USER MOD reduce.3.24.130724 H: found=0, std=0, add=1033, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1031 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 126 GLN : amide:sc= -3.28! C(o=-3.4!,f=-3.9!) USER MOD Set 1.2: A 128 GLN : amide:sc= -0.104 X(o=-3.4,f=-3.3) USER MOD Set 2.1: A 120 SER OG : rot 52:sc= 1.02 USER MOD Set 2.2: A 124 GLN : amide:sc= -0.97 K(o=0.046,f=-1.4!) USER MOD Set 3.1: A 69 ASN : amide:sc= -1.3 X(o=-2.1,f=-2.4) USER MOD Set 3.2: A 77 GLN : amide:sc= -0.791 K(o=-2.1,f=-3.6) USER MOD Set 4.1: A 36 HIS :FLIP no HE2:sc=-0.00618 F(o=-3.5,f=-0.0062) USER MOD Set 4.2: A 55 GLN :FLIP amide:sc= 0 F(o=-0.52,f=-0.0062) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00343) USER MOD Single : A 14 HIS :FLIP no HE2:sc= -9.7! C(o=-10!,f=-9.7!) USER MOD Single : A 19 GLN : amide:sc=-0.00648 K(o=-0.0065,f=-0.95) USER MOD Single : A 20 LYS NZ :NH3+ -150:sc= -0.296 (180deg=-0.858) USER MOD Single : A 23 TYR OH : rot 180:sc= -0.384 USER MOD Single : A 24 THR OG1 : rot 50:sc= 1.15 USER MOD Single : A 28 ASN : amide:sc= -9.82! C(o=-9.8!,f=-15!) USER MOD Single : A 29 HIS : no HD1:sc= 0 X(o=0,f=-0.054) USER MOD Single : A 30 TYR OH : rot -152:sc= -0.862 USER MOD Single : A 33 LYS NZ :NH3+ -157:sc= -0.105 (180deg=-0.553) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 GLN :FLIP amide:sc= -2.89! C(o=-3.8!,f=-2.9!) USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=-0.062) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0.0445 USER MOD Single : A 58 GLN : amide:sc= -0.0772 K(o=-0.077,f=-1.9!) USER MOD Single : A 62 ASN : amide:sc= -0.271 K(o=-0.27,f=-1.7) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 CYS SG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0478) USER MOD Single : A 74 ASN : amide:sc= 0.41 K(o=0.41,f=-4.8!) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 78 MET CE :methyl -158:sc= 0 (180deg=-0.455) USER MOD Single : A 81 ASN : amide:sc= 0.186 K(o=0.19,f=-5.6!) USER MOD Single : A 85 CYS SG : rot 66:sc= 0.018 USER MOD Single : A 87 ASN : amide:sc= 0.203 X(o=0.2,f=-0.032) USER MOD Single : A 92 LYS NZ :NH3+ -141:sc= 0 (180deg=-0.152) USER MOD Single : A 95 ASN :FLIP amide:sc= -0.61 F(o=-1.8!,f=-0.61) USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=-0.066) USER MOD Single : A 100 SER OG : rot 21:sc= 0.823 USER MOD Single : A 106 ASN : amide:sc= -0.311 X(o=-0.31,f=-0.43) USER MOD Single : A 108 ASN : amide:sc= -0.87 K(o=-0.87,f=-11!) USER MOD Single : A 110 LYS NZ :NH3+ 178:sc= -4.14! (180deg=-4.31!) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 127 GLN : amide:sc= 0 K(o=0,f=-1.6) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -11.206 4.296 -16.750 1.00 0.00 N ATOM 2 CA GLY A 1 -9.910 4.027 -17.346 1.00 0.00 C ATOM 3 C GLY A 1 -9.445 5.149 -18.254 1.00 0.00 C ATOM 4 O GLY A 1 -9.021 4.906 -19.384 1.00 0.00 O ATOM 0 H1 GLY A 1 -11.479 3.500 -16.139 1.00 0.00 H new ATOM 0 H2 GLY A 1 -11.153 5.166 -16.183 1.00 0.00 H new ATOM 0 H3 GLY A 1 -11.916 4.415 -17.501 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -9.175 3.875 -16.556 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -9.961 3.100 -17.917 1.00 0.00 H new ATOM 8 N SER A 2 -9.526 6.380 -17.759 1.00 0.00 N ATOM 9 CA SER A 2 -9.115 7.544 -18.536 1.00 0.00 C ATOM 10 C SER A 2 -7.611 7.526 -18.786 1.00 0.00 C ATOM 11 O SER A 2 -6.840 7.023 -17.969 1.00 0.00 O ATOM 12 CB SER A 2 -9.508 8.832 -17.810 1.00 0.00 C ATOM 13 OG SER A 2 -10.911 8.907 -17.628 1.00 0.00 O ATOM 0 H SER A 2 -9.872 6.597 -16.824 1.00 0.00 H new ATOM 0 HA SER A 2 -9.626 7.507 -19.498 1.00 0.00 H new ATOM 0 HB2 SER A 2 -9.010 8.874 -16.841 1.00 0.00 H new ATOM 0 HB3 SER A 2 -9.166 9.694 -18.382 1.00 0.00 H new ATOM 0 HG SER A 2 -11.136 9.738 -17.160 1.00 0.00 H new ATOM 19 N SER A 3 -7.200 8.080 -19.923 1.00 0.00 N ATOM 20 CA SER A 3 -5.788 8.125 -20.285 1.00 0.00 C ATOM 21 C SER A 3 -5.278 9.563 -20.305 1.00 0.00 C ATOM 22 O SER A 3 -5.948 10.464 -20.808 1.00 0.00 O ATOM 23 CB SER A 3 -5.569 7.475 -21.652 1.00 0.00 C ATOM 24 OG SER A 3 -6.170 8.239 -22.682 1.00 0.00 O ATOM 0 H SER A 3 -7.825 8.504 -20.609 1.00 0.00 H new ATOM 0 HA SER A 3 -5.228 7.570 -19.533 1.00 0.00 H new ATOM 0 HB2 SER A 3 -4.501 7.376 -21.844 1.00 0.00 H new ATOM 0 HB3 SER A 3 -5.987 6.468 -21.651 1.00 0.00 H new ATOM 0 HG SER A 3 -6.014 7.803 -23.546 1.00 0.00 H new ATOM 30 N GLY A 4 -4.086 9.769 -19.753 1.00 0.00 N ATOM 31 CA GLY A 4 -3.505 11.099 -19.718 1.00 0.00 C ATOM 32 C GLY A 4 -2.641 11.386 -20.930 1.00 0.00 C ATOM 33 O GLY A 4 -2.876 10.846 -22.010 1.00 0.00 O ATOM 0 H GLY A 4 -3.513 9.039 -19.330 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -4.303 11.839 -19.661 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -2.905 11.206 -18.814 1.00 0.00 H new ATOM 37 N SER A 5 -1.639 12.241 -20.750 1.00 0.00 N ATOM 38 CA SER A 5 -0.741 12.605 -21.840 1.00 0.00 C ATOM 39 C SER A 5 0.670 12.086 -21.576 1.00 0.00 C ATOM 40 O SER A 5 1.230 12.297 -20.501 1.00 0.00 O ATOM 41 CB SER A 5 -0.712 14.124 -22.021 1.00 0.00 C ATOM 42 OG SER A 5 -1.827 14.569 -22.774 1.00 0.00 O ATOM 0 H SER A 5 -1.429 12.694 -19.861 1.00 0.00 H new ATOM 0 HA SER A 5 -1.115 12.145 -22.755 1.00 0.00 H new ATOM 0 HB2 SER A 5 -0.711 14.610 -21.045 1.00 0.00 H new ATOM 0 HB3 SER A 5 0.210 14.416 -22.523 1.00 0.00 H new ATOM 0 HG SER A 5 -1.786 15.543 -22.874 1.00 0.00 H new ATOM 48 N SER A 6 1.238 11.406 -22.567 1.00 0.00 N ATOM 49 CA SER A 6 2.582 10.853 -22.442 1.00 0.00 C ATOM 50 C SER A 6 3.632 11.958 -22.509 1.00 0.00 C ATOM 51 O SER A 6 4.002 12.414 -23.590 1.00 0.00 O ATOM 52 CB SER A 6 2.837 9.824 -23.545 1.00 0.00 C ATOM 53 OG SER A 6 3.943 8.997 -23.225 1.00 0.00 O ATOM 0 H SER A 6 0.789 11.225 -23.465 1.00 0.00 H new ATOM 0 HA SER A 6 2.658 10.362 -21.472 1.00 0.00 H new ATOM 0 HB2 SER A 6 1.948 9.209 -23.686 1.00 0.00 H new ATOM 0 HB3 SER A 6 3.023 10.336 -24.489 1.00 0.00 H new ATOM 0 HG SER A 6 4.084 8.347 -23.945 1.00 0.00 H new ATOM 59 N GLY A 7 4.109 12.383 -21.343 1.00 0.00 N ATOM 60 CA GLY A 7 5.112 13.431 -21.290 1.00 0.00 C ATOM 61 C GLY A 7 5.347 13.938 -19.881 1.00 0.00 C ATOM 62 O GLY A 7 4.457 14.531 -19.269 1.00 0.00 O ATOM 0 H GLY A 7 3.819 12.021 -20.435 1.00 0.00 H new ATOM 0 HA2 GLY A 7 6.050 13.053 -21.698 1.00 0.00 H new ATOM 0 HA3 GLY A 7 4.800 14.261 -21.924 1.00 0.00 H new ATOM 66 N LYS A 8 6.547 13.703 -19.361 1.00 0.00 N ATOM 67 CA LYS A 8 6.897 14.139 -18.015 1.00 0.00 C ATOM 68 C LYS A 8 8.159 14.997 -18.032 1.00 0.00 C ATOM 69 O LYS A 8 8.995 14.905 -17.133 1.00 0.00 O ATOM 70 CB LYS A 8 7.103 12.929 -17.102 1.00 0.00 C ATOM 71 CG LYS A 8 8.057 11.893 -17.670 1.00 0.00 C ATOM 72 CD LYS A 8 9.495 12.181 -17.272 1.00 0.00 C ATOM 73 CE LYS A 8 10.346 10.921 -17.306 1.00 0.00 C ATOM 74 NZ LYS A 8 11.800 11.236 -17.367 1.00 0.00 N ATOM 0 H LYS A 8 7.294 13.212 -19.852 1.00 0.00 H new ATOM 0 HA LYS A 8 6.074 14.741 -17.630 1.00 0.00 H new ATOM 0 HB2 LYS A 8 7.483 13.271 -16.140 1.00 0.00 H new ATOM 0 HB3 LYS A 8 6.138 12.458 -16.914 1.00 0.00 H new ATOM 0 HG2 LYS A 8 7.772 10.902 -17.316 1.00 0.00 H new ATOM 0 HG3 LYS A 8 7.975 11.879 -18.757 1.00 0.00 H new ATOM 0 HD2 LYS A 8 9.918 12.925 -17.947 1.00 0.00 H new ATOM 0 HD3 LYS A 8 9.517 12.609 -16.270 1.00 0.00 H new ATOM 0 HE2 LYS A 8 10.141 10.320 -16.420 1.00 0.00 H new ATOM 0 HE3 LYS A 8 10.068 10.318 -18.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 12.346 10.351 -17.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 12.000 11.788 -18.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 12.071 11.789 -16.529 1.00 0.00 H new ATOM 88 N ARG A 9 8.288 15.831 -19.058 1.00 0.00 N ATOM 89 CA ARG A 9 9.448 16.704 -19.191 1.00 0.00 C ATOM 90 C ARG A 9 9.429 17.799 -18.128 1.00 0.00 C ATOM 91 O ARG A 9 10.399 17.982 -17.392 1.00 0.00 O ATOM 92 CB ARG A 9 9.482 17.334 -20.585 1.00 0.00 C ATOM 93 CG ARG A 9 10.025 16.406 -21.659 1.00 0.00 C ATOM 94 CD ARG A 9 11.544 16.451 -21.718 1.00 0.00 C ATOM 95 NE ARG A 9 12.028 17.568 -22.525 1.00 0.00 N ATOM 96 CZ ARG A 9 13.312 17.789 -22.780 1.00 0.00 C ATOM 97 NH1 ARG A 9 14.238 16.973 -22.295 1.00 0.00 N ATOM 98 NH2 ARG A 9 13.674 18.827 -23.523 1.00 0.00 N ATOM 0 H ARG A 9 7.604 15.921 -19.809 1.00 0.00 H new ATOM 0 HA ARG A 9 10.344 16.099 -19.050 1.00 0.00 H new ATOM 0 HB2 ARG A 9 8.473 17.643 -20.860 1.00 0.00 H new ATOM 0 HB3 ARG A 9 10.094 18.236 -20.552 1.00 0.00 H new ATOM 0 HG2 ARG A 9 9.698 15.386 -21.459 1.00 0.00 H new ATOM 0 HG3 ARG A 9 9.614 16.689 -22.628 1.00 0.00 H new ATOM 0 HD2 ARG A 9 11.944 16.534 -20.707 1.00 0.00 H new ATOM 0 HD3 ARG A 9 11.918 15.515 -22.133 1.00 0.00 H new ATOM 0 HE ARG A 9 11.341 18.214 -22.914 1.00 0.00 H new ATOM 0 HH11 ARG A 9 13.965 16.173 -21.724 1.00 0.00 H new ATOM 0 HH12 ARG A 9 15.224 17.145 -22.493 1.00 0.00 H new ATOM 0 HH21 ARG A 9 12.965 19.457 -23.899 1.00 0.00 H new ATOM 0 HH22 ARG A 9 14.661 18.995 -23.718 1.00 0.00 H new ATOM 112 N LYS A 10 8.318 18.524 -18.053 1.00 0.00 N ATOM 113 CA LYS A 10 8.170 19.600 -17.080 1.00 0.00 C ATOM 114 C LYS A 10 8.332 19.073 -15.657 1.00 0.00 C ATOM 115 O LYS A 10 8.092 17.899 -15.373 1.00 0.00 O ATOM 116 CB LYS A 10 6.804 20.271 -17.234 1.00 0.00 C ATOM 117 CG LYS A 10 6.631 21.001 -18.555 1.00 0.00 C ATOM 118 CD LYS A 10 7.153 22.426 -18.477 1.00 0.00 C ATOM 119 CE LYS A 10 6.898 23.184 -19.771 1.00 0.00 C ATOM 120 NZ LYS A 10 7.768 22.699 -20.878 1.00 0.00 N ATOM 0 H LYS A 10 7.506 18.386 -18.655 1.00 0.00 H new ATOM 0 HA LYS A 10 8.952 20.336 -17.268 1.00 0.00 H new ATOM 0 HB2 LYS A 10 6.024 19.515 -17.141 1.00 0.00 H new ATOM 0 HB3 LYS A 10 6.661 20.978 -16.416 1.00 0.00 H new ATOM 0 HG2 LYS A 10 7.159 20.462 -19.342 1.00 0.00 H new ATOM 0 HG3 LYS A 10 5.576 21.013 -18.830 1.00 0.00 H new ATOM 0 HD2 LYS A 10 6.672 22.946 -17.649 1.00 0.00 H new ATOM 0 HD3 LYS A 10 8.222 22.412 -18.267 1.00 0.00 H new ATOM 0 HE2 LYS A 10 5.852 23.074 -20.056 1.00 0.00 H new ATOM 0 HE3 LYS A 10 7.074 24.248 -19.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 7.588 23.263 -21.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 8.766 22.796 -20.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 7.558 21.699 -21.072 1.00 0.00 H new ATOM 134 N PRO A 11 8.747 19.959 -14.740 1.00 0.00 N ATOM 135 CA PRO A 11 8.948 19.606 -13.332 1.00 0.00 C ATOM 136 C PRO A 11 7.633 19.329 -12.611 1.00 0.00 C ATOM 137 O PRO A 11 6.681 20.102 -12.716 1.00 0.00 O ATOM 138 CB PRO A 11 9.626 20.848 -12.748 1.00 0.00 C ATOM 139 CG PRO A 11 9.196 21.966 -13.633 1.00 0.00 C ATOM 140 CD PRO A 11 9.053 21.375 -15.008 1.00 0.00 C ATOM 0 HA PRO A 11 9.532 18.692 -13.220 1.00 0.00 H new ATOM 0 HB2 PRO A 11 9.318 21.019 -11.716 1.00 0.00 H new ATOM 0 HB3 PRO A 11 10.711 20.742 -12.743 1.00 0.00 H new ATOM 0 HG2 PRO A 11 8.253 22.393 -13.292 1.00 0.00 H new ATOM 0 HG3 PRO A 11 9.930 22.771 -13.629 1.00 0.00 H new ATOM 0 HD2 PRO A 11 8.256 21.859 -15.572 1.00 0.00 H new ATOM 0 HD3 PRO A 11 9.968 21.485 -15.590 1.00 0.00 H new ATOM 148 N VAL A 12 7.588 18.221 -11.878 1.00 0.00 N ATOM 149 CA VAL A 12 6.390 17.842 -11.138 1.00 0.00 C ATOM 150 C VAL A 12 6.599 18.001 -9.636 1.00 0.00 C ATOM 151 O VAL A 12 7.731 18.115 -9.166 1.00 0.00 O ATOM 152 CB VAL A 12 5.981 16.388 -11.438 1.00 0.00 C ATOM 153 CG1 VAL A 12 7.039 15.420 -10.931 1.00 0.00 C ATOM 154 CG2 VAL A 12 4.625 16.079 -10.822 1.00 0.00 C ATOM 0 H VAL A 12 8.367 17.570 -11.781 1.00 0.00 H new ATOM 0 HA VAL A 12 5.592 18.510 -11.464 1.00 0.00 H new ATOM 0 HB VAL A 12 5.900 16.267 -12.518 1.00 0.00 H new ATOM 0 HG11 VAL A 12 6.733 14.398 -11.152 1.00 0.00 H new ATOM 0 HG12 VAL A 12 7.989 15.629 -11.423 1.00 0.00 H new ATOM 0 HG13 VAL A 12 7.155 15.539 -9.854 1.00 0.00 H new ATOM 0 HG21 VAL A 12 4.351 15.047 -11.044 1.00 0.00 H new ATOM 0 HG22 VAL A 12 4.676 16.217 -9.742 1.00 0.00 H new ATOM 0 HG23 VAL A 12 3.875 16.751 -11.238 1.00 0.00 H new ATOM 164 N ILE A 13 5.500 18.006 -8.889 1.00 0.00 N ATOM 165 CA ILE A 13 5.563 18.148 -7.440 1.00 0.00 C ATOM 166 C ILE A 13 4.978 16.926 -6.741 1.00 0.00 C ATOM 167 O ILE A 13 5.419 16.547 -5.655 1.00 0.00 O ATOM 168 CB ILE A 13 4.813 19.406 -6.964 1.00 0.00 C ATOM 169 CG1 ILE A 13 5.680 20.651 -7.165 1.00 0.00 C ATOM 170 CG2 ILE A 13 4.411 19.264 -5.504 1.00 0.00 C ATOM 171 CD1 ILE A 13 5.182 21.863 -6.409 1.00 0.00 C ATOM 0 H ILE A 13 4.556 17.913 -9.263 1.00 0.00 H new ATOM 0 HA ILE A 13 6.617 18.243 -7.179 1.00 0.00 H new ATOM 0 HB ILE A 13 3.907 19.517 -7.560 1.00 0.00 H new ATOM 0 HG12 ILE A 13 6.699 20.429 -6.849 1.00 0.00 H new ATOM 0 HG13 ILE A 13 5.721 20.888 -8.228 1.00 0.00 H new ATOM 0 HG21 ILE A 13 3.882 20.161 -5.183 1.00 0.00 H new ATOM 0 HG22 ILE A 13 3.759 18.398 -5.389 1.00 0.00 H new ATOM 0 HG23 ILE A 13 5.303 19.131 -4.892 1.00 0.00 H new ATOM 0 HD11 ILE A 13 5.845 22.707 -6.598 1.00 0.00 H new ATOM 0 HD12 ILE A 13 4.174 22.111 -6.742 1.00 0.00 H new ATOM 0 HD13 ILE A 13 5.168 21.645 -5.341 1.00 0.00 H new ATOM 183 N HIS A 14 3.982 16.311 -7.372 1.00 0.00 N ATOM 184 CA HIS A 14 3.336 15.129 -6.812 1.00 0.00 C ATOM 185 C HIS A 14 2.663 15.456 -5.482 1.00 0.00 C ATOM 186 O HIS A 14 2.872 14.769 -4.484 1.00 0.00 O ATOM 187 CB HIS A 14 4.358 14.008 -6.617 1.00 0.00 C ATOM 188 CG HIS A 14 4.911 13.472 -7.902 1.00 0.00 C ATOM 189 ND1 HIS A 14 6.008 12.718 -8.147 1.00 0.00 N flip ATOM 190 CD2 HIS A 14 4.321 13.698 -9.127 1.00 0.00 C flip ATOM 191 CE1 HIS A 14 6.059 12.503 -9.502 1.00 0.00 C flip ATOM 192 NE2 HIS A 14 5.030 13.105 -10.071 1.00 0.00 N flip ATOM 0 H HIS A 14 3.605 16.612 -8.271 1.00 0.00 H new ATOM 0 HA HIS A 14 2.571 14.796 -7.514 1.00 0.00 H new ATOM 0 HB2 HIS A 14 5.179 14.379 -6.004 1.00 0.00 H new ATOM 0 HB3 HIS A 14 3.890 13.193 -6.064 1.00 0.00 H new ATOM 0 HD1 HIS A 14 6.673 12.374 -7.454 1.00 0.00 H new ATOM 0 HD2 HIS A 14 3.420 14.270 -9.290 1.00 0.00 H new ATOM 0 HE1 HIS A 14 6.817 11.934 -10.019 1.00 0.00 H new ATOM 201 N GLY A 15 1.854 16.512 -5.477 1.00 0.00 N ATOM 202 CA GLY A 15 1.164 16.912 -4.265 1.00 0.00 C ATOM 203 C GLY A 15 0.596 15.730 -3.505 1.00 0.00 C ATOM 204 O GLY A 15 0.522 14.620 -4.033 1.00 0.00 O ATOM 0 H GLY A 15 1.665 17.097 -6.291 1.00 0.00 H new ATOM 0 HA2 GLY A 15 1.854 17.457 -3.621 1.00 0.00 H new ATOM 0 HA3 GLY A 15 0.356 17.598 -4.520 1.00 0.00 H new ATOM 208 N LEU A 16 0.194 15.967 -2.261 1.00 0.00 N ATOM 209 CA LEU A 16 -0.370 14.913 -1.425 1.00 0.00 C ATOM 210 C LEU A 16 -1.334 14.041 -2.224 1.00 0.00 C ATOM 211 O LEU A 16 -1.221 12.816 -2.225 1.00 0.00 O ATOM 212 CB LEU A 16 -1.091 15.520 -0.221 1.00 0.00 C ATOM 213 CG LEU A 16 -0.218 15.843 0.992 1.00 0.00 C ATOM 214 CD1 LEU A 16 -1.023 16.588 2.046 1.00 0.00 C ATOM 215 CD2 LEU A 16 0.377 14.570 1.575 1.00 0.00 C ATOM 0 H LEU A 16 0.248 16.880 -1.809 1.00 0.00 H new ATOM 0 HA LEU A 16 0.449 14.287 -1.071 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -1.584 16.437 -0.543 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -1.874 14.830 0.094 1.00 0.00 H new ATOM 0 HG LEU A 16 0.599 16.486 0.666 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -0.385 16.809 2.902 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -1.401 17.519 1.624 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -1.861 15.970 2.368 1.00 0.00 H new ATOM 0 HD21 LEU A 16 0.995 14.819 2.437 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -0.426 13.902 1.885 1.00 0.00 H new ATOM 0 HD23 LEU A 16 0.989 14.076 0.821 1.00 0.00 H new ATOM 227 N GLU A 17 -2.280 14.683 -2.903 1.00 0.00 N ATOM 228 CA GLU A 17 -3.262 13.965 -3.706 1.00 0.00 C ATOM 229 C GLU A 17 -2.594 13.265 -4.886 1.00 0.00 C ATOM 230 O GLU A 17 -2.934 12.131 -5.223 1.00 0.00 O ATOM 231 CB GLU A 17 -4.339 14.926 -4.213 1.00 0.00 C ATOM 232 CG GLU A 17 -5.493 15.113 -3.243 1.00 0.00 C ATOM 233 CD GLU A 17 -5.992 13.801 -2.668 1.00 0.00 C ATOM 234 OE1 GLU A 17 -5.938 12.781 -3.386 1.00 0.00 O ATOM 235 OE2 GLU A 17 -6.435 13.796 -1.501 1.00 0.00 O ATOM 0 H GLU A 17 -2.387 15.697 -2.913 1.00 0.00 H new ATOM 0 HA GLU A 17 -3.727 13.209 -3.074 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -3.883 15.896 -4.414 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -4.729 14.554 -5.161 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -5.176 15.765 -2.429 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -6.314 15.617 -3.754 1.00 0.00 H new ATOM 242 N ASP A 18 -1.641 13.950 -5.509 1.00 0.00 N ATOM 243 CA ASP A 18 -0.923 13.395 -6.651 1.00 0.00 C ATOM 244 C ASP A 18 -0.192 12.114 -6.263 1.00 0.00 C ATOM 245 O ASP A 18 -0.146 11.157 -7.036 1.00 0.00 O ATOM 246 CB ASP A 18 0.072 14.418 -7.202 1.00 0.00 C ATOM 247 CG ASP A 18 -0.596 15.462 -8.075 1.00 0.00 C ATOM 248 OD1 ASP A 18 -1.351 15.075 -8.991 1.00 0.00 O ATOM 249 OD2 ASP A 18 -0.361 16.667 -7.844 1.00 0.00 O ATOM 0 H ASP A 18 -1.348 14.890 -5.243 1.00 0.00 H new ATOM 0 HA ASP A 18 -1.652 13.156 -7.425 1.00 0.00 H new ATOM 0 HB2 ASP A 18 0.578 14.912 -6.372 1.00 0.00 H new ATOM 0 HB3 ASP A 18 0.838 13.901 -7.780 1.00 0.00 H new ATOM 254 N GLN A 19 0.378 12.104 -5.063 1.00 0.00 N ATOM 255 CA GLN A 19 1.109 10.941 -4.574 1.00 0.00 C ATOM 256 C GLN A 19 0.211 9.709 -4.540 1.00 0.00 C ATOM 257 O GLN A 19 0.635 8.608 -4.894 1.00 0.00 O ATOM 258 CB GLN A 19 1.671 11.215 -3.178 1.00 0.00 C ATOM 259 CG GLN A 19 2.531 12.466 -3.103 1.00 0.00 C ATOM 260 CD GLN A 19 3.609 12.371 -2.041 1.00 0.00 C ATOM 261 OE1 GLN A 19 3.501 11.585 -1.100 1.00 0.00 O ATOM 262 NE2 GLN A 19 4.656 13.174 -2.187 1.00 0.00 N ATOM 0 H GLN A 19 0.348 12.888 -4.411 1.00 0.00 H new ATOM 0 HA GLN A 19 1.935 10.748 -5.259 1.00 0.00 H new ATOM 0 HB2 GLN A 19 0.844 11.310 -2.475 1.00 0.00 H new ATOM 0 HB3 GLN A 19 2.263 10.357 -2.859 1.00 0.00 H new ATOM 0 HG2 GLN A 19 2.996 12.641 -4.073 1.00 0.00 H new ATOM 0 HG3 GLN A 19 1.896 13.327 -2.894 1.00 0.00 H new ATOM 0 HE21 GLN A 19 4.704 13.810 -2.983 1.00 0.00 H new ATOM 0 HE22 GLN A 19 5.413 13.155 -1.503 1.00 0.00 H new ATOM 271 N LYS A 20 -1.033 9.900 -4.113 1.00 0.00 N ATOM 272 CA LYS A 20 -1.992 8.805 -4.034 1.00 0.00 C ATOM 273 C LYS A 20 -2.014 8.006 -5.333 1.00 0.00 C ATOM 274 O LYS A 20 -2.222 6.793 -5.323 1.00 0.00 O ATOM 275 CB LYS A 20 -3.391 9.347 -3.732 1.00 0.00 C ATOM 276 CG LYS A 20 -4.484 8.296 -3.829 1.00 0.00 C ATOM 277 CD LYS A 20 -5.827 8.919 -4.172 1.00 0.00 C ATOM 278 CE LYS A 20 -6.959 7.912 -4.036 1.00 0.00 C ATOM 279 NZ LYS A 20 -8.294 8.552 -4.197 1.00 0.00 N ATOM 0 H LYS A 20 -1.401 10.804 -3.816 1.00 0.00 H new ATOM 0 HA LYS A 20 -1.683 8.142 -3.226 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -3.397 9.774 -2.729 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -3.615 10.158 -4.425 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -4.218 7.562 -4.589 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -4.561 7.761 -2.882 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -6.014 9.769 -3.515 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -5.801 9.304 -5.192 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -6.840 7.128 -4.784 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -6.902 7.432 -3.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -8.998 8.034 -3.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -8.248 9.538 -3.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -8.570 8.531 -5.199 1.00 0.00 H new ATOM 293 N ARG A 21 -1.797 8.694 -6.449 1.00 0.00 N ATOM 294 CA ARG A 21 -1.792 8.048 -7.756 1.00 0.00 C ATOM 295 C ARG A 21 -0.501 7.263 -7.969 1.00 0.00 C ATOM 296 O ARG A 21 -0.529 6.107 -8.394 1.00 0.00 O ATOM 297 CB ARG A 21 -1.958 9.089 -8.864 1.00 0.00 C ATOM 298 CG ARG A 21 -2.391 8.497 -10.196 1.00 0.00 C ATOM 299 CD ARG A 21 -3.896 8.288 -10.249 1.00 0.00 C ATOM 300 NE ARG A 21 -4.629 9.540 -10.085 1.00 0.00 N ATOM 301 CZ ARG A 21 -5.045 10.000 -8.910 1.00 0.00 C ATOM 302 NH1 ARG A 21 -4.801 9.313 -7.802 1.00 0.00 N ATOM 303 NH2 ARG A 21 -5.706 11.148 -8.841 1.00 0.00 N ATOM 0 H ARG A 21 -1.622 9.699 -6.474 1.00 0.00 H new ATOM 0 HA ARG A 21 -2.630 7.352 -7.793 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -2.694 9.829 -8.549 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -1.014 9.616 -9.000 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -2.086 9.159 -11.006 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -1.884 7.545 -10.354 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -4.165 7.833 -11.202 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -4.193 7.589 -9.467 1.00 0.00 H new ATOM 0 HE ARG A 21 -4.833 10.092 -10.918 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -4.293 8.430 -7.851 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -5.121 9.668 -6.901 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -5.896 11.679 -9.691 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -6.025 11.500 -7.938 1.00 0.00 H new ATOM 317 N ILE A 22 0.627 7.899 -7.673 1.00 0.00 N ATOM 318 CA ILE A 22 1.928 7.260 -7.832 1.00 0.00 C ATOM 319 C ILE A 22 1.938 5.870 -7.204 1.00 0.00 C ATOM 320 O ILE A 22 2.329 4.892 -7.843 1.00 0.00 O ATOM 321 CB ILE A 22 3.051 8.104 -7.200 1.00 0.00 C ATOM 322 CG1 ILE A 22 3.151 9.463 -7.897 1.00 0.00 C ATOM 323 CG2 ILE A 22 4.377 7.364 -7.278 1.00 0.00 C ATOM 324 CD1 ILE A 22 4.043 10.448 -7.175 1.00 0.00 C ATOM 0 H ILE A 22 0.667 8.856 -7.322 1.00 0.00 H new ATOM 0 HA ILE A 22 2.108 7.174 -8.904 1.00 0.00 H new ATOM 0 HB ILE A 22 2.812 8.272 -6.150 1.00 0.00 H new ATOM 0 HG12 ILE A 22 3.529 9.316 -8.909 1.00 0.00 H new ATOM 0 HG13 ILE A 22 2.152 9.889 -7.989 1.00 0.00 H new ATOM 0 HG21 ILE A 22 5.161 7.973 -6.827 1.00 0.00 H new ATOM 0 HG22 ILE A 22 4.298 6.419 -6.741 1.00 0.00 H new ATOM 0 HG23 ILE A 22 4.624 7.169 -8.322 1.00 0.00 H new ATOM 0 HD11 ILE A 22 4.067 11.389 -7.725 1.00 0.00 H new ATOM 0 HD12 ILE A 22 3.654 10.624 -6.172 1.00 0.00 H new ATOM 0 HD13 ILE A 22 5.052 10.042 -7.106 1.00 0.00 H new ATOM 336 N TYR A 23 1.505 5.789 -5.951 1.00 0.00 N ATOM 337 CA TYR A 23 1.464 4.519 -5.237 1.00 0.00 C ATOM 338 C TYR A 23 0.409 3.592 -5.833 1.00 0.00 C ATOM 339 O TYR A 23 0.670 2.416 -6.088 1.00 0.00 O ATOM 340 CB TYR A 23 1.174 4.754 -3.753 1.00 0.00 C ATOM 341 CG TYR A 23 2.230 5.578 -3.053 1.00 0.00 C ATOM 342 CD1 TYR A 23 3.571 5.215 -3.106 1.00 0.00 C ATOM 343 CD2 TYR A 23 1.888 6.718 -2.336 1.00 0.00 C ATOM 344 CE1 TYR A 23 4.539 5.964 -2.467 1.00 0.00 C ATOM 345 CE2 TYR A 23 2.850 7.474 -1.695 1.00 0.00 C ATOM 346 CZ TYR A 23 4.174 7.093 -1.763 1.00 0.00 C ATOM 347 OH TYR A 23 5.135 7.843 -1.125 1.00 0.00 O ATOM 0 H TYR A 23 1.177 6.588 -5.409 1.00 0.00 H new ATOM 0 HA TYR A 23 2.439 4.042 -5.339 1.00 0.00 H new ATOM 0 HB2 TYR A 23 0.211 5.254 -3.654 1.00 0.00 H new ATOM 0 HB3 TYR A 23 1.086 3.790 -3.252 1.00 0.00 H new ATOM 0 HD1 TYR A 23 3.860 4.332 -3.656 1.00 0.00 H new ATOM 0 HD2 TYR A 23 0.852 7.018 -2.279 1.00 0.00 H new ATOM 0 HE1 TYR A 23 5.576 5.668 -2.518 1.00 0.00 H new ATOM 0 HE2 TYR A 23 2.567 8.359 -1.144 1.00 0.00 H new ATOM 0 HH TYR A 23 4.711 8.604 -0.676 1.00 0.00 H new ATOM 357 N THR A 24 -0.786 4.131 -6.053 1.00 0.00 N ATOM 358 CA THR A 24 -1.883 3.354 -6.618 1.00 0.00 C ATOM 359 C THR A 24 -1.404 2.494 -7.782 1.00 0.00 C ATOM 360 O THR A 24 -1.648 1.288 -7.816 1.00 0.00 O ATOM 361 CB THR A 24 -3.025 4.266 -7.105 1.00 0.00 C ATOM 362 OG1 THR A 24 -3.664 4.890 -5.986 1.00 0.00 O ATOM 363 CG2 THR A 24 -4.048 3.473 -7.902 1.00 0.00 C ATOM 0 H THR A 24 -1.019 5.103 -5.849 1.00 0.00 H new ATOM 0 HA THR A 24 -2.257 2.710 -5.822 1.00 0.00 H new ATOM 0 HB THR A 24 -2.598 5.032 -7.753 1.00 0.00 H new ATOM 0 HG1 THR A 24 -2.986 5.292 -5.404 1.00 0.00 H new ATOM 0 HG21 THR A 24 -4.845 4.138 -8.235 1.00 0.00 H new ATOM 0 HG22 THR A 24 -3.564 3.023 -8.769 1.00 0.00 H new ATOM 0 HG23 THR A 24 -4.470 2.688 -7.274 1.00 0.00 H new ATOM 371 N ASP A 25 -0.721 3.121 -8.733 1.00 0.00 N ATOM 372 CA ASP A 25 -0.206 2.411 -9.898 1.00 0.00 C ATOM 373 C ASP A 25 0.884 1.423 -9.495 1.00 0.00 C ATOM 374 O ASP A 25 0.954 0.313 -10.022 1.00 0.00 O ATOM 375 CB ASP A 25 0.343 3.403 -10.925 1.00 0.00 C ATOM 376 CG ASP A 25 0.626 2.753 -12.265 1.00 0.00 C ATOM 377 OD1 ASP A 25 -0.337 2.308 -12.923 1.00 0.00 O ATOM 378 OD2 ASP A 25 1.811 2.689 -12.655 1.00 0.00 O ATOM 0 H ASP A 25 -0.511 4.119 -8.720 1.00 0.00 H new ATOM 0 HA ASP A 25 -1.029 1.854 -10.346 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -0.373 4.213 -11.062 1.00 0.00 H new ATOM 0 HB3 ASP A 25 1.260 3.849 -10.540 1.00 0.00 H new ATOM 383 N TRP A 26 1.731 1.834 -8.559 1.00 0.00 N ATOM 384 CA TRP A 26 2.819 0.985 -8.086 1.00 0.00 C ATOM 385 C TRP A 26 2.291 -0.369 -7.625 1.00 0.00 C ATOM 386 O TRP A 26 2.808 -1.414 -8.019 1.00 0.00 O ATOM 387 CB TRP A 26 3.568 1.671 -6.942 1.00 0.00 C ATOM 388 CG TRP A 26 4.680 0.839 -6.378 1.00 0.00 C ATOM 389 CD1 TRP A 26 5.890 0.587 -6.957 1.00 0.00 C ATOM 390 CD2 TRP A 26 4.682 0.149 -5.123 1.00 0.00 C ATOM 391 NE1 TRP A 26 6.645 -0.218 -6.139 1.00 0.00 N ATOM 392 CE2 TRP A 26 5.927 -0.500 -5.007 1.00 0.00 C ATOM 393 CE3 TRP A 26 3.755 0.018 -4.086 1.00 0.00 C ATOM 394 CZ2 TRP A 26 6.264 -1.268 -3.896 1.00 0.00 C ATOM 395 CZ3 TRP A 26 4.091 -0.745 -2.984 1.00 0.00 C ATOM 396 CH2 TRP A 26 5.337 -1.379 -2.895 1.00 0.00 C ATOM 0 H TRP A 26 1.686 2.750 -8.112 1.00 0.00 H new ATOM 0 HA TRP A 26 3.507 0.822 -8.915 1.00 0.00 H new ATOM 0 HB2 TRP A 26 3.976 2.616 -7.300 1.00 0.00 H new ATOM 0 HB3 TRP A 26 2.862 1.909 -6.146 1.00 0.00 H new ATOM 0 HD1 TRP A 26 6.207 0.965 -7.918 1.00 0.00 H new ATOM 0 HE1 TRP A 26 7.587 -0.552 -6.342 1.00 0.00 H new ATOM 0 HE3 TRP A 26 2.793 0.505 -4.145 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 7.223 -1.759 -3.826 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 3.381 -0.854 -2.178 1.00 0.00 H new ATOM 0 HH2 TRP A 26 5.571 -1.967 -2.020 1.00 0.00 H new ATOM 407 N ALA A 27 1.259 -0.343 -6.788 1.00 0.00 N ATOM 408 CA ALA A 27 0.660 -1.569 -6.276 1.00 0.00 C ATOM 409 C ALA A 27 -0.074 -2.324 -7.379 1.00 0.00 C ATOM 410 O ALA A 27 -0.027 -3.552 -7.441 1.00 0.00 O ATOM 411 CB ALA A 27 -0.288 -1.254 -5.128 1.00 0.00 C ATOM 0 H ALA A 27 0.821 0.514 -6.450 1.00 0.00 H new ATOM 0 HA ALA A 27 1.461 -2.208 -5.906 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -0.728 -2.179 -4.755 1.00 0.00 H new ATOM 0 HB2 ALA A 27 0.263 -0.765 -4.325 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -1.079 -0.592 -5.481 1.00 0.00 H new ATOM 417 N ASN A 28 -0.753 -1.582 -8.247 1.00 0.00 N ATOM 418 CA ASN A 28 -1.498 -2.182 -9.348 1.00 0.00 C ATOM 419 C ASN A 28 -0.638 -3.193 -10.100 1.00 0.00 C ATOM 420 O ASN A 28 -1.140 -4.197 -10.606 1.00 0.00 O ATOM 421 CB ASN A 28 -1.990 -1.099 -10.309 1.00 0.00 C ATOM 422 CG ASN A 28 -3.355 -0.560 -9.924 1.00 0.00 C ATOM 423 OD1 ASN A 28 -4.277 -0.533 -10.740 1.00 0.00 O ATOM 424 ND2 ASN A 28 -3.490 -0.128 -8.676 1.00 0.00 N ATOM 0 H ASN A 28 -0.803 -0.564 -8.210 1.00 0.00 H new ATOM 0 HA ASN A 28 -2.358 -2.704 -8.929 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -1.271 -0.280 -10.328 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -2.035 -1.507 -11.319 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -4.385 0.245 -8.359 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -2.699 -0.169 -8.034 1.00 0.00 H new ATOM 431 N HIS A 29 0.661 -2.920 -10.169 1.00 0.00 N ATOM 432 CA HIS A 29 1.593 -3.806 -10.859 1.00 0.00 C ATOM 433 C HIS A 29 1.657 -5.167 -10.173 1.00 0.00 C ATOM 434 O HIS A 29 1.626 -6.207 -10.831 1.00 0.00 O ATOM 435 CB HIS A 29 2.986 -3.179 -10.905 1.00 0.00 C ATOM 436 CG HIS A 29 4.071 -4.156 -11.241 1.00 0.00 C ATOM 437 ND1 HIS A 29 4.050 -4.946 -12.371 1.00 0.00 N ATOM 438 CD2 HIS A 29 5.216 -4.466 -10.588 1.00 0.00 C ATOM 439 CE1 HIS A 29 5.133 -5.701 -12.398 1.00 0.00 C ATOM 440 NE2 HIS A 29 5.858 -5.429 -11.328 1.00 0.00 N ATOM 0 H HIS A 29 1.092 -2.093 -9.756 1.00 0.00 H new ATOM 0 HA HIS A 29 1.234 -3.949 -11.878 1.00 0.00 H new ATOM 0 HB2 HIS A 29 2.990 -2.376 -11.642 1.00 0.00 H new ATOM 0 HB3 HIS A 29 3.203 -2.725 -9.938 1.00 0.00 H new ATOM 0 HD2 HIS A 29 5.560 -4.036 -9.659 1.00 0.00 H new ATOM 0 HE1 HIS A 29 5.383 -6.419 -13.165 1.00 0.00 H new ATOM 0 HE2 HIS A 29 6.750 -5.863 -11.090 1.00 0.00 H new ATOM 449 N TYR A 30 1.747 -5.153 -8.848 1.00 0.00 N ATOM 450 CA TYR A 30 1.818 -6.386 -8.073 1.00 0.00 C ATOM 451 C TYR A 30 0.488 -7.133 -8.114 1.00 0.00 C ATOM 452 O TYR A 30 0.417 -8.317 -7.782 1.00 0.00 O ATOM 453 CB TYR A 30 2.200 -6.081 -6.624 1.00 0.00 C ATOM 454 CG TYR A 30 3.593 -5.512 -6.472 1.00 0.00 C ATOM 455 CD1 TYR A 30 4.711 -6.336 -6.523 1.00 0.00 C ATOM 456 CD2 TYR A 30 3.791 -4.151 -6.276 1.00 0.00 C ATOM 457 CE1 TYR A 30 5.985 -5.821 -6.384 1.00 0.00 C ATOM 458 CE2 TYR A 30 5.062 -3.627 -6.138 1.00 0.00 C ATOM 459 CZ TYR A 30 6.155 -4.466 -6.192 1.00 0.00 C ATOM 460 OH TYR A 30 7.423 -3.948 -6.053 1.00 0.00 O ATOM 0 H TYR A 30 1.773 -4.301 -8.288 1.00 0.00 H new ATOM 0 HA TYR A 30 2.584 -7.021 -8.518 1.00 0.00 H new ATOM 0 HB2 TYR A 30 1.481 -5.375 -6.208 1.00 0.00 H new ATOM 0 HB3 TYR A 30 2.124 -6.996 -6.037 1.00 0.00 H new ATOM 0 HD1 TYR A 30 4.581 -7.398 -6.674 1.00 0.00 H new ATOM 0 HD2 TYR A 30 2.937 -3.491 -6.231 1.00 0.00 H new ATOM 0 HE1 TYR A 30 6.843 -6.476 -6.425 1.00 0.00 H new ATOM 0 HE2 TYR A 30 5.199 -2.566 -5.989 1.00 0.00 H new ATOM 0 HH TYR A 30 7.387 -3.139 -5.502 1.00 0.00 H new ATOM 470 N LEU A 31 -0.563 -6.433 -8.524 1.00 0.00 N ATOM 471 CA LEU A 31 -1.892 -7.028 -8.609 1.00 0.00 C ATOM 472 C LEU A 31 -2.124 -7.648 -9.984 1.00 0.00 C ATOM 473 O LEU A 31 -2.519 -8.809 -10.093 1.00 0.00 O ATOM 474 CB LEU A 31 -2.964 -5.974 -8.326 1.00 0.00 C ATOM 475 CG LEU A 31 -3.154 -5.587 -6.859 1.00 0.00 C ATOM 476 CD1 LEU A 31 -4.242 -4.534 -6.721 1.00 0.00 C ATOM 477 CD2 LEU A 31 -3.487 -6.814 -6.023 1.00 0.00 C ATOM 0 H LEU A 31 -0.521 -5.453 -8.803 1.00 0.00 H new ATOM 0 HA LEU A 31 -1.959 -7.816 -7.859 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -2.718 -5.074 -8.889 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -3.916 -6.340 -8.711 1.00 0.00 H new ATOM 0 HG LEU A 31 -2.219 -5.164 -6.491 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -4.363 -4.271 -5.670 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -3.962 -3.646 -7.287 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -5.182 -4.929 -7.107 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -3.619 -6.520 -4.982 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -4.408 -7.267 -6.392 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -2.673 -7.536 -6.096 1.00 0.00 H new ATOM 489 N ALA A 32 -1.873 -6.867 -11.029 1.00 0.00 N ATOM 490 CA ALA A 32 -2.049 -7.341 -12.396 1.00 0.00 C ATOM 491 C ALA A 32 -1.093 -8.488 -12.708 1.00 0.00 C ATOM 492 O ALA A 32 -1.346 -9.295 -13.602 1.00 0.00 O ATOM 493 CB ALA A 32 -1.846 -6.199 -13.381 1.00 0.00 C ATOM 0 H ALA A 32 -1.547 -5.903 -10.955 1.00 0.00 H new ATOM 0 HA ALA A 32 -3.068 -7.715 -12.496 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -1.980 -6.567 -14.398 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -2.573 -5.412 -13.181 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -0.838 -5.798 -13.271 1.00 0.00 H new ATOM 499 N LYS A 33 0.007 -8.553 -11.966 1.00 0.00 N ATOM 500 CA LYS A 33 1.002 -9.600 -12.162 1.00 0.00 C ATOM 501 C LYS A 33 0.546 -10.909 -11.525 1.00 0.00 C ATOM 502 O LYS A 33 0.804 -11.991 -12.054 1.00 0.00 O ATOM 503 CB LYS A 33 2.346 -9.173 -11.568 1.00 0.00 C ATOM 504 CG LYS A 33 2.445 -9.391 -10.068 1.00 0.00 C ATOM 505 CD LYS A 33 3.775 -8.902 -9.520 1.00 0.00 C ATOM 506 CE LYS A 33 4.895 -9.889 -9.812 1.00 0.00 C ATOM 507 NZ LYS A 33 4.670 -11.199 -9.140 1.00 0.00 N ATOM 0 H LYS A 33 0.232 -7.892 -11.222 1.00 0.00 H new ATOM 0 HA LYS A 33 1.120 -9.759 -13.234 1.00 0.00 H new ATOM 0 HB2 LYS A 33 3.144 -9.728 -12.061 1.00 0.00 H new ATOM 0 HB3 LYS A 33 2.511 -8.118 -11.785 1.00 0.00 H new ATOM 0 HG2 LYS A 33 1.630 -8.867 -9.569 1.00 0.00 H new ATOM 0 HG3 LYS A 33 2.326 -10.451 -9.845 1.00 0.00 H new ATOM 0 HD2 LYS A 33 4.017 -7.935 -9.960 1.00 0.00 H new ATOM 0 HD3 LYS A 33 3.693 -8.751 -8.444 1.00 0.00 H new ATOM 0 HE2 LYS A 33 4.973 -10.042 -10.888 1.00 0.00 H new ATOM 0 HE3 LYS A 33 5.845 -9.469 -9.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 5.579 -11.691 -9.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 4.242 -11.041 -8.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 4.032 -11.781 -9.719 1.00 0.00 H new ATOM 521 N SER A 34 -0.134 -10.804 -10.388 1.00 0.00 N ATOM 522 CA SER A 34 -0.624 -11.980 -9.679 1.00 0.00 C ATOM 523 C SER A 34 -1.948 -12.458 -10.269 1.00 0.00 C ATOM 524 O SER A 34 -2.545 -13.419 -9.785 1.00 0.00 O ATOM 525 CB SER A 34 -0.799 -11.669 -8.192 1.00 0.00 C ATOM 526 OG SER A 34 0.405 -11.892 -7.479 1.00 0.00 O ATOM 0 H SER A 34 -0.358 -9.916 -9.938 1.00 0.00 H new ATOM 0 HA SER A 34 0.113 -12.775 -9.793 1.00 0.00 H new ATOM 0 HB2 SER A 34 -1.112 -10.632 -8.069 1.00 0.00 H new ATOM 0 HB3 SER A 34 -1.591 -12.292 -7.778 1.00 0.00 H new ATOM 0 HG SER A 34 0.267 -11.684 -6.531 1.00 0.00 H new ATOM 532 N GLY A 35 -2.400 -11.780 -11.319 1.00 0.00 N ATOM 533 CA GLY A 35 -3.649 -12.148 -11.959 1.00 0.00 C ATOM 534 C GLY A 35 -4.859 -11.606 -11.224 1.00 0.00 C ATOM 535 O GLY A 35 -5.654 -12.368 -10.673 1.00 0.00 O ATOM 0 H GLY A 35 -1.923 -10.982 -11.738 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -3.653 -11.775 -12.983 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -3.719 -13.234 -12.015 1.00 0.00 H new ATOM 539 N HIS A 36 -5.000 -10.284 -11.214 1.00 0.00 N ATOM 540 CA HIS A 36 -6.121 -9.639 -10.540 1.00 0.00 C ATOM 541 C HIS A 36 -6.960 -8.836 -11.529 1.00 0.00 C ATOM 542 O HIS A 36 -6.427 -8.196 -12.436 1.00 0.00 O ATOM 543 CB HIS A 36 -5.616 -8.726 -9.423 1.00 0.00 C ATOM 544 CG HIS A 36 -5.517 -9.406 -8.092 1.00 0.00 C ATOM 545 ND1 HIS A 36 -4.586 -10.255 -7.598 1.00 0.00 N flip ATOM 546 CD2 HIS A 36 -6.454 -9.245 -7.093 1.00 0.00 C flip ATOM 547 CE1 HIS A 36 -4.972 -10.587 -6.323 1.00 0.00 C flip ATOM 548 NE2 HIS A 36 -6.102 -9.964 -6.042 1.00 0.00 N flip ATOM 0 H HIS A 36 -4.352 -9.639 -11.665 1.00 0.00 H new ATOM 0 HA HIS A 36 -6.748 -10.418 -10.106 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -4.635 -8.338 -9.698 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -6.284 -7.869 -9.335 1.00 0.00 H new ATOM 0 HD1 HIS A 36 -3.752 -10.587 -8.083 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -7.338 -8.628 -7.159 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -4.438 -11.250 -5.658 1.00 0.00 H new ATOM 557 N LYS A 37 -8.276 -8.875 -11.349 1.00 0.00 N ATOM 558 CA LYS A 37 -9.190 -8.151 -12.225 1.00 0.00 C ATOM 559 C LYS A 37 -9.549 -6.792 -11.632 1.00 0.00 C ATOM 560 O LYS A 37 -9.902 -5.861 -12.357 1.00 0.00 O ATOM 561 CB LYS A 37 -10.462 -8.969 -12.458 1.00 0.00 C ATOM 562 CG LYS A 37 -10.226 -10.250 -13.240 1.00 0.00 C ATOM 563 CD LYS A 37 -11.435 -11.169 -13.182 1.00 0.00 C ATOM 564 CE LYS A 37 -11.088 -12.576 -13.646 1.00 0.00 C ATOM 565 NZ LYS A 37 -11.111 -12.692 -15.130 1.00 0.00 N ATOM 0 H LYS A 37 -8.734 -9.400 -10.604 1.00 0.00 H new ATOM 0 HA LYS A 37 -8.688 -7.991 -13.179 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -10.906 -9.218 -11.494 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -11.186 -8.355 -12.993 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -10.002 -10.007 -14.279 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -9.355 -10.767 -12.838 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -11.817 -11.205 -12.162 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -12.231 -10.765 -13.807 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -10.099 -12.847 -13.276 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -11.795 -13.285 -13.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -10.869 -13.665 -15.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -12.061 -12.458 -15.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -10.418 -12.034 -15.540 1.00 0.00 H new ATOM 579 N ARG A 38 -9.456 -6.684 -10.311 1.00 0.00 N ATOM 580 CA ARG A 38 -9.771 -5.439 -9.622 1.00 0.00 C ATOM 581 C ARG A 38 -8.506 -4.623 -9.368 1.00 0.00 C ATOM 582 O ARG A 38 -7.454 -5.174 -9.041 1.00 0.00 O ATOM 583 CB ARG A 38 -10.477 -5.729 -8.296 1.00 0.00 C ATOM 584 CG ARG A 38 -10.741 -4.486 -7.462 1.00 0.00 C ATOM 585 CD ARG A 38 -11.128 -4.845 -6.035 1.00 0.00 C ATOM 586 NE ARG A 38 -12.127 -5.909 -5.991 1.00 0.00 N ATOM 587 CZ ARG A 38 -11.823 -7.200 -5.915 1.00 0.00 C ATOM 588 NH1 ARG A 38 -10.555 -7.584 -5.874 1.00 0.00 N ATOM 589 NH2 ARG A 38 -12.789 -8.109 -5.878 1.00 0.00 N ATOM 0 H ARG A 38 -9.165 -7.444 -9.696 1.00 0.00 H new ATOM 0 HA ARG A 38 -10.436 -4.858 -10.261 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -11.425 -6.227 -8.500 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -9.870 -6.424 -7.715 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -9.851 -3.857 -7.452 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -11.539 -3.901 -7.920 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -10.240 -5.159 -5.486 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -11.518 -3.960 -5.532 1.00 0.00 H new ATOM 0 HE ARG A 38 -13.112 -5.647 -6.020 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -9.810 -6.888 -5.901 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -10.324 -8.576 -5.816 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -13.766 -7.817 -5.908 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -12.555 -9.100 -5.820 1.00 0.00 H new ATOM 603 N LEU A 39 -8.616 -3.308 -9.523 1.00 0.00 N ATOM 604 CA LEU A 39 -7.482 -2.415 -9.312 1.00 0.00 C ATOM 605 C LEU A 39 -7.733 -1.485 -8.129 1.00 0.00 C ATOM 606 O LEU A 39 -8.784 -1.549 -7.490 1.00 0.00 O ATOM 607 CB LEU A 39 -7.213 -1.593 -10.573 1.00 0.00 C ATOM 608 CG LEU A 39 -6.503 -2.325 -11.713 1.00 0.00 C ATOM 609 CD1 LEU A 39 -6.266 -1.386 -12.885 1.00 0.00 C ATOM 610 CD2 LEU A 39 -5.188 -2.918 -11.228 1.00 0.00 C ATOM 0 H LEU A 39 -9.479 -2.837 -9.794 1.00 0.00 H new ATOM 0 HA LEU A 39 -6.607 -3.026 -9.091 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -8.165 -1.217 -10.947 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.614 -0.726 -10.296 1.00 0.00 H new ATOM 0 HG LEU A 39 -7.144 -3.140 -12.051 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -5.760 -1.925 -13.686 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -7.222 -1.009 -13.248 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -5.646 -0.550 -12.562 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -4.696 -3.435 -12.052 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -4.542 -2.120 -10.863 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -5.383 -3.624 -10.421 1.00 0.00 H new ATOM 622 N ILE A 40 -6.764 -0.622 -7.845 1.00 0.00 N ATOM 623 CA ILE A 40 -6.882 0.323 -6.742 1.00 0.00 C ATOM 624 C ILE A 40 -7.299 1.702 -7.241 1.00 0.00 C ATOM 625 O ILE A 40 -6.558 2.357 -7.975 1.00 0.00 O ATOM 626 CB ILE A 40 -5.559 0.449 -5.964 1.00 0.00 C ATOM 627 CG1 ILE A 40 -5.130 -0.915 -5.419 1.00 0.00 C ATOM 628 CG2 ILE A 40 -5.703 1.455 -4.832 1.00 0.00 C ATOM 629 CD1 ILE A 40 -3.826 -0.878 -4.654 1.00 0.00 C ATOM 0 H ILE A 40 -5.888 -0.558 -8.364 1.00 0.00 H new ATOM 0 HA ILE A 40 -7.651 -0.067 -6.074 1.00 0.00 H new ATOM 0 HB ILE A 40 -4.787 0.806 -6.646 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -5.914 -1.299 -4.766 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -5.035 -1.615 -6.249 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -4.759 1.532 -4.292 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -5.967 2.430 -5.243 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -6.486 1.125 -4.149 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -3.585 -1.879 -4.298 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -3.030 -0.524 -5.309 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -3.922 -0.203 -3.803 1.00 0.00 H new ATOM 641 N ARG A 41 -8.488 2.137 -6.837 1.00 0.00 N ATOM 642 CA ARG A 41 -9.003 3.439 -7.244 1.00 0.00 C ATOM 643 C ARG A 41 -8.700 4.498 -6.187 1.00 0.00 C ATOM 644 O ARG A 41 -8.075 5.518 -6.476 1.00 0.00 O ATOM 645 CB ARG A 41 -10.511 3.362 -7.486 1.00 0.00 C ATOM 646 CG ARG A 41 -10.880 2.990 -8.913 1.00 0.00 C ATOM 647 CD ARG A 41 -10.532 4.105 -9.887 1.00 0.00 C ATOM 648 NE ARG A 41 -9.171 3.977 -10.401 1.00 0.00 N ATOM 649 CZ ARG A 41 -8.823 3.122 -11.356 1.00 0.00 C ATOM 650 NH1 ARG A 41 -9.732 2.323 -11.897 1.00 0.00 N ATOM 651 NH2 ARG A 41 -7.564 3.064 -11.771 1.00 0.00 N ATOM 0 H ARG A 41 -9.112 1.607 -6.229 1.00 0.00 H new ATOM 0 HA ARG A 41 -8.507 3.724 -8.172 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -10.943 2.629 -6.805 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -10.959 4.325 -7.243 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -10.356 2.078 -9.200 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -11.947 2.776 -8.970 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -11.236 4.093 -10.719 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -10.643 5.069 -9.390 1.00 0.00 H new ATOM 0 HE ARG A 41 -8.448 4.577 -10.005 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -10.701 2.364 -11.580 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -9.463 1.667 -12.630 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -6.862 3.677 -11.356 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -7.299 2.407 -12.504 1.00 0.00 H new ATOM 665 N ASP A 42 -9.148 4.247 -4.961 1.00 0.00 N ATOM 666 CA ASP A 42 -8.925 5.178 -3.861 1.00 0.00 C ATOM 667 C ASP A 42 -7.962 4.587 -2.836 1.00 0.00 C ATOM 668 O ASP A 42 -8.357 3.788 -1.986 1.00 0.00 O ATOM 669 CB ASP A 42 -10.252 5.531 -3.187 1.00 0.00 C ATOM 670 CG ASP A 42 -11.257 4.399 -3.258 1.00 0.00 C ATOM 671 OD1 ASP A 42 -10.829 3.226 -3.301 1.00 0.00 O ATOM 672 OD2 ASP A 42 -12.473 4.685 -3.270 1.00 0.00 O ATOM 0 H ASP A 42 -9.667 3.407 -4.705 1.00 0.00 H new ATOM 0 HA ASP A 42 -8.481 6.086 -4.270 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -10.069 5.786 -2.143 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -10.673 6.417 -3.662 1.00 0.00 H new ATOM 677 N LEU A 43 -6.697 4.983 -2.923 1.00 0.00 N ATOM 678 CA LEU A 43 -5.676 4.492 -2.004 1.00 0.00 C ATOM 679 C LEU A 43 -6.119 4.666 -0.555 1.00 0.00 C ATOM 680 O LEU A 43 -5.698 3.917 0.326 1.00 0.00 O ATOM 681 CB LEU A 43 -4.356 5.228 -2.238 1.00 0.00 C ATOM 682 CG LEU A 43 -3.092 4.502 -1.775 1.00 0.00 C ATOM 683 CD1 LEU A 43 -2.880 3.231 -2.583 1.00 0.00 C ATOM 684 CD2 LEU A 43 -1.880 5.415 -1.888 1.00 0.00 C ATOM 0 H LEU A 43 -6.354 5.643 -3.621 1.00 0.00 H new ATOM 0 HA LEU A 43 -5.531 3.429 -2.195 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -4.262 5.435 -3.304 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.405 6.191 -1.730 1.00 0.00 H new ATOM 0 HG LEU A 43 -3.218 4.226 -0.728 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -1.976 2.728 -2.239 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.736 2.569 -2.451 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -2.776 3.484 -3.638 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -0.990 4.881 -1.554 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -1.751 5.722 -2.926 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.029 6.297 -1.265 1.00 0.00 H new ATOM 696 N GLN A 44 -6.972 5.657 -0.317 1.00 0.00 N ATOM 697 CA GLN A 44 -7.473 5.927 1.025 1.00 0.00 C ATOM 698 C GLN A 44 -8.505 4.885 1.441 1.00 0.00 C ATOM 699 O GLN A 44 -8.520 4.436 2.587 1.00 0.00 O ATOM 700 CB GLN A 44 -8.088 7.326 1.091 1.00 0.00 C ATOM 701 CG GLN A 44 -7.057 8.442 1.145 1.00 0.00 C ATOM 702 CD GLN A 44 -7.593 9.758 0.616 1.00 0.00 C ATOM 703 OE1 GLN A 44 -7.286 10.846 1.312 1.00 0.00 O flip ATOM 704 NE2 GLN A 44 -8.276 9.796 -0.408 1.00 0.00 N flip ATOM 0 H GLN A 44 -7.330 6.286 -1.036 1.00 0.00 H new ATOM 0 HA GLN A 44 -6.632 5.875 1.716 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -8.727 7.474 0.220 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -8.728 7.391 1.971 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -6.726 8.576 2.175 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -6.181 8.151 0.565 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -8.488 8.935 -0.912 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -8.630 10.689 -0.752 1.00 0.00 H new ATOM 713 N GLN A 45 -9.367 4.505 0.503 1.00 0.00 N ATOM 714 CA GLN A 45 -10.403 3.516 0.773 1.00 0.00 C ATOM 715 C GLN A 45 -10.004 2.147 0.232 1.00 0.00 C ATOM 716 O GLN A 45 -10.801 1.209 0.241 1.00 0.00 O ATOM 717 CB GLN A 45 -11.731 3.955 0.153 1.00 0.00 C ATOM 718 CG GLN A 45 -12.532 4.898 1.036 1.00 0.00 C ATOM 719 CD GLN A 45 -14.026 4.787 0.804 1.00 0.00 C ATOM 720 OE1 GLN A 45 -14.616 3.720 0.982 1.00 0.00 O ATOM 721 NE2 GLN A 45 -14.648 5.891 0.405 1.00 0.00 N ATOM 0 H GLN A 45 -9.368 4.867 -0.450 1.00 0.00 H new ATOM 0 HA GLN A 45 -10.522 3.438 1.854 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -11.533 4.444 -0.801 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -12.333 3.071 -0.060 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -12.314 4.683 2.082 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -12.214 5.924 0.848 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -14.120 6.753 0.270 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -15.653 5.876 0.234 1.00 0.00 H new ATOM 730 N ASP A 46 -8.767 2.041 -0.238 1.00 0.00 N ATOM 731 CA ASP A 46 -8.261 0.786 -0.783 1.00 0.00 C ATOM 732 C ASP A 46 -7.452 0.026 0.263 1.00 0.00 C ATOM 733 O ASP A 46 -6.991 -1.089 0.018 1.00 0.00 O ATOM 734 CB ASP A 46 -7.399 1.052 -2.018 1.00 0.00 C ATOM 735 CG ASP A 46 -8.213 1.086 -3.296 1.00 0.00 C ATOM 736 OD1 ASP A 46 -8.592 0.002 -3.787 1.00 0.00 O ATOM 737 OD2 ASP A 46 -8.470 2.197 -3.807 1.00 0.00 O ATOM 0 H ASP A 46 -8.095 2.809 -0.253 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.115 0.173 -1.071 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -6.879 2.002 -1.897 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -6.635 0.279 -2.098 1.00 0.00 H new ATOM 742 N VAL A 47 -7.283 0.637 1.432 1.00 0.00 N ATOM 743 CA VAL A 47 -6.530 0.018 2.516 1.00 0.00 C ATOM 744 C VAL A 47 -7.310 0.066 3.825 1.00 0.00 C ATOM 745 O VAL A 47 -6.835 -0.396 4.862 1.00 0.00 O ATOM 746 CB VAL A 47 -5.167 0.708 2.718 1.00 0.00 C ATOM 747 CG1 VAL A 47 -4.312 0.577 1.467 1.00 0.00 C ATOM 748 CG2 VAL A 47 -5.361 2.170 3.091 1.00 0.00 C ATOM 0 H VAL A 47 -7.658 1.560 1.652 1.00 0.00 H new ATOM 0 HA VAL A 47 -6.365 -1.022 2.233 1.00 0.00 H new ATOM 0 HB VAL A 47 -4.646 0.214 3.538 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -3.353 1.070 1.628 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -4.145 -0.478 1.249 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -4.824 1.045 0.626 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -4.388 2.642 3.230 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -5.902 2.680 2.294 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -5.932 2.237 4.017 1.00 0.00 H new ATOM 758 N THR A 48 -8.513 0.629 3.769 1.00 0.00 N ATOM 759 CA THR A 48 -9.361 0.739 4.950 1.00 0.00 C ATOM 760 C THR A 48 -9.646 -0.633 5.551 1.00 0.00 C ATOM 761 O THR A 48 -9.643 -0.799 6.771 1.00 0.00 O ATOM 762 CB THR A 48 -10.697 1.430 4.620 1.00 0.00 C ATOM 763 OG1 THR A 48 -11.113 1.085 3.294 1.00 0.00 O ATOM 764 CG2 THR A 48 -10.569 2.941 4.740 1.00 0.00 C ATOM 0 H THR A 48 -8.922 1.016 2.918 1.00 0.00 H new ATOM 0 HA THR A 48 -8.817 1.345 5.675 1.00 0.00 H new ATOM 0 HB THR A 48 -11.444 1.087 5.335 1.00 0.00 H new ATOM 0 HG1 THR A 48 -11.964 1.527 3.093 1.00 0.00 H new ATOM 0 HG21 THR A 48 -11.525 3.407 4.502 1.00 0.00 H new ATOM 0 HG22 THR A 48 -10.281 3.202 5.758 1.00 0.00 H new ATOM 0 HG23 THR A 48 -9.809 3.298 4.045 1.00 0.00 H new ATOM 772 N ASP A 49 -9.892 -1.612 4.688 1.00 0.00 N ATOM 773 CA ASP A 49 -10.177 -2.971 5.135 1.00 0.00 C ATOM 774 C ASP A 49 -8.886 -3.748 5.370 1.00 0.00 C ATOM 775 O ASP A 49 -8.836 -4.652 6.203 1.00 0.00 O ATOM 776 CB ASP A 49 -11.044 -3.697 4.105 1.00 0.00 C ATOM 777 CG ASP A 49 -11.464 -5.077 4.572 1.00 0.00 C ATOM 778 OD1 ASP A 49 -10.596 -5.826 5.067 1.00 0.00 O ATOM 779 OD2 ASP A 49 -12.661 -5.408 4.443 1.00 0.00 O ATOM 0 H ASP A 49 -9.900 -1.491 3.675 1.00 0.00 H new ATOM 0 HA ASP A 49 -10.720 -2.911 6.078 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -11.933 -3.101 3.897 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -10.493 -3.785 3.168 1.00 0.00 H new ATOM 784 N GLY A 50 -7.842 -3.390 4.628 1.00 0.00 N ATOM 785 CA GLY A 50 -6.565 -4.065 4.770 1.00 0.00 C ATOM 786 C GLY A 50 -6.466 -5.307 3.906 1.00 0.00 C ATOM 787 O GLY A 50 -5.389 -5.881 3.753 1.00 0.00 O ATOM 0 H GLY A 50 -7.858 -2.645 3.932 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -5.762 -3.377 4.505 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -6.417 -4.340 5.814 1.00 0.00 H new ATOM 791 N VAL A 51 -7.595 -5.723 3.340 1.00 0.00 N ATOM 792 CA VAL A 51 -7.631 -6.905 2.487 1.00 0.00 C ATOM 793 C VAL A 51 -6.895 -6.659 1.175 1.00 0.00 C ATOM 794 O VAL A 51 -5.847 -7.252 0.918 1.00 0.00 O ATOM 795 CB VAL A 51 -9.079 -7.331 2.179 1.00 0.00 C ATOM 796 CG1 VAL A 51 -9.103 -8.403 1.101 1.00 0.00 C ATOM 797 CG2 VAL A 51 -9.771 -7.819 3.443 1.00 0.00 C ATOM 0 H VAL A 51 -8.496 -5.259 3.457 1.00 0.00 H new ATOM 0 HA VAL A 51 -7.133 -7.705 3.034 1.00 0.00 H new ATOM 0 HB VAL A 51 -9.623 -6.463 1.806 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -10.134 -8.691 0.897 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -8.648 -8.013 0.190 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -8.544 -9.274 1.442 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -10.793 -8.116 3.207 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -9.229 -8.674 3.848 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -9.787 -7.017 4.181 1.00 0.00 H new ATOM 807 N LEU A 52 -7.451 -5.781 0.347 1.00 0.00 N ATOM 808 CA LEU A 52 -6.847 -5.455 -0.940 1.00 0.00 C ATOM 809 C LEU A 52 -5.411 -4.972 -0.762 1.00 0.00 C ATOM 810 O LEU A 52 -4.571 -5.148 -1.645 1.00 0.00 O ATOM 811 CB LEU A 52 -7.672 -4.384 -1.656 1.00 0.00 C ATOM 812 CG LEU A 52 -7.641 -4.423 -3.184 1.00 0.00 C ATOM 813 CD1 LEU A 52 -8.528 -3.331 -3.764 1.00 0.00 C ATOM 814 CD2 LEU A 52 -6.214 -4.280 -3.693 1.00 0.00 C ATOM 0 H LEU A 52 -8.319 -5.282 0.544 1.00 0.00 H new ATOM 0 HA LEU A 52 -6.833 -6.361 -1.546 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -8.709 -4.475 -1.331 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -7.320 -3.405 -1.330 1.00 0.00 H new ATOM 0 HG LEU A 52 -8.027 -5.388 -3.511 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -8.493 -3.374 -4.853 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -9.554 -3.479 -3.427 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -8.173 -2.357 -3.428 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -6.212 -4.310 -4.783 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -5.801 -3.330 -3.355 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -5.606 -5.098 -3.306 1.00 0.00 H new ATOM 826 N LEU A 53 -5.135 -4.365 0.387 1.00 0.00 N ATOM 827 CA LEU A 53 -3.800 -3.859 0.684 1.00 0.00 C ATOM 828 C LEU A 53 -2.793 -5.001 0.779 1.00 0.00 C ATOM 829 O LEU A 53 -1.843 -5.070 0.000 1.00 0.00 O ATOM 830 CB LEU A 53 -3.812 -3.065 1.991 1.00 0.00 C ATOM 831 CG LEU A 53 -2.500 -3.042 2.776 1.00 0.00 C ATOM 832 CD1 LEU A 53 -1.342 -2.658 1.868 1.00 0.00 C ATOM 833 CD2 LEU A 53 -2.599 -2.084 3.953 1.00 0.00 C ATOM 0 H LEU A 53 -5.818 -4.211 1.128 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.499 -3.200 -0.131 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -4.095 -2.037 1.765 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -4.590 -3.476 2.635 1.00 0.00 H new ATOM 0 HG LEU A 53 -2.313 -4.043 3.164 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -0.416 -2.647 2.444 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -1.258 -3.384 1.059 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -1.521 -1.668 1.449 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -1.656 -2.081 4.500 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -2.810 -1.079 3.587 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -3.402 -2.405 4.616 1.00 0.00 H new ATOM 845 N ALA A 54 -3.010 -5.895 1.737 1.00 0.00 N ATOM 846 CA ALA A 54 -2.124 -7.037 1.931 1.00 0.00 C ATOM 847 C ALA A 54 -1.885 -7.775 0.618 1.00 0.00 C ATOM 848 O ALA A 54 -0.778 -8.242 0.353 1.00 0.00 O ATOM 849 CB ALA A 54 -2.703 -7.983 2.973 1.00 0.00 C ATOM 0 H ALA A 54 -3.791 -5.851 2.391 1.00 0.00 H new ATOM 0 HA ALA A 54 -1.164 -6.665 2.288 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -2.031 -8.831 3.108 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -2.816 -7.456 3.920 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -3.677 -8.341 2.638 1.00 0.00 H new ATOM 855 N GLN A 55 -2.929 -7.876 -0.198 1.00 0.00 N ATOM 856 CA GLN A 55 -2.831 -8.559 -1.482 1.00 0.00 C ATOM 857 C GLN A 55 -1.540 -8.181 -2.202 1.00 0.00 C ATOM 858 O GLN A 55 -0.930 -9.011 -2.878 1.00 0.00 O ATOM 859 CB GLN A 55 -4.037 -8.217 -2.359 1.00 0.00 C ATOM 860 CG GLN A 55 -5.354 -8.742 -1.812 1.00 0.00 C ATOM 861 CD GLN A 55 -6.361 -9.042 -2.905 1.00 0.00 C ATOM 862 OE1 GLN A 55 -6.556 -8.090 -3.809 1.00 0.00 O flip ATOM 863 NE2 GLN A 55 -6.958 -10.119 -2.936 1.00 0.00 N flip ATOM 0 H GLN A 55 -3.852 -7.494 0.007 1.00 0.00 H new ATOM 0 HA GLN A 55 -2.820 -9.633 -1.294 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -4.103 -7.134 -2.466 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -3.878 -8.626 -3.357 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -5.168 -9.648 -1.235 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -5.776 -8.008 -1.125 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -6.777 -10.823 -2.220 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -7.633 -10.307 -3.677 1.00 0.00 H new ATOM 872 N ILE A 56 -1.131 -6.926 -2.054 1.00 0.00 N ATOM 873 CA ILE A 56 0.087 -6.440 -2.690 1.00 0.00 C ATOM 874 C ILE A 56 1.320 -6.817 -1.876 1.00 0.00 C ATOM 875 O ILE A 56 2.260 -7.418 -2.397 1.00 0.00 O ATOM 876 CB ILE A 56 0.055 -4.911 -2.872 1.00 0.00 C ATOM 877 CG1 ILE A 56 -1.037 -4.517 -3.870 1.00 0.00 C ATOM 878 CG2 ILE A 56 1.412 -4.404 -3.337 1.00 0.00 C ATOM 879 CD1 ILE A 56 -2.390 -4.297 -3.230 1.00 0.00 C ATOM 0 H ILE A 56 -1.625 -6.227 -1.499 1.00 0.00 H new ATOM 0 HA ILE A 56 0.142 -6.914 -3.670 1.00 0.00 H new ATOM 0 HB ILE A 56 -0.173 -4.450 -1.911 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -0.735 -3.605 -4.385 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -1.125 -5.296 -4.627 1.00 0.00 H new ATOM 0 HG21 ILE A 56 1.373 -3.322 -3.461 1.00 0.00 H new ATOM 0 HG22 ILE A 56 2.169 -4.657 -2.595 1.00 0.00 H new ATOM 0 HG23 ILE A 56 1.668 -4.869 -4.289 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -3.114 -4.021 -3.996 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -2.714 -5.215 -2.739 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -2.318 -3.497 -2.493 1.00 0.00 H new ATOM 891 N ILE A 57 1.309 -6.462 -0.596 1.00 0.00 N ATOM 892 CA ILE A 57 2.425 -6.766 0.291 1.00 0.00 C ATOM 893 C ILE A 57 2.870 -8.217 0.136 1.00 0.00 C ATOM 894 O ILE A 57 4.025 -8.489 -0.190 1.00 0.00 O ATOM 895 CB ILE A 57 2.060 -6.508 1.765 1.00 0.00 C ATOM 896 CG1 ILE A 57 1.527 -5.084 1.938 1.00 0.00 C ATOM 897 CG2 ILE A 57 3.270 -6.739 2.658 1.00 0.00 C ATOM 898 CD1 ILE A 57 1.231 -4.721 3.377 1.00 0.00 C ATOM 0 H ILE A 57 0.539 -5.963 -0.150 1.00 0.00 H new ATOM 0 HA ILE A 57 3.243 -6.104 0.007 1.00 0.00 H new ATOM 0 HB ILE A 57 1.277 -7.207 2.059 1.00 0.00 H new ATOM 0 HG12 ILE A 57 2.256 -4.380 1.537 1.00 0.00 H new ATOM 0 HG13 ILE A 57 0.617 -4.971 1.349 1.00 0.00 H new ATOM 0 HG21 ILE A 57 2.997 -6.553 3.697 1.00 0.00 H new ATOM 0 HG22 ILE A 57 3.610 -7.769 2.551 1.00 0.00 H new ATOM 0 HG23 ILE A 57 4.072 -6.061 2.367 1.00 0.00 H new ATOM 0 HD11 ILE A 57 0.857 -3.698 3.425 1.00 0.00 H new ATOM 0 HD12 ILE A 57 0.479 -5.401 3.777 1.00 0.00 H new ATOM 0 HD13 ILE A 57 2.144 -4.802 3.968 1.00 0.00 H new ATOM 910 N GLN A 58 1.945 -9.142 0.371 1.00 0.00 N ATOM 911 CA GLN A 58 2.243 -10.565 0.257 1.00 0.00 C ATOM 912 C GLN A 58 2.969 -10.866 -1.051 1.00 0.00 C ATOM 913 O GLN A 58 3.695 -11.854 -1.156 1.00 0.00 O ATOM 914 CB GLN A 58 0.955 -11.385 0.339 1.00 0.00 C ATOM 915 CG GLN A 58 0.282 -11.327 1.701 1.00 0.00 C ATOM 916 CD GLN A 58 -1.111 -11.924 1.690 1.00 0.00 C ATOM 917 OE1 GLN A 58 -2.060 -11.324 2.197 1.00 0.00 O ATOM 918 NE2 GLN A 58 -1.242 -13.111 1.111 1.00 0.00 N ATOM 0 H GLN A 58 0.984 -8.932 0.641 1.00 0.00 H new ATOM 0 HA GLN A 58 2.895 -10.842 1.085 1.00 0.00 H new ATOM 0 HB2 GLN A 58 0.257 -11.026 -0.417 1.00 0.00 H new ATOM 0 HB3 GLN A 58 1.180 -12.424 0.098 1.00 0.00 H new ATOM 0 HG2 GLN A 58 0.895 -11.859 2.428 1.00 0.00 H new ATOM 0 HG3 GLN A 58 0.226 -10.289 2.030 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -0.429 -13.572 0.704 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -2.156 -13.562 1.073 1.00 0.00 H new ATOM 927 N VAL A 59 2.767 -10.007 -2.045 1.00 0.00 N ATOM 928 CA VAL A 59 3.403 -10.180 -3.346 1.00 0.00 C ATOM 929 C VAL A 59 4.796 -9.561 -3.364 1.00 0.00 C ATOM 930 O VAL A 59 5.797 -10.264 -3.502 1.00 0.00 O ATOM 931 CB VAL A 59 2.559 -9.552 -4.471 1.00 0.00 C ATOM 932 CG1 VAL A 59 3.183 -9.835 -5.828 1.00 0.00 C ATOM 933 CG2 VAL A 59 1.129 -10.066 -4.415 1.00 0.00 C ATOM 0 H VAL A 59 2.168 -9.184 -1.974 1.00 0.00 H new ATOM 0 HA VAL A 59 3.484 -11.253 -3.518 1.00 0.00 H new ATOM 0 HB VAL A 59 2.538 -8.472 -4.326 1.00 0.00 H new ATOM 0 HG11 VAL A 59 2.573 -9.384 -6.610 1.00 0.00 H new ATOM 0 HG12 VAL A 59 4.187 -9.413 -5.862 1.00 0.00 H new ATOM 0 HG13 VAL A 59 3.237 -10.912 -5.986 1.00 0.00 H new ATOM 0 HG21 VAL A 59 0.547 -9.612 -5.217 1.00 0.00 H new ATOM 0 HG22 VAL A 59 1.127 -11.149 -4.534 1.00 0.00 H new ATOM 0 HG23 VAL A 59 0.686 -9.806 -3.454 1.00 0.00 H new ATOM 943 N VAL A 60 4.852 -8.241 -3.222 1.00 0.00 N ATOM 944 CA VAL A 60 6.123 -7.526 -3.220 1.00 0.00 C ATOM 945 C VAL A 60 7.069 -8.090 -2.166 1.00 0.00 C ATOM 946 O VAL A 60 8.281 -7.883 -2.231 1.00 0.00 O ATOM 947 CB VAL A 60 5.921 -6.021 -2.960 1.00 0.00 C ATOM 948 CG1 VAL A 60 5.162 -5.802 -1.660 1.00 0.00 C ATOM 949 CG2 VAL A 60 7.260 -5.300 -2.934 1.00 0.00 C ATOM 0 H VAL A 60 4.032 -7.645 -3.107 1.00 0.00 H new ATOM 0 HA VAL A 60 6.563 -7.660 -4.208 1.00 0.00 H new ATOM 0 HB VAL A 60 5.327 -5.605 -3.774 1.00 0.00 H new ATOM 0 HG11 VAL A 60 5.028 -4.733 -1.492 1.00 0.00 H new ATOM 0 HG12 VAL A 60 4.186 -6.284 -1.723 1.00 0.00 H new ATOM 0 HG13 VAL A 60 5.727 -6.231 -0.832 1.00 0.00 H new ATOM 0 HG21 VAL A 60 7.098 -4.238 -2.749 1.00 0.00 H new ATOM 0 HG22 VAL A 60 7.882 -5.716 -2.141 1.00 0.00 H new ATOM 0 HG23 VAL A 60 7.761 -5.429 -3.893 1.00 0.00 H new ATOM 959 N ALA A 61 6.508 -8.804 -1.196 1.00 0.00 N ATOM 960 CA ALA A 61 7.301 -9.400 -0.129 1.00 0.00 C ATOM 961 C ALA A 61 7.315 -10.921 -0.240 1.00 0.00 C ATOM 962 O ALA A 61 7.989 -11.603 0.532 1.00 0.00 O ATOM 963 CB ALA A 61 6.766 -8.973 1.229 1.00 0.00 C ATOM 0 H ALA A 61 5.506 -8.984 -1.127 1.00 0.00 H new ATOM 0 HA ALA A 61 8.326 -9.045 -0.231 1.00 0.00 H new ATOM 0 HB1 ALA A 61 7.368 -9.426 2.016 1.00 0.00 H new ATOM 0 HB2 ALA A 61 6.815 -7.887 1.314 1.00 0.00 H new ATOM 0 HB3 ALA A 61 5.731 -9.299 1.331 1.00 0.00 H new ATOM 969 N ASN A 62 6.566 -11.447 -1.204 1.00 0.00 N ATOM 970 CA ASN A 62 6.492 -12.888 -1.414 1.00 0.00 C ATOM 971 C ASN A 62 6.255 -13.618 -0.096 1.00 0.00 C ATOM 972 O ASN A 62 6.897 -14.629 0.189 1.00 0.00 O ATOM 973 CB ASN A 62 7.779 -13.396 -2.067 1.00 0.00 C ATOM 974 CG ASN A 62 7.639 -14.810 -2.597 1.00 0.00 C ATOM 975 OD1 ASN A 62 6.536 -15.354 -2.664 1.00 0.00 O ATOM 976 ND2 ASN A 62 8.759 -15.413 -2.977 1.00 0.00 N ATOM 0 H ASN A 62 6.002 -10.897 -1.852 1.00 0.00 H new ATOM 0 HA ASN A 62 5.651 -13.091 -2.078 1.00 0.00 H new ATOM 0 HB2 ASN A 62 8.056 -12.730 -2.884 1.00 0.00 H new ATOM 0 HB3 ASN A 62 8.590 -13.362 -1.340 1.00 0.00 H new ATOM 0 HD21 ASN A 62 8.727 -16.365 -3.342 1.00 0.00 H new ATOM 0 HD22 ASN A 62 9.651 -14.924 -2.904 1.00 0.00 H new ATOM 983 N GLU A 63 5.328 -13.100 0.704 1.00 0.00 N ATOM 984 CA GLU A 63 5.006 -13.703 1.992 1.00 0.00 C ATOM 985 C GLU A 63 3.503 -13.658 2.253 1.00 0.00 C ATOM 986 O GLU A 63 2.758 -12.983 1.544 1.00 0.00 O ATOM 987 CB GLU A 63 5.753 -12.984 3.117 1.00 0.00 C ATOM 988 CG GLU A 63 6.002 -13.856 4.336 1.00 0.00 C ATOM 989 CD GLU A 63 6.520 -15.234 3.972 1.00 0.00 C ATOM 990 OE1 GLU A 63 7.687 -15.333 3.537 1.00 0.00 O ATOM 991 OE2 GLU A 63 5.759 -16.213 4.120 1.00 0.00 O ATOM 0 H GLU A 63 4.787 -12.264 0.483 1.00 0.00 H new ATOM 0 HA GLU A 63 5.321 -14.746 1.966 1.00 0.00 H new ATOM 0 HB2 GLU A 63 6.709 -12.625 2.736 1.00 0.00 H new ATOM 0 HB3 GLU A 63 5.181 -12.107 3.419 1.00 0.00 H new ATOM 0 HG2 GLU A 63 6.721 -13.363 4.990 1.00 0.00 H new ATOM 0 HG3 GLU A 63 5.075 -13.958 4.901 1.00 0.00 H new ATOM 998 N LYS A 64 3.065 -14.382 3.278 1.00 0.00 N ATOM 999 CA LYS A 64 1.653 -14.426 3.636 1.00 0.00 C ATOM 1000 C LYS A 64 1.432 -13.888 5.046 1.00 0.00 C ATOM 1001 O LYS A 64 2.213 -14.168 5.956 1.00 0.00 O ATOM 1002 CB LYS A 64 1.125 -15.859 3.537 1.00 0.00 C ATOM 1003 CG LYS A 64 -0.391 -15.947 3.485 1.00 0.00 C ATOM 1004 CD LYS A 64 -0.898 -17.224 4.133 1.00 0.00 C ATOM 1005 CE LYS A 64 -0.445 -18.457 3.365 1.00 0.00 C ATOM 1006 NZ LYS A 64 -1.347 -18.759 2.219 1.00 0.00 N ATOM 0 H LYS A 64 3.669 -14.947 3.876 1.00 0.00 H new ATOM 0 HA LYS A 64 1.107 -13.795 2.935 1.00 0.00 H new ATOM 0 HB2 LYS A 64 1.539 -16.329 2.645 1.00 0.00 H new ATOM 0 HB3 LYS A 64 1.484 -16.430 4.393 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -0.824 -15.084 3.991 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -0.723 -15.908 2.448 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -0.537 -17.280 5.160 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -1.987 -17.202 4.179 1.00 0.00 H new ATOM 0 HE2 LYS A 64 0.570 -18.304 2.998 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -0.414 -19.313 4.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -1.005 -19.606 1.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -2.310 -18.930 2.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -1.357 -17.952 1.563 1.00 0.00 H new ATOM 1020 N ILE A 65 0.364 -13.117 5.219 1.00 0.00 N ATOM 1021 CA ILE A 65 0.040 -12.542 6.519 1.00 0.00 C ATOM 1022 C ILE A 65 -1.095 -13.307 7.190 1.00 0.00 C ATOM 1023 O ILE A 65 -2.270 -13.057 6.920 1.00 0.00 O ATOM 1024 CB ILE A 65 -0.357 -11.059 6.396 1.00 0.00 C ATOM 1025 CG1 ILE A 65 0.672 -10.301 5.555 1.00 0.00 C ATOM 1026 CG2 ILE A 65 -0.489 -10.430 7.775 1.00 0.00 C ATOM 1027 CD1 ILE A 65 0.235 -8.902 5.182 1.00 0.00 C ATOM 0 H ILE A 65 -0.292 -12.876 4.476 1.00 0.00 H new ATOM 0 HA ILE A 65 0.939 -12.619 7.131 1.00 0.00 H new ATOM 0 HB ILE A 65 -1.323 -10.997 5.896 1.00 0.00 H new ATOM 0 HG12 ILE A 65 1.610 -10.245 6.107 1.00 0.00 H new ATOM 0 HG13 ILE A 65 0.872 -10.866 4.644 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -0.770 -9.382 7.671 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -1.256 -10.957 8.343 1.00 0.00 H new ATOM 0 HG23 ILE A 65 0.464 -10.500 8.300 1.00 0.00 H new ATOM 0 HD11 ILE A 65 1.013 -8.424 4.587 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -0.687 -8.951 4.602 1.00 0.00 H new ATOM 0 HD13 ILE A 65 0.063 -8.321 6.088 1.00 0.00 H new ATOM 1039 N GLU A 66 -0.737 -14.238 8.068 1.00 0.00 N ATOM 1040 CA GLU A 66 -1.726 -15.039 8.779 1.00 0.00 C ATOM 1041 C GLU A 66 -2.481 -14.191 9.799 1.00 0.00 C ATOM 1042 O GLU A 66 -3.447 -14.648 10.410 1.00 0.00 O ATOM 1043 CB GLU A 66 -1.052 -16.219 9.481 1.00 0.00 C ATOM 1044 CG GLU A 66 -0.251 -17.108 8.543 1.00 0.00 C ATOM 1045 CD GLU A 66 0.037 -18.473 9.137 1.00 0.00 C ATOM 1046 OE1 GLU A 66 -0.831 -19.000 9.863 1.00 0.00 O ATOM 1047 OE2 GLU A 66 1.132 -19.013 8.875 1.00 0.00 O ATOM 0 H GLU A 66 0.231 -14.456 8.304 1.00 0.00 H new ATOM 0 HA GLU A 66 -2.439 -15.420 8.048 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -0.391 -15.838 10.260 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -1.815 -16.821 9.976 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -0.799 -17.231 7.609 1.00 0.00 H new ATOM 0 HG3 GLU A 66 0.691 -16.616 8.298 1.00 0.00 H new ATOM 1054 N ASP A 67 -2.032 -12.953 9.979 1.00 0.00 N ATOM 1055 CA ASP A 67 -2.663 -12.040 10.924 1.00 0.00 C ATOM 1056 C ASP A 67 -3.678 -11.145 10.220 1.00 0.00 C ATOM 1057 O ASP A 67 -3.904 -10.005 10.629 1.00 0.00 O ATOM 1058 CB ASP A 67 -1.606 -11.184 11.623 1.00 0.00 C ATOM 1059 CG ASP A 67 -1.037 -11.858 12.855 1.00 0.00 C ATOM 1060 OD1 ASP A 67 -0.166 -12.739 12.700 1.00 0.00 O ATOM 1061 OD2 ASP A 67 -1.462 -11.505 13.976 1.00 0.00 O ATOM 0 H ASP A 67 -1.233 -12.559 9.482 1.00 0.00 H new ATOM 0 HA ASP A 67 -3.188 -12.635 11.671 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -0.798 -10.968 10.924 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -2.046 -10.228 11.906 1.00 0.00 H new ATOM 1066 N ILE A 68 -4.284 -11.667 9.159 1.00 0.00 N ATOM 1067 CA ILE A 68 -5.274 -10.915 8.398 1.00 0.00 C ATOM 1068 C ILE A 68 -6.667 -11.513 8.565 1.00 0.00 C ATOM 1069 O ILE A 68 -6.841 -12.729 8.514 1.00 0.00 O ATOM 1070 CB ILE A 68 -4.921 -10.875 6.900 1.00 0.00 C ATOM 1071 CG1 ILE A 68 -3.567 -10.194 6.690 1.00 0.00 C ATOM 1072 CG2 ILE A 68 -6.009 -10.154 6.118 1.00 0.00 C ATOM 1073 CD1 ILE A 68 -3.580 -8.714 7.001 1.00 0.00 C ATOM 0 H ILE A 68 -4.107 -12.608 8.807 1.00 0.00 H new ATOM 0 HA ILE A 68 -5.268 -9.899 8.791 1.00 0.00 H new ATOM 0 HB ILE A 68 -4.853 -11.898 6.531 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -2.822 -10.682 7.319 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -3.254 -10.337 5.656 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -5.745 -10.134 5.061 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -6.956 -10.678 6.245 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -6.106 -9.133 6.487 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -2.587 -8.298 6.830 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -4.300 -8.213 6.354 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -3.862 -8.564 8.043 1.00 0.00 H new ATOM 1085 N ASN A 69 -7.656 -10.648 8.764 1.00 0.00 N ATOM 1086 CA ASN A 69 -9.035 -11.090 8.937 1.00 0.00 C ATOM 1087 C ASN A 69 -9.626 -11.560 7.611 1.00 0.00 C ATOM 1088 O ASN A 69 -9.817 -12.755 7.394 1.00 0.00 O ATOM 1089 CB ASN A 69 -9.887 -9.959 9.516 1.00 0.00 C ATOM 1090 CG ASN A 69 -11.338 -10.361 9.697 1.00 0.00 C ATOM 1091 OD1 ASN A 69 -11.688 -11.535 9.572 1.00 0.00 O ATOM 1092 ND2 ASN A 69 -12.190 -9.387 9.992 1.00 0.00 N ATOM 0 H ASN A 69 -7.528 -9.637 8.809 1.00 0.00 H new ATOM 0 HA ASN A 69 -9.037 -11.929 9.633 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -9.475 -9.654 10.478 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -9.833 -9.093 8.856 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -13.179 -9.598 10.125 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -11.856 -8.428 10.086 1.00 0.00 H new ATOM 1099 N GLY A 70 -9.913 -10.609 6.727 1.00 0.00 N ATOM 1100 CA GLY A 70 -10.479 -10.945 5.434 1.00 0.00 C ATOM 1101 C GLY A 70 -11.819 -10.277 5.196 1.00 0.00 C ATOM 1102 O GLY A 70 -12.030 -9.643 4.161 1.00 0.00 O ATOM 0 H GLY A 70 -9.764 -9.612 6.883 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -9.784 -10.648 4.648 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -10.598 -12.026 5.363 1.00 0.00 H new ATOM 1106 N CYS A 71 -12.727 -10.419 6.155 1.00 0.00 N ATOM 1107 CA CYS A 71 -14.056 -9.826 6.044 1.00 0.00 C ATOM 1108 C CYS A 71 -14.430 -9.088 7.325 1.00 0.00 C ATOM 1109 O CYS A 71 -15.186 -9.586 8.159 1.00 0.00 O ATOM 1110 CB CYS A 71 -15.095 -10.906 5.741 1.00 0.00 C ATOM 1111 SG CYS A 71 -15.183 -11.377 3.997 1.00 0.00 S ATOM 0 H CYS A 71 -12.568 -10.939 7.018 1.00 0.00 H new ATOM 0 HA CYS A 71 -14.040 -9.108 5.224 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -14.867 -11.791 6.334 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -16.075 -10.552 6.061 1.00 0.00 H new ATOM 0 HG CYS A 71 -16.088 -12.297 3.841 1.00 0.00 H new ATOM 1117 N PRO A 72 -13.888 -7.872 7.487 1.00 0.00 N ATOM 1118 CA PRO A 72 -14.151 -7.039 8.665 1.00 0.00 C ATOM 1119 C PRO A 72 -15.582 -6.513 8.696 1.00 0.00 C ATOM 1120 O PRO A 72 -16.086 -5.997 7.699 1.00 0.00 O ATOM 1121 CB PRO A 72 -13.159 -5.883 8.510 1.00 0.00 C ATOM 1122 CG PRO A 72 -12.895 -5.804 7.046 1.00 0.00 C ATOM 1123 CD PRO A 72 -12.978 -7.215 6.533 1.00 0.00 C ATOM 0 HA PRO A 72 -14.034 -7.598 9.594 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -13.577 -4.950 8.888 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -12.242 -6.071 9.068 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -13.627 -5.165 6.551 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -11.913 -5.374 6.849 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -13.368 -7.250 5.516 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -11.999 -7.695 6.516 1.00 0.00 H new ATOM 1131 N LYS A 73 -16.231 -6.647 9.848 1.00 0.00 N ATOM 1132 CA LYS A 73 -17.604 -6.184 10.010 1.00 0.00 C ATOM 1133 C LYS A 73 -17.703 -5.160 11.136 1.00 0.00 C ATOM 1134 O LYS A 73 -18.483 -4.212 11.059 1.00 0.00 O ATOM 1135 CB LYS A 73 -18.532 -7.367 10.299 1.00 0.00 C ATOM 1136 CG LYS A 73 -18.255 -8.047 11.629 1.00 0.00 C ATOM 1137 CD LYS A 73 -19.066 -7.423 12.753 1.00 0.00 C ATOM 1138 CE LYS A 73 -20.483 -7.974 12.789 1.00 0.00 C ATOM 1139 NZ LYS A 73 -20.530 -9.347 13.363 1.00 0.00 N ATOM 0 H LYS A 73 -15.828 -7.072 10.683 1.00 0.00 H new ATOM 0 HA LYS A 73 -17.913 -5.707 9.080 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -19.565 -7.019 10.287 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -18.433 -8.100 9.498 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -18.493 -9.108 11.553 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -17.193 -7.974 11.862 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -18.575 -7.615 13.707 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -19.098 -6.341 12.623 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -21.115 -7.311 13.380 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -20.893 -7.988 11.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -21.520 -9.627 13.512 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -20.076 -10.014 12.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -20.026 -9.360 14.273 1.00 0.00 H new ATOM 1153 N ASN A 74 -16.906 -5.358 12.182 1.00 0.00 N ATOM 1154 CA ASN A 74 -16.904 -4.450 13.323 1.00 0.00 C ATOM 1155 C ASN A 74 -16.099 -3.191 13.015 1.00 0.00 C ATOM 1156 O ASN A 74 -15.365 -3.136 12.028 1.00 0.00 O ATOM 1157 CB ASN A 74 -16.326 -5.149 14.556 1.00 0.00 C ATOM 1158 CG ASN A 74 -16.763 -4.492 15.851 1.00 0.00 C ATOM 1159 OD1 ASN A 74 -17.582 -3.573 15.848 1.00 0.00 O ATOM 1160 ND2 ASN A 74 -16.216 -4.962 16.966 1.00 0.00 N ATOM 0 H ASN A 74 -16.254 -6.138 12.262 1.00 0.00 H new ATOM 0 HA ASN A 74 -17.935 -4.160 13.527 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -16.638 -6.193 14.558 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -15.238 -5.142 14.497 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -16.471 -4.560 17.868 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -15.541 -5.725 16.920 1.00 0.00 H new ATOM 1167 N ARG A 75 -16.243 -2.181 13.867 1.00 0.00 N ATOM 1168 CA ARG A 75 -15.530 -0.922 13.686 1.00 0.00 C ATOM 1169 C ARG A 75 -14.032 -1.109 13.904 1.00 0.00 C ATOM 1170 O ARG A 75 -13.215 -0.624 13.121 1.00 0.00 O ATOM 1171 CB ARG A 75 -16.068 0.137 14.651 1.00 0.00 C ATOM 1172 CG ARG A 75 -15.411 1.498 14.491 1.00 0.00 C ATOM 1173 CD ARG A 75 -15.972 2.250 13.294 1.00 0.00 C ATOM 1174 NE ARG A 75 -17.123 3.072 13.655 1.00 0.00 N ATOM 1175 CZ ARG A 75 -17.731 3.897 12.809 1.00 0.00 C ATOM 1176 NH1 ARG A 75 -17.300 4.007 11.560 1.00 0.00 N ATOM 1177 NH2 ARG A 75 -18.773 4.613 13.212 1.00 0.00 N ATOM 0 H ARG A 75 -16.846 -2.210 14.689 1.00 0.00 H new ATOM 0 HA ARG A 75 -15.692 -0.586 12.662 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -17.142 0.242 14.500 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -15.923 -0.209 15.674 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -15.564 2.086 15.396 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -14.335 1.372 14.371 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -15.194 2.883 12.867 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -16.263 1.537 12.522 1.00 0.00 H new ATOM 0 HE ARG A 75 -17.480 3.010 14.608 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -16.500 3.458 11.246 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -17.769 4.641 10.913 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -19.108 4.530 14.172 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -19.239 5.246 12.562 1.00 0.00 H new ATOM 1191 N SER A 76 -13.678 -1.814 14.974 1.00 0.00 N ATOM 1192 CA SER A 76 -12.278 -2.062 15.297 1.00 0.00 C ATOM 1193 C SER A 76 -11.716 -3.196 14.446 1.00 0.00 C ATOM 1194 O SER A 76 -10.539 -3.192 14.087 1.00 0.00 O ATOM 1195 CB SER A 76 -12.127 -2.400 16.781 1.00 0.00 C ATOM 1196 OG SER A 76 -12.866 -1.499 17.588 1.00 0.00 O ATOM 0 H SER A 76 -14.341 -2.223 15.632 1.00 0.00 H new ATOM 0 HA SER A 76 -11.715 -1.155 15.079 1.00 0.00 H new ATOM 0 HB2 SER A 76 -12.469 -3.419 16.962 1.00 0.00 H new ATOM 0 HB3 SER A 76 -11.074 -2.363 17.060 1.00 0.00 H new ATOM 0 HG SER A 76 -12.754 -1.738 18.532 1.00 0.00 H new ATOM 1202 N GLN A 77 -12.567 -4.166 14.127 1.00 0.00 N ATOM 1203 CA GLN A 77 -12.156 -5.307 13.318 1.00 0.00 C ATOM 1204 C GLN A 77 -11.188 -4.877 12.221 1.00 0.00 C ATOM 1205 O GLN A 77 -10.154 -5.510 12.008 1.00 0.00 O ATOM 1206 CB GLN A 77 -13.378 -5.987 12.699 1.00 0.00 C ATOM 1207 CG GLN A 77 -14.000 -7.050 13.590 1.00 0.00 C ATOM 1208 CD GLN A 77 -13.275 -8.379 13.507 1.00 0.00 C ATOM 1209 OE1 GLN A 77 -13.191 -8.988 12.440 1.00 0.00 O ATOM 1210 NE2 GLN A 77 -12.745 -8.836 14.636 1.00 0.00 N ATOM 0 H GLN A 77 -13.545 -4.184 14.416 1.00 0.00 H new ATOM 0 HA GLN A 77 -11.645 -6.016 13.969 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -14.129 -5.230 12.473 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -13.089 -6.442 11.752 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -13.995 -6.701 14.623 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -15.043 -7.191 13.307 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -12.839 -8.298 15.498 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -12.244 -9.725 14.641 1.00 0.00 H new ATOM 1219 N MET A 78 -11.530 -3.796 11.527 1.00 0.00 N ATOM 1220 CA MET A 78 -10.691 -3.281 10.452 1.00 0.00 C ATOM 1221 C MET A 78 -9.307 -2.908 10.974 1.00 0.00 C ATOM 1222 O MET A 78 -8.292 -3.239 10.360 1.00 0.00 O ATOM 1223 CB MET A 78 -11.349 -2.063 9.802 1.00 0.00 C ATOM 1224 CG MET A 78 -12.583 -2.403 8.982 1.00 0.00 C ATOM 1225 SD MET A 78 -13.576 -0.952 8.586 1.00 0.00 S ATOM 1226 CE MET A 78 -15.206 -1.514 9.071 1.00 0.00 C ATOM 0 H MET A 78 -12.382 -3.260 11.690 1.00 0.00 H new ATOM 0 HA MET A 78 -10.578 -4.066 9.704 1.00 0.00 H new ATOM 0 HB2 MET A 78 -11.625 -1.351 10.580 1.00 0.00 H new ATOM 0 HB3 MET A 78 -10.621 -1.567 9.160 1.00 0.00 H new ATOM 0 HG2 MET A 78 -12.276 -2.892 8.057 1.00 0.00 H new ATOM 0 HG3 MET A 78 -13.195 -3.118 9.533 1.00 0.00 H new ATOM 0 HE1 MET A 78 -15.963 -0.926 8.552 1.00 0.00 H new ATOM 0 HE2 MET A 78 -15.321 -2.566 8.810 1.00 0.00 H new ATOM 0 HE3 MET A 78 -15.328 -1.392 10.147 1.00 0.00 H new ATOM 1236 N ILE A 79 -9.274 -2.218 12.109 1.00 0.00 N ATOM 1237 CA ILE A 79 -8.014 -1.801 12.712 1.00 0.00 C ATOM 1238 C ILE A 79 -6.980 -2.920 12.653 1.00 0.00 C ATOM 1239 O ILE A 79 -5.883 -2.736 12.126 1.00 0.00 O ATOM 1240 CB ILE A 79 -8.207 -1.373 14.179 1.00 0.00 C ATOM 1241 CG1 ILE A 79 -9.193 -0.206 14.267 1.00 0.00 C ATOM 1242 CG2 ILE A 79 -6.872 -0.993 14.800 1.00 0.00 C ATOM 1243 CD1 ILE A 79 -8.828 0.962 13.377 1.00 0.00 C ATOM 0 H ILE A 79 -10.105 -1.936 12.629 1.00 0.00 H new ATOM 0 HA ILE A 79 -7.656 -0.947 12.137 1.00 0.00 H new ATOM 0 HB ILE A 79 -8.618 -2.215 14.736 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -10.188 -0.560 13.998 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -9.246 0.137 15.300 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -7.025 -0.693 15.837 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -6.198 -1.849 14.766 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -6.434 -0.164 14.243 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -9.570 1.752 13.491 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -7.847 1.343 13.660 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -8.804 0.634 12.338 1.00 0.00 H new ATOM 1255 N GLU A 80 -7.338 -4.079 13.196 1.00 0.00 N ATOM 1256 CA GLU A 80 -6.440 -5.228 13.203 1.00 0.00 C ATOM 1257 C GLU A 80 -5.875 -5.486 11.809 1.00 0.00 C ATOM 1258 O GLU A 80 -4.661 -5.527 11.618 1.00 0.00 O ATOM 1259 CB GLU A 80 -7.173 -6.473 13.707 1.00 0.00 C ATOM 1260 CG GLU A 80 -7.182 -6.602 15.221 1.00 0.00 C ATOM 1261 CD GLU A 80 -5.818 -6.947 15.786 1.00 0.00 C ATOM 1262 OE1 GLU A 80 -5.077 -7.703 15.124 1.00 0.00 O ATOM 1263 OE2 GLU A 80 -5.492 -6.461 16.889 1.00 0.00 O ATOM 0 H GLU A 80 -8.243 -4.247 13.636 1.00 0.00 H new ATOM 0 HA GLU A 80 -5.612 -5.005 13.876 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -8.201 -6.450 13.347 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -6.705 -7.359 13.278 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -7.526 -5.665 15.659 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -7.897 -7.372 15.512 1.00 0.00 H new ATOM 1270 N ASN A 81 -6.767 -5.660 10.839 1.00 0.00 N ATOM 1271 CA ASN A 81 -6.358 -5.916 9.463 1.00 0.00 C ATOM 1272 C ASN A 81 -5.127 -5.092 9.099 1.00 0.00 C ATOM 1273 O ASN A 81 -4.046 -5.638 8.875 1.00 0.00 O ATOM 1274 CB ASN A 81 -7.504 -5.594 8.501 1.00 0.00 C ATOM 1275 CG ASN A 81 -8.700 -6.505 8.701 1.00 0.00 C ATOM 1276 OD1 ASN A 81 -9.018 -6.893 9.825 1.00 0.00 O ATOM 1277 ND2 ASN A 81 -9.369 -6.851 7.607 1.00 0.00 N ATOM 0 H ASN A 81 -7.777 -5.628 10.980 1.00 0.00 H new ATOM 0 HA ASN A 81 -6.104 -6.973 9.376 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -7.812 -4.558 8.641 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -7.149 -5.685 7.474 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -10.182 -7.462 7.679 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -9.069 -6.505 6.695 1.00 0.00 H new ATOM 1284 N ILE A 82 -5.299 -3.776 9.042 1.00 0.00 N ATOM 1285 CA ILE A 82 -4.202 -2.876 8.707 1.00 0.00 C ATOM 1286 C ILE A 82 -3.032 -3.054 9.669 1.00 0.00 C ATOM 1287 O ILE A 82 -1.870 -2.987 9.269 1.00 0.00 O ATOM 1288 CB ILE A 82 -4.653 -1.404 8.731 1.00 0.00 C ATOM 1289 CG1 ILE A 82 -5.742 -1.165 7.683 1.00 0.00 C ATOM 1290 CG2 ILE A 82 -3.466 -0.483 8.490 1.00 0.00 C ATOM 1291 CD1 ILE A 82 -6.714 -0.069 8.062 1.00 0.00 C ATOM 0 H ILE A 82 -6.187 -3.309 9.223 1.00 0.00 H new ATOM 0 HA ILE A 82 -3.881 -3.132 7.697 1.00 0.00 H new ATOM 0 HB ILE A 82 -5.067 -1.181 9.715 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.272 -0.910 6.733 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -6.294 -2.092 7.527 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -3.800 0.554 8.510 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -2.720 -0.639 9.270 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -3.026 -0.704 7.518 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -7.458 0.046 7.274 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -7.212 -0.331 8.996 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -6.173 0.869 8.190 1.00 0.00 H new ATOM 1303 N ASP A 83 -3.348 -3.281 10.940 1.00 0.00 N ATOM 1304 CA ASP A 83 -2.323 -3.472 11.960 1.00 0.00 C ATOM 1305 C ASP A 83 -1.367 -4.593 11.566 1.00 0.00 C ATOM 1306 O ASP A 83 -0.148 -4.424 11.605 1.00 0.00 O ATOM 1307 CB ASP A 83 -2.970 -3.787 13.310 1.00 0.00 C ATOM 1308 CG ASP A 83 -2.104 -3.362 14.479 1.00 0.00 C ATOM 1309 OD1 ASP A 83 -1.293 -2.428 14.309 1.00 0.00 O ATOM 1310 OD2 ASP A 83 -2.237 -3.965 15.566 1.00 0.00 O ATOM 0 H ASP A 83 -4.305 -3.337 11.288 1.00 0.00 H new ATOM 0 HA ASP A 83 -1.753 -2.547 12.046 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -3.935 -3.283 13.374 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -3.164 -4.858 13.376 1.00 0.00 H new ATOM 1315 N ALA A 84 -1.927 -5.737 11.189 1.00 0.00 N ATOM 1316 CA ALA A 84 -1.124 -6.886 10.788 1.00 0.00 C ATOM 1317 C ALA A 84 -0.110 -6.499 9.717 1.00 0.00 C ATOM 1318 O ALA A 84 1.029 -6.968 9.729 1.00 0.00 O ATOM 1319 CB ALA A 84 -2.021 -8.008 10.288 1.00 0.00 C ATOM 0 H ALA A 84 -2.934 -5.893 11.153 1.00 0.00 H new ATOM 0 HA ALA A 84 -0.575 -7.237 11.661 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -1.408 -8.859 9.992 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -2.703 -8.311 11.083 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -2.596 -7.659 9.430 1.00 0.00 H new ATOM 1325 N CYS A 85 -0.530 -5.643 8.792 1.00 0.00 N ATOM 1326 CA CYS A 85 0.342 -5.195 7.712 1.00 0.00 C ATOM 1327 C CYS A 85 1.477 -4.332 8.253 1.00 0.00 C ATOM 1328 O CYS A 85 2.637 -4.504 7.874 1.00 0.00 O ATOM 1329 CB CYS A 85 -0.461 -4.410 6.674 1.00 0.00 C ATOM 1330 SG CYS A 85 -1.880 -5.308 6.004 1.00 0.00 S ATOM 0 H CYS A 85 -1.469 -5.245 8.768 1.00 0.00 H new ATOM 0 HA CYS A 85 0.774 -6.076 7.237 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -0.812 -3.483 7.127 1.00 0.00 H new ATOM 0 HB3 CYS A 85 0.200 -4.132 5.853 1.00 0.00 H new ATOM 0 HG CYS A 85 -2.755 -5.502 6.946 1.00 0.00 H new ATOM 1336 N LEU A 86 1.137 -3.404 9.140 1.00 0.00 N ATOM 1337 CA LEU A 86 2.128 -2.512 9.733 1.00 0.00 C ATOM 1338 C LEU A 86 3.184 -3.303 10.499 1.00 0.00 C ATOM 1339 O LEU A 86 4.382 -3.082 10.331 1.00 0.00 O ATOM 1340 CB LEU A 86 1.448 -1.511 10.668 1.00 0.00 C ATOM 1341 CG LEU A 86 0.311 -0.689 10.058 1.00 0.00 C ATOM 1342 CD1 LEU A 86 -0.377 0.145 11.128 1.00 0.00 C ATOM 1343 CD2 LEU A 86 0.836 0.201 8.941 1.00 0.00 C ATOM 0 H LEU A 86 0.183 -3.249 9.465 1.00 0.00 H new ATOM 0 HA LEU A 86 2.621 -1.970 8.926 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.056 -2.055 11.527 1.00 0.00 H new ATOM 0 HB3 LEU A 86 2.205 -0.823 11.045 1.00 0.00 H new ATOM 0 HG LEU A 86 -0.422 -1.376 9.634 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -1.183 0.723 10.676 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -0.788 -0.513 11.894 1.00 0.00 H new ATOM 0 HD13 LEU A 86 0.346 0.823 11.582 1.00 0.00 H new ATOM 0 HD21 LEU A 86 0.013 0.778 8.519 1.00 0.00 H new ATOM 0 HD22 LEU A 86 1.589 0.881 9.341 1.00 0.00 H new ATOM 0 HD23 LEU A 86 1.282 -0.417 8.162 1.00 0.00 H new ATOM 1355 N ASN A 87 2.730 -4.229 11.337 1.00 0.00 N ATOM 1356 CA ASN A 87 3.635 -5.055 12.128 1.00 0.00 C ATOM 1357 C ASN A 87 4.460 -5.971 11.229 1.00 0.00 C ATOM 1358 O ASN A 87 5.622 -6.258 11.515 1.00 0.00 O ATOM 1359 CB ASN A 87 2.847 -5.888 13.140 1.00 0.00 C ATOM 1360 CG ASN A 87 2.193 -5.034 14.209 1.00 0.00 C ATOM 1361 OD1 ASN A 87 2.862 -4.531 15.112 1.00 0.00 O ATOM 1362 ND2 ASN A 87 0.879 -4.867 14.111 1.00 0.00 N ATOM 0 H ASN A 87 1.740 -4.426 11.486 1.00 0.00 H new ATOM 0 HA ASN A 87 4.315 -4.394 12.665 1.00 0.00 H new ATOM 0 HB2 ASN A 87 2.081 -6.460 12.617 1.00 0.00 H new ATOM 0 HB3 ASN A 87 3.515 -6.608 13.613 1.00 0.00 H new ATOM 0 HD21 ASN A 87 0.384 -4.303 14.801 1.00 0.00 H new ATOM 0 HD22 ASN A 87 0.365 -5.303 13.345 1.00 0.00 H new ATOM 1369 N PHE A 88 3.849 -6.428 10.140 1.00 0.00 N ATOM 1370 CA PHE A 88 4.526 -7.313 9.199 1.00 0.00 C ATOM 1371 C PHE A 88 5.678 -6.591 8.506 1.00 0.00 C ATOM 1372 O PHE A 88 6.807 -7.081 8.480 1.00 0.00 O ATOM 1373 CB PHE A 88 3.536 -7.837 8.157 1.00 0.00 C ATOM 1374 CG PHE A 88 4.197 -8.388 6.926 1.00 0.00 C ATOM 1375 CD1 PHE A 88 4.651 -7.540 5.928 1.00 0.00 C ATOM 1376 CD2 PHE A 88 4.364 -9.754 6.766 1.00 0.00 C ATOM 1377 CE1 PHE A 88 5.260 -8.044 4.795 1.00 0.00 C ATOM 1378 CE2 PHE A 88 4.973 -10.264 5.635 1.00 0.00 C ATOM 1379 CZ PHE A 88 5.420 -9.408 4.647 1.00 0.00 C ATOM 0 H PHE A 88 2.887 -6.200 9.888 1.00 0.00 H new ATOM 0 HA PHE A 88 4.933 -8.155 9.759 1.00 0.00 H new ATOM 0 HB2 PHE A 88 2.923 -8.616 8.610 1.00 0.00 H new ATOM 0 HB3 PHE A 88 2.864 -7.029 7.868 1.00 0.00 H new ATOM 0 HD1 PHE A 88 4.527 -6.473 6.037 1.00 0.00 H new ATOM 0 HD2 PHE A 88 4.014 -10.428 7.534 1.00 0.00 H new ATOM 0 HE1 PHE A 88 5.611 -7.372 4.026 1.00 0.00 H new ATOM 0 HE2 PHE A 88 5.099 -11.331 5.524 1.00 0.00 H new ATOM 0 HZ PHE A 88 5.893 -9.804 3.761 1.00 0.00 H new ATOM 1389 N LEU A 89 5.383 -5.424 7.944 1.00 0.00 N ATOM 1390 CA LEU A 89 6.393 -4.633 7.249 1.00 0.00 C ATOM 1391 C LEU A 89 7.605 -4.391 8.143 1.00 0.00 C ATOM 1392 O LEU A 89 8.745 -4.416 7.680 1.00 0.00 O ATOM 1393 CB LEU A 89 5.802 -3.295 6.800 1.00 0.00 C ATOM 1394 CG LEU A 89 4.711 -3.369 5.731 1.00 0.00 C ATOM 1395 CD1 LEU A 89 4.158 -1.983 5.437 1.00 0.00 C ATOM 1396 CD2 LEU A 89 5.252 -4.010 4.461 1.00 0.00 C ATOM 0 H LEU A 89 4.453 -5.005 7.956 1.00 0.00 H new ATOM 0 HA LEU A 89 6.717 -5.193 6.372 1.00 0.00 H new ATOM 0 HB2 LEU A 89 5.392 -2.790 7.675 1.00 0.00 H new ATOM 0 HB3 LEU A 89 6.612 -2.671 6.422 1.00 0.00 H new ATOM 0 HG LEU A 89 3.899 -3.989 6.110 1.00 0.00 H new ATOM 0 HD11 LEU A 89 3.383 -2.055 4.674 1.00 0.00 H new ATOM 0 HD12 LEU A 89 3.733 -1.560 6.347 1.00 0.00 H new ATOM 0 HD13 LEU A 89 4.961 -1.339 5.079 1.00 0.00 H new ATOM 0 HD21 LEU A 89 4.462 -4.055 3.711 1.00 0.00 H new ATOM 0 HD22 LEU A 89 6.082 -3.416 4.079 1.00 0.00 H new ATOM 0 HD23 LEU A 89 5.600 -5.019 4.682 1.00 0.00 H new ATOM 1408 N ALA A 90 7.351 -4.160 9.427 1.00 0.00 N ATOM 1409 CA ALA A 90 8.422 -3.919 10.386 1.00 0.00 C ATOM 1410 C ALA A 90 9.345 -5.127 10.494 1.00 0.00 C ATOM 1411 O ALA A 90 10.553 -4.983 10.680 1.00 0.00 O ATOM 1412 CB ALA A 90 7.841 -3.573 11.749 1.00 0.00 C ATOM 0 H ALA A 90 6.413 -4.135 9.827 1.00 0.00 H new ATOM 0 HA ALA A 90 9.012 -3.075 10.029 1.00 0.00 H new ATOM 0 HB1 ALA A 90 8.652 -3.395 12.456 1.00 0.00 H new ATOM 0 HB2 ALA A 90 7.229 -2.675 11.666 1.00 0.00 H new ATOM 0 HB3 ALA A 90 7.226 -4.400 12.103 1.00 0.00 H new ATOM 1418 N ALA A 91 8.769 -6.319 10.377 1.00 0.00 N ATOM 1419 CA ALA A 91 9.541 -7.552 10.460 1.00 0.00 C ATOM 1420 C ALA A 91 10.459 -7.707 9.253 1.00 0.00 C ATOM 1421 O ALA A 91 11.550 -8.270 9.357 1.00 0.00 O ATOM 1422 CB ALA A 91 8.610 -8.751 10.575 1.00 0.00 C ATOM 0 H ALA A 91 7.770 -6.456 10.224 1.00 0.00 H new ATOM 0 HA ALA A 91 10.164 -7.502 11.353 1.00 0.00 H new ATOM 0 HB1 ALA A 91 9.200 -9.665 10.636 1.00 0.00 H new ATOM 0 HB2 ALA A 91 7.999 -8.653 11.472 1.00 0.00 H new ATOM 0 HB3 ALA A 91 7.963 -8.795 9.699 1.00 0.00 H new ATOM 1428 N LYS A 92 10.012 -7.206 8.106 1.00 0.00 N ATOM 1429 CA LYS A 92 10.793 -7.288 6.878 1.00 0.00 C ATOM 1430 C LYS A 92 12.008 -6.368 6.944 1.00 0.00 C ATOM 1431 O LYS A 92 13.006 -6.591 6.259 1.00 0.00 O ATOM 1432 CB LYS A 92 9.926 -6.920 5.672 1.00 0.00 C ATOM 1433 CG LYS A 92 8.874 -7.963 5.338 1.00 0.00 C ATOM 1434 CD LYS A 92 9.492 -9.191 4.692 1.00 0.00 C ATOM 1435 CE LYS A 92 8.449 -10.267 4.428 1.00 0.00 C ATOM 1436 NZ LYS A 92 9.046 -11.631 4.430 1.00 0.00 N ATOM 0 H LYS A 92 9.112 -6.738 8.002 1.00 0.00 H new ATOM 0 HA LYS A 92 11.142 -8.315 6.767 1.00 0.00 H new ATOM 0 HB2 LYS A 92 9.432 -5.968 5.867 1.00 0.00 H new ATOM 0 HB3 LYS A 92 10.569 -6.774 4.804 1.00 0.00 H new ATOM 0 HG2 LYS A 92 8.348 -8.255 6.247 1.00 0.00 H new ATOM 0 HG3 LYS A 92 8.133 -7.531 4.666 1.00 0.00 H new ATOM 0 HD2 LYS A 92 9.970 -8.908 3.754 1.00 0.00 H new ATOM 0 HD3 LYS A 92 10.272 -9.590 5.340 1.00 0.00 H new ATOM 0 HE2 LYS A 92 7.669 -10.211 5.188 1.00 0.00 H new ATOM 0 HE3 LYS A 92 7.971 -10.081 3.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 8.606 -12.204 3.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 10.069 -11.562 4.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 8.880 -12.081 5.353 1.00 0.00 H new ATOM 1450 N GLY A 93 11.918 -5.334 7.774 1.00 0.00 N ATOM 1451 CA GLY A 93 13.017 -4.397 7.915 1.00 0.00 C ATOM 1452 C GLY A 93 12.637 -2.990 7.498 1.00 0.00 C ATOM 1453 O GLY A 93 13.445 -2.270 6.911 1.00 0.00 O ATOM 0 H GLY A 93 11.103 -5.128 8.352 1.00 0.00 H new ATOM 0 HA2 GLY A 93 13.351 -4.387 8.952 1.00 0.00 H new ATOM 0 HA3 GLY A 93 13.859 -4.736 7.312 1.00 0.00 H new ATOM 1457 N ILE A 94 11.403 -2.598 7.799 1.00 0.00 N ATOM 1458 CA ILE A 94 10.918 -1.269 7.451 1.00 0.00 C ATOM 1459 C ILE A 94 10.536 -0.478 8.698 1.00 0.00 C ATOM 1460 O ILE A 94 10.093 -1.048 9.694 1.00 0.00 O ATOM 1461 CB ILE A 94 9.700 -1.342 6.511 1.00 0.00 C ATOM 1462 CG1 ILE A 94 10.086 -2.018 5.193 1.00 0.00 C ATOM 1463 CG2 ILE A 94 9.144 0.051 6.255 1.00 0.00 C ATOM 1464 CD1 ILE A 94 8.899 -2.528 4.406 1.00 0.00 C ATOM 0 H ILE A 94 10.721 -3.182 8.283 1.00 0.00 H new ATOM 0 HA ILE A 94 11.734 -0.761 6.937 1.00 0.00 H new ATOM 0 HB ILE A 94 8.924 -1.939 6.991 1.00 0.00 H new ATOM 0 HG12 ILE A 94 10.641 -1.309 4.579 1.00 0.00 H new ATOM 0 HG13 ILE A 94 10.757 -2.851 5.404 1.00 0.00 H new ATOM 0 HG21 ILE A 94 8.284 -0.017 5.589 1.00 0.00 H new ATOM 0 HG22 ILE A 94 8.837 0.499 7.200 1.00 0.00 H new ATOM 0 HG23 ILE A 94 9.913 0.670 5.792 1.00 0.00 H new ATOM 0 HD11 ILE A 94 9.247 -2.995 3.484 1.00 0.00 H new ATOM 0 HD12 ILE A 94 8.356 -3.261 5.002 1.00 0.00 H new ATOM 0 HD13 ILE A 94 8.238 -1.696 4.164 1.00 0.00 H new ATOM 1476 N ASN A 95 10.710 0.838 8.634 1.00 0.00 N ATOM 1477 CA ASN A 95 10.382 1.707 9.758 1.00 0.00 C ATOM 1478 C ASN A 95 8.929 2.164 9.687 1.00 0.00 C ATOM 1479 O ASN A 95 8.547 2.914 8.788 1.00 0.00 O ATOM 1480 CB ASN A 95 11.311 2.923 9.777 1.00 0.00 C ATOM 1481 CG ASN A 95 11.002 3.869 10.921 1.00 0.00 C ATOM 1482 OD1 ASN A 95 9.877 4.569 10.822 1.00 0.00 O flip ATOM 1483 ND2 ASN A 95 11.765 3.969 11.882 1.00 0.00 N flip ATOM 0 H ASN A 95 11.076 1.326 7.816 1.00 0.00 H new ATOM 0 HA ASN A 95 10.520 1.138 10.677 1.00 0.00 H new ATOM 0 HB2 ASN A 95 12.344 2.586 9.857 1.00 0.00 H new ATOM 0 HB3 ASN A 95 11.223 3.459 8.832 1.00 0.00 H new ATOM 0 HD21 ASN A 95 12.618 3.411 11.916 1.00 0.00 H new ATOM 0 HD22 ASN A 95 11.544 4.609 12.644 1.00 0.00 H new ATOM 1490 N ILE A 96 8.123 1.708 10.640 1.00 0.00 N ATOM 1491 CA ILE A 96 6.712 2.072 10.686 1.00 0.00 C ATOM 1492 C ILE A 96 6.420 2.990 11.868 1.00 0.00 C ATOM 1493 O ILE A 96 5.354 3.602 11.941 1.00 0.00 O ATOM 1494 CB ILE A 96 5.813 0.826 10.784 1.00 0.00 C ATOM 1495 CG1 ILE A 96 6.063 0.091 12.103 1.00 0.00 C ATOM 1496 CG2 ILE A 96 6.059 -0.100 9.601 1.00 0.00 C ATOM 1497 CD1 ILE A 96 4.927 -0.821 12.511 1.00 0.00 C ATOM 0 H ILE A 96 8.423 1.086 11.391 1.00 0.00 H new ATOM 0 HA ILE A 96 6.491 2.598 9.757 1.00 0.00 H new ATOM 0 HB ILE A 96 4.771 1.146 10.760 1.00 0.00 H new ATOM 0 HG12 ILE A 96 6.976 -0.497 12.014 1.00 0.00 H new ATOM 0 HG13 ILE A 96 6.231 0.824 12.892 1.00 0.00 H new ATOM 0 HG21 ILE A 96 5.416 -0.976 9.685 1.00 0.00 H new ATOM 0 HG22 ILE A 96 5.835 0.427 8.674 1.00 0.00 H new ATOM 0 HG23 ILE A 96 7.103 -0.415 9.596 1.00 0.00 H new ATOM 0 HD11 ILE A 96 5.173 -1.309 13.454 1.00 0.00 H new ATOM 0 HD12 ILE A 96 4.016 -0.235 12.632 1.00 0.00 H new ATOM 0 HD13 ILE A 96 4.773 -1.577 11.741 1.00 0.00 H new ATOM 1509 N GLN A 97 7.373 3.083 12.789 1.00 0.00 N ATOM 1510 CA GLN A 97 7.218 3.928 13.967 1.00 0.00 C ATOM 1511 C GLN A 97 6.699 5.310 13.581 1.00 0.00 C ATOM 1512 O GLN A 97 7.459 6.164 13.126 1.00 0.00 O ATOM 1513 CB GLN A 97 8.550 4.059 14.706 1.00 0.00 C ATOM 1514 CG GLN A 97 8.774 2.977 15.751 1.00 0.00 C ATOM 1515 CD GLN A 97 9.861 3.341 16.743 1.00 0.00 C ATOM 1516 OE1 GLN A 97 9.784 4.369 17.416 1.00 0.00 O ATOM 1517 NE2 GLN A 97 10.881 2.496 16.840 1.00 0.00 N ATOM 0 H GLN A 97 8.261 2.583 12.742 1.00 0.00 H new ATOM 0 HA GLN A 97 6.489 3.457 14.627 1.00 0.00 H new ATOM 0 HB2 GLN A 97 9.363 4.026 13.981 1.00 0.00 H new ATOM 0 HB3 GLN A 97 8.593 5.035 15.190 1.00 0.00 H new ATOM 0 HG2 GLN A 97 7.843 2.797 16.288 1.00 0.00 H new ATOM 0 HG3 GLN A 97 9.040 2.045 15.252 1.00 0.00 H new ATOM 0 HE21 GLN A 97 10.904 1.656 16.262 1.00 0.00 H new ATOM 0 HE22 GLN A 97 11.642 2.687 17.492 1.00 0.00 H new ATOM 1526 N GLY A 98 5.400 5.522 13.764 1.00 0.00 N ATOM 1527 CA GLY A 98 4.802 6.801 13.430 1.00 0.00 C ATOM 1528 C GLY A 98 3.400 6.658 12.871 1.00 0.00 C ATOM 1529 O GLY A 98 2.518 7.462 13.174 1.00 0.00 O ATOM 0 H GLY A 98 4.750 4.830 14.138 1.00 0.00 H new ATOM 0 HA2 GLY A 98 4.772 7.428 14.321 1.00 0.00 H new ATOM 0 HA3 GLY A 98 5.430 7.313 12.701 1.00 0.00 H new ATOM 1533 N LEU A 99 3.194 5.633 12.051 1.00 0.00 N ATOM 1534 CA LEU A 99 1.889 5.388 11.447 1.00 0.00 C ATOM 1535 C LEU A 99 0.847 5.067 12.513 1.00 0.00 C ATOM 1536 O LEU A 99 1.155 5.023 13.704 1.00 0.00 O ATOM 1537 CB LEU A 99 1.978 4.238 10.442 1.00 0.00 C ATOM 1538 CG LEU A 99 3.059 4.367 9.369 1.00 0.00 C ATOM 1539 CD1 LEU A 99 3.245 3.047 8.636 1.00 0.00 C ATOM 1540 CD2 LEU A 99 2.709 5.478 8.390 1.00 0.00 C ATOM 0 H LEU A 99 3.913 4.959 11.789 1.00 0.00 H new ATOM 0 HA LEU A 99 1.581 6.295 10.926 1.00 0.00 H new ATOM 0 HB2 LEU A 99 2.149 3.313 10.993 1.00 0.00 H new ATOM 0 HB3 LEU A 99 1.012 4.140 9.946 1.00 0.00 H new ATOM 0 HG LEU A 99 3.999 4.623 9.857 1.00 0.00 H new ATOM 0 HD11 LEU A 99 4.018 3.159 7.876 1.00 0.00 H new ATOM 0 HD12 LEU A 99 3.543 2.275 9.346 1.00 0.00 H new ATOM 0 HD13 LEU A 99 2.307 2.760 8.160 1.00 0.00 H new ATOM 0 HD21 LEU A 99 3.490 5.555 7.633 1.00 0.00 H new ATOM 0 HD22 LEU A 99 1.758 5.252 7.908 1.00 0.00 H new ATOM 0 HD23 LEU A 99 2.629 6.424 8.926 1.00 0.00 H new ATOM 1552 N SER A 100 -0.388 4.840 12.077 1.00 0.00 N ATOM 1553 CA SER A 100 -1.477 4.524 12.994 1.00 0.00 C ATOM 1554 C SER A 100 -2.608 3.802 12.267 1.00 0.00 C ATOM 1555 O SER A 100 -3.332 4.401 11.473 1.00 0.00 O ATOM 1556 CB SER A 100 -2.009 5.802 13.647 1.00 0.00 C ATOM 1557 OG SER A 100 -1.155 6.235 14.691 1.00 0.00 O ATOM 0 H SER A 100 -0.659 4.869 11.094 1.00 0.00 H new ATOM 0 HA SER A 100 -1.087 3.864 13.768 1.00 0.00 H new ATOM 0 HB2 SER A 100 -2.098 6.587 12.897 1.00 0.00 H new ATOM 0 HB3 SER A 100 -3.009 5.623 14.042 1.00 0.00 H new ATOM 0 HG SER A 100 -0.263 5.848 14.566 1.00 0.00 H new ATOM 1563 N ALA A 101 -2.751 2.511 12.545 1.00 0.00 N ATOM 1564 CA ALA A 101 -3.794 1.706 11.921 1.00 0.00 C ATOM 1565 C ALA A 101 -5.122 2.454 11.893 1.00 0.00 C ATOM 1566 O ALA A 101 -5.835 2.433 10.891 1.00 0.00 O ATOM 1567 CB ALA A 101 -3.947 0.381 12.652 1.00 0.00 C ATOM 0 H ALA A 101 -2.158 2.000 13.198 1.00 0.00 H new ATOM 0 HA ALA A 101 -3.498 1.507 10.891 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -4.729 -0.209 12.175 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -3.005 -0.166 12.614 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -4.216 0.568 13.691 1.00 0.00 H new ATOM 1573 N GLU A 102 -5.448 3.113 13.001 1.00 0.00 N ATOM 1574 CA GLU A 102 -6.692 3.866 13.102 1.00 0.00 C ATOM 1575 C GLU A 102 -6.776 4.929 12.011 1.00 0.00 C ATOM 1576 O GLU A 102 -7.769 5.016 11.290 1.00 0.00 O ATOM 1577 CB GLU A 102 -6.806 4.524 14.480 1.00 0.00 C ATOM 1578 CG GLU A 102 -8.170 5.134 14.752 1.00 0.00 C ATOM 1579 CD GLU A 102 -8.287 5.698 16.155 1.00 0.00 C ATOM 1580 OE1 GLU A 102 -8.593 4.921 17.084 1.00 0.00 O ATOM 1581 OE2 GLU A 102 -8.072 6.916 16.324 1.00 0.00 O ATOM 0 H GLU A 102 -4.868 3.140 13.840 1.00 0.00 H new ATOM 0 HA GLU A 102 -7.519 3.169 12.970 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -6.590 3.780 15.247 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -6.046 5.301 14.566 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -8.360 5.927 14.029 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -8.939 4.376 14.604 1.00 0.00 H new ATOM 1588 N GLU A 103 -5.725 5.736 11.897 1.00 0.00 N ATOM 1589 CA GLU A 103 -5.681 6.794 10.895 1.00 0.00 C ATOM 1590 C GLU A 103 -5.899 6.227 9.495 1.00 0.00 C ATOM 1591 O GLU A 103 -6.706 6.746 8.722 1.00 0.00 O ATOM 1592 CB GLU A 103 -4.340 7.529 10.956 1.00 0.00 C ATOM 1593 CG GLU A 103 -4.178 8.399 12.191 1.00 0.00 C ATOM 1594 CD GLU A 103 -4.954 9.698 12.094 1.00 0.00 C ATOM 1595 OE1 GLU A 103 -6.198 9.640 11.995 1.00 0.00 O ATOM 1596 OE2 GLU A 103 -4.319 10.773 12.119 1.00 0.00 O ATOM 0 H GLU A 103 -4.894 5.677 12.486 1.00 0.00 H new ATOM 0 HA GLU A 103 -6.484 7.498 11.112 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -3.533 6.797 10.929 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -4.236 8.151 10.067 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -4.512 7.845 13.068 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -3.121 8.621 12.338 1.00 0.00 H new ATOM 1603 N ILE A 104 -5.175 5.160 9.176 1.00 0.00 N ATOM 1604 CA ILE A 104 -5.290 4.522 7.870 1.00 0.00 C ATOM 1605 C ILE A 104 -6.717 4.053 7.611 1.00 0.00 C ATOM 1606 O ILE A 104 -7.254 4.240 6.519 1.00 0.00 O ATOM 1607 CB ILE A 104 -4.335 3.320 7.745 1.00 0.00 C ATOM 1608 CG1 ILE A 104 -2.880 3.788 7.806 1.00 0.00 C ATOM 1609 CG2 ILE A 104 -4.600 2.565 6.451 1.00 0.00 C ATOM 1610 CD1 ILE A 104 -1.877 2.672 7.610 1.00 0.00 C ATOM 0 H ILE A 104 -4.503 4.719 9.803 1.00 0.00 H new ATOM 0 HA ILE A 104 -5.017 5.271 7.127 1.00 0.00 H new ATOM 0 HB ILE A 104 -4.515 2.644 8.581 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -2.719 4.548 7.042 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -2.700 4.262 8.771 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -3.917 1.719 6.377 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -5.628 2.203 6.445 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -4.445 3.231 5.603 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -0.867 3.077 7.666 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -2.011 1.922 8.389 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -2.030 2.212 6.634 1.00 0.00 H new ATOM 1622 N ARG A 105 -7.326 3.443 8.623 1.00 0.00 N ATOM 1623 CA ARG A 105 -8.692 2.947 8.505 1.00 0.00 C ATOM 1624 C ARG A 105 -9.664 4.091 8.226 1.00 0.00 C ATOM 1625 O ARG A 105 -10.690 3.901 7.576 1.00 0.00 O ATOM 1626 CB ARG A 105 -9.103 2.214 9.783 1.00 0.00 C ATOM 1627 CG ARG A 105 -10.416 1.459 9.656 1.00 0.00 C ATOM 1628 CD ARG A 105 -11.035 1.185 11.018 1.00 0.00 C ATOM 1629 NE ARG A 105 -12.491 1.100 10.951 1.00 0.00 N ATOM 1630 CZ ARG A 105 -13.271 2.114 10.591 1.00 0.00 C ATOM 1631 NH1 ARG A 105 -12.736 3.283 10.268 1.00 0.00 N ATOM 1632 NH2 ARG A 105 -14.588 1.959 10.554 1.00 0.00 N ATOM 0 H ARG A 105 -6.895 3.281 9.533 1.00 0.00 H new ATOM 0 HA ARG A 105 -8.728 2.250 7.667 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -8.315 1.513 10.059 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -9.186 2.936 10.595 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -11.112 2.037 9.048 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -10.246 0.516 9.136 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -10.636 0.252 11.417 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -10.750 1.976 11.711 1.00 0.00 H new ATOM 0 HE ARG A 105 -12.934 0.214 11.194 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -11.724 3.406 10.295 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -13.337 4.060 9.992 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -15.003 1.061 10.802 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -15.186 2.738 10.278 1.00 0.00 H new ATOM 1646 N ASN A 106 -9.331 5.277 8.724 1.00 0.00 N ATOM 1647 CA ASN A 106 -10.174 6.451 8.530 1.00 0.00 C ATOM 1648 C ASN A 106 -10.087 6.952 7.091 1.00 0.00 C ATOM 1649 O ASN A 106 -11.021 7.568 6.579 1.00 0.00 O ATOM 1650 CB ASN A 106 -9.764 7.565 9.495 1.00 0.00 C ATOM 1651 CG ASN A 106 -10.167 7.267 10.926 1.00 0.00 C ATOM 1652 OD1 ASN A 106 -11.278 6.807 11.187 1.00 0.00 O ATOM 1653 ND2 ASN A 106 -9.261 7.530 11.862 1.00 0.00 N ATOM 0 H ASN A 106 -8.484 5.451 9.265 1.00 0.00 H new ATOM 0 HA ASN A 106 -11.205 6.164 8.734 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -8.684 7.705 9.446 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -10.222 8.502 9.179 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -9.475 7.351 12.843 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -8.352 7.911 11.599 1.00 0.00 H new ATOM 1660 N GLY A 107 -8.958 6.681 6.444 1.00 0.00 N ATOM 1661 CA GLY A 107 -8.769 7.111 5.070 1.00 0.00 C ATOM 1662 C GLY A 107 -7.990 8.407 4.970 1.00 0.00 C ATOM 1663 O GLY A 107 -8.205 9.198 4.053 1.00 0.00 O ATOM 0 H GLY A 107 -8.171 6.172 6.846 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -8.244 6.332 4.518 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -9.742 7.238 4.595 1.00 0.00 H new ATOM 1667 N ASN A 108 -7.084 8.626 5.917 1.00 0.00 N ATOM 1668 CA ASN A 108 -6.272 9.837 5.933 1.00 0.00 C ATOM 1669 C ASN A 108 -5.087 9.710 4.980 1.00 0.00 C ATOM 1670 O ASN A 108 -4.196 8.885 5.186 1.00 0.00 O ATOM 1671 CB ASN A 108 -5.772 10.123 7.350 1.00 0.00 C ATOM 1672 CG ASN A 108 -4.899 11.362 7.417 1.00 0.00 C ATOM 1673 OD1 ASN A 108 -4.660 12.021 6.405 1.00 0.00 O ATOM 1674 ND2 ASN A 108 -4.418 11.683 8.612 1.00 0.00 N ATOM 0 H ASN A 108 -6.894 7.981 6.683 1.00 0.00 H new ATOM 0 HA ASN A 108 -6.896 10.667 5.601 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -6.626 10.248 8.015 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -5.208 9.264 7.713 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -3.824 12.505 8.719 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -4.642 11.107 9.424 1.00 0.00 H new ATOM 1681 N LEU A 109 -5.084 10.533 3.936 1.00 0.00 N ATOM 1682 CA LEU A 109 -4.008 10.513 2.951 1.00 0.00 C ATOM 1683 C LEU A 109 -2.645 10.593 3.631 1.00 0.00 C ATOM 1684 O LEU A 109 -1.696 9.921 3.225 1.00 0.00 O ATOM 1685 CB LEU A 109 -4.169 11.675 1.968 1.00 0.00 C ATOM 1686 CG LEU A 109 -3.641 11.436 0.554 1.00 0.00 C ATOM 1687 CD1 LEU A 109 -4.468 10.372 -0.152 1.00 0.00 C ATOM 1688 CD2 LEU A 109 -3.643 12.732 -0.243 1.00 0.00 C ATOM 0 H LEU A 109 -5.814 11.221 3.750 1.00 0.00 H new ATOM 0 HA LEU A 109 -4.066 9.571 2.405 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -5.228 11.924 1.901 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -3.662 12.547 2.381 1.00 0.00 H new ATOM 0 HG LEU A 109 -2.613 11.080 0.626 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -4.077 10.215 -1.157 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -4.414 9.438 0.408 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -5.506 10.699 -0.213 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -3.264 12.542 -1.247 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -4.660 13.119 -0.306 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -3.006 13.465 0.253 1.00 0.00 H new ATOM 1700 N LYS A 110 -2.555 11.417 4.669 1.00 0.00 N ATOM 1701 CA LYS A 110 -1.309 11.583 5.409 1.00 0.00 C ATOM 1702 C LYS A 110 -0.842 10.253 5.992 1.00 0.00 C ATOM 1703 O LYS A 110 0.350 10.050 6.222 1.00 0.00 O ATOM 1704 CB LYS A 110 -1.491 12.609 6.530 1.00 0.00 C ATOM 1705 CG LYS A 110 -1.284 14.045 6.080 1.00 0.00 C ATOM 1706 CD LYS A 110 0.168 14.314 5.724 1.00 0.00 C ATOM 1707 CE LYS A 110 0.546 15.764 5.983 1.00 0.00 C ATOM 1708 NZ LYS A 110 0.234 16.636 4.817 1.00 0.00 N ATOM 0 H LYS A 110 -3.330 11.981 5.017 1.00 0.00 H new ATOM 0 HA LYS A 110 -0.548 11.943 4.716 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -2.494 12.508 6.944 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -0.790 12.384 7.334 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -1.916 14.251 5.216 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -1.597 14.724 6.873 1.00 0.00 H new ATOM 0 HD2 LYS A 110 0.814 13.659 6.308 1.00 0.00 H new ATOM 0 HD3 LYS A 110 0.337 14.075 4.674 1.00 0.00 H new ATOM 0 HE2 LYS A 110 0.012 16.127 6.861 1.00 0.00 H new ATOM 0 HE3 LYS A 110 1.610 15.827 6.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 0.475 17.621 5.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 0.789 16.326 3.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -0.780 16.570 4.596 1.00 0.00 H new ATOM 1722 N ALA A 111 -1.789 9.351 6.229 1.00 0.00 N ATOM 1723 CA ALA A 111 -1.473 8.040 6.783 1.00 0.00 C ATOM 1724 C ALA A 111 -1.115 7.050 5.679 1.00 0.00 C ATOM 1725 O ALA A 111 -0.008 6.514 5.649 1.00 0.00 O ATOM 1726 CB ALA A 111 -2.643 7.518 7.604 1.00 0.00 C ATOM 0 H ALA A 111 -2.781 9.504 6.046 1.00 0.00 H new ATOM 0 HA ALA A 111 -0.606 8.147 7.435 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -2.393 6.538 8.012 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -2.851 8.209 8.421 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -3.524 7.432 6.968 1.00 0.00 H new ATOM 1732 N ILE A 112 -2.060 6.813 4.775 1.00 0.00 N ATOM 1733 CA ILE A 112 -1.843 5.887 3.670 1.00 0.00 C ATOM 1734 C ILE A 112 -0.546 6.205 2.933 1.00 0.00 C ATOM 1735 O ILE A 112 0.322 5.345 2.781 1.00 0.00 O ATOM 1736 CB ILE A 112 -3.012 5.923 2.668 1.00 0.00 C ATOM 1737 CG1 ILE A 112 -4.289 5.391 3.322 1.00 0.00 C ATOM 1738 CG2 ILE A 112 -2.669 5.114 1.426 1.00 0.00 C ATOM 1739 CD1 ILE A 112 -5.113 6.463 3.999 1.00 0.00 C ATOM 0 H ILE A 112 -2.982 7.249 4.786 1.00 0.00 H new ATOM 0 HA ILE A 112 -1.777 4.889 4.103 1.00 0.00 H new ATOM 0 HB ILE A 112 -3.184 6.957 2.368 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -4.899 4.900 2.563 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -4.022 4.631 4.057 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -3.505 5.149 0.727 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -1.782 5.534 0.952 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -2.475 4.079 1.708 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -6.003 6.014 4.440 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -4.520 6.938 4.781 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -5.411 7.211 3.264 1.00 0.00 H new ATOM 1751 N LEU A 113 -0.421 7.447 2.478 1.00 0.00 N ATOM 1752 CA LEU A 113 0.772 7.881 1.758 1.00 0.00 C ATOM 1753 C LEU A 113 2.038 7.452 2.492 1.00 0.00 C ATOM 1754 O LEU A 113 2.999 6.993 1.877 1.00 0.00 O ATOM 1755 CB LEU A 113 0.760 9.400 1.582 1.00 0.00 C ATOM 1756 CG LEU A 113 -0.232 9.950 0.556 1.00 0.00 C ATOM 1757 CD1 LEU A 113 -0.253 11.470 0.596 1.00 0.00 C ATOM 1758 CD2 LEU A 113 0.116 9.456 -0.841 1.00 0.00 C ATOM 0 H LEU A 113 -1.130 8.171 2.595 1.00 0.00 H new ATOM 0 HA LEU A 113 0.766 7.407 0.776 1.00 0.00 H new ATOM 0 HB2 LEU A 113 0.543 9.856 2.548 1.00 0.00 H new ATOM 0 HB3 LEU A 113 1.762 9.720 1.297 1.00 0.00 H new ATOM 0 HG LEU A 113 -1.228 9.586 0.810 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.964 11.844 -0.141 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -0.551 11.804 1.590 1.00 0.00 H new ATOM 0 HD13 LEU A 113 0.741 11.854 0.367 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -0.600 9.857 -1.558 1.00 0.00 H new ATOM 0 HD22 LEU A 113 1.119 9.790 -1.105 1.00 0.00 H new ATOM 0 HD23 LEU A 113 0.078 8.367 -0.862 1.00 0.00 H new ATOM 1770 N GLY A 114 2.030 7.603 3.813 1.00 0.00 N ATOM 1771 CA GLY A 114 3.182 7.225 4.610 1.00 0.00 C ATOM 1772 C GLY A 114 3.516 5.751 4.484 1.00 0.00 C ATOM 1773 O GLY A 114 4.686 5.378 4.390 1.00 0.00 O ATOM 0 H GLY A 114 1.246 7.980 4.345 1.00 0.00 H new ATOM 0 HA2 GLY A 114 4.043 7.817 4.302 1.00 0.00 H new ATOM 0 HA3 GLY A 114 2.990 7.463 5.656 1.00 0.00 H new ATOM 1777 N LEU A 115 2.487 4.911 4.484 1.00 0.00 N ATOM 1778 CA LEU A 115 2.676 3.469 4.370 1.00 0.00 C ATOM 1779 C LEU A 115 3.326 3.109 3.038 1.00 0.00 C ATOM 1780 O LEU A 115 4.385 2.482 3.001 1.00 0.00 O ATOM 1781 CB LEU A 115 1.335 2.746 4.508 1.00 0.00 C ATOM 1782 CG LEU A 115 1.208 1.419 3.761 1.00 0.00 C ATOM 1783 CD1 LEU A 115 0.257 0.483 4.491 1.00 0.00 C ATOM 1784 CD2 LEU A 115 0.736 1.653 2.333 1.00 0.00 C ATOM 0 H LEU A 115 1.513 5.204 4.562 1.00 0.00 H new ATOM 0 HA LEU A 115 3.338 3.150 5.175 1.00 0.00 H new ATOM 0 HB2 LEU A 115 1.151 2.563 5.567 1.00 0.00 H new ATOM 0 HB3 LEU A 115 0.547 3.414 4.158 1.00 0.00 H new ATOM 0 HG LEU A 115 2.191 0.950 3.726 1.00 0.00 H new ATOM 0 HD11 LEU A 115 0.180 -0.456 3.944 1.00 0.00 H new ATOM 0 HD12 LEU A 115 0.637 0.288 5.494 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -0.728 0.945 4.559 1.00 0.00 H new ATOM 0 HD21 LEU A 115 0.651 0.697 1.816 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -0.237 2.145 2.347 1.00 0.00 H new ATOM 0 HD23 LEU A 115 1.455 2.285 1.811 1.00 0.00 H new ATOM 1796 N PHE A 116 2.685 3.511 1.945 1.00 0.00 N ATOM 1797 CA PHE A 116 3.201 3.231 0.610 1.00 0.00 C ATOM 1798 C PHE A 116 4.509 3.978 0.365 1.00 0.00 C ATOM 1799 O PHE A 116 5.264 3.647 -0.549 1.00 0.00 O ATOM 1800 CB PHE A 116 2.171 3.624 -0.451 1.00 0.00 C ATOM 1801 CG PHE A 116 1.227 2.512 -0.810 1.00 0.00 C ATOM 1802 CD1 PHE A 116 1.620 1.504 -1.676 1.00 0.00 C ATOM 1803 CD2 PHE A 116 -0.054 2.475 -0.283 1.00 0.00 C ATOM 1804 CE1 PHE A 116 0.754 0.479 -2.008 1.00 0.00 C ATOM 1805 CE2 PHE A 116 -0.924 1.453 -0.611 1.00 0.00 C ATOM 1806 CZ PHE A 116 -0.520 0.454 -1.476 1.00 0.00 C ATOM 0 H PHE A 116 1.808 4.031 1.958 1.00 0.00 H new ATOM 0 HA PHE A 116 3.395 2.161 0.540 1.00 0.00 H new ATOM 0 HB2 PHE A 116 1.595 4.476 -0.089 1.00 0.00 H new ATOM 0 HB3 PHE A 116 2.694 3.951 -1.350 1.00 0.00 H new ATOM 0 HD1 PHE A 116 2.615 1.519 -2.096 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -0.376 3.254 0.392 1.00 0.00 H new ATOM 0 HE1 PHE A 116 1.073 -0.301 -2.683 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -1.919 1.435 -0.192 1.00 0.00 H new ATOM 0 HZ PHE A 116 -1.199 -0.345 -1.735 1.00 0.00 H new ATOM 1816 N PHE A 117 4.770 4.987 1.189 1.00 0.00 N ATOM 1817 CA PHE A 117 5.986 5.783 1.062 1.00 0.00 C ATOM 1818 C PHE A 117 7.194 5.019 1.595 1.00 0.00 C ATOM 1819 O PHE A 117 8.292 5.111 1.047 1.00 0.00 O ATOM 1820 CB PHE A 117 5.835 7.108 1.812 1.00 0.00 C ATOM 1821 CG PHE A 117 7.095 7.924 1.848 1.00 0.00 C ATOM 1822 CD1 PHE A 117 8.187 7.505 2.590 1.00 0.00 C ATOM 1823 CD2 PHE A 117 7.187 9.111 1.139 1.00 0.00 C ATOM 1824 CE1 PHE A 117 9.348 8.253 2.625 1.00 0.00 C ATOM 1825 CE2 PHE A 117 8.346 9.863 1.170 1.00 0.00 C ATOM 1826 CZ PHE A 117 9.427 9.435 1.914 1.00 0.00 C ATOM 0 H PHE A 117 4.156 5.273 1.952 1.00 0.00 H new ATOM 0 HA PHE A 117 6.146 5.989 0.004 1.00 0.00 H new ATOM 0 HB2 PHE A 117 5.045 7.694 1.342 1.00 0.00 H new ATOM 0 HB3 PHE A 117 5.515 6.903 2.834 1.00 0.00 H new ATOM 0 HD1 PHE A 117 8.130 6.582 3.148 1.00 0.00 H new ATOM 0 HD2 PHE A 117 6.344 9.452 0.556 1.00 0.00 H new ATOM 0 HE1 PHE A 117 10.192 7.914 3.207 1.00 0.00 H new ATOM 0 HE2 PHE A 117 8.406 10.786 0.612 1.00 0.00 H new ATOM 0 HZ PHE A 117 10.333 10.023 1.940 1.00 0.00 H new ATOM 1836 N SER A 118 6.983 4.263 2.668 1.00 0.00 N ATOM 1837 CA SER A 118 8.055 3.486 3.279 1.00 0.00 C ATOM 1838 C SER A 118 8.089 2.070 2.713 1.00 0.00 C ATOM 1839 O SER A 118 9.160 1.509 2.477 1.00 0.00 O ATOM 1840 CB SER A 118 7.875 3.436 4.798 1.00 0.00 C ATOM 1841 OG SER A 118 8.269 4.658 5.399 1.00 0.00 O ATOM 0 H SER A 118 6.079 4.172 3.132 1.00 0.00 H new ATOM 0 HA SER A 118 9.002 3.974 3.048 1.00 0.00 H new ATOM 0 HB2 SER A 118 6.832 3.229 5.037 1.00 0.00 H new ATOM 0 HB3 SER A 118 8.465 2.617 5.210 1.00 0.00 H new ATOM 0 HG SER A 118 8.143 4.601 6.369 1.00 0.00 H new ATOM 1847 N LEU A 119 6.910 1.497 2.497 1.00 0.00 N ATOM 1848 CA LEU A 119 6.804 0.145 1.958 1.00 0.00 C ATOM 1849 C LEU A 119 7.587 0.015 0.656 1.00 0.00 C ATOM 1850 O LEU A 119 8.453 -0.849 0.524 1.00 0.00 O ATOM 1851 CB LEU A 119 5.336 -0.217 1.723 1.00 0.00 C ATOM 1852 CG LEU A 119 5.073 -1.315 0.692 1.00 0.00 C ATOM 1853 CD1 LEU A 119 5.962 -2.520 0.957 1.00 0.00 C ATOM 1854 CD2 LEU A 119 3.606 -1.719 0.706 1.00 0.00 C ATOM 0 H LEU A 119 6.014 1.947 2.687 1.00 0.00 H new ATOM 0 HA LEU A 119 7.230 -0.545 2.686 1.00 0.00 H new ATOM 0 HB2 LEU A 119 4.902 -0.527 2.674 1.00 0.00 H new ATOM 0 HB3 LEU A 119 4.806 0.683 1.410 1.00 0.00 H new ATOM 0 HG LEU A 119 5.312 -0.923 -0.297 1.00 0.00 H new ATOM 0 HD11 LEU A 119 5.761 -3.291 0.213 1.00 0.00 H new ATOM 0 HD12 LEU A 119 7.008 -2.221 0.895 1.00 0.00 H new ATOM 0 HD13 LEU A 119 5.755 -2.913 1.952 1.00 0.00 H new ATOM 0 HD21 LEU A 119 3.437 -2.501 -0.034 1.00 0.00 H new ATOM 0 HD22 LEU A 119 3.341 -2.092 1.695 1.00 0.00 H new ATOM 0 HD23 LEU A 119 2.988 -0.854 0.467 1.00 0.00 H new ATOM 1866 N SER A 120 7.277 0.881 -0.304 1.00 0.00 N ATOM 1867 CA SER A 120 7.950 0.862 -1.597 1.00 0.00 C ATOM 1868 C SER A 120 9.462 0.752 -1.421 1.00 0.00 C ATOM 1869 O SER A 120 10.124 -0.021 -2.114 1.00 0.00 O ATOM 1870 CB SER A 120 7.608 2.124 -2.393 1.00 0.00 C ATOM 1871 OG SER A 120 7.683 1.883 -3.787 1.00 0.00 O ATOM 0 H SER A 120 6.564 1.604 -0.210 1.00 0.00 H new ATOM 0 HA SER A 120 7.601 -0.012 -2.148 1.00 0.00 H new ATOM 0 HB2 SER A 120 6.605 2.461 -2.132 1.00 0.00 H new ATOM 0 HB3 SER A 120 8.295 2.926 -2.122 1.00 0.00 H new ATOM 0 HG SER A 120 7.144 1.096 -4.012 1.00 0.00 H new ATOM 1877 N ARG A 121 10.001 1.532 -0.490 1.00 0.00 N ATOM 1878 CA ARG A 121 11.434 1.523 -0.222 1.00 0.00 C ATOM 1879 C ARG A 121 11.957 0.095 -0.106 1.00 0.00 C ATOM 1880 O ARG A 121 12.937 -0.273 -0.755 1.00 0.00 O ATOM 1881 CB ARG A 121 11.739 2.296 1.062 1.00 0.00 C ATOM 1882 CG ARG A 121 11.229 3.727 1.048 1.00 0.00 C ATOM 1883 CD ARG A 121 12.001 4.603 2.022 1.00 0.00 C ATOM 1884 NE ARG A 121 13.445 4.457 1.864 1.00 0.00 N ATOM 1885 CZ ARG A 121 14.154 5.108 0.948 1.00 0.00 C ATOM 1886 NH1 ARG A 121 13.554 5.946 0.113 1.00 0.00 N ATOM 1887 NH2 ARG A 121 15.465 4.922 0.866 1.00 0.00 N ATOM 0 H ARG A 121 9.467 2.178 0.091 1.00 0.00 H new ATOM 0 HA ARG A 121 11.937 2.008 -1.058 1.00 0.00 H new ATOM 0 HB2 ARG A 121 11.295 1.770 1.907 1.00 0.00 H new ATOM 0 HB3 ARG A 121 12.817 2.305 1.223 1.00 0.00 H new ATOM 0 HG2 ARG A 121 11.316 4.136 0.041 1.00 0.00 H new ATOM 0 HG3 ARG A 121 10.170 3.740 1.306 1.00 0.00 H new ATOM 0 HD2 ARG A 121 11.723 5.646 1.870 1.00 0.00 H new ATOM 0 HD3 ARG A 121 11.720 4.344 3.043 1.00 0.00 H new ATOM 0 HE ARG A 121 13.937 3.820 2.491 1.00 0.00 H new ATOM 0 HH11 ARG A 121 12.546 6.092 0.173 1.00 0.00 H new ATOM 0 HH12 ARG A 121 14.100 6.445 -0.589 1.00 0.00 H new ATOM 0 HH21 ARG A 121 15.930 4.279 1.507 1.00 0.00 H new ATOM 0 HH22 ARG A 121 16.008 5.422 0.162 1.00 0.00 H new ATOM 1901 N TYR A 122 11.298 -0.705 0.724 1.00 0.00 N ATOM 1902 CA TYR A 122 11.699 -2.093 0.928 1.00 0.00 C ATOM 1903 C TYR A 122 12.131 -2.733 -0.387 1.00 0.00 C ATOM 1904 O TYR A 122 13.233 -3.270 -0.498 1.00 0.00 O ATOM 1905 CB TYR A 122 10.549 -2.892 1.544 1.00 0.00 C ATOM 1906 CG TYR A 122 10.732 -4.389 1.445 1.00 0.00 C ATOM 1907 CD1 TYR A 122 10.343 -5.083 0.305 1.00 0.00 C ATOM 1908 CD2 TYR A 122 11.292 -5.111 2.492 1.00 0.00 C ATOM 1909 CE1 TYR A 122 10.508 -6.451 0.211 1.00 0.00 C ATOM 1910 CE2 TYR A 122 11.461 -6.480 2.406 1.00 0.00 C ATOM 1911 CZ TYR A 122 11.067 -7.145 1.263 1.00 0.00 C ATOM 1912 OH TYR A 122 11.233 -8.508 1.174 1.00 0.00 O ATOM 0 H TYR A 122 10.484 -0.417 1.267 1.00 0.00 H new ATOM 0 HA TYR A 122 12.547 -2.104 1.612 1.00 0.00 H new ATOM 0 HB2 TYR A 122 10.446 -2.615 2.593 1.00 0.00 H new ATOM 0 HB3 TYR A 122 9.618 -2.614 1.049 1.00 0.00 H new ATOM 0 HD1 TYR A 122 9.904 -4.543 -0.521 1.00 0.00 H new ATOM 0 HD2 TYR A 122 11.600 -4.593 3.388 1.00 0.00 H new ATOM 0 HE1 TYR A 122 10.201 -6.975 -0.682 1.00 0.00 H new ATOM 0 HE2 TYR A 122 11.899 -7.026 3.229 1.00 0.00 H new ATOM 0 HH TYR A 122 11.641 -8.842 2.000 1.00 0.00 H new ATOM 1922 N LYS A 123 11.254 -2.673 -1.384 1.00 0.00 N ATOM 1923 CA LYS A 123 11.542 -3.245 -2.694 1.00 0.00 C ATOM 1924 C LYS A 123 12.513 -2.362 -3.471 1.00 0.00 C ATOM 1925 O LYS A 123 13.560 -2.825 -3.924 1.00 0.00 O ATOM 1926 CB LYS A 123 10.248 -3.423 -3.491 1.00 0.00 C ATOM 1927 CG LYS A 123 10.347 -4.475 -4.582 1.00 0.00 C ATOM 1928 CD LYS A 123 10.454 -5.874 -3.999 1.00 0.00 C ATOM 1929 CE LYS A 123 9.851 -6.914 -4.931 1.00 0.00 C ATOM 1930 NZ LYS A 123 10.723 -7.175 -6.109 1.00 0.00 N ATOM 0 H LYS A 123 10.337 -2.233 -1.309 1.00 0.00 H new ATOM 0 HA LYS A 123 12.006 -4.220 -2.544 1.00 0.00 H new ATOM 0 HB2 LYS A 123 9.444 -3.695 -2.807 1.00 0.00 H new ATOM 0 HB3 LYS A 123 9.974 -2.469 -3.941 1.00 0.00 H new ATOM 0 HG2 LYS A 123 9.471 -4.415 -5.227 1.00 0.00 H new ATOM 0 HG3 LYS A 123 11.217 -4.272 -5.206 1.00 0.00 H new ATOM 0 HD2 LYS A 123 11.501 -6.113 -3.814 1.00 0.00 H new ATOM 0 HD3 LYS A 123 9.945 -5.908 -3.036 1.00 0.00 H new ATOM 0 HE2 LYS A 123 9.692 -7.843 -4.384 1.00 0.00 H new ATOM 0 HE3 LYS A 123 8.873 -6.573 -5.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 10.277 -7.889 -6.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 10.854 -6.294 -6.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 11.648 -7.525 -5.786 1.00 0.00 H new ATOM 1944 N GLN A 124 12.160 -1.089 -3.619 1.00 0.00 N ATOM 1945 CA GLN A 124 13.002 -0.142 -4.340 1.00 0.00 C ATOM 1946 C GLN A 124 14.480 -0.456 -4.129 1.00 0.00 C ATOM 1947 O GLN A 124 15.220 -0.676 -5.087 1.00 0.00 O ATOM 1948 CB GLN A 124 12.703 1.288 -3.887 1.00 0.00 C ATOM 1949 CG GLN A 124 11.359 1.810 -4.369 1.00 0.00 C ATOM 1950 CD GLN A 124 11.199 1.710 -5.873 1.00 0.00 C ATOM 1951 OE1 GLN A 124 12.179 1.562 -6.604 1.00 0.00 O ATOM 1952 NE2 GLN A 124 9.960 1.790 -6.344 1.00 0.00 N ATOM 0 H GLN A 124 11.297 -0.690 -3.249 1.00 0.00 H new ATOM 0 HA GLN A 124 12.778 -0.233 -5.403 1.00 0.00 H new ATOM 0 HB2 GLN A 124 12.730 1.328 -2.798 1.00 0.00 H new ATOM 0 HB3 GLN A 124 13.491 1.948 -4.250 1.00 0.00 H new ATOM 0 HG2 GLN A 124 10.560 1.248 -3.884 1.00 0.00 H new ATOM 0 HG3 GLN A 124 11.247 2.850 -4.064 1.00 0.00 H new ATOM 0 HE21 GLN A 124 9.177 1.913 -5.702 1.00 0.00 H new ATOM 0 HE22 GLN A 124 9.791 1.729 -7.348 1.00 0.00 H new ATOM 1961 N GLN A 125 14.901 -0.475 -2.869 1.00 0.00 N ATOM 1962 CA GLN A 125 16.291 -0.761 -2.533 1.00 0.00 C ATOM 1963 C GLN A 125 16.644 -2.207 -2.865 1.00 0.00 C ATOM 1964 O GLN A 125 17.736 -2.491 -3.357 1.00 0.00 O ATOM 1965 CB GLN A 125 16.545 -0.490 -1.049 1.00 0.00 C ATOM 1966 CG GLN A 125 17.997 -0.171 -0.729 1.00 0.00 C ATOM 1967 CD GLN A 125 18.169 0.448 0.644 1.00 0.00 C ATOM 1968 OE1 GLN A 125 17.724 1.569 0.893 1.00 0.00 O ATOM 1969 NE2 GLN A 125 18.818 -0.281 1.545 1.00 0.00 N ATOM 0 H GLN A 125 14.300 -0.296 -2.064 1.00 0.00 H new ATOM 0 HA GLN A 125 16.925 -0.105 -3.129 1.00 0.00 H new ATOM 0 HB2 GLN A 125 15.919 0.343 -0.728 1.00 0.00 H new ATOM 0 HB3 GLN A 125 16.237 -1.361 -0.471 1.00 0.00 H new ATOM 0 HG2 GLN A 125 18.587 -1.085 -0.788 1.00 0.00 H new ATOM 0 HG3 GLN A 125 18.390 0.511 -1.483 1.00 0.00 H new ATOM 0 HE21 GLN A 125 19.170 -1.205 1.296 1.00 0.00 H new ATOM 0 HE22 GLN A 125 18.964 0.083 2.486 1.00 0.00 H new ATOM 1978 N GLN A 126 15.714 -3.117 -2.592 1.00 0.00 N ATOM 1979 CA GLN A 126 15.929 -4.533 -2.861 1.00 0.00 C ATOM 1980 C GLN A 126 16.136 -4.779 -4.352 1.00 0.00 C ATOM 1981 O GLN A 126 15.174 -4.875 -5.114 1.00 0.00 O ATOM 1982 CB GLN A 126 14.742 -5.356 -2.357 1.00 0.00 C ATOM 1983 CG GLN A 126 15.093 -6.802 -2.046 1.00 0.00 C ATOM 1984 CD GLN A 126 15.527 -7.575 -3.275 1.00 0.00 C ATOM 1985 OE1 GLN A 126 15.158 -7.234 -4.400 1.00 0.00 O ATOM 1986 NE2 GLN A 126 16.315 -8.624 -3.068 1.00 0.00 N ATOM 0 H GLN A 126 14.805 -2.898 -2.185 1.00 0.00 H new ATOM 0 HA GLN A 126 16.829 -4.844 -2.331 1.00 0.00 H new ATOM 0 HB2 GLN A 126 14.341 -4.887 -1.459 1.00 0.00 H new ATOM 0 HB3 GLN A 126 13.952 -5.336 -3.107 1.00 0.00 H new ATOM 0 HG2 GLN A 126 15.892 -6.826 -1.305 1.00 0.00 H new ATOM 0 HG3 GLN A 126 14.229 -7.293 -1.599 1.00 0.00 H new ATOM 0 HE21 GLN A 126 16.597 -8.871 -2.119 1.00 0.00 H new ATOM 0 HE22 GLN A 126 16.639 -9.183 -3.858 1.00 0.00 H new ATOM 1995 N GLN A 127 17.397 -4.879 -4.761 1.00 0.00 N ATOM 1996 CA GLN A 127 17.729 -5.112 -6.162 1.00 0.00 C ATOM 1997 C GLN A 127 18.946 -6.022 -6.288 1.00 0.00 C ATOM 1998 O GLN A 127 19.932 -5.857 -5.570 1.00 0.00 O ATOM 1999 CB GLN A 127 17.994 -3.784 -6.873 1.00 0.00 C ATOM 2000 CG GLN A 127 16.822 -2.817 -6.812 1.00 0.00 C ATOM 2001 CD GLN A 127 15.771 -3.108 -7.865 1.00 0.00 C ATOM 2002 OE1 GLN A 127 15.771 -4.174 -8.481 1.00 0.00 O ATOM 2003 NE2 GLN A 127 14.866 -2.158 -8.077 1.00 0.00 N ATOM 0 H GLN A 127 18.205 -4.802 -4.143 1.00 0.00 H new ATOM 0 HA GLN A 127 16.879 -5.605 -6.634 1.00 0.00 H new ATOM 0 HB2 GLN A 127 18.869 -3.311 -6.427 1.00 0.00 H new ATOM 0 HB3 GLN A 127 18.237 -3.982 -7.917 1.00 0.00 H new ATOM 0 HG2 GLN A 127 16.365 -2.868 -5.824 1.00 0.00 H new ATOM 0 HG3 GLN A 127 17.189 -1.799 -6.942 1.00 0.00 H new ATOM 0 HE21 GLN A 127 14.904 -1.290 -7.543 1.00 0.00 H new ATOM 0 HE22 GLN A 127 14.134 -2.297 -8.773 1.00 0.00 H new ATOM 2012 N GLN A 128 18.869 -6.981 -7.205 1.00 0.00 N ATOM 2013 CA GLN A 128 19.966 -7.917 -7.424 1.00 0.00 C ATOM 2014 C GLN A 128 20.344 -7.977 -8.900 1.00 0.00 C ATOM 2015 O GLN A 128 19.499 -7.856 -9.788 1.00 0.00 O ATOM 2016 CB GLN A 128 19.580 -9.312 -6.927 1.00 0.00 C ATOM 2017 CG GLN A 128 19.276 -9.365 -5.438 1.00 0.00 C ATOM 2018 CD GLN A 128 19.449 -10.754 -4.856 1.00 0.00 C ATOM 2019 OE1 GLN A 128 18.507 -11.334 -4.315 1.00 0.00 O ATOM 2020 NE2 GLN A 128 20.657 -11.295 -4.964 1.00 0.00 N ATOM 0 H GLN A 128 18.060 -7.130 -7.808 1.00 0.00 H new ATOM 0 HA GLN A 128 20.830 -7.564 -6.861 1.00 0.00 H new ATOM 0 HB2 GLN A 128 18.706 -9.657 -7.480 1.00 0.00 H new ATOM 0 HB3 GLN A 128 20.392 -10.005 -7.149 1.00 0.00 H new ATOM 0 HG2 GLN A 128 19.932 -8.671 -4.912 1.00 0.00 H new ATOM 0 HG3 GLN A 128 18.253 -9.029 -5.268 1.00 0.00 H new ATOM 0 HE21 GLN A 128 21.408 -10.778 -5.420 1.00 0.00 H new ATOM 0 HE22 GLN A 128 20.833 -12.228 -4.591 1.00 0.00 H new ATOM 2029 N PRO A 129 21.643 -8.168 -9.171 1.00 0.00 N ATOM 2030 CA PRO A 129 22.163 -8.248 -10.540 1.00 0.00 C ATOM 2031 C PRO A 129 21.726 -9.524 -11.252 1.00 0.00 C ATOM 2032 O PRO A 129 22.049 -9.736 -12.420 1.00 0.00 O ATOM 2033 CB PRO A 129 23.681 -8.238 -10.344 1.00 0.00 C ATOM 2034 CG PRO A 129 23.889 -8.776 -8.971 1.00 0.00 C ATOM 2035 CD PRO A 129 22.706 -8.320 -8.163 1.00 0.00 C ATOM 0 HA PRO A 129 21.795 -7.434 -11.164 1.00 0.00 H new ATOM 0 HB2 PRO A 129 24.181 -8.855 -11.091 1.00 0.00 H new ATOM 0 HB3 PRO A 129 24.086 -7.231 -10.440 1.00 0.00 H new ATOM 0 HG2 PRO A 129 23.956 -9.864 -8.984 1.00 0.00 H new ATOM 0 HG3 PRO A 129 24.820 -8.404 -8.543 1.00 0.00 H new ATOM 0 HD2 PRO A 129 22.435 -9.050 -7.400 1.00 0.00 H new ATOM 0 HD3 PRO A 129 22.909 -7.381 -7.648 1.00 0.00 H new TER 2043 PRO A 129