 0 HZ PHE A 95 -14.474 2.903 1.170 1.00 0.00 H new ATOM 953 N THR A 96 -8.409 -1.591 4.367 1.00 0.00 N ATOM 954 CA THR A 96 -7.205 -2.116 4.999 1.00 0.00 C ATOM 955 C THR A 96 -5.967 -1.351 4.543 1.00 0.00 C ATOM 956 O THR A 96 -5.725 -1.201 3.345 1.00 0.00 O ATOM 957 CB THR A 96 -7.013 -3.612 4.688 1.00 0.00 C ATOM 958 OG1 THR A 96 -8.202 -4.337 5.020 1.00 0.00 O ATOM 959 CG2 THR A 96 -5.834 -4.179 5.464 1.00 0.00 C ATOM 0 H THR A 96 -8.323 -1.430 3.363 1.00 0.00 H new ATOM 0 HA THR A 96 -7.332 -1.990 6.074 1.00 0.00 H new ATOM 0 HB THR A 96 -6.810 -3.716 3.622 1.00 0.00 H new ATOM 0 HG1 THR A 96 -8.033 -4.901 5.803 1.00 0.00 H new ATOM 0 HG21 THR A 96 -5.718 -5.237 5.228 1.00 0.00 H new ATOM 0 HG22 THR A 96 -4.925 -3.644 5.188 1.00 0.00 H new ATOM 0 HG23 THR A 96 -6.012 -4.063 6.533 1.00 0.00 H new ATOM 967 N CYS A 97 -5.187 -0.870 5.504 1.00 0.00 N ATOM 968 CA CYS A 97 -3.973 -0.120 5.201 1.00 0.00 C ATOM 969 C CYS A 97 -2.781 -1.058 5.042 1.00 0.00 C ATOM 970 O CYS A 97 -2.324 -1.667 6.009 1.00 0.00 O ATOM 971 CB CYS A 97 -3.691 0.901 6.304 1.00 0.00 C ATOM 972 SG CYS A 97 -4.454 2.516 6.027 1.00 0.00 S ATOM 0 H CYS A 97 -5.373 -0.986 6.500 1.00 0.00 H new ATOM 0 HA CYS A 97 -4.126 0.407 4.259 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -4.046 0.501 7.254 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -2.613 1.032 6.397 1.00 0.00 H new ATOM 0 HG CYS A 97 -4.160 3.310 7.014 1.00 0.00 H new ATOM 978 N TRP A 98 -2.282 -1.169 3.816 1.00 0.00 N ATOM 979 CA TRP A 98 -1.143 -2.034 3.530 1.00 0.00 C ATOM 980 C TRP A 98 0.170 -1.277 3.694 1.00 0.00 C ATOM 981 O TRP A 98 0.414 -0.285 3.010 1.00 0.00 O ATOM 982 CB TRP A 98 -1.248 -2.597 2.111 1.00 0.00 C ATOM 983 CG TRP A 98 0.023 -3.227 1.627 1.00 0.00 C ATOM 984 CD1 TRP A 98 0.872 -2.734 0.677 1.00 0.00 C ATOM 985 CD2 TRP A 98 0.586 -4.467 2.067 1.00 0.00 C ATOM 986 NE1 TRP A 98 1.930 -3.594 0.501 1.00 0.00 N ATOM 987 CE2 TRP A 98 1.778 -4.664 1.343 1.00 0.00 C ATOM 988 CE3 TRP A 98 0.202 -5.429 3.005 1.00 0.00 C ATOM 989 CZ2 TRP A 98 2.585 -5.784 1.527 1.00 0.00 C ATOM 990 CZ3 TRP A 98 1.003 -6.540 3.186 1.00 0.00 C ATOM 991 CH2 TRP A 98 2.184 -6.710 2.451 1.00 0.00 C ATOM 0 H TRP A 98 -2.648 -0.671 3.004 1.00 0.00 H new ATOM 0 HA TRP A 98 -1.156 -2.859 4.243 1.00 0.00 H new ATOM 0 HB2 TRP A 98 -2.047 -3.338 2.080 1.00 0.00 H new ATOM 0 HB3 TRP A 98 -1.530 -1.795 1.429 1.00 0.00 H new ATOM 0 HD1 TRP A 98 0.733 -1.806 0.143 1.00 0.00 H new ATOM 0 HE1 TRP A 98 2.703 -3.458 -0.151 1.00 0.00 H new ATOM 0 HE3 TRP A 98 -0.705 -5.306 3.578 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 3.495 -5.917 0.961 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 0.714 -7.291 3.907 1.00 0.00 H new ATOM 0 HH2 TRP A 98 2.789 -7.589 2.617 1.00 0.00 H new ATOM 1002 N ASN A 99 1.012 -1.753 4.606 1.00 0.00 N ATOM 1003 CA ASN A 99 2.301 -1.120 4.860 1.00 0.00 C ATOM 1004 C ASN A 99 3.444 -2.108 4.646 1.00 0.00 C ATOM 1005 O ASN A 99 3.286 -3.311 4.857 1.00 0.00 O ATOM 1006 CB ASN A 99 2.349 -0.568 6.286 1.00 0.00 C ATOM 1007 CG ASN A 99 1.008 -0.028 6.742 1.00 0.00 C ATOM 1008 OD1 ASN A 99 0.477 -0.444 7.772 1.00 0.00 O ATOM 1009 ND2 ASN A 99 0.453 0.903 5.975 1.00 0.00 N ATOM 0 H ASN A 99 0.825 -2.574 5.181 1.00 0.00 H new ATOM 0 HA ASN A 99 2.419 -0.297 4.155 1.00 0.00 H new ATOM 0 HB2 ASN A 99 2.671 -1.356 6.967 1.00 0.00 H new ATOM 0 HB3 ASN A 99 3.095 0.225 6.341 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -0.450 1.303 6.231 1.00 0.00 H new ATOM 0 HD22 ASN A 99 0.929 1.218 5.130 1.00 0.00 H new ATOM 1016 N ARG A 100 4.594 -1.592 4.227 1.00 0.00 N ATOM 1017 CA ARG A 100 5.764 -2.429 3.984 1.00 0.00 C ATOM 1018 C ARG A 100 7.050 -1.619 4.122 1.00 0.00 C ATOM 1019 O ARG A 100 7.121 -0.470 3.685 1.00 0.00 O ATOM 1020 CB ARG A 100 5.689 -3.054 2.590 1.00 0.00 C ATOM 1021 CG ARG A 100 6.935 -3.836 2.206 1.00 0.00 C ATOM 1022 CD ARG A 100 6.709 -4.660 0.947 1.00 0.00 C ATOM 1023 NE ARG A 100 6.237 -6.007 1.252 1.00 0.00 N ATOM 1024 CZ ARG A 100 6.932 -6.886 1.965 1.00 0.00 C ATOM 1025 NH1 ARG A 100 8.125 -6.561 2.444 1.00 0.00 N ATOM 1026 NH2 ARG A 100 6.434 -8.094 2.201 1.00 0.00 N ATOM 0 H ARG A 100 4.742 -0.599 4.048 1.00 0.00 H new ATOM 0 HA ARG A 100 5.773 -3.223 4.731 1.00 0.00 H new ATOM 0 HB2 ARG A 100 4.825 -3.717 2.544 1.00 0.00 H new ATOM 0 HB3 ARG A 100 5.524 -2.265 1.856 1.00 0.00 H new ATOM 0 HG2 ARG A 100 7.764 -3.147 2.047 1.00 0.00 H new ATOM 0 HG3 ARG A 100 7.220 -4.494 3.027 1.00 0.00 H new ATOM 0 HD2 ARG A 100 5.982 -4.157 0.310 1.00 0.00 H new ATOM 0 HD3 ARG A 100 7.639 -4.721 0.382 1.00 0.00 H new ATOM 0 HE ARG A 100 5.323 -6.289 0.898 1.00 0.00 H new ATOM 0 HH11 ARG A 100 8.511 -5.634 2.265 1.00 0.00 H new ATOM 0 HH12 ARG A 100 8.657 -7.238 2.991 1.00 0.00 H new ATOM 0 HH21 ARG A 100 5.517 -8.348 1.835 1.00 0.00 H new ATOM 0 HH22 ARG A 100 6.969 -8.768 2.749 1.00 0.00 H new ATOM 1040 N TRP A 101 8.062 -2.225 4.731 1.00 0.00 N ATOM 1041 CA TRP A 101 9.345 -1.560 4.927 1.00 0.00 C ATOM 1042 C TRP A 101 10.489 -2.568 4.906 1.00 0.00 C ATOM 1043 O TRP A 101 10.265 -3.773 4.804 1.00 0.00 O ATOM 1044 CB TRP A 101 9.348 -0.794 6.251 1.00 0.00 C ATOM 1045 CG TRP A 101 9.258 -1.684 7.453 1.00 0.00 C ATOM 1046 CD1 TRP A 101 10.289 -2.326 8.077 1.00 0.00 C ATOM 1047 CD2 TRP A 101 8.071 -2.032 8.174 1.00 0.00 C ATOM 1048 NE1 TRP A 101 9.815 -3.052 9.143 1.00 0.00 N ATOM 1049 CE2 TRP A 101 8.458 -2.888 9.224 1.00 0.00 C ATOM 1050 CE3 TRP A 101 6.720 -1.703 8.036 1.00 0.00 C ATOM 1051 CZ2 TRP A 101 7.541 -3.418 10.128 1.00 0.00 C ATOM 1052 CZ3 TRP A 101 5.811 -2.230 8.934 1.00 0.00 C ATOM 1053 CH2 TRP A 101 6.224 -3.079 9.969 1.00 0.00 C ATOM 0 H TRP A 101 8.019 -3.176 5.098 1.00 0.00 H new ATOM 0 HA TRP A 101 9.491 -0.856 4.108 1.00 0.00 H new ATOM 0 HB2 TRP A 101 10.259 -0.199 6.316 1.00 0.00 H new ATOM 0 HB3 TRP A 101 8.510 -0.097 6.261 1.00 0.00 H new ATOM 0 HD1 TRP A 101 11.325 -2.271 7.777 1.00 0.00 H new ATOM 0 HE1 TRP A 101 10.382 -3.621 9.772 1.00 0.00 H new ATOM 0 HE3 TRP A 101 6.392 -1.049 7.242 1.00 0.00 H new ATOM 0 HZ2 TRP A 101 7.857 -4.073 10.926 1.00 0.00 H new ATOM 0 HZ3 TRP A 101 4.764 -1.983 8.836 1.00 0.00 H new ATOM 0 HH2 TRP A 101 5.489 -3.474 10.655 1.00 0.00 H new ATOM 1064 N GLY A 102 11.716 -2.065 5.002 1.00 0.00 N ATOM 1065 CA GLY A 102 12.877 -2.936 4.992 1.00 0.00 C ATOM 1066 C GLY A 102 14.059 -2.319 4.271 1.00 0.00 C ATOM 1067 O GLY A 102 14.066 -1.120 3.989 1.00 0.00 O ATOM 0 H GLY A 102 11.927 -1.071 5.086 1.00 0.00 H new ATOM 0 HA2 GLY A 102 13.162 -3.168 6.018 1.00 0.00 H new ATOM 0 HA3 GLY A 102 12.615 -3.879 4.513 1.00 0.00 H new ATOM 1071 N ARG A 103 15.062 -3.138 3.972 1.00 0.00 N ATOM 1072 CA ARG A 103 16.256 -2.664 3.282 1.00 0.00 C ATOM 1073 C ARG A 103 15.980 -2.465 1.795 1.00 0.00 C ATOM 1074 O ARG A 103 15.322 -3.288 1.158 1.00 0.00 O ATOM 1075 CB ARG A 103 17.406 -3.655 3.470 1.00 0.00 C ATOM 1076 CG ARG A 103 18.265 -3.366 4.690 1.00 0.00 C ATOM 1077 CD ARG A 103 19.631 -4.026 4.580 1.00 0.00 C ATOM 1078 NE ARG A 103 20.265 -4.194 5.884 1.00 0.00 N ATOM 1079 CZ ARG A 103 21.559 -4.449 6.045 1.00 0.00 C ATOM 1080 NH1 ARG A 103 22.351 -4.565 4.988 1.00 0.00 N ATOM 1081 NH2 ARG A 103 22.062 -4.588 7.265 1.00 0.00 N ATOM 0 H ARG A 103 15.072 -4.133 4.197 1.00 0.00 H new ATOM 0 HA ARG A 103 16.539 -1.704 3.714 1.00 0.00 H new ATOM 0 HB2 ARG A 103 16.997 -4.662 3.554 1.00 0.00 H new ATOM 0 HB3 ARG A 103 18.036 -3.641 2.581 1.00 0.00 H new ATOM 0 HG2 ARG A 103 18.388 -2.289 4.802 1.00 0.00 H new ATOM 0 HG3 ARG A 103 17.758 -3.724 5.586 1.00 0.00 H new ATOM 0 HD2 ARG A 103 19.526 -4.999 4.100 1.00 0.00 H new ATOM 0 HD3 ARG A 103 20.274 -3.423 3.939 1.00 0.00 H new ATOM 0 HE ARG A 103 19.683 -4.111 6.717 1.00 0.00 H new ATOM 0 HH11 ARG A 103 21.967 -4.458 4.049 1.00 0.00 H new ATOM 0 HH12 ARG A 103 23.344 -4.761 5.114 1.00 0.00 H new ATOM 0 HH21 ARG A 103 21.455 -4.499 8.080 1.00 0.00 H new ATOM 0 HH22 ARG A 103 23.055 -4.784 7.388 1.00 0.00 H new ATOM 1095 N VAL A 104 16.488 -1.365 1.246 1.00 0.00 N ATOM 1096 CA VAL A 104 16.298 -1.057 -0.166 1.00 0.00 C ATOM 1097 C VAL A 104 16.799 -2.194 -1.049 1.00 0.00 C ATOM 1098 O VAL A 104 17.954 -2.607 -0.951 1.00 0.00 O ATOM 1099 CB VAL A 104 17.025 0.242 -0.560 1.00 0.00 C ATOM 1100 CG1 VAL A 104 16.945 0.465 -2.062 1.00 0.00 C ATOM 1101 CG2 VAL A 104 16.442 1.428 0.195 1.00 0.00 C ATOM 0 H VAL A 104 17.034 -0.673 1.759 1.00 0.00 H new ATOM 0 HA VAL A 104 15.227 -0.926 -0.320 1.00 0.00 H new ATOM 0 HB VAL A 104 18.076 0.147 -0.287 1.00 0.00 H new ATOM 0 HG11 VAL A 104 17.464 1.388 -2.321 1.00 0.00 H new ATOM 0 HG12 VAL A 104 17.413 -0.372 -2.580 1.00 0.00 H new ATOM 0 HG13 VAL A 104 15.900 0.540 -2.364 1.00 0.00 H new ATOM 0 HG21 VAL A 104 16.967 2.338 -0.095 1.00 0.00 H new ATOM 0 HG22 VAL A 104 15.384 1.528 -0.045 1.00 0.00 H new ATOM 0 HG23 VAL A 104 16.557 1.269 1.267 1.00 0.00 H new ATOM 1111 N GLY A 105 15.922 -2.697 -1.912 1.00 0.00 N ATOM 1112 CA GLY A 105 16.294 -3.782 -2.801 1.00 0.00 C ATOM 1113 C GLY A 105 15.650 -5.098 -2.410 1.00 0.00 C ATOM 1114 O GLY A 105 15.182 -5.845 -3.269 1.00 0.00 O ATOM 0 H GLY A 105 14.960 -2.372 -2.011 1.00 0.00 H new ATOM 0 HA2 GLY A 105 16.004 -3.528 -3.821 1.00 0.00 H new ATOM 0 HA3 GLY A 105 17.378 -3.896 -2.797 1.00 0.00 H new ATOM 1118 N GLU A 106 15.629 -5.382 -1.112 1.00 0.00 N ATOM 1119 CA GLU A 106 15.040 -6.619 -0.611 1.00 0.00 C ATOM 1120 C GLU A 106 13.587 -6.401 -0.197 1.00 0.00 C ATOM 1121 O GLU A 106 13.121 -5.266 -0.103 1.00 0.00 O ATOM 1122 CB GLU A 106 15.846 -7.149 0.577 1.00 0.00 C ATOM 1123 CG GLU A 106 15.599 -6.388 1.868 1.00 0.00 C ATOM 1124 CD GLU A 106 15.989 -7.184 3.098 1.00 0.00 C ATOM 1125 OE1 GLU A 106 16.832 -8.097 2.971 1.00 0.00 O ATOM 1126 OE2 GLU A 106 15.451 -6.895 4.188 1.00 0.00 O ATOM 0 H GLU A 106 16.012 -4.774 -0.389 1.00 0.00 H new ATOM 0 HA GLU A 106 15.064 -7.355 -1.415 1.00 0.00 H new ATOM 0 HB2 GLU A 106 15.601 -8.200 0.732 1.00 0.00 H new ATOM 0 HB3 GLU A 106 16.908 -7.102 0.335 1.00 0.00 H new ATOM 0 HG2 GLU A 106 16.163 -5.456 1.849 1.00 0.00 H new ATOM 0 HG3 GLU A 106 14.544 -6.121 1.932 1.00 0.00 H new ATOM 1133 N VAL A 107 12.877 -7.498 0.047 1.00 0.00 N ATOM 1134 CA VAL A 107 11.478 -7.428 0.451 1.00 0.00 C ATOM 1135 C VAL A 107 11.338 -6.824 1.844 1.00 0.00 C ATOM 1136 O VAL A 107 10.512 -5.939 2.068 1.00 0.00 O ATOM 1137 CB VAL A 107 10.820 -8.821 0.439 1.00 0.00 C ATOM 1138 CG1 VAL A 107 9.324 -8.707 0.685 1.00 0.00 C ATOM 1139 CG2 VAL A 107 11.100 -9.530 -0.877 1.00 0.00 C ATOM 0 H VAL A 107 13.248 -8.445 -0.028 1.00 0.00 H new ATOM 0 HA VAL A 107 10.971 -6.789 -0.272 1.00 0.00 H new ATOM 0 HB VAL A 107 11.252 -9.415 1.245 1.00 0.00 H new ATOM 0 HG11 VAL A 107 8.877 -9.701 0.673 1.00 0.00 H new ATOM 0 HG12 VAL A 107 9.149 -8.242 1.655 1.00 0.00 H new ATOM 0 HG13 VAL A 107 8.872 -8.096 -0.097 1.00 0.00 H new ATOM 0 HG21 VAL A 107 10.628 -10.512 -0.869 1.00 0.00 H new ATOM 0 HG22 VAL A 107 10.697 -8.941 -1.701 1.00 0.00 H new ATOM 0 HG23 VAL A 107 12.176 -9.646 -1.006 1.00 0.00 H new ATOM 1149 N GLY A 108 12.151 -7.308 2.778 1.00 0.00 N ATOM 1150 CA GLY A 108 12.102 -6.803 4.138 1.00 0.00 C ATOM 1151 C GLY A 108 10.930 -7.361 4.921 1.00 0.00 C ATOM 1152 O GLY A 108 10.483 -8.480 4.669 1.00 0.00 O ATOM 0 H GLY A 108 12.842 -8.040 2.617 1.00 0.00 H new ATOM 0 HA2 GLY A 108 13.031 -7.056 4.650 1.00 0.00 H new ATOM 0 HA3 GLY A 108 12.036 -5.715 4.116 1.00 0.00 H new ATOM 1156 N GLN A 109 10.432 -6.581 5.875 1.00 0.00 N ATOM 1157 CA GLN A 109 9.307 -7.005 6.699 1.00 0.00 C ATOM 1158 C GLN A 109 7.981 -6.644 6.037 1.00 0.00 C ATOM 1159 O GLN A 109 7.954 -6.133 4.918 1.00 0.00 O ATOM 1160 CB GLN A 109 9.391 -6.362 8.085 1.00 0.00 C ATOM 1161 CG GLN A 109 10.178 -7.186 9.091 1.00 0.00 C ATOM 1162 CD GLN A 109 9.447 -8.444 9.514 1.00 0.00 C ATOM 1163 OE1 GLN A 109 9.766 -9.544 9.060 1.00 0.00 O ATOM 1164 NE2 GLN A 109 8.460 -8.291 10.389 1.00 0.00 N ATOM 0 H GLN A 109 10.790 -5.652 6.096 1.00 0.00 H new ATOM 0 HA GLN A 109 9.356 -8.089 6.806 1.00 0.00 H new ATOM 0 HB2 GLN A 109 9.852 -5.379 7.993 1.00 0.00 H new ATOM 0 HB3 GLN A 109 8.382 -6.206 8.466 1.00 0.00 H new ATOM 0 HG2 GLN A 109 11.141 -7.458 8.658 1.00 0.00 H new ATOM 0 HG3 GLN A 109 10.385 -6.577 9.971 1.00 0.00 H new ATOM 0 HE21 GLN A 109 8.229 -7.361 10.740 1.00 0.00 H new ATOM 0 HE22 GLN A 109 7.933 -9.103 10.711 1.00 0.00 H new ATOM 1173 N SER A 110 6.883 -6.914 6.737 1.00 0.00 N ATOM 1174 CA SER A 110 5.554 -6.622 6.215 1.00 0.00 C ATOM 1175 C SER A 110 4.552 -6.442 7.352 1.00 0.00 C ATOM 1176 O SER A 110 4.634 -7.114 8.380 1.00 0.00 O ATOM 1177 CB SER A 110 5.090 -7.744 5.284 1.00 0.00 C ATOM 1178 OG SER A 110 5.038 -8.985 5.967 1.00 0.00 O ATOM 0 H SER A 110 6.888 -7.334 7.666 1.00 0.00 H new ATOM 0 HA SER A 110 5.609 -5.691 5.651 1.00 0.00 H new ATOM 0 HB2 SER A 110 4.105 -7.504 4.883 1.00 0.00 H new ATOM 0 HB3 SER A 110 5.769 -7.821 4.435 1.00 0.00 H new ATOM 0 HG SER A 110 4.737 -9.685 5.351 1.00 0.00 H new ATOM 1184 N LYS A 111 3.605 -5.531 7.158 1.00 0.00 N ATOM 1185 CA LYS A 111 2.585 -5.261 8.165 1.00 0.00 C ATOM 1186 C LYS A 111 1.288 -4.791 7.513 1.00 0.00 C ATOM 1187 O LYS A 111 1.310 -4.094 6.498 1.00 0.00 O ATOM 1188 CB LYS A 111 3.082 -4.206 9.155 1.00 0.00 C ATOM 1189 CG LYS A 111 2.123 -3.951 10.305 1.00 0.00 C ATOM 1190 CD LYS A 111 2.280 -4.989 11.403 1.00 0.00 C ATOM 1191 CE LYS A 111 3.317 -4.561 12.430 1.00 0.00 C ATOM 1192 NZ LYS A 111 3.486 -5.578 13.505 1.00 0.00 N ATOM 0 H LYS A 111 3.522 -4.967 6.312 1.00 0.00 H new ATOM 0 HA LYS A 111 2.386 -6.188 8.702 1.00 0.00 H new ATOM 0 HB2 LYS A 111 4.044 -4.523 9.558 1.00 0.00 H new ATOM 0 HB3 LYS A 111 3.253 -3.271 8.621 1.00 0.00 H new ATOM 0 HG2 LYS A 111 2.301 -2.957 10.715 1.00 0.00 H new ATOM 0 HG3 LYS A 111 1.098 -3.964 9.935 1.00 0.00 H new ATOM 0 HD2 LYS A 111 1.321 -5.146 11.896 1.00 0.00 H new ATOM 0 HD3 LYS A 111 2.573 -5.943 10.964 1.00 0.00 H new ATOM 0 HE2 LYS A 111 4.273 -4.395 11.933 1.00 0.00 H new ATOM 0 HE3 LYS A 111 3.019 -3.611 12.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 4.201 -5.249 14.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 2.580 -5.718 13.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 3.795 -6.478 13.086 1.00 0.00 H new ATOM 1206 N ILE A 112 0.161 -5.174 8.103 1.00 0.00 N ATOM 1207 CA ILE A 112 -1.144 -4.789 7.581 1.00 0.00 C ATOM 1208 C ILE A 112 -2.086 -4.376 8.706 1.00 0.00 C ATOM 1209 O ILE A 112 -2.144 -5.024 9.750 1.00 0.00 O ATOM 1210 CB ILE A 112 -1.790 -5.935 6.779 1.00 0.00 C ATOM 1211 CG1 ILE A 112 -2.948 -5.404 5.932 1.00 0.00 C ATOM 1212 CG2 ILE A 112 -2.272 -7.031 7.717 1.00 0.00 C ATOM 1213 CD1 ILE A 112 -3.174 -6.189 4.659 1.00 0.00 C ATOM 0 H ILE A 112 0.125 -5.751 8.943 1.00 0.00 H new ATOM 0 HA ILE A 112 -0.981 -3.940 6.918 1.00 0.00 H new ATOM 0 HB ILE A 112 -1.040 -6.359 6.111 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -3.861 -5.422 6.527 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -2.754 -4.362 5.677 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -2.726 -7.834 7.136 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -1.427 -7.425 8.281 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -3.009 -6.621 8.407 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -4.010 -5.757 4.109 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -2.275 -6.150 4.043 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -3.400 -7.226 4.906 1.00 0.00 H new ATOM 1225 N ASN A 113 -2.825 -3.294 8.484 1.00 0.00 N ATOM 1226 CA ASN A 113 -3.767 -2.795 9.479 1.00 0.00 C ATOM 1227 C ASN A 113 -5.178 -2.720 8.904 1.00 0.00 C ATOM 1228 O ASN A 113 -5.389 -2.180 7.817 1.00 0.00 O ATOM 1229 CB ASN A 113 -3.333 -1.414 9.976 1.00 0.00 C ATOM 1230 CG ASN A 113 -2.273 -1.496 11.057 1.00 0.00 C ATOM 1231 OD1 ASN A 113 -1.159 -2.149 10.745 1.00 0.00 O flip ATOM 1232 ND2 ASN A 113 -2.453 -0.978 12.159 1.00 0.00 N flip ATOM 0 H ASN A 113 -2.790 -2.746 7.624 1.00 0.00 H new ATOM 0 HA ASN A 113 -3.772 -3.491 10.318 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -2.949 -0.833 9.137 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -4.201 -0.880 10.362 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -3.325 -0.486 12.355 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -1.730 -1.041 12.876 1.00 0.00 H new ATOM 1239 N HIS A 114 -6.142 -3.264 9.640 1.00 0.00 N ATOM 1240 CA HIS A 114 -7.534 -3.257 9.203 1.00 0.00 C ATOM 1241 C HIS A 114 -8.334 -2.199 9.956 1.00 0.00 C ATOM 1242 O HIS A 114 -8.248 -2.095 11.180 1.00 0.00 O ATOM 1243 CB HIS A 114 -8.162 -4.635 9.413 1.00 0.00 C ATOM 1244 CG HIS A 114 -7.374 -5.752 8.803 1.00 0.00 C ATOM 1245 ND1 HIS A 114 -7.422 -6.061 7.459 1.00 0.00 N ATOM 1246 CD2 HIS A 114 -6.513 -6.636 9.359 1.00 0.00 C ATOM 1247 CE1 HIS A 114 -6.626 -7.087 7.217 1.00 0.00 C ATOM 1248 NE2 HIS A 114 -6.062 -7.455 8.353 1.00 0.00 N ATOM 0 H HIS A 114 -5.985 -3.715 10.541 1.00 0.00 H new ATOM 0 HA HIS A 114 -7.555 -3.014 8.141 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -8.268 -4.818 10.482 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -9.166 -4.636 8.989 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -6.233 -6.688 10.401 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -6.464 -7.547 6.253 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -5.399 -8.222 8.465 1.00 0.00 H new ATOM 1256 N PHE A 115 -9.113 -1.416 9.217 1.00 0.00 N ATOM 1257 CA PHE A 115 -9.928 -0.365 9.815 1.00 0.00 C ATOM 1258 C PHE A 115 -11.394 -0.524 9.423 1.00 0.00 C ATOM 1259 O PHE A 115 -11.710 -0.885 8.289 1.00 0.00 O ATOM 1260 CB PHE A 115 -9.419 1.012 9.383 1.00 0.00 C ATOM 1261 CG PHE A 115 -8.039 1.326 9.884 1.00 0.00 C ATOM 1262 CD1 PHE A 115 -7.833 1.686 11.206 1.00 0.00 C ATOM 1263 CD2 PHE A 115 -6.947 1.262 9.034 1.00 0.00 C ATOM 1264 CE1 PHE A 115 -6.564 1.976 11.670 1.00 0.00 C ATOM 1265 CE2 PHE A 115 -5.675 1.550 9.492 1.00 0.00 C ATOM 1266 CZ PHE A 115 -5.484 1.907 10.813 1.00 0.00 C ATOM 0 H PHE A 115 -9.197 -1.489 8.203 1.00 0.00 H new ATOM 0 HA PHE A 115 -9.849 -0.450 10.899 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -9.423 1.067 8.294 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -10.110 1.775 9.743 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -8.674 1.741 11.882 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -7.091 0.984 8.001 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -6.417 2.256 12.703 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -4.832 1.496 8.819 1.00 0.00 H new ATOM 0 HZ PHE A 115 -4.491 2.132 11.174 1.00 0.00 H new ATOM 1276 N THR A 116 -12.286 -0.252 10.371 1.00 0.00 N ATOM 1277 CA THR A 116 -13.718 -0.367 10.127 1.00 0.00 C ATOM 1278 C THR A 116 -14.243 0.840 9.357 1.00 0.00 C ATOM 1279 O THR A 116 -15.076 0.701 8.461 1.00 0.00 O ATOM 1280 CB THR A 116 -14.504 -0.501 11.445 1.00 0.00 C ATOM 1281 OG1 THR A 116 -14.121 0.540 12.352 1.00 0.00 O ATOM 1282 CG2 THR A 116 -14.255 -1.857 12.088 1.00 0.00 C ATOM 0 H THR A 116 -12.041 0.049 11.314 1.00 0.00 H new ATOM 0 HA THR A 116 -13.865 -1.268 9.531 1.00 0.00 H new ATOM 0 HB THR A 116 -15.567 -0.413 11.219 1.00 0.00 H new ATOM 0 HG1 THR A 116 -14.626 0.449 13.187 1.00 0.00 H new ATOM 0 HG21 THR A 116 -14.820 -1.928 13.017 1.00 0.00 H new ATOM 0 HG22 THR A 116 -14.574 -2.646 11.408 1.00 0.00 H new ATOM 0 HG23 THR A 116 -13.192 -1.969 12.301 1.00 0.00 H new ATOM 1290 N ARG A 117 -13.750 2.022 9.711 1.00 0.00 N ATOM 1291 CA ARG A 117 -14.170 3.253 9.052 1.00 0.00 C ATOM 1292 C ARG A 117 -13.185 3.647 7.956 1.00 0.00 C ATOM 1293 O ARG A 117 -11.985 3.388 8.062 1.00 0.00 O ATOM 1294 CB ARG A 117 -14.295 4.386 10.073 1.00 0.00 C ATOM 1295 CG ARG A 117 -15.677 4.497 10.694 1.00 0.00 C ATOM 1296 CD ARG A 117 -15.885 5.852 11.353 1.00 0.00 C ATOM 1297 NE ARG A 117 -17.289 6.253 11.349 1.00 0.00 N ATOM 1298 CZ ARG A 117 -17.896 6.795 10.299 1.00 0.00 C ATOM 1299 NH1 ARG A 117 -17.224 6.999 9.174 1.00 0.00 N ATOM 1300 NH2 ARG A 117 -19.176 7.133 10.372 1.00 0.00 N ATOM 0 H ARG A 117 -13.060 2.153 10.450 1.00 0.00 H new ATOM 0 HA ARG A 117 -15.143 3.077 8.594 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -13.562 4.233 10.865 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -14.047 5.330 9.588 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -16.435 4.345 9.926 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -15.809 3.707 11.434 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -15.522 5.815 12.380 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -15.292 6.603 10.832 1.00 0.00 H new ATOM 0 HE ARG A 117 -17.834 6.109 12.199 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -16.239 6.740 9.114 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -17.692 7.415 8.369 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -19.696 6.977 11.235 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -19.640 7.549 9.565 1.00 0.00 H new ATOM 1314 N LEU A 118 -13.698 4.275 6.904 1.00 0.00 N ATOM 1315 CA LEU A 118 -12.863 4.705 5.787 1.00 0.00 C ATOM 1316 C LEU A 118 -11.973 5.875 6.192 1.00 0.00 C ATOM 1317 O LEU A 118 -10.757 5.836 6.004 1.00 0.00 O ATOM 1318 CB LEU A 118 -13.736 5.101 4.595 1.00 0.00 C ATOM 1319 CG LEU A 118 -13.061 5.959 3.525 1.00 0.00 C ATOM 1320 CD1 LEU A 118 -11.946 5.182 2.843 1.00 0.00 C ATOM 1321 CD2 LEU A 118 -14.082 6.438 2.503 1.00 0.00 C ATOM 0 H LEU A 118 -14.688 4.498 6.801 1.00 0.00 H new ATOM 0 HA LEU A 118 -12.224 3.870 5.500 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -14.106 4.191 4.123 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -14.605 5.641 4.970 1.00 0.00 H new ATOM 0 HG LEU A 118 -12.624 6.832 4.009 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -11.477 5.809 2.084 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -11.201 4.889 3.583 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -12.359 4.290 2.372 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -13.584 7.047 1.749 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -14.549 5.577 2.024 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -14.846 7.033 3.003 1.00 0.00 H new ATOM 1333 N GLU A 119 -12.587 6.914 6.750 1.00 0.00 N ATOM 1334 CA GLU A 119 -11.849 8.095 7.182 1.00 0.00 C ATOM 1335 C GLU A 119 -10.670 7.705 8.069 1.00 0.00 C ATOM 1336 O GLU A 119 -9.534 8.111 7.824 1.00 0.00 O ATOM 1337 CB GLU A 119 -12.773 9.053 7.936 1.00 0.00 C ATOM 1338 CG GLU A 119 -13.457 10.071 7.039 1.00 0.00 C ATOM 1339 CD GLU A 119 -14.244 11.104 7.823 1.00 0.00 C ATOM 1340 OE1 GLU A 119 -13.635 11.803 8.659 1.00 0.00 O ATOM 1341 OE2 GLU A 119 -15.468 11.212 7.600 1.00 0.00 O ATOM 0 H GLU A 119 -13.593 6.962 6.913 1.00 0.00 H new ATOM 0 HA GLU A 119 -11.464 8.596 6.294 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -13.533 8.474 8.460 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -12.195 9.580 8.695 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -12.707 10.576 6.431 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -14.127 9.553 6.353 1.00 0.00 H new ATOM 1348 N ASP A 120 -10.949 6.915 9.101 1.00 0.00 N ATOM 1349 CA ASP A 120 -9.912 6.469 10.024 1.00 0.00 C ATOM 1350 C ASP A 120 -8.675 5.998 9.267 1.00 0.00 C ATOM 1351 O ASP A 120 -7.547 6.323 9.636 1.00 0.00 O ATOM 1352 CB ASP A 120 -10.442 5.343 10.913 1.00 0.00 C ATOM 1353 CG ASP A 120 -9.457 4.949 11.997 1.00 0.00 C ATOM 1354 OD1 ASP A 120 -8.238 5.098 11.773 1.00 0.00 O ATOM 1355 OD2 ASP A 120 -9.906 4.491 13.069 1.00 0.00 O ATOM 0 H ASP A 120 -11.884 6.571 9.319 1.00 0.00 H new ATOM 0 HA ASP A 120 -9.630 7.315 10.651 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -11.378 5.658 11.374 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -10.667 4.473 10.297 1.00 0.00 H new ATOM 1360 N ALA A 121 -8.895 5.228 8.205 1.00 0.00 N ATOM 1361 CA ALA A 121 -7.799 4.713 7.395 1.00 0.00 C ATOM 1362 C ALA A 121 -7.058 5.844 6.690 1.00 0.00 C ATOM 1363 O ALA A 121 -5.829 5.913 6.726 1.00 0.00 O ATOM 1364 CB ALA A 121 -8.320 3.707 6.380 1.00 0.00 C ATOM 0 H ALA A 121 -9.823 4.948 7.887 1.00 0.00 H new ATOM 0 HA ALA A 121 -7.095 4.211 8.059 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -7.490 3.331 5.782 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -8.797 2.877 6.902 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -9.047 4.191 5.728 1.00 0.00 H new ATOM 1370 N LYS A 122 -7.813 6.729 6.048 1.00 0.00 N ATOM 1371 CA LYS A 122 -7.229 7.858 5.334 1.00 0.00 C ATOM 1372 C LYS A 122 -6.323 8.672 6.251 1.00 0.00 C ATOM 1373 O LYS A 122 -5.223 9.067 5.864 1.00 0.00 O ATOM 1374 CB LYS A 122 -8.332 8.752 4.763 1.00 0.00 C ATOM 1375 CG LYS A 122 -9.357 8.000 3.932 1.00 0.00 C ATOM 1376 CD LYS A 122 -10.506 8.902 3.513 1.00 0.00 C ATOM 1377 CE LYS A 122 -10.237 9.558 2.168 1.00 0.00 C ATOM 1378 NZ LYS A 122 -10.887 10.894 2.063 1.00 0.00 N ATOM 0 H LYS A 122 -8.831 6.686 6.008 1.00 0.00 H new ATOM 0 HA LYS A 122 -6.627 7.466 4.514 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -8.842 9.255 5.585 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -7.877 9.528 4.148 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -8.876 7.587 3.046 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -9.745 7.158 4.506 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -11.426 8.320 3.458 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -10.661 9.671 4.270 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -9.162 9.665 2.025 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -10.602 8.912 1.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -10.680 11.309 1.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -11.916 10.789 2.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -10.520 11.518 2.809 1.00 0.00 H new ATOM 1392 N LYS A 123 -6.792 8.920 7.470 1.00 0.00 N ATOM 1393 CA LYS A 123 -6.023 9.685 8.445 1.00 0.00 C ATOM 1394 C LYS A 123 -4.650 9.060 8.666 1.00 0.00 C ATOM 1395 O LYS A 123 -3.629 9.745 8.605 1.00 0.00 O ATOM 1396 CB LYS A 123 -6.780 9.764 9.773 1.00 0.00 C ATOM 1397 CG LYS A 123 -8.078 10.549 9.688 1.00 0.00 C ATOM 1398 CD LYS A 123 -8.946 10.324 10.914 1.00 0.00 C ATOM 1399 CE LYS A 123 -8.404 11.067 12.125 1.00 0.00 C ATOM 1400 NZ LYS A 123 -8.595 12.539 12.004 1.00 0.00 N ATOM 0 H LYS A 123 -7.701 8.602 7.806 1.00 0.00 H new ATOM 0 HA LYS A 123 -5.885 10.692 8.052 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -6.998 8.753 10.118 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -6.135 10.224 10.522 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -7.856 11.611 9.588 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -8.626 10.252 8.794 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -9.963 10.657 10.707 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -8.998 9.258 11.133 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -8.904 10.709 13.025 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -7.343 10.847 12.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -8.437 12.987 12.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -7.918 12.921 11.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -9.564 12.738 11.685 1.00 0.00 H new ATOM 1414 N ASP A 124 -4.632 7.757 8.922 1.00 0.00 N ATOM 1415 CA ASP A 124 -3.384 7.039 9.150 1.00 0.00 C ATOM 1416 C ASP A 124 -2.491 7.096 7.915 1.00 0.00 C ATOM 1417 O ASP A 124 -1.287 7.336 8.016 1.00 0.00 O ATOM 1418 CB ASP A 124 -3.668 5.583 9.522 1.00 0.00 C ATOM 1419 CG ASP A 124 -2.469 4.901 10.152 1.00 0.00 C ATOM 1420 OD1 ASP A 124 -1.362 5.004 9.583 1.00 0.00 O ATOM 1421 OD2 ASP A 124 -2.638 4.265 11.213 1.00 0.00 O ATOM 0 H ASP A 124 -5.468 7.176 8.977 1.00 0.00 H new ATOM 0 HA ASP A 124 -2.862 7.522 9.977 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -4.509 5.546 10.215 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -3.966 5.034 8.629 1.00 0.00 H new ATOM 1426 N PHE A 125 -3.087 6.873 6.748 1.00 0.00 N ATOM 1427 CA PHE A 125 -2.346 6.897 5.493 1.00 0.00 C ATOM 1428 C PHE A 125 -1.699 8.261 5.269 1.00 0.00 C ATOM 1429 O PHE A 125 -0.481 8.367 5.136 1.00 0.00 O ATOM 1430 CB PHE A 125 -3.272 6.561 4.322 1.00 0.00 C ATOM 1431 CG PHE A 125 -2.583 6.579 2.988 1.00 0.00 C ATOM 1432 CD1 PHE A 125 -2.098 7.764 2.459 1.00 0.00 C ATOM 1433 CD2 PHE A 125 -2.418 5.410 2.263 1.00 0.00 C ATOM 1434 CE1 PHE A 125 -1.464 7.783 1.232 1.00 0.00 C ATOM 1435 CE2 PHE A 125 -1.785 5.422 1.035 1.00 0.00 C ATOM 1436 CZ PHE A 125 -1.306 6.610 0.519 1.00 0.00 C ATOM 0 H PHE A 125 -4.082 6.673 6.646 1.00 0.00 H new ATOM 0 HA PHE A 125 -1.558 6.146 5.551 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -3.706 5.574 4.484 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -4.097 7.273 4.306 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -2.217 8.684 3.012 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -2.789 4.478 2.663 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -1.092 8.714 0.830 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -1.665 4.504 0.479 1.00 0.00 H new ATOM 0 HZ PHE A 125 -0.809 6.622 -0.440 1.00 0.00 H new ATOM 1446 N GLU A 126 -2.526 9.302 5.229 1.00 0.00 N ATOM 1447 CA GLU A 126 -2.034 10.659 5.021 1.00 0.00 C ATOM 1448 C GLU A 126 -1.107 11.082 6.156 1.00 0.00 C ATOM 1449 O GLU A 126 -0.092 11.743 5.931 1.00 0.00 O ATOM 1450 CB GLU A 126 -3.205 11.638 4.912 1.00 0.00 C ATOM 1451 CG GLU A 126 -3.756 11.773 3.502 1.00 0.00 C ATOM 1452 CD GLU A 126 -4.900 12.764 3.415 1.00 0.00 C ATOM 1453 OE1 GLU A 126 -5.971 12.485 3.995 1.00 0.00 O ATOM 1454 OE2 GLU A 126 -4.726 13.818 2.768 1.00 0.00 O ATOM 0 H GLU A 126 -3.538 9.231 5.338 1.00 0.00 H new ATOM 0 HA GLU A 126 -1.469 10.674 4.089 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -4.005 11.310 5.576 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -2.882 12.618 5.262 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -2.956 12.088 2.832 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -4.098 10.798 3.155 1.00 0.00 H new ATOM 1461 N LYS A 127 -1.463 10.698 7.377 1.00 0.00 N ATOM 1462 CA LYS A 127 -0.664 11.037 8.549 1.00 0.00 C ATOM 1463 C LYS A 127 0.771 10.545 8.390 1.00 0.00 C ATOM 1464 O LYS A 127 1.720 11.320 8.507 1.00 0.00 O ATOM 1465 CB LYS A 127 -1.286 10.428 9.808 1.00 0.00 C ATOM 1466 CG LYS A 127 -0.481 10.687 11.070 1.00 0.00 C ATOM 1467 CD LYS A 127 0.534 9.584 11.320 1.00 0.00 C ATOM 1468 CE LYS A 127 -0.084 8.421 12.081 1.00 0.00 C ATOM 1469 NZ LYS A 127 -0.086 8.658 13.551 1.00 0.00 N ATOM 0 H LYS A 127 -2.300 10.152 7.581 1.00 0.00 H new ATOM 0 HA LYS A 127 -0.649 12.123 8.646 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -2.290 10.831 9.938 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -1.390 9.352 9.668 1.00 0.00 H new ATOM 0 HG2 LYS A 127 0.034 11.644 10.984 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -1.155 10.763 11.923 1.00 0.00 H new ATOM 0 HD2 LYS A 127 0.929 9.229 10.368 1.00 0.00 H new ATOM 0 HD3 LYS A 127 1.376 9.984 11.885 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -1.106 8.264 11.737 1.00 0.00 H new ATOM 0 HE3 LYS A 127 0.470 7.508 11.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -0.515 7.843 14.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 0.891 8.782 13.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -0.636 9.515 13.764 1.00 0.00 H new ATOM 1483 N LYS A 128 0.922 9.253 8.121 1.00 0.00 N ATOM 1484 CA LYS A 128 2.241 8.657 7.943 1.00 0.00 C ATOM 1485 C LYS A 128 3.000 9.345 6.812 1.00 0.00 C ATOM 1486 O LYS A 128 4.126 9.808 6.999 1.00 0.00 O ATOM 1487 CB LYS A 128 2.113 7.161 7.649 1.00 0.00 C ATOM 1488 CG LYS A 128 3.448 6.455 7.490 1.00 0.00 C ATOM 1489 CD LYS A 128 4.210 6.400 8.804 1.00 0.00 C ATOM 1490 CE LYS A 128 3.666 5.313 9.718 1.00 0.00 C ATOM 1491 NZ LYS A 128 4.724 4.754 10.604 1.00 0.00 N ATOM 0 H LYS A 128 0.147 8.598 8.021 1.00 0.00 H new ATOM 0 HA LYS A 128 2.801 8.792 8.868 1.00 0.00 H new ATOM 0 HB2 LYS A 128 1.555 6.687 8.457 1.00 0.00 H new ATOM 0 HB3 LYS A 128 1.530 7.027 6.738 1.00 0.00 H new ATOM 0 HG2 LYS A 128 3.284 5.443 7.121 1.00 0.00 H new ATOM 0 HG3 LYS A 128 4.048 6.973 6.742 1.00 0.00 H new ATOM 0 HD2 LYS A 128 5.266 6.216 8.606 1.00 0.00 H new ATOM 0 HD3 LYS A 128 4.143 7.366 9.305 1.00 0.00 H new ATOM 0 HE2 LYS A 128 2.860 5.721 10.328 1.00 0.00 H new ATOM 0 HE3 LYS A 128 3.237 4.513 9.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 4.296 4.436 11.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 5.182 3.948 10.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 5.434 5.488 10.802 1.00 0.00 H new ATOM 1505 N PHE A 129 2.377 9.410 5.641 1.00 0.00 N ATOM 1506 CA PHE A 129 2.993 10.042 4.480 1.00 0.00 C ATOM 1507 C PHE A 129 3.364 11.491 4.783 1.00 0.00 C ATOM 1508 O PHE A 129 4.540 11.853 4.793 1.00 0.00 O ATOM 1509 CB PHE A 129 2.047 9.986 3.279 1.00 0.00 C ATOM 1510 CG PHE A 129 2.410 10.948 2.185 1.00 0.00 C ATOM 1511 CD1 PHE A 129 3.274 10.568 1.169 1.00 0.00 C ATOM 1512 CD2 PHE A 129 1.888 12.231 2.170 1.00 0.00 C ATOM 1513 CE1 PHE A 129 3.610 11.452 0.161 1.00 0.00 C ATOM 1514 CE2 PHE A 129 2.221 13.119 1.164 1.00 0.00 C ATOM 1515 CZ PHE A 129 3.082 12.728 0.158 1.00 0.00 C ATOM 0 H PHE A 129 1.445 9.032 5.470 1.00 0.00 H new ATOM 0 HA PHE A 129 3.904 9.494 4.241 1.00 0.00 H new ATOM 0 HB2 PHE A 129 2.045 8.973 2.875 1.00 0.00 H new ATOM 0 HB3 PHE A 129 1.032 10.197 3.616 1.00 0.00 H new ATOM 0 HD1 PHE A 129 3.689 9.571 1.165 1.00 0.00 H new ATOM 0 HD2 PHE A 129 1.213 12.541 2.954 1.00 0.00 H new ATOM 0 HE1 PHE A 129 4.285 11.145 -0.624 1.00 0.00 H new ATOM 0 HE2 PHE A 129 1.808 14.117 1.165 1.00 0.00 H new ATOM 0 HZ PHE A 129 3.342 13.419 -0.630 1.00 0.00 H new ATOM 1525 N ARG A 130 2.351 12.316 5.029 1.00 0.00 N ATOM 1526 CA ARG A 130 2.569 13.725 5.330 1.00 0.00 C ATOM 1527 C ARG A 130 3.574 13.890 6.466 1.00 0.00 C ATOM 1528 O ARG A 130 4.118 14.973 6.674 1.00 0.00 O ATOM 1529 CB ARG A 130 1.247 14.399 5.702 1.00 0.00 C ATOM 1530 CG ARG A 130 1.418 15.785 6.303 1.00 0.00 C ATOM 1531 CD ARG A 130 0.207 16.663 6.032 1.00 0.00 C ATOM 1532 NE ARG A 130 0.021 17.674 7.070 1.00 0.00 N ATOM 1533 CZ ARG A 130 0.794 18.747 7.198 1.00 0.00 C ATOM 1534 NH1 ARG A 130 1.800 18.947 6.358 1.00 0.00 N ATOM 1535 NH2 ARG A 130 0.561 19.622 8.168 1.00 0.00 N ATOM 0 H ARG A 130 1.371 12.032 5.026 1.00 0.00 H new ATOM 0 HA ARG A 130 2.974 14.203 4.438 1.00 0.00 H new ATOM 0 HB2 ARG A 130 0.623 14.473 4.811 1.00 0.00 H new ATOM 0 HB3 ARG A 130 0.714 13.767 6.413 1.00 0.00 H new ATOM 0 HG2 ARG A 130 1.574 15.700 7.378 1.00 0.00 H new ATOM 0 HG3 ARG A 130 2.310 16.255 5.888 1.00 0.00 H new ATOM 0 HD2 ARG A 130 0.323 17.153 5.065 1.00 0.00 H new ATOM 0 HD3 ARG A 130 -0.685 16.040 5.968 1.00 0.00 H new ATOM 0 HE ARG A 130 -0.744 17.549 7.733 1.00 0.00 H new ATOM 0 HH11 ARG A 130 1.982 18.276 5.611 1.00 0.00 H new ATOM 0 HH12 ARG A 130 2.392 19.772 6.458 1.00 0.00 H new ATOM 0 HH21 ARG A 130 -0.212 19.471 8.816 1.00 0.00 H new ATOM 0 HH22 ARG A 130 1.155 20.445 8.266 1.00 0.00 H new ATOM 1549 N GLU A 131 3.814 12.806 7.198 1.00 0.00 N ATOM 1550 CA GLU A 131 4.753 12.831 8.313 1.00 0.00 C ATOM 1551 C GLU A 131 6.157 12.454 7.852 1.00 0.00 C ATOM 1552 O GLU A 131 7.152 12.863 8.451 1.00 0.00 O ATOM 1553 CB GLU A 131 4.293 11.877 9.417 1.00 0.00 C ATOM 1554 CG GLU A 131 3.262 12.482 10.355 1.00 0.00 C ATOM 1555 CD GLU A 131 3.894 13.264 11.490 1.00 0.00 C ATOM 1556 OE1 GLU A 131 4.366 12.629 12.457 1.00 0.00 O ATOM 1557 OE2 GLU A 131 3.916 14.510 11.413 1.00 0.00 O ATOM 0 H GLU A 131 3.372 11.901 7.039 1.00 0.00 H new ATOM 0 HA GLU A 131 4.781 13.847 8.708 1.00 0.00 H new ATOM 0 HB2 GLU A 131 3.874 10.981 8.960 1.00 0.00 H new ATOM 0 HB3 GLU A 131 5.160 11.562 9.998 1.00 0.00 H new ATOM 0 HG2 GLU A 131 2.603 13.140 9.789 1.00 0.00 H new ATOM 0 HG3 GLU A 131 2.641 11.687 10.768 1.00 0.00 H new ATOM 1564 N LYS A 132 6.231 11.670 6.781 1.00 0.00 N ATOM 1565 CA LYS A 132 7.512 11.236 6.237 1.00 0.00 C ATOM 1566 C LYS A 132 7.955 12.147 5.096 1.00 0.00 C ATOM 1567 O LYS A 132 9.134 12.191 4.744 1.00 0.00 O ATOM 1568 CB LYS A 132 7.416 9.791 5.742 1.00 0.00 C ATOM 1569 CG LYS A 132 7.079 8.794 6.837 1.00 0.00 C ATOM 1570 CD LYS A 132 8.297 8.460 7.682 1.00 0.00 C ATOM 1571 CE LYS A 132 8.166 7.092 8.333 1.00 0.00 C ATOM 1572 NZ LYS A 132 9.477 6.581 8.820 1.00 0.00 N ATOM 0 H LYS A 132 5.418 11.322 6.273 1.00 0.00 H new ATOM 0 HA LYS A 132 8.254 11.292 7.033 1.00 0.00 H new ATOM 0 HB2 LYS A 132 6.656 9.733 4.963 1.00 0.00 H new ATOM 0 HB3 LYS A 132 8.364 9.509 5.285 1.00 0.00 H new ATOM 0 HG2 LYS A 132 6.295 9.203 7.474 1.00 0.00 H new ATOM 0 HG3 LYS A 132 6.684 7.882 6.390 1.00 0.00 H new ATOM 0 HD2 LYS A 132 9.191 8.483 7.059 1.00 0.00 H new ATOM 0 HD3 LYS A 132 8.426 9.220 8.453 1.00 0.00 H new ATOM 0 HE2 LYS A 132 7.467 7.152 9.167 1.00 0.00 H new ATOM 0 HE3 LYS A 132 7.746 6.387 7.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 9.440 5.544 8.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 10.226 6.856 8.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 9.681 6.986 9.756 1.00 0.00 H new ATOM 1586 N THR A 133 7.002 12.874 4.521 1.00 0.00 N ATOM 1587 CA THR A 133 7.293 13.784 3.421 1.00 0.00 C ATOM 1588 C THR A 133 7.024 15.231 3.818 1.00 0.00 C ATOM 1589 O THR A 133 7.329 16.158 3.068 1.00 0.00 O ATOM 1590 CB THR A 133 6.458 13.442 2.172 1.00 0.00 C ATOM 1591 OG1 THR A 133 5.071 13.684 2.430 1.00 0.00 O ATOM 1592 CG2 THR A 133 6.658 11.989 1.769 1.00 0.00 C ATOM 0 H THR A 133 6.021 12.850 4.800 1.00 0.00 H new ATOM 0 HA THR A 133 8.351 13.666 3.185 1.00 0.00 H new ATOM 0 HB THR A 133 6.792 14.079 1.353 1.00 0.00 H new ATOM 0 HG1 THR A 133 4.534 13.322 1.695 1.00 0.00 H new ATOM 0 HG21 THR A 133 6.059 11.771 0.885 1.00 0.00 H new ATOM 0 HG22 THR A 133 7.711 11.815 1.546 1.00 0.00 H new ATOM 0 HG23 THR A 133 6.348 11.339 2.587 1.00 0.00 H new ATOM 1600 N LYS A 134 6.450 15.418 5.002 1.00 0.00 N ATOM 1601 CA LYS A 134 6.141 16.752 5.500 1.00 0.00 C ATOM 1602 C LYS A 134 5.358 17.553 4.464 1.00 0.00 C ATOM 1603 O LYS A 134 5.584 18.749 4.290 1.00 0.00 O ATOM 1604 CB LYS A 134 7.429 17.494 5.866 1.00 0.00 C ATOM 1605 CG LYS A 134 8.127 16.931 7.093 1.00 0.00 C ATOM 1606 CD LYS A 134 9.521 17.511 7.256 1.00 0.00 C ATOM 1607 CE LYS A 134 9.473 18.947 7.756 1.00 0.00 C ATOM 1608 NZ LYS A 134 10.817 19.436 8.170 1.00 0.00 N ATOM 0 H LYS A 134 6.190 14.661 5.634 1.00 0.00 H new ATOM 0 HA LYS A 134 5.524 16.645 6.392 1.00 0.00 H new ATOM 0 HB2 LYS A 134 8.114 17.456 5.019 1.00 0.00 H new ATOM 0 HB3 LYS A 134 7.196 18.544 6.040 1.00 0.00 H new ATOM 0 HG2 LYS A 134 7.535 17.149 7.982 1.00 0.00 H new ATOM 0 HG3 LYS A 134 8.191 15.846 7.011 1.00 0.00 H new ATOM 0 HD2 LYS A 134 10.091 16.900 7.956 1.00 0.00 H new ATOM 0 HD3 LYS A 134 10.045 17.475 6.301 1.00 0.00 H new ATOM 0 HE2 LYS A 134 9.078 19.592 6.971 1.00 0.00 H new ATOM 0 HE3 LYS A 134 8.786 19.015 8.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 10.741 20.418 8.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 11.184 18.837 8.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 11.466 19.396 7.359 1.00 0.00 H new ATOM 1622 N ASN A 135 4.437 16.884 3.779 1.00 0.00 N ATOM 1623 CA ASN A 135 3.620 17.533 2.760 1.00 0.00 C ATOM 1624 C ASN A 135 2.251 16.869 2.655 1.00 0.00 C ATOM 1625 O ASN A 135 2.133 15.648 2.754 1.00 0.00 O ATOM 1626 CB ASN A 135 4.327 17.487 1.404 1.00 0.00 C ATOM 1627 CG ASN A 135 5.323 18.617 1.232 1.00 0.00 C ATOM 1628 OD1 ASN A 135 4.967 19.713 0.797 1.00 0.00 O ATOM 1629 ND2 ASN A 135 6.580 18.356 1.573 1.00 0.00 N ATOM 0 H ASN A 135 4.237 15.892 3.911 1.00 0.00 H new ATOM 0 HA ASN A 135 3.478 18.573 3.053 1.00 0.00 H new ATOM 0 HB2 ASN A 135 4.843 16.533 1.299 1.00 0.00 H new ATOM 0 HB3 ASN A 135 3.584 17.537 0.608 1.00 0.00 H new ATOM 0 HD21 ASN A 135 7.294 19.078 1.479 1.00 0.00 H new ATOM 0 HD22 ASN A 135 6.831 17.434 1.929 1.00 0.00 H new ATOM 1636 N ASN A 136 1.219 17.682 2.454 1.00 0.00 N ATOM 1637 CA ASN A 136 -0.143 17.173 2.335 1.00 0.00 C ATOM 1638 C ASN A 136 -0.282 16.268 1.114 1.00 0.00 C ATOM 1639 O ASN A 136 0.260 16.561 0.048 1.00 0.00 O ATOM 1640 CB ASN A 136 -1.136 18.333 2.240 1.00 0.00 C ATOM 1641 CG ASN A 136 -1.142 19.193 3.488 1.00 0.00 C ATOM 1642 OD1 ASN A 136 -0.217 19.137 4.299 1.00 0.00 O ATOM 1643 ND2 ASN A 136 -2.188 19.996 3.649 1.00 0.00 N ATOM 0 H ASN A 136 1.300 18.695 2.370 1.00 0.00 H new ATOM 0 HA ASN A 136 -0.364 16.586 3.226 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -0.887 18.951 1.377 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -2.137 17.937 2.070 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -2.247 20.598 4.470 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -2.932 20.010 2.952 1.00 0.00 H new ATOM 1650 N TRP A 137 -1.010 15.170 1.279 1.00 0.00 N ATOM 1651 CA TRP A 137 -1.221 14.223 0.190 1.00 0.00 C ATOM 1652 C TRP A 137 -2.021 14.862 -0.940 1.00 0.00 C ATOM 1653 O TRP A 137 -1.811 14.553 -2.113 1.00 0.00 O ATOM 1654 CB TRP A 137 -1.945 12.977 0.703 1.00 0.00 C ATOM 1655 CG TRP A 137 -2.155 11.935 -0.354 1.00 0.00 C ATOM 1656 CD1 TRP A 137 -3.280 11.746 -1.105 1.00 0.00 C ATOM 1657 CD2 TRP A 137 -1.217 10.939 -0.774 1.00 0.00 C ATOM 1658 NE1 TRP A 137 -3.097 10.691 -1.967 1.00 0.00 N ATOM 1659 CE2 TRP A 137 -1.839 10.180 -1.784 1.00 0.00 C ATOM 1660 CE3 TRP A 137 0.089 10.616 -0.397 1.00 0.00 C ATOM 1661 CZ2 TRP A 137 -1.200 9.119 -2.419 1.00 0.00 C ATOM 1662 CZ3 TRP A 137 0.723 9.562 -1.028 1.00 0.00 C ATOM 1663 CH2 TRP A 137 0.079 8.824 -2.030 1.00 0.00 C ATOM 0 H TRP A 137 -1.464 14.913 2.156 1.00 0.00 H new ATOM 0 HA TRP A 137 -0.245 13.933 -0.200 1.00 0.00 H new ATOM 0 HB2 TRP A 137 -1.371 12.543 1.522 1.00 0.00 H new ATOM 0 HB3 TRP A 137 -2.912 13.270 1.112 1.00 0.00 H new ATOM 0 HD1 TRP A 137 -4.180 12.338 -1.032 1.00 0.00 H new ATOM 0 HE1 TRP A 137 -3.786 10.345 -2.635 1.00 0.00 H new ATOM 0 HE3 TRP A 137 0.594 11.180 0.373 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 -1.695 8.549 -3.191 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 1.732 9.303 -0.744 1.00 0.00 H new ATOM 0 HH2 TRP A 137 0.602 8.007 -2.505 1.00 0.00 H new ATOM 1674 N ALA A 138 -2.938 15.753 -0.580 1.00 0.00 N ATOM 1675 CA ALA A 138 -3.768 16.436 -1.565 1.00 0.00 C ATOM 1676 C ALA A 138 -2.957 17.464 -2.347 1.00 0.00 C ATOM 1677 O ALA A 138 -3.151 17.635 -3.550 1.00 0.00 O ATOM 1678 CB ALA A 138 -4.953 17.104 -0.884 1.00 0.00 C ATOM 0 H ALA A 138 -3.125 16.019 0.387 1.00 0.00 H new ATOM 0 HA ALA A 138 -4.140 15.692 -2.270 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -5.564 17.610 -1.631 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -5.553 16.350 -0.375 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -4.592 17.832 -0.157 1.00 0.00 H new ATOM 1684 N GLU A 139 -2.049 18.146 -1.655 1.00 0.00 N ATOM 1685 CA GLU A 139 -1.211 19.158 -2.287 1.00 0.00 C ATOM 1686 C GLU A 139 0.100 18.550 -2.776 1.00 0.00 C ATOM 1687 O GLU A 139 1.149 19.194 -2.735 1.00 0.00 O ATOM 1688 CB GLU A 139 -0.923 20.298 -1.307 1.00 0.00 C ATOM 1689 CG GLU A 139 -2.172 20.882 -0.668 1.00 0.00 C ATOM 1690 CD GLU A 139 -1.985 22.321 -0.230 1.00 0.00 C ATOM 1691 OE1 GLU A 139 -1.367 22.543 0.832 1.00 0.00 O ATOM 1692 OE2 GLU A 139 -2.456 23.226 -0.950 1.00 0.00 O ATOM 0 H GLU A 139 -1.875 18.016 -0.658 1.00 0.00 H new ATOM 0 HA GLU A 139 -1.751 19.555 -3.147 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -0.261 19.933 -0.522 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -0.389 21.090 -1.831 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -2.998 20.826 -1.377 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -2.451 20.277 0.195 1.00 0.00 H new ATOM 1699 N ARG A 140 0.033 17.306 -3.239 1.00 0.00 N ATOM 1700 CA ARG A 140 1.214 16.610 -3.735 1.00 0.00 C ATOM 1701 C ARG A 140 1.842 17.368 -4.901 1.00 0.00 C ATOM 1702 O ARG A 140 3.018 17.182 -5.214 1.00 0.00 O ATOM 1703 CB ARG A 140 0.849 15.190 -4.172 1.00 0.00 C ATOM 1704 CG ARG A 140 -0.081 15.143 -5.373 1.00 0.00 C ATOM 1705 CD ARG A 140 -0.962 13.904 -5.347 1.00 0.00 C ATOM 1706 NE ARG A 140 -1.913 13.885 -6.456 1.00 0.00 N ATOM 1707 CZ ARG A 140 -1.604 13.475 -7.681 1.00 0.00 C ATOM 1708 NH1 ARG A 140 -0.377 13.052 -7.953 1.00 0.00 N ATOM 1709 NH2 ARG A 140 -2.524 13.486 -8.637 1.00 0.00 N ATOM 0 H ARG A 140 -0.827 16.759 -3.281 1.00 0.00 H new ATOM 0 HA ARG A 140 1.941 16.557 -2.925 1.00 0.00 H new ATOM 0 HB2 ARG A 140 1.763 14.646 -4.409 1.00 0.00 H new ATOM 0 HB3 ARG A 140 0.377 14.672 -3.337 1.00 0.00 H new ATOM 0 HG2 ARG A 140 -0.707 16.035 -5.385 1.00 0.00 H new ATOM 0 HG3 ARG A 140 0.507 15.153 -6.291 1.00 0.00 H new ATOM 0 HD2 ARG A 140 -0.336 13.013 -5.391 1.00 0.00 H new ATOM 0 HD3 ARG A 140 -1.505 13.865 -4.403 1.00 0.00 H new ATOM 0 HE ARG A 140 -2.866 14.204 -6.280 1.00 0.00 H new ATOM 0 HH11 ARG A 140 0.333 13.041 -7.220 1.00 0.00 H new ATOM 0 HH12 ARG A 140 -0.143 12.738 -8.895 1.00 0.00 H new ATOM 0 HH21 ARG A 140 -3.469 13.809 -8.431 1.00 0.00 H new ATOM 0 HH22 ARG A 140 -2.286 13.171 -9.577 1.00 0.00 H new ATOM 1723 N ASP A 141 1.049 18.221 -5.541 1.00 0.00 N ATOM 1724 CA ASP A 141 1.527 19.007 -6.672 1.00 0.00 C ATOM 1725 C ASP A 141 2.795 19.772 -6.306 1.00 0.00 C ATOM 1726 O ASP A 141 3.766 19.784 -7.063 1.00 0.00 O ATOM 1727 CB ASP A 141 0.444 19.982 -7.137 1.00 0.00 C ATOM 1728 CG ASP A 141 0.896 20.836 -8.305 1.00 0.00 C ATOM 1729 OD1 ASP A 141 1.646 20.321 -9.162 1.00 0.00 O ATOM 1730 OD2 ASP A 141 0.501 22.019 -8.363 1.00 0.00 O ATOM 0 H ASP A 141 0.073 18.385 -5.296 1.00 0.00 H new ATOM 0 HA ASP A 141 1.761 18.321 -7.486 1.00 0.00 H new ATOM 0 HB2 ASP A 141 -0.446 19.422 -7.423 1.00 0.00 H new ATOM 0 HB3 ASP A 141 0.160 20.628 -6.306 1.00 0.00 H new ATOM 1735 N HIS A 142 2.778 20.410 -5.140 1.00 0.00 N ATOM 1736 CA HIS A 142 3.927 21.179 -4.673 1.00 0.00 C ATOM 1737 C HIS A 142 4.756 20.368 -3.682 1.00 0.00 C ATOM 1738 O HIS A 142 5.228 20.896 -2.674 1.00 0.00 O ATOM 1739 CB HIS A 142 3.464 22.483 -4.022 1.00 0.00 C ATOM 1740 CG HIS A 142 2.690 22.279 -2.756 1.00 0.00 C ATOM 1741 ND1 HIS A 142 2.550 21.185 -1.971 1.00 0.00 N flip ATOM 1742 CD2 HIS A 142 1.943 23.274 -2.163 1.00 0.00 C flip ATOM 1743 CE1 HIS A 142 1.729 21.536 -0.927 1.00 0.00 C flip ATOM 1744 NE2 HIS A 142 1.377 22.802 -1.066 1.00 0.00 N flip ATOM 0 H HIS A 142 1.982 20.410 -4.502 1.00 0.00 H new ATOM 0 HA HIS A 142 4.551 21.414 -5.535 1.00 0.00 H new ATOM 0 HB2 HIS A 142 4.335 23.103 -3.810 1.00 0.00 H new ATOM 0 HB3 HIS A 142 2.846 23.034 -4.731 1.00 0.00 H new ATOM 0 HD2 HIS A 142 1.837 24.282 -2.536 1.00 0.00 H new ATOM 0 HE1 HIS A 142 1.421 20.883 -0.123 1.00 0.00 H new ATOM 0 HE2 HIS A 142 0.771 23.326 -0.434 1.00 0.00 H new ATOM 1752 N PHE A 143 4.928 19.083 -3.973 1.00 0.00 N ATOM 1753 CA PHE A 143 5.699 18.199 -3.107 1.00 0.00 C ATOM 1754 C PHE A 143 7.118 18.727 -2.915 1.00 0.00 C ATOM 1755 O PHE A 143 7.921 18.736 -3.848 1.00 0.00 O ATOM 1756 CB PHE A 143 5.743 16.787 -3.693 1.00 0.00 C ATOM 1757 CG PHE A 143 6.454 15.796 -2.816 1.00 0.00 C ATOM 1758 CD1 PHE A 143 7.822 15.605 -2.932 1.00 0.00 C ATOM 1759 CD2 PHE A 143 5.755 15.055 -1.877 1.00 0.00 C ATOM 1760 CE1 PHE A 143 8.479 14.694 -2.126 1.00 0.00 C ATOM 1761 CE2 PHE A 143 6.407 14.143 -1.069 1.00 0.00 C ATOM 1762 CZ PHE A 143 7.770 13.961 -1.194 1.00 0.00 C ATOM 0 H PHE A 143 4.544 18.630 -4.802 1.00 0.00 H new ATOM 0 HA PHE A 143 5.208 18.166 -2.134 1.00 0.00 H new ATOM 0 HB2 PHE A 143 4.724 16.442 -3.865 1.00 0.00 H new ATOM 0 HB3 PHE A 143 6.237 16.820 -4.664 1.00 0.00 H new ATOM 0 HD1 PHE A 143 8.381 16.174 -3.660 1.00 0.00 H new ATOM 0 HD2 PHE A 143 4.689 15.192 -1.775 1.00 0.00 H new ATOM 0 HE1 PHE A 143 9.546 14.555 -2.225 1.00 0.00 H new ATOM 0 HE2 PHE A 143 5.851 13.573 -0.340 1.00 0.00 H new ATOM 0 HZ PHE A 143 8.281 13.247 -0.565 1.00 0.00 H new ATOM 1772 N VAL A 144 7.420 19.167 -1.697 1.00 0.00 N ATOM 1773 CA VAL A 144 8.741 19.696 -1.382 1.00 0.00 C ATOM 1774 C VAL A 144 9.611 18.639 -0.711 1.00 0.00 C ATOM 1775 O VAL A 144 9.370 18.258 0.435 1.00 0.00 O ATOM 1776 CB VAL A 144 8.647 20.928 -0.461 1.00 0.00 C ATOM 1777 CG1 VAL A 144 10.036 21.433 -0.102 1.00 0.00 C ATOM 1778 CG2 VAL A 144 7.826 22.025 -1.121 1.00 0.00 C ATOM 0 H VAL A 144 6.767 19.167 -0.913 1.00 0.00 H new ATOM 0 HA VAL A 144 9.197 19.991 -2.327 1.00 0.00 H new ATOM 0 HB VAL A 144 8.144 20.634 0.460 1.00 0.00 H new ATOM 0 HG11 VAL A 144 9.950 22.303 0.549 1.00 0.00 H new ATOM 0 HG12 VAL A 144 10.587 20.647 0.414 1.00 0.00 H new ATOM 0 HG13 VAL A 144 10.568 21.711 -1.012 1.00 0.00 H new ATOM 0 HG21 VAL A 144 7.770 22.887 -0.457 1.00 0.00 H new ATOM 0 HG22 VAL A 144 8.298 22.319 -2.058 1.00 0.00 H new ATOM 0 HG23 VAL A 144 6.820 21.656 -1.322 1.00 0.00 H new ATOM 1788 N SER A 145 10.623 18.168 -1.433 1.00 0.00 N ATOM 1789 CA SER A 145 11.528 17.152 -0.909 1.00 0.00 C ATOM 1790 C SER A 145 12.562 17.773 0.025 1.00 0.00 C ATOM 1791 O SER A 145 13.559 18.340 -0.424 1.00 0.00 O ATOM 1792 CB SER A 145 12.232 16.425 -2.056 1.00 0.00 C ATOM 1793 OG SER A 145 13.007 17.324 -2.830 1.00 0.00 O ATOM 0 H SER A 145 10.837 18.474 -2.382 1.00 0.00 H new ATOM 0 HA SER A 145 10.937 16.434 -0.341 1.00 0.00 H new ATOM 0 HB2 SER A 145 12.873 15.640 -1.654 1.00 0.00 H new ATOM 0 HB3 SER A 145 11.492 15.938 -2.691 1.00 0.00 H new ATOM 0 HG SER A 145 13.448 17.969 -2.238 1.00 0.00 H new ATOM 1799 N HIS A 146 12.317 17.663 1.327 1.00 0.00 N ATOM 1800 CA HIS A 146 13.226 18.214 2.325 1.00 0.00 C ATOM 1801 C HIS A 146 14.393 17.264 2.580 1.00 0.00 C ATOM 1802 O HIS A 146 14.240 16.043 2.589 1.00 0.00 O ATOM 1803 CB HIS A 146 12.479 18.485 3.632 1.00 0.00 C ATOM 1804 CG HIS A 146 11.123 19.087 3.432 1.00 0.00 C ATOM 1805 ND1 HIS A 146 10.853 20.422 3.645 1.00 0.00 N ATOM 1806 CD2 HIS A 146 9.955 18.527 3.036 1.00 0.00 C ATOM 1807 CE1 HIS A 146 9.578 20.658 3.389 1.00 0.00 C ATOM 1808 NE2 HIS A 146 9.011 19.524 3.017 1.00 0.00 N ATOM 0 H HIS A 146 11.497 17.197 1.715 1.00 0.00 H new ATOM 0 HA HIS A 146 13.622 19.154 1.940 1.00 0.00 H new ATOM 0 HB2 HIS A 146 12.375 17.550 4.182 1.00 0.00 H new ATOM 0 HB3 HIS A 146 13.077 19.154 4.251 1.00 0.00 H new ATOM 0 HD1 HIS A 146 11.531 21.119 3.952 1.00 0.00 H new ATOM 0 HD2 HIS A 146 9.796 17.489 2.782 1.00 0.00 H new ATOM 0 HE1 HIS A 146 9.084 21.615 3.470 1.00 0.00 H new ATOM 1816 N PRO A 147 15.587 17.837 2.790 1.00 0.00 N ATOM 1817 CA PRO A 147 16.803 17.060 3.048 1.00 0.00 C ATOM 1818 C PRO A 147 16.779 16.381 4.413 1.00 0.00 C ATOM 1819 O PRO A 147 16.771 17.047 5.448 1.00 0.00 O ATOM 1820 CB PRO A 147 17.915 18.111 2.993 1.00 0.00 C ATOM 1821 CG PRO A 147 17.240 19.394 3.339 1.00 0.00 C ATOM 1822 CD PRO A 147 15.843 19.287 2.792 1.00 0.00 C ATOM 0 HA PRO A 147 16.928 16.250 2.330 1.00 0.00 H new ATOM 0 HB2 PRO A 147 18.713 17.880 3.699 1.00 0.00 H new ATOM 0 HB3 PRO A 147 18.368 18.156 2.003 1.00 0.00 H new ATOM 0 HG2 PRO A 147 17.226 19.549 4.418 1.00 0.00 H new ATOM 0 HG3 PRO A 147 17.766 20.242 2.902 1.00 0.00 H new ATOM 0 HD2 PRO A 147 15.126 19.821 3.415 1.00 0.00 H new ATOM 0 HD3 PRO A 147 15.771 19.709 1.790 1.00 0.00 H new ATOM 1830 N GLY A 148 16.767 15.052 4.408 1.00 0.00 N ATOM 1831 CA GLY A 148 16.744 14.305 5.653 1.00 0.00 C ATOM 1832 C GLY A 148 15.515 13.428 5.780 1.00 0.00 C ATOM 1833 O GLY A 148 15.593 12.304 6.275 1.00 0.00 O ATOM 0 H GLY A 148 16.773 14.479 3.564 1.00 0.00 H new ATOM 0 HA2 GLY A 148 17.638 13.684 5.717 1.00 0.00 H new ATOM 0 HA3 GLY A 148 16.778 15.001 6.491 1.00 0.00 H new ATOM 1837 N LYS A 149 14.374 13.944 5.334 1.00 0.00 N ATOM 1838 CA LYS A 149 13.121 13.201 5.400 1.00 0.00 C ATOM 1839 C LYS A 149 12.990 12.247 4.217 1.00 0.00 C ATOM 1840 O LYS A 149 13.880 12.169 3.370 1.00 0.00 O ATOM 1841 CB LYS A 149 11.933 14.165 5.425 1.00 0.00 C ATOM 1842 CG LYS A 149 11.902 15.061 6.652 1.00 0.00 C ATOM 1843 CD LYS A 149 11.540 14.280 7.904 1.00 0.00 C ATOM 1844 CE LYS A 149 10.034 14.113 8.040 1.00 0.00 C ATOM 1845 NZ LYS A 149 9.681 12.975 8.933 1.00 0.00 N ATOM 0 H LYS A 149 14.292 14.874 4.923 1.00 0.00 H new ATOM 0 HA LYS A 149 13.124 12.614 6.318 1.00 0.00 H new ATOM 0 HB2 LYS A 149 11.963 14.788 4.531 1.00 0.00 H new ATOM 0 HB3 LYS A 149 11.008 13.590 5.382 1.00 0.00 H new ATOM 0 HG2 LYS A 149 12.876 15.532 6.785 1.00 0.00 H new ATOM 0 HG3 LYS A 149 11.179 15.862 6.500 1.00 0.00 H new ATOM 0 HD2 LYS A 149 12.015 13.299 7.872 1.00 0.00 H new ATOM 0 HD3 LYS A 149 11.931 14.795 8.781 1.00 0.00 H new ATOM 0 HE2 LYS A 149 9.601 15.032 8.434 1.00 0.00 H new ATOM 0 HE3 LYS A 149 9.596 13.951 7.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 8.650 12.841 8.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 10.143 12.109 8.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 10.003 13.180 9.900 1.00 0.00 H new ATOM 1859 N TYR A 150 11.876 11.526 4.164 1.00 0.00 N ATOM 1860 CA TYR A 150 11.630 10.578 3.085 1.00 0.00 C ATOM 1861 C TYR A 150 11.304 11.305 1.784 1.00 0.00 C ATOM 1862 O TYR A 150 10.923 12.476 1.791 1.00 0.00 O ATOM 1863 CB TYR A 150 10.483 9.636 3.457 1.00 0.00 C ATOM 1864 CG TYR A 150 10.901 8.502 4.365 1.00 0.00 C ATOM 1865 CD1 TYR A 150 11.160 8.725 5.712 1.00 0.00 C ATOM 1866 CD2 TYR A 150 11.039 7.209 3.877 1.00 0.00 C ATOM 1867 CE1 TYR A 150 11.543 7.692 6.546 1.00 0.00 C ATOM 1868 CE2 TYR A 150 11.420 6.170 4.703 1.00 0.00 C ATOM 1869 CZ TYR A 150 11.671 6.416 6.037 1.00 0.00 C ATOM 1870 OH TYR A 150 12.053 5.384 6.864 1.00 0.00 O ATOM 0 H TYR A 150 11.129 11.580 4.856 1.00 0.00 H new ATOM 0 HA TYR A 150 12.538 9.994 2.936 1.00 0.00 H new ATOM 0 HB2 TYR A 150 9.696 10.211 3.946 1.00 0.00 H new ATOM 0 HB3 TYR A 150 10.055 9.221 2.545 1.00 0.00 H new ATOM 0 HD1 TYR A 150 11.060 9.723 6.114 1.00 0.00 H new ATOM 0 HD2 TYR A 150 10.845 7.013 2.833 1.00 0.00 H new ATOM 0 HE1 TYR A 150 11.741 7.882 7.590 1.00 0.00 H new ATOM 0 HE2 TYR A 150 11.521 5.170 4.307 1.00 0.00 H new ATOM 0 HH TYR A 150 12.095 4.551 6.350 1.00 0.00 H new ATOM 1880 N THR A 151 11.455 10.602 0.666 1.00 0.00 N ATOM 1881 CA THR A 151 11.178 11.178 -0.643 1.00 0.00 C ATOM 1882 C THR A 151 10.034 10.447 -1.335 1.00 0.00 C ATOM 1883 O THR A 151 9.703 9.314 -0.981 1.00 0.00 O ATOM 1884 CB THR A 151 12.422 11.136 -1.551 1.00 0.00 C ATOM 1885 OG1 THR A 151 13.022 9.837 -1.499 1.00 0.00 O ATOM 1886 CG2 THR A 151 13.438 12.186 -1.126 1.00 0.00 C ATOM 0 H THR A 151 11.768 9.632 0.642 1.00 0.00 H new ATOM 0 HA THR A 151 10.894 12.217 -0.476 1.00 0.00 H new ATOM 0 HB THR A 151 12.107 11.350 -2.572 1.00 0.00 H new ATOM 0 HG1 THR A 151 13.811 9.818 -2.080 1.00 0.00 H new ATOM 0 HG21 THR A 151 14.308 12.137 -1.781 1.00 0.00 H new ATOM 0 HG22 THR A 151 12.988 13.176 -1.194 1.00 0.00 H new ATOM 0 HG23 THR A 151 13.748 11.998 -0.098 1.00 0.00 H new ATOM 1894 N LEU A 152 9.432 11.099 -2.324 1.00 0.00 N ATOM 1895 CA LEU A 152 8.324 10.510 -3.067 1.00 0.00 C ATOM 1896 C LEU A 152 8.786 10.020 -4.436 1.00 0.00 C ATOM 1897 O LEU A 152 9.051 10.818 -5.335 1.00 0.00 O ATOM 1898 CB LEU A 152 7.195 11.529 -3.232 1.00 0.00 C ATOM 1899 CG LEU A 152 6.087 11.150 -4.215 1.00 0.00 C ATOM 1900 CD1 LEU A 152 5.381 9.882 -3.760 1.00 0.00 C ATOM 1901 CD2 LEU A 152 5.093 12.293 -4.363 1.00 0.00 C ATOM 0 H LEU A 152 9.693 12.036 -2.630 1.00 0.00 H new ATOM 0 HA LEU A 152 7.953 9.655 -2.501 1.00 0.00 H new ATOM 0 HB2 LEU A 152 6.743 11.702 -2.255 1.00 0.00 H new ATOM 0 HB3 LEU A 152 7.631 12.475 -3.554 1.00 0.00 H new ATOM 0 HG LEU A 152 6.539 10.960 -5.188 1.00 0.00 H new ATOM 0 HD11 LEU A 152 4.596 9.628 -4.472 1.00 0.00 H new ATOM 0 HD12 LEU A 152 6.100 9.065 -3.706 1.00 0.00 H new ATOM 0 HD13 LEU A 152 4.941 10.044 -2.776 1.00 0.00 H new ATOM 0 HD21 LEU A 152 4.311 12.006 -5.066 1.00 0.00 H new ATOM 0 HD22 LEU A 152 4.646 12.514 -3.394 1.00 0.00 H new ATOM 0 HD23 LEU A 152 5.609 13.178 -4.735 1.00 0.00 H new ATOM 1913 N ILE A 153 8.877 8.703 -4.587 1.00 0.00 N ATOM 1914 CA ILE A 153 9.303 8.107 -5.847 1.00 0.00 C ATOM 1915 C ILE A 153 8.147 7.389 -6.534 1.00 0.00 C ATOM 1916 O ILE A 153 7.090 7.183 -5.938 1.00 0.00 O ATOM 1917 CB ILE A 153 10.458 7.110 -5.636 1.00 0.00 C ATOM 1918 CG1 ILE A 153 10.293 6.379 -4.302 1.00 0.00 C ATOM 1919 CG2 ILE A 153 11.797 7.831 -5.688 1.00 0.00 C ATOM 1920 CD1 ILE A 153 10.721 7.199 -3.106 1.00 0.00 C ATOM 0 H ILE A 153 8.661 8.029 -3.853 1.00 0.00 H new ATOM 0 HA ILE A 153 9.649 8.923 -6.481 1.00 0.00 H new ATOM 0 HB ILE A 153 10.432 6.373 -6.439 1.00 0.00 H new ATOM 0 HG12 ILE A 153 9.248 6.093 -4.181 1.00 0.00 H new ATOM 0 HG13 ILE A 153 10.875 5.458 -4.328 1.00 0.00 H new ATOM 0 HG21 ILE A 153 12.603 7.113 -5.537 1.00 0.00 H new ATOM 0 HG22 ILE A 153 11.915 8.310 -6.660 1.00 0.00 H new ATOM 0 HG23 ILE A 153 11.834 8.587 -4.904 1.00 0.00 H new ATOM 0 HD11 ILE A 153 10.576 6.618 -2.196 1.00 0.00 H new ATOM 0 HD12 ILE A 153 11.774 7.463 -3.204 1.00 0.00 H new ATOM 0 HD13 ILE A 153 10.122 8.108 -3.055 1.00 0.00 H new ATOM 1932 N GLU A 154 8.356 7.011 -7.791 1.00 0.00 N ATOM 1933 CA GLU A 154 7.330 6.315 -8.560 1.00 0.00 C ATOM 1934 C GLU A 154 7.786 4.905 -8.924 1.00 0.00 C ATOM 1935 O GLU A 154 7.171 4.237 -9.756 1.00 0.00 O ATOM 1936 CB GLU A 154 6.994 7.099 -9.830 1.00 0.00 C ATOM 1937 CG GLU A 154 8.210 7.441 -10.674 1.00 0.00 C ATOM 1938 CD GLU A 154 7.842 8.121 -11.978 1.00 0.00 C ATOM 1939 OE1 GLU A 154 7.276 9.233 -11.929 1.00 0.00 O ATOM 1940 OE2 GLU A 154 8.122 7.541 -13.049 1.00 0.00 O ATOM 0 H GLU A 154 9.226 7.175 -8.298 1.00 0.00 H new ATOM 0 HA GLU A 154 6.436 6.240 -7.941 1.00 0.00 H new ATOM 0 HB2 GLU A 154 6.296 6.517 -10.432 1.00 0.00 H new ATOM 0 HB3 GLU A 154 6.483 8.021 -9.553 1.00 0.00 H new ATOM 0 HG2 GLU A 154 8.872 8.092 -10.103 1.00 0.00 H new ATOM 0 HG3 GLU A 154 8.767 6.529 -10.889 1.00 0.00 H new ATOM 1947 N VAL A 155 8.869 4.459 -8.296 1.00 0.00 N ATOM 1948 CA VAL A 155 9.408 3.129 -8.553 1.00 0.00 C ATOM 1949 C VAL A 155 9.583 2.886 -10.048 1.00 0.00 C ATOM 1950 O VAL A 155 9.158 3.695 -10.871 1.00 0.00 O ATOM 1951 CB VAL A 155 8.498 2.032 -7.969 1.00 0.00 C ATOM 1952 CG1 VAL A 155 7.241 1.876 -8.812 1.00 0.00 C ATOM 1953 CG2 VAL A 155 9.249 0.713 -7.870 1.00 0.00 C ATOM 0 H VAL A 155 9.390 4.999 -7.606 1.00 0.00 H new ATOM 0 HA VAL A 155 10.381 3.082 -8.064 1.00 0.00 H new ATOM 0 HB VAL A 155 8.199 2.330 -6.964 1.00 0.00 H new ATOM 0 HG11 VAL A 155 6.610 1.097 -8.384 1.00 0.00 H new ATOM 0 HG12 VAL A 155 6.694 2.818 -8.827 1.00 0.00 H new ATOM 0 HG13 VAL A 155 7.517 1.601 -9.830 1.00 0.00 H new ATOM 0 HG21 VAL A 155 8.591 -0.050 -7.455 1.00 0.00 H new ATOM 0 HG22 VAL A 155 9.579 0.407 -8.863 1.00 0.00 H new ATOM 0 HG23 VAL A 155 10.116 0.836 -7.221 1.00 0.00 H new ATOM 1963 N GLN A 156 10.213 1.766 -10.390 1.00 0.00 N ATOM 1964 CA GLN A 156 10.444 1.417 -11.787 1.00 0.00 C ATOM 1965 C GLN A 156 9.480 0.328 -12.243 1.00 0.00 C ATOM 1966 O GLN A 156 9.648 -0.844 -11.907 1.00 0.00 O ATOM 1967 CB GLN A 156 11.888 0.953 -11.986 1.00 0.00 C ATOM 1968 CG GLN A 156 12.922 1.981 -11.556 1.00 0.00 C ATOM 1969 CD GLN A 156 14.250 1.352 -11.181 1.00 0.00 C ATOM 1970 OE1 GLN A 156 15.175 1.296 -11.993 1.00 0.00 O ATOM 1971 NE2 GLN A 156 14.351 0.874 -9.947 1.00 0.00 N ATOM 0 H GLN A 156 10.572 1.086 -9.720 1.00 0.00 H new ATOM 0 HA GLN A 156 10.269 2.307 -12.391 1.00 0.00 H new ATOM 0 HB2 GLN A 156 12.046 0.033 -11.423 1.00 0.00 H new ATOM 0 HB3 GLN A 156 12.042 0.713 -13.038 1.00 0.00 H new ATOM 0 HG2 GLN A 156 13.078 2.694 -12.365 1.00 0.00 H new ATOM 0 HG3 GLN A 156 12.538 2.543 -10.705 1.00 0.00 H new ATOM 0 HE21 GLN A 156 13.559 0.942 -9.307 1.00 0.00 H new ATOM 0 HE22 GLN A 156 15.220 0.439 -9.638 1.00 0.00 H new ATOM 1980 N ALA A 157 8.469 0.722 -13.010 1.00 0.00 N ATOM 1981 CA ALA A 157 7.478 -0.222 -13.513 1.00 0.00 C ATOM 1982 C ALA A 157 8.041 -1.045 -14.666 1.00 0.00 C ATOM 1983 O ALA A 157 7.366 -1.927 -15.200 1.00 0.00 O ATOM 1984 CB ALA A 157 6.222 0.516 -13.953 1.00 0.00 C ATOM 0 H ALA A 157 8.314 1.689 -13.297 1.00 0.00 H new ATOM 0 HA ALA A 157 7.220 -0.906 -12.704 1.00 0.00 H new ATOM 0 HB1 ALA A 157 5.491 -0.201 -14.326 1.00 0.00 H new ATOM 0 HB2 ALA A 157 5.801 1.055 -13.105 1.00 0.00 H new ATOM 0 HB3 ALA A 157 6.473 1.223 -14.744 1.00 0.00 H new TER 1990 ALA A 157