USER MOD reduce.3.24.130724 H: found=0, std=0, add=792, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 792 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 64 CYS SG : rot 146:sc= 0.211! USER MOD Set 1.2: A 83 TYR OH : rot 35:sc= 1.29 USER MOD Set 2.1: A 78 ASN : amide:sc= -0.457 X(o=-0.82,f=-0.39) USER MOD Set 2.2: A 80 ASN : amide:sc= -0.367 X(o=-0.82,f=-0.85) USER MOD Set 3.1: A 19 THR OG1 : rot 180:sc= 0.921 USER MOD Set 3.2: A 66 GLN : amide:sc= 1.19 K(o=2.1,f=-2.5!) USER MOD Single : A 1 GLU N :NH3+ -169:sc=-0.00215 (180deg=-0.171) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.138 USER MOD Single : A 9 THR OG1 : rot 93:sc= 0.376 USER MOD Single : A 11 SER OG : rot 180:sc= 0.326 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 171:sc= -0.0218 (180deg=-0.136) USER MOD Single : A 15 ASN : amide:sc= -1.54 K(o=-1.5,f=-12!) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 180:sc= -0.0592 USER MOD Single : A 22 LYS NZ :NH3+ 166:sc= 1.23 (180deg=0.314) USER MOD Single : A 25 ASN : amide:sc= 0.492 X(o=0.49,f=0) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 ASN : amide:sc= -1.01! C(o=-1!,f=-5.3!) USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 GLN : amide:sc= 0.00817 K(o=0.0082,f=-0.74) USER MOD Single : A 37 THR OG1 : rot -67:sc= 1.17 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 ASN : amide:sc= -1.68 K(o=-1.7,f=-0.24) USER MOD Single : A 57 THR OG1 : rot 43:sc= 0.268 USER MOD Single : A 60 TYR OH : rot -177:sc= 0.517 USER MOD Single : A 69 HIS : no HE2:sc= 1.25 K(o=1.2,f=-3.9!) USER MOD Single : A 74 TYR OH : rot 165:sc= 0 USER MOD Single : A 75 ASN : amide:sc= 1.41 K(o=1.4,f=-3.7!) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 CYS SG : rot -42:sc= -0.02 USER MOD Single : A 88 THR OG1 : rot 180:sc= -0.0807 USER MOD Single : A 89 CYS SG : rot -96:sc= -1.18! USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 ASN : amide:sc= -0.152 X(o=-0.15,f=-0.14) USER MOD Single : A 96 GLN : amide:sc= -2.29! K(o=-2.3!,f=-0.088) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 1 -58.045 113.609 37.123 1.00 0.00 N ATOM 2 CA GLU A 1 -59.406 114.023 36.758 1.00 0.00 C ATOM 3 C GLU A 1 -59.580 114.033 35.245 1.00 0.00 C ATOM 4 O GLU A 1 -60.218 113.143 34.692 1.00 0.00 O ATOM 5 CB GLU A 1 -59.760 115.386 37.371 1.00 0.00 C ATOM 6 CG GLU A 1 -59.752 115.387 38.892 1.00 0.00 C ATOM 7 CD GLU A 1 -60.755 114.421 39.478 1.00 0.00 C ATOM 8 OE1 GLU A 1 -60.460 113.206 39.558 1.00 0.00 O ATOM 9 OE2 GLU A 1 -61.853 114.852 39.872 1.00 0.00 O1- ATOM 0 H1 GLU A 1 -58.000 113.429 38.146 1.00 0.00 H new ATOM 0 H2 GLU A 1 -57.796 112.741 36.607 1.00 0.00 H new ATOM 0 H3 GLU A 1 -57.374 114.364 36.874 1.00 0.00 H new ATOM 0 HA GLU A 1 -60.101 113.292 37.171 1.00 0.00 H new ATOM 0 HB2 GLU A 1 -59.052 116.132 37.011 1.00 0.00 H new ATOM 0 HB3 GLU A 1 -60.747 115.688 37.020 1.00 0.00 H new ATOM 0 HG2 GLU A 1 -58.754 115.129 39.247 1.00 0.00 H new ATOM 0 HG3 GLU A 1 -59.968 116.393 39.252 1.00 0.00 H new ATOM 18 N THR A 2 -58.994 115.007 34.583 1.00 0.00 N ATOM 19 CA THR A 2 -59.054 115.116 33.150 1.00 0.00 C ATOM 20 C THR A 2 -58.107 114.072 32.530 1.00 0.00 C ATOM 21 O THR A 2 -56.879 114.138 32.731 1.00 0.00 O ATOM 22 CB THR A 2 -58.622 116.537 32.732 1.00 0.00 C ATOM 23 OG1 THR A 2 -59.349 117.496 33.525 1.00 0.00 O ATOM 24 CG2 THR A 2 -58.923 116.789 31.264 1.00 0.00 C ATOM 0 H THR A 2 -58.459 115.750 35.033 1.00 0.00 H new ATOM 0 HA THR A 2 -60.070 114.935 32.800 1.00 0.00 H new ATOM 0 HB THR A 2 -57.548 116.635 32.890 1.00 0.00 H new ATOM 0 HG1 THR A 2 -59.081 118.403 33.269 1.00 0.00 H new ATOM 0 HG21 THR A 2 -58.609 117.798 30.996 1.00 0.00 H new ATOM 0 HG22 THR A 2 -58.383 116.066 30.653 1.00 0.00 H new ATOM 0 HG23 THR A 2 -59.994 116.684 31.089 1.00 0.00 H new ATOM 32 N PRO A 3 -58.648 113.074 31.823 1.00 0.00 N ATOM 33 CA PRO A 3 -57.845 112.017 31.244 1.00 0.00 C ATOM 34 C PRO A 3 -57.126 112.473 29.983 1.00 0.00 C ATOM 35 O PRO A 3 -57.733 113.048 29.078 1.00 0.00 O ATOM 36 CB PRO A 3 -58.863 110.914 30.937 1.00 0.00 C ATOM 37 CG PRO A 3 -60.159 111.624 30.727 1.00 0.00 C ATOM 38 CD PRO A 3 -60.092 112.905 31.524 1.00 0.00 C ATOM 0 HA PRO A 3 -57.051 111.687 31.914 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -58.576 110.349 30.050 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -58.933 110.203 31.760 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -60.317 111.835 29.669 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -60.995 111.007 31.057 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -60.482 113.749 30.955 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -60.682 112.837 32.438 1.00 0.00 H new ATOM 46 N ALA A 4 -55.839 112.228 29.931 1.00 0.00 N ATOM 47 CA ALA A 4 -55.020 112.588 28.780 1.00 0.00 C ATOM 48 C ALA A 4 -55.058 111.469 27.750 1.00 0.00 C ATOM 49 O ALA A 4 -54.027 111.077 27.197 1.00 0.00 O ATOM 50 CB ALA A 4 -53.590 112.846 29.224 1.00 0.00 C ATOM 0 H ALA A 4 -55.321 111.773 30.683 1.00 0.00 H new ATOM 0 HA ALA A 4 -55.416 113.497 28.327 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -52.983 113.114 28.359 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -53.575 113.663 29.946 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -53.185 111.946 29.686 1.00 0.00 H new ATOM 56 N THR A 5 -56.241 110.981 27.493 1.00 0.00 N ATOM 57 CA THR A 5 -56.473 109.911 26.581 1.00 0.00 C ATOM 58 C THR A 5 -56.201 110.345 25.128 1.00 0.00 C ATOM 59 O THR A 5 -56.992 111.070 24.499 1.00 0.00 O ATOM 60 CB THR A 5 -57.905 109.400 26.787 1.00 0.00 C ATOM 61 OG1 THR A 5 -58.721 110.517 27.192 1.00 0.00 O ATOM 62 CG2 THR A 5 -57.953 108.334 27.875 1.00 0.00 C ATOM 0 H THR A 5 -57.093 111.333 27.930 1.00 0.00 H new ATOM 0 HA THR A 5 -55.779 109.094 26.778 1.00 0.00 H new ATOM 0 HB THR A 5 -58.267 108.959 25.858 1.00 0.00 H new ATOM 0 HG1 THR A 5 -59.643 110.216 27.329 1.00 0.00 H new ATOM 0 HG21 THR A 5 -58.979 107.989 28.001 1.00 0.00 H new ATOM 0 HG22 THR A 5 -57.320 107.494 27.589 1.00 0.00 H new ATOM 0 HG23 THR A 5 -57.594 108.756 28.814 1.00 0.00 H new ATOM 70 N ARG A 6 -55.059 109.948 24.641 1.00 0.00 N ATOM 71 CA ARG A 6 -54.583 110.305 23.332 1.00 0.00 C ATOM 72 C ARG A 6 -54.930 109.223 22.325 1.00 0.00 C ATOM 73 O ARG A 6 -55.163 108.068 22.706 1.00 0.00 O ATOM 74 CB ARG A 6 -53.068 110.510 23.389 1.00 0.00 C ATOM 75 CG ARG A 6 -52.649 111.669 24.272 1.00 0.00 C ATOM 76 CD ARG A 6 -51.142 111.746 24.421 1.00 0.00 C ATOM 77 NE ARG A 6 -50.586 110.525 25.016 1.00 0.00 N ATOM 78 CZ ARG A 6 -50.051 110.434 26.239 1.00 0.00 C ATOM 79 NH1 ARG A 6 -49.995 111.501 27.037 1.00 0.00 N1+ ATOM 80 NH2 ARG A 6 -49.568 109.276 26.650 1.00 0.00 N ATOM 0 H ARG A 6 -54.414 109.350 25.158 1.00 0.00 H new ATOM 0 HA ARG A 6 -55.065 111.230 23.014 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -52.599 109.597 23.755 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -52.694 110.679 22.379 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -53.021 112.602 23.848 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -53.107 111.561 25.255 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -50.689 111.912 23.444 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -50.882 112.603 25.042 1.00 0.00 H new ATOM 0 HE ARG A 6 -50.609 109.676 24.451 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -50.362 112.397 26.717 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -49.585 111.421 27.968 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -49.605 108.462 26.037 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -49.158 109.196 27.581 1.00 0.00 H new ATOM 94 N PRO A 7 -55.016 109.575 21.030 1.00 0.00 N ATOM 95 CA PRO A 7 -55.274 108.608 19.978 1.00 0.00 C ATOM 96 C PRO A 7 -54.085 107.666 19.798 1.00 0.00 C ATOM 97 O PRO A 7 -53.040 108.051 19.259 1.00 0.00 O ATOM 98 CB PRO A 7 -55.478 109.463 18.709 1.00 0.00 C ATOM 99 CG PRO A 7 -55.623 110.866 19.190 1.00 0.00 C ATOM 100 CD PRO A 7 -54.887 110.942 20.492 1.00 0.00 C ATOM 0 HA PRO A 7 -56.135 107.978 20.203 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -54.630 109.367 18.031 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -56.363 109.144 18.159 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -55.209 111.569 18.468 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -56.673 111.125 19.321 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -53.843 111.222 20.349 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -55.327 111.682 21.161 1.00 0.00 H new ATOM 108 N VAL A 8 -54.214 106.475 20.312 1.00 0.00 N ATOM 109 CA VAL A 8 -53.181 105.481 20.187 1.00 0.00 C ATOM 110 C VAL A 8 -53.571 104.539 19.072 1.00 0.00 C ATOM 111 O VAL A 8 -54.766 104.208 18.941 1.00 0.00 O ATOM 112 CB VAL A 8 -52.986 104.678 21.511 1.00 0.00 C ATOM 113 CG1 VAL A 8 -51.846 103.669 21.394 1.00 0.00 C ATOM 114 CG2 VAL A 8 -52.737 105.617 22.678 1.00 0.00 C ATOM 0 H VAL A 8 -55.037 106.164 20.829 1.00 0.00 H new ATOM 0 HA VAL A 8 -52.236 105.978 19.968 1.00 0.00 H new ATOM 0 HB VAL A 8 -53.907 104.125 21.694 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -51.740 103.129 22.335 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -52.066 102.963 20.593 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -50.917 104.194 21.170 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -52.604 105.036 23.591 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -51.839 106.204 22.487 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -53.590 106.286 22.795 1.00 0.00 H new ATOM 124 N THR A 9 -52.588 104.176 18.251 1.00 0.00 N ATOM 125 CA THR A 9 -52.717 103.251 17.126 1.00 0.00 C ATOM 126 C THR A 9 -53.769 103.656 16.074 1.00 0.00 C ATOM 127 O THR A 9 -53.425 104.260 15.054 1.00 0.00 O ATOM 128 CB THR A 9 -52.810 101.754 17.561 1.00 0.00 C ATOM 129 OG1 THR A 9 -53.670 101.606 18.696 1.00 0.00 O ATOM 130 CG2 THR A 9 -51.436 101.206 17.903 1.00 0.00 C ATOM 0 H THR A 9 -51.639 104.534 18.356 1.00 0.00 H new ATOM 0 HA THR A 9 -51.769 103.343 16.596 1.00 0.00 H new ATOM 0 HB THR A 9 -53.223 101.193 16.722 1.00 0.00 H new ATOM 0 HG1 THR A 9 -54.580 101.403 18.393 1.00 0.00 H new ATOM 0 HG21 THR A 9 -51.525 100.162 18.203 1.00 0.00 H new ATOM 0 HG22 THR A 9 -50.788 101.278 17.030 1.00 0.00 H new ATOM 0 HG23 THR A 9 -51.007 101.784 18.722 1.00 0.00 H new ATOM 138 N GLY A 10 -55.021 103.349 16.312 1.00 0.00 N ATOM 139 CA GLY A 10 -56.057 103.725 15.381 1.00 0.00 C ATOM 140 C GLY A 10 -56.707 102.530 14.765 1.00 0.00 C ATOM 141 O GLY A 10 -57.922 102.362 14.852 1.00 0.00 O ATOM 0 H GLY A 10 -55.346 102.843 17.136 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -56.809 104.323 15.896 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -55.632 104.352 14.597 1.00 0.00 H new ATOM 145 N SER A 11 -55.918 101.708 14.133 1.00 0.00 N ATOM 146 CA SER A 11 -56.399 100.486 13.556 1.00 0.00 C ATOM 147 C SER A 11 -56.664 99.488 14.677 1.00 0.00 C ATOM 148 O SER A 11 -57.819 99.121 14.960 1.00 0.00 O ATOM 149 CB SER A 11 -55.343 99.981 12.581 1.00 0.00 C ATOM 150 OG SER A 11 -54.046 100.093 13.173 1.00 0.00 O ATOM 0 H SER A 11 -54.919 101.868 14.003 1.00 0.00 H new ATOM 0 HA SER A 11 -57.332 100.633 13.012 1.00 0.00 H new ATOM 0 HB2 SER A 11 -55.544 98.943 12.318 1.00 0.00 H new ATOM 0 HB3 SER A 11 -55.382 100.558 11.657 1.00 0.00 H new ATOM 0 HG SER A 11 -53.370 99.766 12.544 1.00 0.00 H new ATOM 156 N TRP A 12 -55.597 99.103 15.332 1.00 0.00 N ATOM 157 CA TRP A 12 -55.655 98.243 16.474 1.00 0.00 C ATOM 158 C TRP A 12 -56.046 99.062 17.675 1.00 0.00 C ATOM 159 O TRP A 12 -55.667 100.226 17.787 1.00 0.00 O ATOM 160 CB TRP A 12 -54.291 97.599 16.742 1.00 0.00 C ATOM 161 CG TRP A 12 -53.792 96.708 15.651 1.00 0.00 C ATOM 162 CD1 TRP A 12 -53.091 97.079 14.545 1.00 0.00 C ATOM 163 CD2 TRP A 12 -53.947 95.292 15.572 1.00 0.00 C ATOM 164 NE1 TRP A 12 -52.795 95.977 13.786 1.00 0.00 N ATOM 165 CE2 TRP A 12 -53.317 94.867 14.394 1.00 0.00 C ATOM 166 CE3 TRP A 12 -54.562 94.345 16.384 1.00 0.00 C ATOM 167 CZ2 TRP A 12 -53.281 93.534 14.010 1.00 0.00 C ATOM 168 CZ3 TRP A 12 -54.531 93.024 16.001 1.00 0.00 C ATOM 169 CH2 TRP A 12 -53.894 92.630 14.823 1.00 0.00 C ATOM 0 H TRP A 12 -54.651 99.387 15.077 1.00 0.00 H new ATOM 0 HA TRP A 12 -56.384 97.455 16.284 1.00 0.00 H new ATOM 0 HB2 TRP A 12 -53.559 98.389 16.910 1.00 0.00 H new ATOM 0 HB3 TRP A 12 -54.353 97.021 17.664 1.00 0.00 H new ATOM 0 HD1 TRP A 12 -52.809 98.093 14.301 1.00 0.00 H new ATOM 0 HE1 TRP A 12 -52.271 95.983 12.911 1.00 0.00 H new ATOM 0 HE3 TRP A 12 -55.055 94.641 17.298 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 -52.786 93.225 13.101 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 -55.007 92.280 16.622 1.00 0.00 H new ATOM 0 HH2 TRP A 12 -53.887 91.585 14.550 1.00 0.00 H new ATOM 180 N LYS A 13 -56.818 98.491 18.526 1.00 0.00 N ATOM 181 CA LYS A 13 -57.194 99.098 19.774 1.00 0.00 C ATOM 182 C LYS A 13 -57.032 98.052 20.831 1.00 0.00 C ATOM 183 O LYS A 13 -57.102 96.869 20.524 1.00 0.00 O ATOM 184 CB LYS A 13 -58.647 99.582 19.739 1.00 0.00 C ATOM 185 CG LYS A 13 -58.928 100.670 18.710 1.00 0.00 C ATOM 186 CD LYS A 13 -60.379 101.134 18.753 1.00 0.00 C ATOM 187 CE LYS A 13 -61.348 100.010 18.423 1.00 0.00 C ATOM 188 NZ LYS A 13 -62.745 100.469 18.445 1.00 0.00 N1+ ATOM 0 H LYS A 13 -57.222 97.566 18.381 1.00 0.00 H new ATOM 0 HA LYS A 13 -56.569 99.968 19.973 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -59.295 98.730 19.534 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -58.915 99.956 20.727 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -58.270 101.520 18.892 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -58.696 100.295 17.713 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -60.604 101.527 19.744 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -60.519 101.952 18.046 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -61.114 99.606 17.438 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -61.221 99.198 19.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -63.375 99.674 18.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -62.976 100.832 19.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -62.873 101.226 17.744 1.00 0.00 H new ATOM 202 N LYS A 14 -56.800 98.443 22.040 1.00 0.00 N ATOM 203 CA LYS A 14 -56.618 97.479 23.082 1.00 0.00 C ATOM 204 C LYS A 14 -57.874 97.381 23.925 1.00 0.00 C ATOM 205 O LYS A 14 -58.485 98.395 24.261 1.00 0.00 O ATOM 206 CB LYS A 14 -55.400 97.823 23.934 1.00 0.00 C ATOM 207 CG LYS A 14 -55.081 96.784 24.996 1.00 0.00 C ATOM 208 CD LYS A 14 -53.803 97.096 25.753 1.00 0.00 C ATOM 209 CE LYS A 14 -53.877 98.411 26.491 1.00 0.00 C ATOM 210 NZ LYS A 14 -55.003 98.496 27.438 1.00 0.00 N1+ ATOM 0 H LYS A 14 -56.732 99.417 22.333 1.00 0.00 H new ATOM 0 HA LYS A 14 -56.434 96.504 22.630 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -54.534 97.941 23.283 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -55.567 98.785 24.419 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -55.911 96.724 25.700 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -54.990 95.805 24.525 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -53.600 96.295 26.464 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -52.967 97.121 25.054 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -52.945 98.566 27.034 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -53.962 99.220 25.766 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -54.906 99.355 28.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -55.898 98.532 26.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -55.000 97.660 28.057 1.00 0.00 H new ATOM 224 N ASN A 15 -58.275 96.180 24.220 1.00 0.00 N ATOM 225 CA ASN A 15 -59.461 95.935 25.027 1.00 0.00 C ATOM 226 C ASN A 15 -59.082 95.739 26.491 1.00 0.00 C ATOM 227 O ASN A 15 -57.902 95.782 26.841 1.00 0.00 O ATOM 228 CB ASN A 15 -60.299 94.734 24.489 1.00 0.00 C ATOM 229 CG ASN A 15 -59.569 93.392 24.449 1.00 0.00 C ATOM 230 OD1 ASN A 15 -58.680 93.111 25.262 1.00 0.00 O ATOM 231 ND2 ASN A 15 -59.943 92.553 23.508 1.00 0.00 N ATOM 0 H ASN A 15 -57.797 95.333 23.913 1.00 0.00 H new ATOM 0 HA ASN A 15 -60.097 96.817 24.954 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -61.188 94.626 25.110 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -60.640 94.973 23.482 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -59.496 91.639 23.433 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -60.680 92.816 22.853 1.00 0.00 H new ATOM 238 N GLN A 16 -60.077 95.485 27.325 1.00 0.00 N ATOM 239 CA GLN A 16 -59.915 95.328 28.784 1.00 0.00 C ATOM 240 C GLN A 16 -59.018 94.140 29.178 1.00 0.00 C ATOM 241 O GLN A 16 -58.543 94.059 30.301 1.00 0.00 O ATOM 242 CB GLN A 16 -61.286 95.199 29.439 1.00 0.00 C ATOM 243 CG GLN A 16 -62.076 93.984 28.984 1.00 0.00 C ATOM 244 CD GLN A 16 -63.493 93.995 29.497 1.00 0.00 C ATOM 245 OE1 GLN A 16 -64.400 94.513 28.841 1.00 0.00 O ATOM 246 NE2 GLN A 16 -63.703 93.437 30.648 1.00 0.00 N ATOM 0 H GLN A 16 -61.042 95.378 27.014 1.00 0.00 H new ATOM 0 HA GLN A 16 -59.407 96.222 29.145 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -61.158 95.152 30.520 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -61.865 96.097 29.225 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -62.087 93.948 27.895 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -61.575 93.079 29.327 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -62.927 93.019 31.161 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -64.644 93.416 31.040 1.00 0.00 H new ATOM 255 N TYR A 17 -58.776 93.234 28.251 1.00 0.00 N ATOM 256 CA TYR A 17 -57.926 92.080 28.518 1.00 0.00 C ATOM 257 C TYR A 17 -56.475 92.439 28.241 1.00 0.00 C ATOM 258 O TYR A 17 -55.576 91.613 28.410 1.00 0.00 O ATOM 259 CB TYR A 17 -58.292 90.906 27.603 1.00 0.00 C ATOM 260 CG TYR A 17 -59.691 90.354 27.733 1.00 0.00 C ATOM 261 CD1 TYR A 17 -60.743 90.893 27.005 1.00 0.00 C ATOM 262 CD2 TYR A 17 -59.951 89.263 28.551 1.00 0.00 C ATOM 263 CE1 TYR A 17 -62.009 90.364 27.087 1.00 0.00 C ATOM 264 CE2 TYR A 17 -61.219 88.731 28.644 1.00 0.00 C ATOM 265 CZ TYR A 17 -62.242 89.284 27.908 1.00 0.00 C ATOM 266 OH TYR A 17 -63.505 88.745 27.976 1.00 0.00 O ATOM 0 H TYR A 17 -59.154 93.271 27.304 1.00 0.00 H new ATOM 0 HA TYR A 17 -58.070 91.796 29.561 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -58.146 91.222 26.570 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -57.588 90.096 27.792 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -60.564 91.743 26.363 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -59.147 88.824 29.123 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -62.816 90.793 26.511 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -61.408 87.886 29.290 1.00 0.00 H new ATOM 0 HH TYR A 17 -63.505 87.988 28.599 1.00 0.00 H new ATOM 276 N GLY A 18 -56.262 93.666 27.786 1.00 0.00 N ATOM 277 CA GLY A 18 -54.950 94.102 27.361 1.00 0.00 C ATOM 278 C GLY A 18 -54.577 93.410 26.074 1.00 0.00 C ATOM 279 O GLY A 18 -53.418 93.129 25.808 1.00 0.00 O ATOM 0 H GLY A 18 -56.989 94.377 27.704 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -54.943 95.183 27.219 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -54.214 93.877 28.133 1.00 0.00 H new ATOM 283 N THR A 19 -55.595 93.104 25.308 1.00 0.00 N ATOM 284 CA THR A 19 -55.456 92.470 24.040 1.00 0.00 C ATOM 285 C THR A 19 -55.698 93.502 22.956 1.00 0.00 C ATOM 286 O THR A 19 -56.629 94.305 23.062 1.00 0.00 O ATOM 287 CB THR A 19 -56.485 91.327 23.923 1.00 0.00 C ATOM 288 OG1 THR A 19 -56.267 90.383 24.989 1.00 0.00 O ATOM 289 CG2 THR A 19 -56.414 90.628 22.571 1.00 0.00 C ATOM 0 H THR A 19 -56.563 93.298 25.564 1.00 0.00 H new ATOM 0 HA THR A 19 -54.455 92.053 23.932 1.00 0.00 H new ATOM 0 HB THR A 19 -57.483 91.757 24.005 1.00 0.00 H new ATOM 0 HG1 THR A 19 -56.919 89.655 24.920 1.00 0.00 H new ATOM 0 HG21 THR A 19 -57.156 89.831 22.534 1.00 0.00 H new ATOM 0 HG22 THR A 19 -56.615 91.348 21.778 1.00 0.00 H new ATOM 0 HG23 THR A 19 -55.419 90.204 22.432 1.00 0.00 H new ATOM 297 N TRP A 20 -54.862 93.512 21.962 1.00 0.00 N ATOM 298 CA TRP A 20 -55.027 94.419 20.862 1.00 0.00 C ATOM 299 C TRP A 20 -55.855 93.749 19.814 1.00 0.00 C ATOM 300 O TRP A 20 -55.635 92.582 19.514 1.00 0.00 O ATOM 301 CB TRP A 20 -53.680 94.821 20.288 1.00 0.00 C ATOM 302 CG TRP A 20 -52.836 95.605 21.237 1.00 0.00 C ATOM 303 CD1 TRP A 20 -52.085 95.118 22.259 1.00 0.00 C ATOM 304 CD2 TRP A 20 -52.650 97.021 21.241 1.00 0.00 C ATOM 305 NE1 TRP A 20 -51.440 96.142 22.896 1.00 0.00 N ATOM 306 CE2 TRP A 20 -51.767 97.321 22.290 1.00 0.00 C ATOM 307 CE3 TRP A 20 -53.142 98.062 20.456 1.00 0.00 C ATOM 308 CZ2 TRP A 20 -51.364 98.617 22.575 1.00 0.00 C ATOM 309 CZ3 TRP A 20 -52.741 99.347 20.741 1.00 0.00 C ATOM 310 CH2 TRP A 20 -51.861 99.615 21.790 1.00 0.00 C ATOM 0 H TRP A 20 -54.051 92.897 21.888 1.00 0.00 H new ATOM 0 HA TRP A 20 -55.524 95.325 21.209 1.00 0.00 H new ATOM 0 HB2 TRP A 20 -53.139 93.923 19.990 1.00 0.00 H new ATOM 0 HB3 TRP A 20 -53.840 95.411 19.385 1.00 0.00 H new ATOM 0 HD1 TRP A 20 -52.009 94.075 22.529 1.00 0.00 H new ATOM 0 HE1 TRP A 20 -50.815 96.041 23.696 1.00 0.00 H new ATOM 0 HE3 TRP A 20 -53.823 97.864 19.642 1.00 0.00 H new ATOM 0 HZ2 TRP A 20 -50.683 98.827 23.387 1.00 0.00 H new ATOM 0 HZ3 TRP A 20 -53.115 100.164 20.141 1.00 0.00 H new ATOM 0 HH2 TRP A 20 -51.567 100.636 21.985 1.00 0.00 H new ATOM 321 N TYR A 21 -56.809 94.448 19.294 1.00 0.00 N ATOM 322 CA TYR A 21 -57.672 93.912 18.288 1.00 0.00 C ATOM 323 C TYR A 21 -57.922 94.955 17.229 1.00 0.00 C ATOM 324 O TYR A 21 -57.828 96.155 17.499 1.00 0.00 O ATOM 325 CB TYR A 21 -59.018 93.460 18.899 1.00 0.00 C ATOM 326 CG TYR A 21 -59.891 94.591 19.423 1.00 0.00 C ATOM 327 CD1 TYR A 21 -60.890 95.145 18.627 1.00 0.00 C ATOM 328 CD2 TYR A 21 -59.717 95.103 20.697 1.00 0.00 C ATOM 329 CE1 TYR A 21 -61.679 96.171 19.085 1.00 0.00 C ATOM 330 CE2 TYR A 21 -60.507 96.132 21.160 1.00 0.00 C ATOM 331 CZ TYR A 21 -61.483 96.660 20.350 1.00 0.00 C ATOM 332 OH TYR A 21 -62.274 97.686 20.814 1.00 0.00 O ATOM 0 H TYR A 21 -57.015 95.412 19.555 1.00 0.00 H new ATOM 0 HA TYR A 21 -57.186 93.043 17.843 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -59.577 92.908 18.143 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -58.816 92.767 19.716 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -61.047 94.760 17.630 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -58.951 94.690 21.337 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -62.448 96.590 18.453 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -60.360 96.522 22.156 1.00 0.00 H new ATOM 0 HH TYR A 21 -62.008 97.916 21.729 1.00 0.00 H new ATOM 342 N LYS A 22 -58.208 94.512 16.051 1.00 0.00 N ATOM 343 CA LYS A 22 -58.601 95.386 14.989 1.00 0.00 C ATOM 344 C LYS A 22 -59.755 94.745 14.260 1.00 0.00 C ATOM 345 O LYS A 22 -59.830 93.502 14.170 1.00 0.00 O ATOM 346 CB LYS A 22 -57.464 95.671 13.977 1.00 0.00 C ATOM 347 CG LYS A 22 -56.992 94.447 13.232 1.00 0.00 C ATOM 348 CD LYS A 22 -56.053 94.784 12.086 1.00 0.00 C ATOM 349 CE LYS A 22 -55.500 93.510 11.466 1.00 0.00 C ATOM 350 NZ LYS A 22 -54.676 93.759 10.271 1.00 0.00 N1+ ATOM 0 H LYS A 22 -58.176 93.526 15.793 1.00 0.00 H new ATOM 0 HA LYS A 22 -58.875 96.343 15.432 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -57.809 96.413 13.257 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -56.619 96.110 14.508 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -56.485 93.777 13.926 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -57.856 93.908 12.842 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -56.583 95.364 11.331 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -55.234 95.406 12.448 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -54.902 92.982 12.209 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -56.328 92.854 11.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -54.140 92.900 10.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -55.291 94.015 9.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -54.014 94.538 10.462 1.00 0.00 H new ATOM 364 N PRO A 23 -60.675 95.547 13.781 1.00 0.00 N ATOM 365 CA PRO A 23 -61.757 95.073 12.954 1.00 0.00 C ATOM 366 C PRO A 23 -61.227 94.786 11.555 1.00 0.00 C ATOM 367 O PRO A 23 -60.578 95.648 10.929 1.00 0.00 O ATOM 368 CB PRO A 23 -62.730 96.252 12.926 1.00 0.00 C ATOM 369 CG PRO A 23 -61.880 97.453 13.160 1.00 0.00 C ATOM 370 CD PRO A 23 -60.727 96.995 14.008 1.00 0.00 C ATOM 0 HA PRO A 23 -62.221 94.157 13.319 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -63.248 96.315 11.969 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -63.494 96.152 13.697 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -61.527 97.870 12.216 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -62.445 98.237 13.663 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -59.796 97.479 13.712 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -60.888 97.229 15.060 1.00 0.00 H new ATOM 378 N GLU A 24 -61.434 93.592 11.087 1.00 0.00 N ATOM 379 CA GLU A 24 -60.982 93.228 9.782 1.00 0.00 C ATOM 380 C GLU A 24 -61.795 92.055 9.305 1.00 0.00 C ATOM 381 O GLU A 24 -61.823 91.020 9.942 1.00 0.00 O ATOM 382 CB GLU A 24 -59.485 92.868 9.841 1.00 0.00 C ATOM 383 CG GLU A 24 -58.851 92.575 8.484 1.00 0.00 C ATOM 384 CD GLU A 24 -57.351 92.417 8.560 1.00 0.00 C ATOM 385 OE1 GLU A 24 -56.627 93.440 8.508 1.00 0.00 O ATOM 386 OE2 GLU A 24 -56.852 91.274 8.675 1.00 0.00 O1- ATOM 0 H GLU A 24 -61.916 92.850 11.595 1.00 0.00 H new ATOM 0 HA GLU A 24 -61.108 94.058 9.087 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -58.945 93.690 10.310 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -59.359 91.996 10.483 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -59.287 91.664 8.073 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -59.092 93.383 7.794 1.00 0.00 H new ATOM 393 N ASN A 25 -62.426 92.209 8.190 1.00 0.00 N ATOM 394 CA ASN A 25 -63.241 91.162 7.638 1.00 0.00 C ATOM 395 C ASN A 25 -62.499 90.525 6.511 1.00 0.00 C ATOM 396 O ASN A 25 -62.315 91.134 5.463 1.00 0.00 O ATOM 397 CB ASN A 25 -64.565 91.717 7.125 1.00 0.00 C ATOM 398 CG ASN A 25 -65.471 90.658 6.488 1.00 0.00 C ATOM 399 OD1 ASN A 25 -66.171 90.940 5.510 1.00 0.00 O ATOM 400 ND2 ASN A 25 -65.519 89.467 7.053 1.00 0.00 N ATOM 0 H ASN A 25 -62.396 93.061 7.630 1.00 0.00 H new ATOM 0 HA ASN A 25 -63.456 90.430 8.416 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -65.097 92.187 7.952 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -64.362 92.497 6.392 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -66.145 88.752 6.683 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -64.930 89.261 7.860 1.00 0.00 H new ATOM 407 N ALA A 26 -62.049 89.340 6.717 1.00 0.00 N ATOM 408 CA ALA A 26 -61.293 88.666 5.687 1.00 0.00 C ATOM 409 C ALA A 26 -61.503 87.186 5.751 1.00 0.00 C ATOM 410 O ALA A 26 -62.043 86.663 6.744 1.00 0.00 O ATOM 411 CB ALA A 26 -59.805 89.010 5.767 1.00 0.00 C ATOM 0 H ALA A 26 -62.182 88.808 7.577 1.00 0.00 H new ATOM 0 HA ALA A 26 -61.661 89.021 4.724 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -59.267 88.485 4.977 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -59.673 90.085 5.644 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -59.413 88.705 6.737 1.00 0.00 H new ATOM 417 N THR A 27 -61.103 86.523 4.711 1.00 0.00 N ATOM 418 CA THR A 27 -61.210 85.120 4.615 1.00 0.00 C ATOM 419 C THR A 27 -59.848 84.477 4.873 1.00 0.00 C ATOM 420 O THR A 27 -58.887 84.707 4.147 1.00 0.00 O ATOM 421 CB THR A 27 -61.747 84.730 3.225 1.00 0.00 C ATOM 422 OG1 THR A 27 -63.079 85.265 3.038 1.00 0.00 O ATOM 423 CG2 THR A 27 -61.738 83.223 3.015 1.00 0.00 C ATOM 0 H THR A 27 -60.685 86.963 3.891 1.00 0.00 H new ATOM 0 HA THR A 27 -61.910 84.757 5.368 1.00 0.00 H new ATOM 0 HB THR A 27 -61.082 85.162 2.478 1.00 0.00 H new ATOM 0 HG1 THR A 27 -63.411 85.013 2.151 1.00 0.00 H new ATOM 0 HG21 THR A 27 -62.124 82.992 2.022 1.00 0.00 H new ATOM 0 HG22 THR A 27 -60.718 82.849 3.103 1.00 0.00 H new ATOM 0 HG23 THR A 27 -62.365 82.747 3.769 1.00 0.00 H new ATOM 431 N PHE A 28 -59.787 83.685 5.888 1.00 0.00 N ATOM 432 CA PHE A 28 -58.604 82.992 6.245 1.00 0.00 C ATOM 433 C PHE A 28 -58.693 81.587 5.722 1.00 0.00 C ATOM 434 O PHE A 28 -59.537 80.803 6.142 1.00 0.00 O ATOM 435 CB PHE A 28 -58.390 82.992 7.771 1.00 0.00 C ATOM 436 CG PHE A 28 -57.289 82.065 8.235 1.00 0.00 C ATOM 437 CD1 PHE A 28 -55.960 82.359 7.990 1.00 0.00 C ATOM 438 CD2 PHE A 28 -57.597 80.889 8.906 1.00 0.00 C ATOM 439 CE1 PHE A 28 -54.961 81.503 8.403 1.00 0.00 C ATOM 440 CE2 PHE A 28 -56.603 80.033 9.323 1.00 0.00 C ATOM 441 CZ PHE A 28 -55.284 80.336 9.069 1.00 0.00 C ATOM 0 H PHE A 28 -60.578 83.499 6.505 1.00 0.00 H new ATOM 0 HA PHE A 28 -57.747 83.499 5.802 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -58.158 84.006 8.096 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -59.322 82.706 8.259 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -55.702 83.269 7.469 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -58.630 80.643 9.103 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -53.927 81.744 8.206 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -56.857 79.125 9.849 1.00 0.00 H new ATOM 0 HZ PHE A 28 -54.503 79.663 9.390 1.00 0.00 H new ATOM 451 N VAL A 29 -57.874 81.296 4.775 1.00 0.00 N ATOM 452 CA VAL A 29 -57.803 79.978 4.231 1.00 0.00 C ATOM 453 C VAL A 29 -56.637 79.310 4.897 1.00 0.00 C ATOM 454 O VAL A 29 -55.500 79.722 4.690 1.00 0.00 O ATOM 455 CB VAL A 29 -57.588 79.986 2.693 1.00 0.00 C ATOM 456 CG1 VAL A 29 -57.622 78.569 2.126 1.00 0.00 C ATOM 457 CG2 VAL A 29 -58.620 80.866 2.005 1.00 0.00 C ATOM 0 H VAL A 29 -57.230 81.964 4.351 1.00 0.00 H new ATOM 0 HA VAL A 29 -58.742 79.454 4.410 1.00 0.00 H new ATOM 0 HB VAL A 29 -56.600 80.403 2.497 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -57.469 78.605 1.047 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -56.832 77.974 2.585 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -58.589 78.115 2.340 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -58.448 80.855 0.929 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -59.620 80.487 2.217 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -58.533 81.887 2.376 1.00 0.00 H new ATOM 467 N ASN A 30 -56.918 78.350 5.742 1.00 0.00 N ATOM 468 CA ASN A 30 -55.873 77.659 6.485 1.00 0.00 C ATOM 469 C ASN A 30 -54.934 76.915 5.533 1.00 0.00 C ATOM 470 O ASN A 30 -55.362 76.430 4.471 1.00 0.00 O ATOM 471 CB ASN A 30 -56.477 76.728 7.561 1.00 0.00 C ATOM 472 CG ASN A 30 -55.436 76.043 8.414 1.00 0.00 C ATOM 473 OD1 ASN A 30 -54.335 76.523 8.580 1.00 0.00 O ATOM 474 ND2 ASN A 30 -55.800 74.942 8.989 1.00 0.00 N ATOM 0 H ASN A 30 -57.864 78.022 5.939 1.00 0.00 H new ATOM 0 HA ASN A 30 -55.275 78.402 7.013 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -57.138 77.309 8.204 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -57.091 75.971 7.073 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -55.152 74.450 9.604 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -56.734 74.567 8.827 1.00 0.00 H new ATOM 481 N GLY A 31 -53.677 76.861 5.896 1.00 0.00 N ATOM 482 CA GLY A 31 -52.671 76.271 5.075 1.00 0.00 C ATOM 483 C GLY A 31 -52.613 74.768 5.161 1.00 0.00 C ATOM 484 O GLY A 31 -53.590 74.073 4.882 1.00 0.00 O ATOM 0 H GLY A 31 -53.328 77.231 6.780 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -52.848 76.559 4.039 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -51.700 76.679 5.358 1.00 0.00 H new ATOM 488 N ASN A 32 -51.491 74.273 5.598 1.00 0.00 N ATOM 489 CA ASN A 32 -51.207 72.842 5.556 1.00 0.00 C ATOM 490 C ASN A 32 -51.416 72.169 6.883 1.00 0.00 C ATOM 491 O ASN A 32 -51.430 70.941 6.968 1.00 0.00 O ATOM 492 CB ASN A 32 -49.759 72.610 5.126 1.00 0.00 C ATOM 493 CG ASN A 32 -49.452 73.087 3.730 1.00 0.00 C ATOM 494 OD1 ASN A 32 -49.584 72.336 2.765 1.00 0.00 O ATOM 495 ND2 ASN A 32 -49.028 74.321 3.605 1.00 0.00 N ATOM 0 H ASN A 32 -50.740 74.837 5.995 1.00 0.00 H new ATOM 0 HA ASN A 32 -51.905 72.409 4.839 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -49.097 73.118 5.827 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -49.537 71.545 5.192 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -48.794 74.689 2.683 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -48.932 74.913 4.430 1.00 0.00 H new ATOM 502 N GLN A 33 -51.585 72.932 7.909 1.00 0.00 N ATOM 503 CA GLN A 33 -51.675 72.371 9.224 1.00 0.00 C ATOM 504 C GLN A 33 -52.979 72.740 9.894 1.00 0.00 C ATOM 505 O GLN A 33 -53.438 73.854 9.766 1.00 0.00 O ATOM 506 CB GLN A 33 -50.491 72.843 10.046 1.00 0.00 C ATOM 507 CG GLN A 33 -50.346 74.358 10.058 1.00 0.00 C ATOM 508 CD GLN A 33 -49.096 74.832 10.727 1.00 0.00 C ATOM 509 OE1 GLN A 33 -48.063 74.162 10.708 1.00 0.00 O ATOM 510 NE2 GLN A 33 -49.166 75.981 11.305 1.00 0.00 N ATOM 0 H GLN A 33 -51.664 73.948 7.868 1.00 0.00 H new ATOM 0 HA GLN A 33 -51.653 71.284 9.147 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -50.600 72.485 11.070 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -49.579 72.399 9.648 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -50.361 74.725 9.032 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -51.207 74.794 10.564 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -50.042 76.503 11.297 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -48.345 76.369 11.771 1.00 0.00 H new ATOM 519 N PRO A 34 -53.617 71.793 10.569 1.00 0.00 N ATOM 520 CA PRO A 34 -54.827 72.069 11.325 1.00 0.00 C ATOM 521 C PRO A 34 -54.511 72.961 12.530 1.00 0.00 C ATOM 522 O PRO A 34 -53.451 72.811 13.166 1.00 0.00 O ATOM 523 CB PRO A 34 -55.308 70.692 11.774 1.00 0.00 C ATOM 524 CG PRO A 34 -54.104 69.813 11.711 1.00 0.00 C ATOM 525 CD PRO A 34 -53.218 70.384 10.637 1.00 0.00 C ATOM 0 HA PRO A 34 -55.580 72.600 10.742 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -55.716 70.728 12.784 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -56.100 70.321 11.124 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -53.587 69.792 12.671 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -54.385 68.786 11.478 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -52.163 70.278 10.890 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -53.369 69.879 9.683 1.00 0.00 H new ATOM 533 N ILE A 35 -55.400 73.872 12.845 1.00 0.00 N ATOM 534 CA ILE A 35 -55.122 74.832 13.892 1.00 0.00 C ATOM 535 C ILE A 35 -56.096 74.656 15.058 1.00 0.00 C ATOM 536 O ILE A 35 -57.270 74.380 14.854 1.00 0.00 O ATOM 537 CB ILE A 35 -55.207 76.294 13.377 1.00 0.00 C ATOM 538 CG1 ILE A 35 -54.664 76.407 11.927 1.00 0.00 C ATOM 539 CG2 ILE A 35 -54.427 77.205 14.320 1.00 0.00 C ATOM 540 CD1 ILE A 35 -54.322 77.815 11.482 1.00 0.00 C ATOM 0 H ILE A 35 -56.312 73.971 12.399 1.00 0.00 H new ATOM 0 HA ILE A 35 -54.103 74.643 14.230 1.00 0.00 H new ATOM 0 HB ILE A 35 -56.252 76.604 13.359 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -53.772 75.787 11.839 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -55.407 75.996 11.243 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -54.484 78.233 13.962 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -54.855 77.145 15.321 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -53.384 76.889 14.352 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -53.951 77.793 10.457 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -55.214 78.439 11.532 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -53.554 78.227 12.137 1.00 0.00 H new ATOM 552 N VAL A 36 -55.611 74.810 16.263 1.00 0.00 N ATOM 553 CA VAL A 36 -56.430 74.661 17.461 1.00 0.00 C ATOM 554 C VAL A 36 -57.141 75.985 17.755 1.00 0.00 C ATOM 555 O VAL A 36 -56.494 77.000 18.014 1.00 0.00 O ATOM 556 CB VAL A 36 -55.570 74.250 18.694 1.00 0.00 C ATOM 557 CG1 VAL A 36 -56.439 74.035 19.923 1.00 0.00 C ATOM 558 CG2 VAL A 36 -54.757 72.999 18.396 1.00 0.00 C ATOM 0 H VAL A 36 -54.636 75.043 16.453 1.00 0.00 H new ATOM 0 HA VAL A 36 -57.159 73.871 17.279 1.00 0.00 H new ATOM 0 HB VAL A 36 -54.881 75.069 18.903 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -55.811 73.749 20.767 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -56.968 74.958 20.160 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -57.161 73.243 19.724 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -54.165 72.732 19.272 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -55.430 72.178 18.149 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -54.092 73.189 17.553 1.00 0.00 H new ATOM 568 N THR A 37 -58.446 75.967 17.716 1.00 0.00 N ATOM 569 CA THR A 37 -59.230 77.170 17.893 1.00 0.00 C ATOM 570 C THR A 37 -59.651 77.348 19.373 1.00 0.00 C ATOM 571 O THR A 37 -59.763 76.360 20.118 1.00 0.00 O ATOM 572 CB THR A 37 -60.470 77.125 16.970 1.00 0.00 C ATOM 573 OG1 THR A 37 -61.287 75.998 17.300 1.00 0.00 O ATOM 574 CG2 THR A 37 -60.048 77.018 15.509 1.00 0.00 C ATOM 0 H THR A 37 -58.999 75.124 17.562 1.00 0.00 H new ATOM 0 HA THR A 37 -58.617 78.029 17.621 1.00 0.00 H new ATOM 0 HB THR A 37 -61.034 78.046 17.115 1.00 0.00 H new ATOM 0 HG1 THR A 37 -60.813 75.172 17.070 1.00 0.00 H new ATOM 0 HG21 THR A 37 -60.934 76.988 14.876 1.00 0.00 H new ATOM 0 HG22 THR A 37 -59.440 77.882 15.242 1.00 0.00 H new ATOM 0 HG23 THR A 37 -59.467 76.107 15.364 1.00 0.00 H new ATOM 582 N ARG A 38 -59.882 78.585 19.785 1.00 0.00 N ATOM 583 CA ARG A 38 -60.238 78.917 21.169 1.00 0.00 C ATOM 584 C ARG A 38 -61.567 79.625 21.187 1.00 0.00 C ATOM 585 O ARG A 38 -61.988 80.137 20.177 1.00 0.00 O ATOM 586 CB ARG A 38 -59.179 79.826 21.796 1.00 0.00 C ATOM 587 CG ARG A 38 -57.788 79.243 21.798 1.00 0.00 C ATOM 588 CD ARG A 38 -57.680 78.017 22.672 1.00 0.00 C ATOM 589 NE ARG A 38 -56.385 77.375 22.494 1.00 0.00 N ATOM 590 CZ ARG A 38 -55.973 76.283 23.115 1.00 0.00 C ATOM 591 NH1 ARG A 38 -56.609 75.847 24.214 1.00 0.00 N1+ ATOM 592 NH2 ARG A 38 -54.878 75.663 22.681 1.00 0.00 N ATOM 0 H ARG A 38 -59.829 79.397 19.170 1.00 0.00 H new ATOM 0 HA ARG A 38 -60.296 77.993 21.744 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -59.163 80.773 21.256 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -59.469 80.049 22.823 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -57.503 78.985 20.778 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -57.081 79.997 22.145 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -57.814 78.296 23.717 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -58.477 77.316 22.425 1.00 0.00 H new ATOM 0 HE ARG A 38 -55.739 77.806 21.832 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -57.415 76.359 24.574 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -56.287 75.004 24.689 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -54.368 76.031 21.878 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -54.549 74.820 23.151 1.00 0.00 H new ATOM 606 N ILE A 39 -62.219 79.656 22.321 1.00 0.00 N ATOM 607 CA ILE A 39 -63.522 80.278 22.416 1.00 0.00 C ATOM 608 C ILE A 39 -63.590 81.333 23.523 1.00 0.00 C ATOM 609 O ILE A 39 -63.039 81.161 24.604 1.00 0.00 O ATOM 610 CB ILE A 39 -64.650 79.217 22.613 1.00 0.00 C ATOM 611 CG1 ILE A 39 -64.668 78.261 21.420 1.00 0.00 C ATOM 612 CG2 ILE A 39 -66.015 79.883 22.778 1.00 0.00 C ATOM 613 CD1 ILE A 39 -65.743 77.214 21.475 1.00 0.00 C ATOM 0 H ILE A 39 -61.872 79.259 23.194 1.00 0.00 H new ATOM 0 HA ILE A 39 -63.684 80.787 21.466 1.00 0.00 H new ATOM 0 HB ILE A 39 -64.441 78.657 23.525 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -64.792 78.843 20.507 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -63.699 77.766 21.353 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -66.779 79.118 22.913 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -65.998 80.537 23.650 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -66.243 80.470 21.889 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -65.680 76.581 20.590 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -65.610 76.603 22.368 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -66.720 77.697 21.508 1.00 0.00 H new ATOM 625 N GLY A 40 -64.200 82.458 23.188 1.00 0.00 N ATOM 626 CA GLY A 40 -64.492 83.517 24.120 1.00 0.00 C ATOM 627 C GLY A 40 -63.387 84.526 24.203 1.00 0.00 C ATOM 628 O GLY A 40 -63.605 85.730 24.126 1.00 0.00 O ATOM 0 H GLY A 40 -64.510 82.658 22.237 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -65.414 84.016 23.822 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -64.666 83.090 25.108 1.00 0.00 H new ATOM 632 N SER A 41 -62.223 84.035 24.341 1.00 0.00 N ATOM 633 CA SER A 41 -61.046 84.839 24.551 1.00 0.00 C ATOM 634 C SER A 41 -59.864 84.307 23.717 1.00 0.00 C ATOM 635 O SER A 41 -59.764 83.098 23.489 1.00 0.00 O ATOM 636 CB SER A 41 -60.704 84.837 26.046 1.00 0.00 C ATOM 637 OG SER A 41 -61.818 85.277 26.824 1.00 0.00 O ATOM 0 H SER A 41 -62.034 83.033 24.313 1.00 0.00 H new ATOM 0 HA SER A 41 -61.241 85.861 24.226 1.00 0.00 H new ATOM 0 HB2 SER A 41 -60.413 83.833 26.355 1.00 0.00 H new ATOM 0 HB3 SER A 41 -59.848 85.487 26.228 1.00 0.00 H new ATOM 0 HG SER A 41 -61.578 85.266 27.774 1.00 0.00 H new ATOM 643 N PRO A 42 -58.982 85.193 23.228 1.00 0.00 N ATOM 644 CA PRO A 42 -57.807 84.787 22.479 1.00 0.00 C ATOM 645 C PRO A 42 -56.612 84.483 23.393 1.00 0.00 C ATOM 646 O PRO A 42 -55.759 85.334 23.632 1.00 0.00 O ATOM 647 CB PRO A 42 -57.511 85.992 21.593 1.00 0.00 C ATOM 648 CG PRO A 42 -58.084 87.176 22.317 1.00 0.00 C ATOM 649 CD PRO A 42 -59.070 86.661 23.343 1.00 0.00 C ATOM 0 HA PRO A 42 -57.979 83.867 21.920 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -56.439 86.110 21.437 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -57.966 85.876 20.609 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -57.292 87.747 22.802 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -58.579 87.849 21.617 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -58.812 86.998 24.347 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -60.080 87.016 23.138 1.00 0.00 H new ATOM 657 N PHE A 43 -56.601 83.300 23.954 1.00 0.00 N ATOM 658 CA PHE A 43 -55.528 82.868 24.831 1.00 0.00 C ATOM 659 C PHE A 43 -55.289 81.402 24.619 1.00 0.00 C ATOM 660 O PHE A 43 -56.180 80.686 24.183 1.00 0.00 O ATOM 661 CB PHE A 43 -55.878 83.073 26.324 1.00 0.00 C ATOM 662 CG PHE A 43 -56.055 84.498 26.784 1.00 0.00 C ATOM 663 CD1 PHE A 43 -57.299 85.092 26.783 1.00 0.00 C ATOM 664 CD2 PHE A 43 -54.973 85.231 27.233 1.00 0.00 C ATOM 665 CE1 PHE A 43 -57.467 86.394 27.217 1.00 0.00 C ATOM 666 CE2 PHE A 43 -55.131 86.533 27.668 1.00 0.00 C ATOM 667 CZ PHE A 43 -56.380 87.115 27.660 1.00 0.00 C ATOM 0 H PHE A 43 -57.334 82.604 23.819 1.00 0.00 H new ATOM 0 HA PHE A 43 -54.648 83.465 24.591 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -56.798 82.529 26.536 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -55.092 82.616 26.925 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -58.155 84.532 26.438 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -53.991 84.781 27.244 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -58.448 86.845 27.209 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -54.276 87.094 28.014 1.00 0.00 H new ATOM 0 HZ PHE A 43 -56.506 88.132 28.000 1.00 0.00 H new ATOM 677 N LEU A 44 -54.104 80.948 24.957 1.00 0.00 N ATOM 678 CA LEU A 44 -53.763 79.529 24.895 1.00 0.00 C ATOM 679 C LEU A 44 -54.404 78.821 26.083 1.00 0.00 C ATOM 680 O LEU A 44 -54.548 77.609 26.113 1.00 0.00 O ATOM 681 CB LEU A 44 -52.245 79.354 24.946 1.00 0.00 C ATOM 682 CG LEU A 44 -51.451 80.058 23.844 1.00 0.00 C ATOM 683 CD1 LEU A 44 -49.973 79.832 24.042 1.00 0.00 C ATOM 684 CD2 LEU A 44 -51.883 79.575 22.469 1.00 0.00 C ATOM 0 H LEU A 44 -53.344 81.544 25.284 1.00 0.00 H new ATOM 0 HA LEU A 44 -54.132 79.101 23.963 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -51.890 79.717 25.911 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -52.020 78.288 24.904 1.00 0.00 H new ATOM 0 HG LEU A 44 -51.655 81.127 23.905 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -49.418 80.338 23.252 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -49.670 80.231 25.010 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -49.760 78.763 24.008 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -51.303 80.091 21.703 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -51.713 78.501 22.391 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -52.943 79.786 22.326 1.00 0.00 H new ATOM 696 N ASN A 45 -54.792 79.629 27.050 1.00 0.00 N ATOM 697 CA ASN A 45 -55.438 79.182 28.280 1.00 0.00 C ATOM 698 C ASN A 45 -56.952 79.176 28.121 1.00 0.00 C ATOM 699 O ASN A 45 -57.686 78.892 29.063 1.00 0.00 O ATOM 700 CB ASN A 45 -55.065 80.130 29.436 1.00 0.00 C ATOM 701 CG ASN A 45 -53.610 80.049 29.854 1.00 0.00 C ATOM 702 OD1 ASN A 45 -52.743 80.742 29.301 1.00 0.00 O ATOM 703 ND2 ASN A 45 -53.329 79.260 30.846 1.00 0.00 N ATOM 0 H ASN A 45 -54.666 80.640 27.006 1.00 0.00 H new ATOM 0 HA ASN A 45 -55.096 78.170 28.497 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -55.291 81.154 29.140 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -55.693 79.901 30.297 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -52.372 79.197 31.192 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -54.066 78.703 31.279 1.00 0.00 H new ATOM 710 N ALA A 46 -57.416 79.494 26.940 1.00 0.00 N ATOM 711 CA ALA A 46 -58.834 79.595 26.682 1.00 0.00 C ATOM 712 C ALA A 46 -59.410 78.238 26.265 1.00 0.00 C ATOM 713 O ALA A 46 -58.656 77.340 25.814 1.00 0.00 O ATOM 714 CB ALA A 46 -59.084 80.645 25.604 1.00 0.00 C ATOM 0 H ALA A 46 -56.826 79.690 26.131 1.00 0.00 H new ATOM 0 HA ALA A 46 -59.339 79.901 27.598 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -60.154 80.720 25.410 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -58.708 81.610 25.942 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -58.569 80.356 24.688 1.00 0.00 H new ATOM 720 N PRO A 47 -60.744 78.042 26.440 1.00 0.00 N ATOM 721 CA PRO A 47 -61.436 76.820 26.023 1.00 0.00 C ATOM 722 C PRO A 47 -61.255 76.552 24.526 1.00 0.00 C ATOM 723 O PRO A 47 -61.153 77.484 23.726 1.00 0.00 O ATOM 724 CB PRO A 47 -62.919 77.100 26.342 1.00 0.00 C ATOM 725 CG PRO A 47 -63.005 78.566 26.575 1.00 0.00 C ATOM 726 CD PRO A 47 -61.671 78.977 27.109 1.00 0.00 C ATOM 0 HA PRO A 47 -61.047 75.938 26.533 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -63.562 76.795 25.517 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -63.243 76.543 27.221 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -63.235 79.095 25.650 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -63.799 78.803 27.284 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -61.442 80.015 26.867 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -61.624 78.885 28.194 1.00 0.00 H new ATOM 734 N VAL A 48 -61.208 75.295 24.165 1.00 0.00 N ATOM 735 CA VAL A 48 -60.940 74.896 22.802 1.00 0.00 C ATOM 736 C VAL A 48 -62.242 74.765 22.008 1.00 0.00 C ATOM 737 O VAL A 48 -63.237 74.212 22.503 1.00 0.00 O ATOM 738 CB VAL A 48 -60.164 73.544 22.764 1.00 0.00 C ATOM 739 CG1 VAL A 48 -59.744 73.176 21.355 1.00 0.00 C ATOM 740 CG2 VAL A 48 -58.957 73.587 23.672 1.00 0.00 C ATOM 0 H VAL A 48 -61.354 74.516 24.807 1.00 0.00 H new ATOM 0 HA VAL A 48 -60.324 75.670 22.344 1.00 0.00 H new ATOM 0 HB VAL A 48 -60.846 72.774 23.123 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -59.206 72.228 21.372 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -60.628 73.081 20.725 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -59.095 73.954 20.954 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -58.434 72.632 23.627 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -58.287 74.384 23.349 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -59.279 73.776 24.696 1.00 0.00 H new ATOM 750 N GLY A 49 -62.240 75.284 20.803 1.00 0.00 N ATOM 751 CA GLY A 49 -63.392 75.173 19.939 1.00 0.00 C ATOM 752 C GLY A 49 -63.290 73.969 19.039 1.00 0.00 C ATOM 753 O GLY A 49 -64.268 73.546 18.420 1.00 0.00 O ATOM 0 H GLY A 49 -61.452 75.789 20.398 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -64.296 75.102 20.543 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -63.483 76.075 19.334 1.00 0.00 H new ATOM 757 N GLY A 50 -62.113 73.428 18.968 1.00 0.00 N ATOM 758 CA GLY A 50 -61.857 72.289 18.143 1.00 0.00 C ATOM 759 C GLY A 50 -60.685 72.576 17.269 1.00 0.00 C ATOM 760 O GLY A 50 -60.045 73.629 17.419 1.00 0.00 O ATOM 0 H GLY A 50 -61.300 73.766 19.483 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -61.660 71.413 18.761 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -62.732 72.060 17.535 1.00 0.00 H new ATOM 764 N ASN A 51 -60.342 71.683 16.406 1.00 0.00 N ATOM 765 CA ASN A 51 -59.261 71.953 15.489 1.00 0.00 C ATOM 766 C ASN A 51 -59.812 72.265 14.134 1.00 0.00 C ATOM 767 O ASN A 51 -60.690 71.564 13.632 1.00 0.00 O ATOM 768 CB ASN A 51 -58.210 70.818 15.406 1.00 0.00 C ATOM 769 CG ASN A 51 -57.286 70.705 16.626 1.00 0.00 C ATOM 770 OD1 ASN A 51 -56.122 70.334 16.499 1.00 0.00 O ATOM 771 ND2 ASN A 51 -57.786 70.990 17.803 1.00 0.00 N ATOM 0 H ASN A 51 -60.780 70.767 16.307 1.00 0.00 H new ATOM 0 HA ASN A 51 -58.727 72.818 15.883 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -58.730 69.869 15.273 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -57.598 70.973 14.518 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -57.206 70.906 18.638 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -58.755 71.296 17.885 1.00 0.00 H new ATOM 778 N LEU A 52 -59.371 73.354 13.592 1.00 0.00 N ATOM 779 CA LEU A 52 -59.728 73.755 12.263 1.00 0.00 C ATOM 780 C LEU A 52 -58.929 72.933 11.280 1.00 0.00 C ATOM 781 O LEU A 52 -57.707 72.869 11.392 1.00 0.00 O ATOM 782 CB LEU A 52 -59.388 75.219 12.041 1.00 0.00 C ATOM 783 CG LEU A 52 -59.729 75.741 10.655 1.00 0.00 C ATOM 784 CD1 LEU A 52 -61.204 76.028 10.522 1.00 0.00 C ATOM 785 CD2 LEU A 52 -58.890 76.932 10.281 1.00 0.00 C ATOM 0 H LEU A 52 -58.742 74.003 14.065 1.00 0.00 H new ATOM 0 HA LEU A 52 -60.799 73.606 12.124 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -59.917 75.818 12.782 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -58.322 75.362 12.218 1.00 0.00 H new ATOM 0 HG LEU A 52 -59.487 74.951 9.944 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -61.413 76.400 9.519 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -61.770 75.113 10.695 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -61.496 76.779 11.256 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -59.166 77.273 9.283 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -59.058 77.735 10.998 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -57.837 76.652 10.290 1.00 0.00 H new ATOM 797 N PRO A 53 -59.591 72.300 10.317 1.00 0.00 N ATOM 798 CA PRO A 53 -58.915 71.520 9.309 1.00 0.00 C ATOM 799 C PRO A 53 -58.004 72.372 8.425 1.00 0.00 C ATOM 800 O PRO A 53 -58.210 73.594 8.267 1.00 0.00 O ATOM 801 CB PRO A 53 -60.033 70.935 8.464 1.00 0.00 C ATOM 802 CG PRO A 53 -61.292 71.622 8.851 1.00 0.00 C ATOM 803 CD PRO A 53 -61.056 72.287 10.161 1.00 0.00 C ATOM 0 HA PRO A 53 -58.273 70.769 9.769 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -59.828 71.080 7.403 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -60.116 69.861 8.629 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -61.577 72.354 8.095 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -62.111 70.907 8.926 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -61.464 73.298 10.171 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -61.536 71.742 10.974 1.00 0.00 H new ATOM 811 N ALA A 54 -57.001 71.746 7.865 1.00 0.00 N ATOM 812 CA ALA A 54 -56.100 72.410 6.960 1.00 0.00 C ATOM 813 C ALA A 54 -56.824 72.643 5.640 1.00 0.00 C ATOM 814 O ALA A 54 -57.552 71.760 5.166 1.00 0.00 O ATOM 815 CB ALA A 54 -54.855 71.566 6.762 1.00 0.00 C ATOM 0 H ALA A 54 -56.786 70.762 8.024 1.00 0.00 H new ATOM 0 HA ALA A 54 -55.788 73.371 7.369 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -54.177 72.073 6.076 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -54.358 71.419 7.721 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -55.134 70.598 6.346 1.00 0.00 H new ATOM 821 N GLY A 55 -56.663 73.815 5.073 1.00 0.00 N ATOM 822 CA GLY A 55 -57.339 74.142 3.833 1.00 0.00 C ATOM 823 C GLY A 55 -58.754 74.676 4.039 1.00 0.00 C ATOM 824 O GLY A 55 -59.482 74.914 3.068 1.00 0.00 O ATOM 0 H GLY A 55 -56.073 74.558 5.446 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -56.753 74.885 3.293 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -57.382 73.252 3.205 1.00 0.00 H new ATOM 828 N ALA A 56 -59.148 74.872 5.290 1.00 0.00 N ATOM 829 CA ALA A 56 -60.484 75.365 5.596 1.00 0.00 C ATOM 830 C ALA A 56 -60.599 76.862 5.353 1.00 0.00 C ATOM 831 O ALA A 56 -59.639 77.610 5.566 1.00 0.00 O ATOM 832 CB ALA A 56 -60.854 75.042 7.019 1.00 0.00 C ATOM 0 H ALA A 56 -58.563 74.698 6.107 1.00 0.00 H new ATOM 0 HA ALA A 56 -61.179 74.862 4.924 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -61.855 75.418 7.229 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -60.834 73.962 7.164 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -60.141 75.512 7.696 1.00 0.00 H new ATOM 838 N THR A 57 -61.765 77.284 4.915 1.00 0.00 N ATOM 839 CA THR A 57 -62.038 78.666 4.624 1.00 0.00 C ATOM 840 C THR A 57 -62.818 79.332 5.761 1.00 0.00 C ATOM 841 O THR A 57 -64.010 79.053 5.968 1.00 0.00 O ATOM 842 CB THR A 57 -62.831 78.775 3.314 1.00 0.00 C ATOM 843 OG1 THR A 57 -63.938 77.845 3.352 1.00 0.00 O ATOM 844 CG2 THR A 57 -61.943 78.468 2.117 1.00 0.00 C ATOM 0 H THR A 57 -62.558 76.664 4.750 1.00 0.00 H new ATOM 0 HA THR A 57 -61.085 79.184 4.520 1.00 0.00 H new ATOM 0 HB THR A 57 -63.203 79.794 3.211 1.00 0.00 H new ATOM 0 HG1 THR A 57 -64.366 77.881 4.233 1.00 0.00 H new ATOM 0 HG21 THR A 57 -62.527 78.551 1.200 1.00 0.00 H new ATOM 0 HG22 THR A 57 -61.116 79.177 2.086 1.00 0.00 H new ATOM 0 HG23 THR A 57 -61.550 77.455 2.206 1.00 0.00 H new ATOM 852 N ILE A 58 -62.146 80.163 6.492 1.00 0.00 N ATOM 853 CA ILE A 58 -62.719 80.900 7.601 1.00 0.00 C ATOM 854 C ILE A 58 -63.003 82.329 7.181 1.00 0.00 C ATOM 855 O ILE A 58 -62.247 82.906 6.439 1.00 0.00 O ATOM 856 CB ILE A 58 -61.716 80.916 8.805 1.00 0.00 C ATOM 857 CG1 ILE A 58 -61.642 79.555 9.479 1.00 0.00 C ATOM 858 CG2 ILE A 58 -62.049 82.001 9.832 1.00 0.00 C ATOM 859 CD1 ILE A 58 -62.906 79.193 10.220 1.00 0.00 C ATOM 0 H ILE A 58 -61.157 80.361 6.340 1.00 0.00 H new ATOM 0 HA ILE A 58 -63.647 80.414 7.901 1.00 0.00 H new ATOM 0 HB ILE A 58 -60.738 81.154 8.387 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -61.438 78.794 8.726 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -60.804 79.546 10.176 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -61.323 81.968 10.645 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -62.013 82.979 9.353 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -63.049 81.830 10.231 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -62.790 78.211 10.679 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -63.099 79.935 10.995 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -63.743 79.171 9.522 1.00 0.00 H new ATOM 871 N VAL A 59 -64.086 82.872 7.630 1.00 0.00 N ATOM 872 CA VAL A 59 -64.341 84.266 7.441 1.00 0.00 C ATOM 873 C VAL A 59 -64.380 84.921 8.825 1.00 0.00 C ATOM 874 O VAL A 59 -65.205 84.576 9.669 1.00 0.00 O ATOM 875 CB VAL A 59 -65.640 84.532 6.599 1.00 0.00 C ATOM 876 CG1 VAL A 59 -66.870 83.865 7.200 1.00 0.00 C ATOM 877 CG2 VAL A 59 -65.871 86.026 6.403 1.00 0.00 C ATOM 0 H VAL A 59 -64.816 82.369 8.135 1.00 0.00 H new ATOM 0 HA VAL A 59 -63.543 84.714 6.849 1.00 0.00 H new ATOM 0 HB VAL A 59 -65.479 84.078 5.621 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -67.740 84.080 6.580 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -66.714 82.787 7.245 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -67.037 84.250 8.206 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -66.777 86.180 5.817 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -65.981 86.508 7.375 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -65.020 86.460 5.877 1.00 0.00 H new ATOM 887 N TYR A 60 -63.461 85.811 9.075 1.00 0.00 N ATOM 888 CA TYR A 60 -63.365 86.425 10.369 1.00 0.00 C ATOM 889 C TYR A 60 -63.751 87.881 10.302 1.00 0.00 C ATOM 890 O TYR A 60 -63.861 88.457 9.200 1.00 0.00 O ATOM 891 CB TYR A 60 -61.961 86.246 10.992 1.00 0.00 C ATOM 892 CG TYR A 60 -60.808 86.868 10.212 1.00 0.00 C ATOM 893 CD1 TYR A 60 -60.066 86.126 9.302 1.00 0.00 C ATOM 894 CD2 TYR A 60 -60.454 88.194 10.406 1.00 0.00 C ATOM 895 CE1 TYR A 60 -59.009 86.693 8.614 1.00 0.00 C ATOM 896 CE2 TYR A 60 -59.407 88.765 9.722 1.00 0.00 C ATOM 897 CZ TYR A 60 -58.684 88.017 8.833 1.00 0.00 C ATOM 898 OH TYR A 60 -57.641 88.599 8.142 1.00 0.00 O ATOM 0 H TYR A 60 -62.767 86.128 8.398 1.00 0.00 H new ATOM 0 HA TYR A 60 -64.071 85.915 11.024 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -61.971 86.675 11.994 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -61.766 85.179 11.104 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -60.318 85.090 9.129 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -61.013 88.792 11.110 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -58.441 86.104 7.909 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -59.155 89.802 9.886 1.00 0.00 H new ATOM 0 HH TYR A 60 -57.518 89.521 8.451 1.00 0.00 H new ATOM 908 N ASP A 61 -63.952 88.476 11.451 1.00 0.00 N ATOM 909 CA ASP A 61 -64.338 89.869 11.517 1.00 0.00 C ATOM 910 C ASP A 61 -63.381 90.673 12.378 1.00 0.00 C ATOM 911 O ASP A 61 -63.478 91.913 12.454 1.00 0.00 O ATOM 912 CB ASP A 61 -65.768 90.018 12.048 1.00 0.00 C ATOM 913 CG ASP A 61 -65.947 89.616 13.525 1.00 0.00 C ATOM 914 OD1 ASP A 61 -65.646 90.440 14.440 1.00 0.00 O ATOM 915 OD2 ASP A 61 -66.419 88.496 13.801 1.00 0.00 O1- ATOM 0 H ASP A 61 -63.855 88.019 12.358 1.00 0.00 H new ATOM 0 HA ASP A 61 -64.296 90.262 10.501 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -66.081 91.055 11.927 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -66.434 89.410 11.436 1.00 0.00 H new ATOM 920 N GLU A 62 -62.427 90.011 12.984 1.00 0.00 N ATOM 921 CA GLU A 62 -61.542 90.689 13.889 1.00 0.00 C ATOM 922 C GLU A 62 -60.220 89.966 13.940 1.00 0.00 C ATOM 923 O GLU A 62 -60.156 88.775 13.653 1.00 0.00 O ATOM 924 CB GLU A 62 -62.181 90.676 15.267 1.00 0.00 C ATOM 925 CG GLU A 62 -61.486 91.492 16.323 1.00 0.00 C ATOM 926 CD GLU A 62 -62.187 91.349 17.661 1.00 0.00 C ATOM 927 OE1 GLU A 62 -62.412 90.195 18.116 1.00 0.00 O ATOM 928 OE2 GLU A 62 -62.553 92.368 18.266 1.00 0.00 O1- ATOM 0 H GLU A 62 -62.247 89.014 12.867 1.00 0.00 H new ATOM 0 HA GLU A 62 -61.371 91.713 13.558 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -63.206 91.035 15.174 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -62.235 89.643 15.611 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -60.449 91.170 16.414 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -61.469 92.541 16.026 1.00 0.00 H new ATOM 935 N VAL A 63 -59.178 90.680 14.266 1.00 0.00 N ATOM 936 CA VAL A 63 -57.879 90.098 14.482 1.00 0.00 C ATOM 937 C VAL A 63 -57.403 90.603 15.828 1.00 0.00 C ATOM 938 O VAL A 63 -57.575 91.776 16.127 1.00 0.00 O ATOM 939 CB VAL A 63 -56.843 90.529 13.408 1.00 0.00 C ATOM 940 CG1 VAL A 63 -55.575 89.723 13.514 1.00 0.00 C ATOM 941 CG2 VAL A 63 -57.402 90.461 12.010 1.00 0.00 C ATOM 0 H VAL A 63 -59.205 91.692 14.391 1.00 0.00 H new ATOM 0 HA VAL A 63 -57.964 89.012 14.431 1.00 0.00 H new ATOM 0 HB VAL A 63 -56.604 91.573 13.610 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -54.871 90.050 12.748 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -55.133 89.869 14.499 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -55.802 88.667 13.371 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -56.638 90.772 11.297 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -57.709 89.438 11.790 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -58.264 91.123 11.930 1.00 0.00 H new ATOM 951 N CYS A 64 -56.859 89.742 16.626 1.00 0.00 N ATOM 952 CA CYS A 64 -56.360 90.103 17.931 1.00 0.00 C ATOM 953 C CYS A 64 -54.921 89.658 18.098 1.00 0.00 C ATOM 954 O CYS A 64 -54.464 88.767 17.402 1.00 0.00 O ATOM 955 CB CYS A 64 -57.224 89.480 19.025 1.00 0.00 C ATOM 956 SG CYS A 64 -58.939 90.023 19.005 1.00 0.00 S ATOM 0 H CYS A 64 -56.743 88.755 16.396 1.00 0.00 H new ATOM 0 HA CYS A 64 -56.403 91.189 18.020 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -57.196 88.395 18.921 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -56.790 89.719 19.996 1.00 0.00 H new ATOM 0 HG CYS A 64 -59.708 89.047 19.387 1.00 0.00 H new ATOM 962 N ILE A 65 -54.216 90.308 18.982 1.00 0.00 N ATOM 963 CA ILE A 65 -52.854 89.958 19.321 1.00 0.00 C ATOM 964 C ILE A 65 -52.772 89.741 20.815 1.00 0.00 C ATOM 965 O ILE A 65 -53.052 90.668 21.598 1.00 0.00 O ATOM 966 CB ILE A 65 -51.840 91.064 18.897 1.00 0.00 C ATOM 967 CG1 ILE A 65 -51.862 91.232 17.379 1.00 0.00 C ATOM 968 CG2 ILE A 65 -50.424 90.738 19.389 1.00 0.00 C ATOM 969 CD1 ILE A 65 -50.919 92.281 16.847 1.00 0.00 C ATOM 0 H ILE A 65 -54.573 91.111 19.499 1.00 0.00 H new ATOM 0 HA ILE A 65 -52.588 89.050 18.779 1.00 0.00 H new ATOM 0 HB ILE A 65 -52.139 92.004 19.361 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -51.617 90.275 16.918 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -52.876 91.484 17.070 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -49.740 91.527 19.078 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -50.424 90.666 20.477 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -50.100 89.789 18.963 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -51.004 92.329 15.761 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -51.175 93.251 17.274 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -49.896 92.023 17.120 1.00 0.00 H new ATOM 981 N GLN A 66 -52.430 88.528 21.205 1.00 0.00 N ATOM 982 CA GLN A 66 -52.306 88.166 22.596 1.00 0.00 C ATOM 983 C GLN A 66 -51.551 86.857 22.700 1.00 0.00 C ATOM 984 O GLN A 66 -51.597 86.035 21.768 1.00 0.00 O ATOM 985 CB GLN A 66 -53.689 88.031 23.246 1.00 0.00 C ATOM 986 CG GLN A 66 -53.662 87.833 24.752 1.00 0.00 C ATOM 987 CD GLN A 66 -52.897 88.934 25.460 1.00 0.00 C ATOM 988 OE1 GLN A 66 -51.692 88.814 25.702 1.00 0.00 O ATOM 989 NE2 GLN A 66 -53.561 90.008 25.752 1.00 0.00 N ATOM 0 H GLN A 66 -52.230 87.765 20.559 1.00 0.00 H new ATOM 0 HA GLN A 66 -51.760 88.949 23.123 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -54.271 88.925 23.020 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -54.209 87.188 22.791 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -54.683 87.801 25.131 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -53.206 86.870 24.982 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -54.556 90.067 25.535 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -53.089 90.794 26.198 1.00 0.00 H new ATOM 998 N ALA A 67 -50.823 86.687 23.804 1.00 0.00 N ATOM 999 CA ALA A 67 -50.050 85.482 24.098 1.00 0.00 C ATOM 1000 C ALA A 67 -48.960 85.278 23.044 1.00 0.00 C ATOM 1001 O ALA A 67 -48.555 84.147 22.761 1.00 0.00 O ATOM 1002 CB ALA A 67 -50.979 84.258 24.188 1.00 0.00 C ATOM 0 H ALA A 67 -50.753 87.397 24.533 1.00 0.00 H new ATOM 0 HA ALA A 67 -49.562 85.603 25.065 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -50.389 83.368 24.407 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -51.710 84.413 24.982 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -51.498 84.124 23.239 1.00 0.00 H new ATOM 1008 N GLY A 68 -48.499 86.388 22.459 1.00 0.00 N ATOM 1009 CA GLY A 68 -47.477 86.348 21.416 1.00 0.00 C ATOM 1010 C GLY A 68 -48.012 85.809 20.094 1.00 0.00 C ATOM 1011 O GLY A 68 -47.265 85.552 19.158 1.00 0.00 O ATOM 0 H GLY A 68 -48.821 87.327 22.693 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -47.081 87.352 21.262 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -46.647 85.725 21.749 1.00 0.00 H new ATOM 1015 N HIS A 69 -49.303 85.620 20.024 1.00 0.00 N ATOM 1016 CA HIS A 69 -49.925 85.076 18.845 1.00 0.00 C ATOM 1017 C HIS A 69 -50.917 86.049 18.278 1.00 0.00 C ATOM 1018 O HIS A 69 -51.431 86.910 18.993 1.00 0.00 O ATOM 1019 CB HIS A 69 -50.620 83.738 19.153 1.00 0.00 C ATOM 1020 CG HIS A 69 -49.691 82.609 19.501 1.00 0.00 C ATOM 1021 ND1 HIS A 69 -49.101 82.461 20.735 1.00 0.00 N ATOM 1022 CD2 HIS A 69 -49.262 81.563 18.765 1.00 0.00 C ATOM 1023 CE1 HIS A 69 -48.360 81.385 20.740 1.00 0.00 C ATOM 1024 NE2 HIS A 69 -48.441 80.824 19.563 1.00 0.00 N ATOM 0 H HIS A 69 -49.952 85.838 20.780 1.00 0.00 H new ATOM 0 HA HIS A 69 -49.143 84.896 18.108 1.00 0.00 H new ATOM 0 HB2 HIS A 69 -51.313 83.887 19.981 1.00 0.00 H new ATOM 0 HB3 HIS A 69 -51.215 83.446 18.287 1.00 0.00 H new ATOM 0 HD1 HIS A 69 -49.223 83.094 21.525 1.00 0.00 H new ATOM 0 HD2 HIS A 69 -49.520 81.351 17.738 1.00 0.00 H new ATOM 0 HE1 HIS A 69 -47.779 81.021 21.575 1.00 0.00 H new ATOM 1033 N ILE A 70 -51.166 85.928 17.008 1.00 0.00 N ATOM 1034 CA ILE A 70 -52.172 86.703 16.351 1.00 0.00 C ATOM 1035 C ILE A 70 -53.355 85.793 16.120 1.00 0.00 C ATOM 1036 O ILE A 70 -53.187 84.644 15.673 1.00 0.00 O ATOM 1037 CB ILE A 70 -51.674 87.301 15.014 1.00 0.00 C ATOM 1038 CG1 ILE A 70 -50.463 88.198 15.264 1.00 0.00 C ATOM 1039 CG2 ILE A 70 -52.780 88.067 14.319 1.00 0.00 C ATOM 1040 CD1 ILE A 70 -50.025 89.039 14.078 1.00 0.00 C ATOM 0 H ILE A 70 -50.671 85.281 16.394 1.00 0.00 H new ATOM 0 HA ILE A 70 -52.444 87.553 16.977 1.00 0.00 H new ATOM 0 HB ILE A 70 -51.374 86.485 14.357 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -50.690 88.864 16.097 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -49.626 87.573 15.574 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -52.405 88.478 13.382 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -53.614 87.396 14.113 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -53.119 88.880 14.961 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -49.159 89.639 14.358 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -49.760 88.386 13.247 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -50.841 89.697 13.777 1.00 0.00 H new ATOM 1052 N TRP A 71 -54.514 86.281 16.420 1.00 0.00 N ATOM 1053 CA TRP A 71 -55.708 85.491 16.422 1.00 0.00 C ATOM 1054 C TRP A 71 -56.726 86.136 15.555 1.00 0.00 C ATOM 1055 O TRP A 71 -56.750 87.344 15.435 1.00 0.00 O ATOM 1056 CB TRP A 71 -56.294 85.447 17.833 1.00 0.00 C ATOM 1057 CG TRP A 71 -55.374 84.955 18.895 1.00 0.00 C ATOM 1058 CD1 TRP A 71 -54.415 85.670 19.548 1.00 0.00 C ATOM 1059 CD2 TRP A 71 -55.358 83.654 19.454 1.00 0.00 C ATOM 1060 NE1 TRP A 71 -53.789 84.879 20.469 1.00 0.00 N ATOM 1061 CE2 TRP A 71 -54.351 83.634 20.437 1.00 0.00 C ATOM 1062 CE3 TRP A 71 -56.095 82.502 19.215 1.00 0.00 C ATOM 1063 CZ2 TRP A 71 -54.067 82.498 21.181 1.00 0.00 C ATOM 1064 CZ3 TRP A 71 -55.813 81.379 19.954 1.00 0.00 C ATOM 1065 CH2 TRP A 71 -54.810 81.382 20.926 1.00 0.00 C ATOM 0 H TRP A 71 -54.663 87.257 16.676 1.00 0.00 H new ATOM 0 HA TRP A 71 -55.462 84.490 16.069 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -56.626 86.450 18.101 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -57.179 84.811 17.820 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -54.184 86.709 19.364 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -53.027 85.170 21.081 1.00 0.00 H new ATOM 0 HE3 TRP A 71 -56.872 82.489 18.465 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 -53.290 82.497 21.931 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 -56.378 80.475 19.780 1.00 0.00 H new ATOM 0 HH2 TRP A 71 -54.618 80.480 21.489 1.00 0.00 H new ATOM 1076 N ILE A 72 -57.545 85.358 14.956 1.00 0.00 N ATOM 1077 CA ILE A 72 -58.660 85.877 14.233 1.00 0.00 C ATOM 1078 C ILE A 72 -59.916 85.606 15.018 1.00 0.00 C ATOM 1079 O ILE A 72 -60.075 84.526 15.594 1.00 0.00 O ATOM 1080 CB ILE A 72 -58.787 85.305 12.818 1.00 0.00 C ATOM 1081 CG1 ILE A 72 -58.832 83.775 12.848 1.00 0.00 C ATOM 1082 CG2 ILE A 72 -57.638 85.810 11.953 1.00 0.00 C ATOM 1083 CD1 ILE A 72 -59.259 83.162 11.547 1.00 0.00 C ATOM 0 H ILE A 72 -57.469 84.341 14.948 1.00 0.00 H new ATOM 0 HA ILE A 72 -58.502 86.949 14.111 1.00 0.00 H new ATOM 0 HB ILE A 72 -59.725 85.647 12.381 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -57.845 83.396 13.112 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -59.517 83.455 13.633 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -57.732 85.400 10.947 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -57.669 86.899 11.906 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -56.690 85.493 12.386 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -59.268 82.076 11.642 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -60.259 83.512 11.291 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -58.561 83.452 10.762 1.00 0.00 H new ATOM 1095 N GLY A 73 -60.766 86.576 15.073 1.00 0.00 N ATOM 1096 CA GLY A 73 -61.971 86.456 15.813 1.00 0.00 C ATOM 1097 C GLY A 73 -63.153 86.328 14.919 1.00 0.00 C ATOM 1098 O GLY A 73 -63.344 87.145 14.001 1.00 0.00 O ATOM 0 H GLY A 73 -60.642 87.474 14.605 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -61.912 85.585 16.466 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -62.093 87.328 16.455 1.00 0.00 H new ATOM 1102 N TYR A 74 -63.907 85.300 15.141 1.00 0.00 N ATOM 1103 CA TYR A 74 -65.122 85.055 14.428 1.00 0.00 C ATOM 1104 C TYR A 74 -66.079 84.355 15.374 1.00 0.00 C ATOM 1105 O TYR A 74 -65.707 84.034 16.499 1.00 0.00 O ATOM 1106 CB TYR A 74 -64.862 84.220 13.145 1.00 0.00 C ATOM 1107 CG TYR A 74 -64.183 82.877 13.359 1.00 0.00 C ATOM 1108 CD1 TYR A 74 -64.929 81.719 13.530 1.00 0.00 C ATOM 1109 CD2 TYR A 74 -62.795 82.769 13.369 1.00 0.00 C ATOM 1110 CE1 TYR A 74 -64.318 80.497 13.703 1.00 0.00 C ATOM 1111 CE2 TYR A 74 -62.176 81.548 13.546 1.00 0.00 C ATOM 1112 CZ TYR A 74 -62.942 80.414 13.712 1.00 0.00 C ATOM 1113 OH TYR A 74 -62.331 79.191 13.876 1.00 0.00 O ATOM 0 H TYR A 74 -63.691 84.589 15.840 1.00 0.00 H new ATOM 0 HA TYR A 74 -65.560 85.995 14.092 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -65.816 84.049 12.646 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -64.249 84.812 12.466 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -66.007 81.777 13.527 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -62.193 83.655 13.236 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -64.915 79.606 13.831 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -61.098 81.482 13.554 1.00 0.00 H new ATOM 0 HH TYR A 74 -61.387 79.260 13.623 1.00 0.00 H new ATOM 1123 N ASN A 75 -67.283 84.142 14.967 1.00 0.00 N ATOM 1124 CA ASN A 75 -68.239 83.464 15.810 1.00 0.00 C ATOM 1125 C ASN A 75 -68.717 82.228 15.132 1.00 0.00 C ATOM 1126 O ASN A 75 -68.994 82.240 13.941 1.00 0.00 O ATOM 1127 CB ASN A 75 -69.433 84.355 16.199 1.00 0.00 C ATOM 1128 CG ASN A 75 -69.067 85.496 17.135 1.00 0.00 C ATOM 1129 OD1 ASN A 75 -68.684 86.564 16.697 1.00 0.00 O ATOM 1130 ND2 ASN A 75 -69.202 85.295 18.428 1.00 0.00 N ATOM 0 H ASN A 75 -67.641 84.424 14.055 1.00 0.00 H new ATOM 0 HA ASN A 75 -67.727 83.207 16.737 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -69.876 84.768 15.293 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -70.196 83.738 16.674 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -68.984 86.043 19.086 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -69.525 84.391 18.773 1.00 0.00 H new ATOM 1137 N ALA A 76 -68.763 81.156 15.864 1.00 0.00 N ATOM 1138 CA ALA A 76 -69.248 79.899 15.342 1.00 0.00 C ATOM 1139 C ALA A 76 -70.769 79.887 15.402 1.00 0.00 C ATOM 1140 O ALA A 76 -71.361 80.835 15.913 1.00 0.00 O ATOM 1141 CB ALA A 76 -68.668 78.756 16.138 1.00 0.00 C ATOM 0 H ALA A 76 -68.467 81.120 16.840 1.00 0.00 H new ATOM 0 HA ALA A 76 -68.936 79.782 14.304 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -69.037 77.811 15.740 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -67.580 78.779 16.068 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -68.967 78.851 17.182 1.00 0.00 H new ATOM 1147 N TYR A 77 -71.386 78.813 14.933 1.00 0.00 N ATOM 1148 CA TYR A 77 -72.846 78.689 14.876 1.00 0.00 C ATOM 1149 C TYR A 77 -73.525 78.957 16.228 1.00 0.00 C ATOM 1150 O TYR A 77 -74.527 79.668 16.292 1.00 0.00 O ATOM 1151 CB TYR A 77 -73.253 77.316 14.319 1.00 0.00 C ATOM 1152 CG TYR A 77 -74.742 77.056 14.377 1.00 0.00 C ATOM 1153 CD1 TYR A 77 -75.625 77.734 13.547 1.00 0.00 C ATOM 1154 CD2 TYR A 77 -75.263 76.142 15.278 1.00 0.00 C ATOM 1155 CE1 TYR A 77 -76.985 77.507 13.619 1.00 0.00 C ATOM 1156 CE2 TYR A 77 -76.615 75.910 15.352 1.00 0.00 C ATOM 1157 CZ TYR A 77 -77.471 76.592 14.527 1.00 0.00 C ATOM 1158 OH TYR A 77 -78.823 76.359 14.611 1.00 0.00 O ATOM 0 H TYR A 77 -70.891 77.995 14.578 1.00 0.00 H new ATOM 0 HA TYR A 77 -73.199 79.464 14.196 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -72.919 77.240 13.284 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -72.735 76.538 14.879 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -75.242 78.450 12.834 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -74.595 75.603 15.933 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -77.662 78.042 12.969 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -77.003 75.191 16.059 1.00 0.00 H new ATOM 0 HH TYR A 77 -78.997 75.685 15.301 1.00 0.00 H new ATOM 1168 N ASN A 78 -72.955 78.428 17.301 1.00 0.00 N ATOM 1169 CA ASN A 78 -73.532 78.611 18.647 1.00 0.00 C ATOM 1170 C ASN A 78 -73.317 80.063 19.149 1.00 0.00 C ATOM 1171 O ASN A 78 -73.875 80.483 20.161 1.00 0.00 O ATOM 1172 CB ASN A 78 -72.918 77.592 19.641 1.00 0.00 C ATOM 1173 CG ASN A 78 -73.545 77.600 21.050 1.00 0.00 C ATOM 1174 OD1 ASN A 78 -72.862 77.361 22.043 1.00 0.00 O ATOM 1175 ND2 ASN A 78 -74.837 77.815 21.145 1.00 0.00 N ATOM 0 H ASN A 78 -72.101 77.871 17.279 1.00 0.00 H new ATOM 0 HA ASN A 78 -74.605 78.432 18.586 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -73.018 76.591 19.221 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -71.851 77.794 19.733 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -75.293 77.785 22.057 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -75.384 78.012 20.307 1.00 0.00 H new ATOM 1182 N GLY A 79 -72.548 80.835 18.409 1.00 0.00 N ATOM 1183 CA GLY A 79 -72.254 82.197 18.805 1.00 0.00 C ATOM 1184 C GLY A 79 -70.947 82.277 19.532 1.00 0.00 C ATOM 1185 O GLY A 79 -70.559 83.337 20.031 1.00 0.00 O ATOM 0 H GLY A 79 -72.116 80.544 17.532 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -72.223 82.837 17.923 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -73.053 82.574 19.444 1.00 0.00 H new ATOM 1189 N ASN A 80 -70.272 81.148 19.579 1.00 0.00 N ATOM 1190 CA ASN A 80 -68.982 81.008 20.245 1.00 0.00 C ATOM 1191 C ASN A 80 -67.996 81.956 19.633 1.00 0.00 C ATOM 1192 O ASN A 80 -67.853 81.977 18.411 1.00 0.00 O ATOM 1193 CB ASN A 80 -68.438 79.589 20.061 1.00 0.00 C ATOM 1194 CG ASN A 80 -69.350 78.510 20.589 1.00 0.00 C ATOM 1195 OD1 ASN A 80 -70.085 78.718 21.538 1.00 0.00 O ATOM 1196 ND2 ASN A 80 -69.317 77.363 19.976 1.00 0.00 N ATOM 0 H ASN A 80 -70.604 80.284 19.150 1.00 0.00 H new ATOM 0 HA ASN A 80 -69.121 81.221 21.305 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -68.261 79.414 19.000 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -67.473 79.513 20.562 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -69.920 76.601 20.287 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -68.688 77.226 19.185 1.00 0.00 H new ATOM 1203 N ARG A 81 -67.338 82.752 20.446 1.00 0.00 N ATOM 1204 CA ARG A 81 -66.336 83.667 19.924 1.00 0.00 C ATOM 1205 C ARG A 81 -65.083 82.880 19.685 1.00 0.00 C ATOM 1206 O ARG A 81 -64.300 82.685 20.582 1.00 0.00 O ATOM 1207 CB ARG A 81 -66.047 84.832 20.886 1.00 0.00 C ATOM 1208 CG ARG A 81 -65.226 85.963 20.251 1.00 0.00 C ATOM 1209 CD ARG A 81 -65.838 86.454 18.929 1.00 0.00 C ATOM 1210 NE ARG A 81 -65.131 87.626 18.385 1.00 0.00 N ATOM 1211 CZ ARG A 81 -65.313 88.152 17.151 1.00 0.00 C ATOM 1212 NH1 ARG A 81 -66.281 87.723 16.361 1.00 0.00 N1+ ATOM 1213 NH2 ARG A 81 -64.552 89.148 16.741 1.00 0.00 N ATOM 0 H ARG A 81 -67.472 82.788 21.457 1.00 0.00 H new ATOM 0 HA ARG A 81 -66.710 84.111 19.002 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -66.992 85.238 21.246 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -65.512 84.450 21.756 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -65.158 86.797 20.950 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -64.209 85.614 20.071 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -65.813 85.646 18.198 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -66.886 86.707 19.089 1.00 0.00 H new ATOM 0 HE ARG A 81 -64.446 88.080 18.989 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -66.907 86.983 16.678 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -66.402 88.132 15.434 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -63.827 89.521 17.354 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -64.688 89.545 15.811 1.00 0.00 H new ATOM 1227 N VAL A 82 -64.916 82.418 18.513 1.00 0.00 N ATOM 1228 CA VAL A 82 -63.828 81.544 18.244 1.00 0.00 C ATOM 1229 C VAL A 82 -62.647 82.321 17.745 1.00 0.00 C ATOM 1230 O VAL A 82 -62.761 83.160 16.842 1.00 0.00 O ATOM 1231 CB VAL A 82 -64.190 80.404 17.260 1.00 0.00 C ATOM 1232 CG1 VAL A 82 -63.047 79.417 17.132 1.00 0.00 C ATOM 1233 CG2 VAL A 82 -65.446 79.689 17.704 1.00 0.00 C ATOM 0 H VAL A 82 -65.515 82.625 17.714 1.00 0.00 H new ATOM 0 HA VAL A 82 -63.572 81.063 19.188 1.00 0.00 H new ATOM 0 HB VAL A 82 -64.372 80.853 16.283 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -63.326 78.626 16.436 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -62.161 79.932 16.760 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -62.831 78.982 18.108 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -65.680 78.893 16.998 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -65.290 79.261 18.694 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -66.274 80.397 17.741 1.00 0.00 H new ATOM 1243 N TYR A 83 -61.555 82.080 18.377 1.00 0.00 N ATOM 1244 CA TYR A 83 -60.311 82.669 18.028 1.00 0.00 C ATOM 1245 C TYR A 83 -59.374 81.617 17.526 1.00 0.00 C ATOM 1246 O TYR A 83 -59.082 80.647 18.219 1.00 0.00 O ATOM 1247 CB TYR A 83 -59.694 83.428 19.200 1.00 0.00 C ATOM 1248 CG TYR A 83 -60.335 84.761 19.469 1.00 0.00 C ATOM 1249 CD1 TYR A 83 -59.944 85.875 18.749 1.00 0.00 C ATOM 1250 CD2 TYR A 83 -61.313 84.917 20.435 1.00 0.00 C ATOM 1251 CE1 TYR A 83 -60.503 87.104 18.976 1.00 0.00 C ATOM 1252 CE2 TYR A 83 -61.882 86.152 20.669 1.00 0.00 C ATOM 1253 CZ TYR A 83 -61.468 87.244 19.934 1.00 0.00 C ATOM 1254 OH TYR A 83 -62.030 88.481 20.162 1.00 0.00 O ATOM 0 H TYR A 83 -61.500 81.448 19.176 1.00 0.00 H new ATOM 0 HA TYR A 83 -60.492 83.395 17.235 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -59.767 82.813 20.097 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -58.633 83.580 19.003 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -59.181 85.773 17.991 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -61.635 84.063 21.012 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -60.183 87.960 18.400 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -62.647 86.263 21.423 1.00 0.00 H new ATOM 0 HH TYR A 83 -62.095 88.972 19.316 1.00 0.00 H new ATOM 1264 N CYS A 84 -58.948 81.781 16.330 1.00 0.00 N ATOM 1265 CA CYS A 84 -58.015 80.883 15.732 1.00 0.00 C ATOM 1266 C CYS A 84 -56.698 81.613 15.584 1.00 0.00 C ATOM 1267 O CYS A 84 -56.674 82.735 15.071 1.00 0.00 O ATOM 1268 CB CYS A 84 -58.530 80.418 14.356 1.00 0.00 C ATOM 1269 SG CYS A 84 -57.446 79.253 13.487 1.00 0.00 S ATOM 0 H CYS A 84 -59.237 82.550 15.725 1.00 0.00 H new ATOM 0 HA CYS A 84 -57.886 79.998 16.356 1.00 0.00 H new ATOM 0 HB2 CYS A 84 -59.507 79.953 14.488 1.00 0.00 H new ATOM 0 HB3 CYS A 84 -58.677 81.294 13.725 1.00 0.00 H new ATOM 0 HG CYS A 84 -56.210 79.636 13.611 1.00 0.00 H new ATOM 1275 N PRO A 85 -55.599 81.046 16.081 1.00 0.00 N ATOM 1276 CA PRO A 85 -54.301 81.643 15.906 1.00 0.00 C ATOM 1277 C PRO A 85 -53.877 81.470 14.461 1.00 0.00 C ATOM 1278 O PRO A 85 -54.022 80.395 13.890 1.00 0.00 O ATOM 1279 CB PRO A 85 -53.392 80.872 16.864 1.00 0.00 C ATOM 1280 CG PRO A 85 -54.072 79.563 17.089 1.00 0.00 C ATOM 1281 CD PRO A 85 -55.541 79.774 16.825 1.00 0.00 C ATOM 0 HA PRO A 85 -54.272 82.712 16.118 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -52.400 80.731 16.436 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -53.261 81.413 17.801 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -53.667 78.800 16.424 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -53.910 79.216 18.109 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -55.962 78.954 16.244 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -56.108 79.831 17.754 1.00 0.00 H new ATOM 1289 N VAL A 86 -53.431 82.522 13.855 1.00 0.00 N ATOM 1290 CA VAL A 86 -53.099 82.465 12.446 1.00 0.00 C ATOM 1291 C VAL A 86 -51.643 82.725 12.173 1.00 0.00 C ATOM 1292 O VAL A 86 -51.175 82.502 11.055 1.00 0.00 O ATOM 1293 CB VAL A 86 -53.965 83.432 11.621 1.00 0.00 C ATOM 1294 CG1 VAL A 86 -55.404 82.981 11.647 1.00 0.00 C ATOM 1295 CG2 VAL A 86 -53.842 84.859 12.150 1.00 0.00 C ATOM 0 H VAL A 86 -53.285 83.429 14.298 1.00 0.00 H new ATOM 0 HA VAL A 86 -53.313 81.442 12.136 1.00 0.00 H new ATOM 0 HB VAL A 86 -53.610 83.424 10.591 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -56.012 83.670 11.061 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -55.479 81.980 11.223 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -55.762 82.967 12.676 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -54.463 85.524 11.550 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -54.172 84.892 13.188 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -52.802 85.181 12.089 1.00 0.00 H new ATOM 1305 N ARG A 87 -50.940 83.213 13.180 1.00 0.00 N ATOM 1306 CA ARG A 87 -49.530 83.528 13.082 1.00 0.00 C ATOM 1307 C ARG A 87 -49.069 84.031 14.431 1.00 0.00 C ATOM 1308 O ARG A 87 -49.890 84.181 15.348 1.00 0.00 O ATOM 1309 CB ARG A 87 -49.277 84.578 11.969 1.00 0.00 C ATOM 1310 CG ARG A 87 -49.887 85.940 12.200 1.00 0.00 C ATOM 1311 CD ARG A 87 -49.946 86.747 10.906 1.00 0.00 C ATOM 1312 NE ARG A 87 -48.649 86.831 10.222 1.00 0.00 N ATOM 1313 CZ ARG A 87 -48.370 87.633 9.185 1.00 0.00 C ATOM 1314 NH1 ARG A 87 -49.275 88.489 8.721 1.00 0.00 N1+ ATOM 1315 NH2 ARG A 87 -47.175 87.578 8.626 1.00 0.00 N ATOM 0 H ARG A 87 -51.339 83.403 14.099 1.00 0.00 H new ATOM 0 HA ARG A 87 -48.962 82.638 12.810 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -48.201 84.699 11.847 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -49.662 84.183 11.029 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -50.892 85.827 12.607 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -49.302 86.482 12.943 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -50.676 86.294 10.235 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -50.299 87.754 11.128 1.00 0.00 H new ATOM 0 HE ARG A 87 -47.899 86.230 10.564 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -50.197 88.542 9.155 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -49.048 89.093 7.931 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -46.474 86.929 8.984 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -46.953 88.184 7.836 1.00 0.00 H new ATOM 1329 N THR A 88 -47.808 84.255 14.572 1.00 0.00 N ATOM 1330 CA THR A 88 -47.243 84.746 15.792 1.00 0.00 C ATOM 1331 C THR A 88 -47.026 86.260 15.709 1.00 0.00 C ATOM 1332 O THR A 88 -47.155 86.844 14.622 1.00 0.00 O ATOM 1333 CB THR A 88 -45.914 84.031 16.017 1.00 0.00 C ATOM 1334 OG1 THR A 88 -45.214 83.975 14.758 1.00 0.00 O ATOM 1335 CG2 THR A 88 -46.144 82.621 16.538 1.00 0.00 C ATOM 0 H THR A 88 -47.124 84.101 13.832 1.00 0.00 H new ATOM 0 HA THR A 88 -47.920 84.552 16.624 1.00 0.00 H new ATOM 0 HB THR A 88 -45.328 84.574 16.758 1.00 0.00 H new ATOM 0 HG1 THR A 88 -44.355 83.520 14.881 1.00 0.00 H new ATOM 0 HG21 THR A 88 -45.184 82.129 16.692 1.00 0.00 H new ATOM 0 HG22 THR A 88 -46.684 82.666 17.484 1.00 0.00 H new ATOM 0 HG23 THR A 88 -46.729 82.056 15.813 1.00 0.00 H new ATOM 1343 N CYS A 89 -46.748 86.885 16.830 1.00 0.00 N ATOM 1344 CA CYS A 89 -46.443 88.289 16.879 1.00 0.00 C ATOM 1345 C CYS A 89 -45.505 88.556 18.026 1.00 0.00 C ATOM 1346 O CYS A 89 -45.834 88.300 19.194 1.00 0.00 O ATOM 1347 CB CYS A 89 -47.696 89.146 17.030 1.00 0.00 C ATOM 1348 SG CYS A 89 -47.389 90.928 16.985 1.00 0.00 S ATOM 0 H CYS A 89 -46.728 86.425 17.740 1.00 0.00 H new ATOM 0 HA CYS A 89 -45.974 88.561 15.934 1.00 0.00 H new ATOM 0 HB2 CYS A 89 -48.395 88.889 16.234 1.00 0.00 H new ATOM 0 HB3 CYS A 89 -48.181 88.896 17.974 1.00 0.00 H new ATOM 0 HG CYS A 89 -47.283 91.381 18.199 1.00 0.00 H new ATOM 1354 N GLN A 90 -44.349 89.050 17.705 1.00 0.00 N ATOM 1355 CA GLN A 90 -43.370 89.361 18.691 1.00 0.00 C ATOM 1356 C GLN A 90 -43.705 90.717 19.295 1.00 0.00 C ATOM 1357 O GLN A 90 -43.318 91.760 18.753 1.00 0.00 O ATOM 1358 CB GLN A 90 -41.993 89.423 18.059 1.00 0.00 C ATOM 1359 CG GLN A 90 -40.855 89.339 19.044 1.00 0.00 C ATOM 1360 CD GLN A 90 -39.521 89.502 18.375 1.00 0.00 C ATOM 1361 OE1 GLN A 90 -38.908 88.523 17.931 1.00 0.00 O ATOM 1362 NE2 GLN A 90 -39.054 90.714 18.306 1.00 0.00 N ATOM 0 H GLN A 90 -44.060 89.248 16.747 1.00 0.00 H new ATOM 0 HA GLN A 90 -43.370 88.590 19.461 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -41.898 88.608 17.341 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -41.905 90.353 17.498 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -40.976 90.110 19.805 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -40.889 88.378 19.556 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -39.595 91.491 18.686 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -38.147 90.887 17.872 1.00 0.00 H new ATOM 1371 N GLY A 91 -44.477 90.710 20.340 1.00 0.00 N ATOM 1372 CA GLY A 91 -44.817 91.936 21.000 1.00 0.00 C ATOM 1373 C GLY A 91 -46.152 92.468 20.555 1.00 0.00 C ATOM 1374 O GLY A 91 -46.866 91.818 19.785 1.00 0.00 O ATOM 0 H GLY A 91 -44.883 89.871 20.754 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -44.833 91.774 22.078 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -44.046 92.680 20.801 1.00 0.00 H new ATOM 1378 N VAL A 92 -46.489 93.635 21.023 1.00 0.00 N ATOM 1379 CA VAL A 92 -47.744 94.266 20.686 1.00 0.00 C ATOM 1380 C VAL A 92 -47.517 95.503 19.820 1.00 0.00 C ATOM 1381 O VAL A 92 -46.415 96.056 19.803 1.00 0.00 O ATOM 1382 CB VAL A 92 -48.555 94.652 21.953 1.00 0.00 C ATOM 1383 CG1 VAL A 92 -48.997 93.412 22.696 1.00 0.00 C ATOM 1384 CG2 VAL A 92 -47.757 95.572 22.860 1.00 0.00 C ATOM 0 H VAL A 92 -45.902 94.183 21.652 1.00 0.00 H new ATOM 0 HA VAL A 92 -48.325 93.537 20.121 1.00 0.00 H new ATOM 0 HB VAL A 92 -49.443 95.196 21.632 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -49.564 93.701 23.581 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -49.625 92.803 22.046 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -48.121 92.837 22.998 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -48.352 95.824 23.738 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -46.842 95.069 23.174 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -47.503 96.484 22.320 1.00 0.00 H new ATOM 1394 N PRO A 93 -48.554 95.941 19.071 1.00 0.00 N ATOM 1395 CA PRO A 93 -48.475 97.144 18.231 1.00 0.00 C ATOM 1396 C PRO A 93 -48.244 98.437 19.063 1.00 0.00 C ATOM 1397 O PRO A 93 -48.315 98.395 20.294 1.00 0.00 O ATOM 1398 CB PRO A 93 -49.824 97.181 17.503 1.00 0.00 C ATOM 1399 CG PRO A 93 -50.727 96.256 18.246 1.00 0.00 C ATOM 1400 CD PRO A 93 -49.869 95.283 18.986 1.00 0.00 C ATOM 0 HA PRO A 93 -47.627 97.104 17.548 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -50.230 98.192 17.489 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -49.714 96.867 16.465 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -51.359 96.812 18.938 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -51.391 95.734 17.557 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -50.272 95.072 19.977 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -49.803 94.331 18.459 1.00 0.00 H new ATOM 1408 N PRO A 94 -47.973 99.618 18.421 1.00 0.00 N ATOM 1409 CA PRO A 94 -47.949 99.798 16.945 1.00 0.00 C ATOM 1410 C PRO A 94 -46.828 99.033 16.262 1.00 0.00 C ATOM 1411 O PRO A 94 -46.934 98.660 15.093 1.00 0.00 O ATOM 1412 CB PRO A 94 -47.767 101.304 16.756 1.00 0.00 C ATOM 1413 CG PRO A 94 -47.162 101.790 18.028 1.00 0.00 C ATOM 1414 CD PRO A 94 -47.658 100.882 19.119 1.00 0.00 C ATOM 0 HA PRO A 94 -48.860 99.407 16.491 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -47.120 101.518 15.906 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -48.721 101.794 16.562 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -46.074 101.768 17.972 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -47.450 102.823 18.224 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -46.901 100.734 19.889 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -48.538 101.295 19.612 1.00 0.00 H new ATOM 1422 N ASN A 95 -45.785 98.761 16.989 1.00 0.00 N ATOM 1423 CA ASN A 95 -44.698 97.988 16.452 1.00 0.00 C ATOM 1424 C ASN A 95 -44.907 96.529 16.751 1.00 0.00 C ATOM 1425 O ASN A 95 -44.374 95.973 17.706 1.00 0.00 O ATOM 1426 CB ASN A 95 -43.303 98.516 16.900 1.00 0.00 C ATOM 1427 CG ASN A 95 -43.194 98.836 18.392 1.00 0.00 C ATOM 1428 OD1 ASN A 95 -42.812 97.997 19.210 1.00 0.00 O ATOM 1429 ND2 ASN A 95 -43.508 100.059 18.755 1.00 0.00 N ATOM 0 H ASN A 95 -45.661 99.062 17.956 1.00 0.00 H new ATOM 0 HA ASN A 95 -44.699 98.106 15.368 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -42.548 97.772 16.645 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -43.069 99.416 16.331 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -43.438 100.334 19.735 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -43.821 100.734 18.057 1.00 0.00 H new ATOM 1436 N GLN A 96 -45.759 95.932 15.950 1.00 0.00 N ATOM 1437 CA GLN A 96 -46.043 94.528 16.058 1.00 0.00 C ATOM 1438 C GLN A 96 -45.171 93.811 15.058 1.00 0.00 C ATOM 1439 O GLN A 96 -44.807 94.380 14.010 1.00 0.00 O ATOM 1440 CB GLN A 96 -47.531 94.249 15.781 1.00 0.00 C ATOM 1441 CG GLN A 96 -47.921 94.270 14.305 1.00 0.00 C ATOM 1442 CD GLN A 96 -49.422 94.332 14.066 1.00 0.00 C ATOM 1443 OE1 GLN A 96 -49.929 93.815 13.080 1.00 0.00 O ATOM 1444 NE2 GLN A 96 -50.133 94.975 14.942 1.00 0.00 N ATOM 0 H GLN A 96 -46.272 96.409 15.208 1.00 0.00 H new ATOM 0 HA GLN A 96 -45.833 94.175 17.068 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -47.787 93.274 16.196 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -48.130 94.989 16.311 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -47.451 95.129 13.827 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -47.522 93.378 13.821 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -49.683 95.396 15.755 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -51.142 95.059 14.817 1.00 0.00 H new ATOM 1453 N ILE A 97 -44.837 92.608 15.349 1.00 0.00 N ATOM 1454 CA ILE A 97 -43.968 91.842 14.497 1.00 0.00 C ATOM 1455 C ILE A 97 -44.612 90.492 14.227 1.00 0.00 C ATOM 1456 O ILE A 97 -44.421 89.546 14.981 1.00 0.00 O ATOM 1457 CB ILE A 97 -42.568 91.663 15.144 1.00 0.00 C ATOM 1458 CG1 ILE A 97 -41.958 93.037 15.448 1.00 0.00 C ATOM 1459 CG2 ILE A 97 -41.643 90.862 14.226 1.00 0.00 C ATOM 1460 CD1 ILE A 97 -40.727 93.009 16.313 1.00 0.00 C ATOM 0 H ILE A 97 -45.153 92.114 16.184 1.00 0.00 H new ATOM 0 HA ILE A 97 -43.825 92.374 13.557 1.00 0.00 H new ATOM 0 HB ILE A 97 -42.683 91.108 16.075 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -41.710 93.524 14.505 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -42.713 93.653 15.936 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -40.668 90.749 14.700 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -42.074 89.877 14.044 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -41.527 91.388 13.278 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -40.370 94.027 16.471 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -40.968 92.555 17.274 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -39.950 92.425 15.821 1.00 0.00 H new ATOM 1472 N PRO A 98 -45.457 90.422 13.202 1.00 0.00 N ATOM 1473 CA PRO A 98 -46.146 89.200 12.851 1.00 0.00 C ATOM 1474 C PRO A 98 -45.227 88.199 12.158 1.00 0.00 C ATOM 1475 O PRO A 98 -44.539 88.538 11.178 1.00 0.00 O ATOM 1476 CB PRO A 98 -47.266 89.656 11.910 1.00 0.00 C ATOM 1477 CG PRO A 98 -46.875 91.006 11.407 1.00 0.00 C ATOM 1478 CD PRO A 98 -45.810 91.545 12.320 1.00 0.00 C ATOM 0 HA PRO A 98 -46.518 88.680 13.734 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -47.388 88.955 11.084 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -48.220 89.699 12.435 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -46.504 90.940 10.384 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -47.737 91.672 11.391 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -44.944 91.890 11.755 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -46.176 92.397 12.893 1.00 0.00 H new ATOM 1486 N GLY A 99 -45.216 86.988 12.670 1.00 0.00 N ATOM 1487 CA GLY A 99 -44.400 85.927 12.120 1.00 0.00 C ATOM 1488 C GLY A 99 -45.058 85.268 10.931 1.00 0.00 C ATOM 1489 O GLY A 99 -45.997 85.827 10.357 1.00 0.00 O ATOM 0 H GLY A 99 -45.772 86.711 13.479 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -43.433 86.331 11.822 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -44.210 85.179 12.890 1.00 0.00 H new ATOM 1493 N VAL A 100 -44.611 84.082 10.580 1.00 0.00 N ATOM 1494 CA VAL A 100 -45.135 83.373 9.416 1.00 0.00 C ATOM 1495 C VAL A 100 -46.622 83.032 9.606 1.00 0.00 C ATOM 1496 O VAL A 100 -47.045 82.627 10.692 1.00 0.00 O ATOM 1497 CB VAL A 100 -44.294 82.089 9.091 1.00 0.00 C ATOM 1498 CG1 VAL A 100 -44.295 81.094 10.243 1.00 0.00 C ATOM 1499 CG2 VAL A 100 -44.755 81.424 7.796 1.00 0.00 C ATOM 0 H VAL A 100 -43.880 83.579 11.084 1.00 0.00 H new ATOM 0 HA VAL A 100 -45.048 84.040 8.558 1.00 0.00 H new ATOM 0 HB VAL A 100 -43.266 82.421 8.949 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -43.700 80.222 9.971 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -43.867 81.563 11.129 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -45.318 80.783 10.455 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -44.148 80.539 7.606 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -45.802 81.134 7.889 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -44.645 82.124 6.968 1.00 0.00 H new ATOM 1509 N ALA A 101 -47.405 83.265 8.579 1.00 0.00 N ATOM 1510 CA ALA A 101 -48.813 82.988 8.632 1.00 0.00 C ATOM 1511 C ALA A 101 -49.088 81.531 8.373 1.00 0.00 C ATOM 1512 O ALA A 101 -48.366 80.864 7.619 1.00 0.00 O ATOM 1513 CB ALA A 101 -49.586 83.865 7.671 1.00 0.00 C ATOM 0 H ALA A 101 -47.083 83.649 7.691 1.00 0.00 H new ATOM 0 HA ALA A 101 -49.156 83.222 9.640 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -50.648 83.629 7.737 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -49.430 84.913 7.929 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -49.237 83.686 6.654 1.00 0.00 H new ATOM 1519 N TRP A 102 -50.121 81.037 8.994 1.00 0.00 N ATOM 1520 CA TRP A 102 -50.501 79.651 8.877 1.00 0.00 C ATOM 1521 C TRP A 102 -51.580 79.473 7.820 1.00 0.00 C ATOM 1522 O TRP A 102 -52.189 78.419 7.709 1.00 0.00 O ATOM 1523 CB TRP A 102 -50.950 79.116 10.251 1.00 0.00 C ATOM 1524 CG TRP A 102 -49.865 79.196 11.304 1.00 0.00 C ATOM 1525 CD1 TRP A 102 -48.525 79.289 11.086 1.00 0.00 C ATOM 1526 CD2 TRP A 102 -50.026 79.154 12.725 1.00 0.00 C ATOM 1527 NE1 TRP A 102 -47.852 79.338 12.272 1.00 0.00 N ATOM 1528 CE2 TRP A 102 -48.743 79.251 13.293 1.00 0.00 C ATOM 1529 CE3 TRP A 102 -51.119 79.054 13.571 1.00 0.00 C ATOM 1530 CZ2 TRP A 102 -48.531 79.248 14.664 1.00 0.00 C ATOM 1531 CZ3 TRP A 102 -50.909 79.048 14.929 1.00 0.00 C ATOM 1532 CH2 TRP A 102 -49.627 79.146 15.467 1.00 0.00 C ATOM 0 H TRP A 102 -50.730 81.586 9.601 1.00 0.00 H new ATOM 0 HA TRP A 102 -49.638 79.069 8.552 1.00 0.00 H new ATOM 0 HB2 TRP A 102 -51.818 79.682 10.589 1.00 0.00 H new ATOM 0 HB3 TRP A 102 -51.268 78.079 10.144 1.00 0.00 H new ATOM 0 HD1 TRP A 102 -48.060 79.320 10.112 1.00 0.00 H new ATOM 0 HE1 TRP A 102 -46.841 79.426 12.375 1.00 0.00 H new ATOM 0 HE3 TRP A 102 -52.119 78.982 13.170 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 -47.537 79.324 15.078 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 -51.756 78.966 15.594 1.00 0.00 H new ATOM 0 HH2 TRP A 102 -49.500 79.141 16.540 1.00 0.00 H new ATOM 1543 N GLY A 103 -51.780 80.501 7.024 1.00 0.00 N ATOM 1544 CA GLY A 103 -52.747 80.445 5.976 1.00 0.00 C ATOM 1545 C GLY A 103 -52.780 81.716 5.188 1.00 0.00 C ATOM 1546 O GLY A 103 -51.866 82.553 5.301 1.00 0.00 O ATOM 0 H GLY A 103 -51.277 81.386 7.092 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -52.518 79.611 5.313 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -53.733 80.253 6.400 1.00 0.00 H new ATOM 1550 N VAL A 104 -53.826 81.880 4.429 1.00 0.00 N ATOM 1551 CA VAL A 104 -54.004 83.026 3.561 1.00 0.00 C ATOM 1552 C VAL A 104 -55.037 83.931 4.178 1.00 0.00 C ATOM 1553 O VAL A 104 -55.913 83.467 4.898 1.00 0.00 O ATOM 1554 CB VAL A 104 -54.577 82.613 2.187 1.00 0.00 C ATOM 1555 CG1 VAL A 104 -54.373 83.692 1.135 1.00 0.00 C ATOM 1556 CG2 VAL A 104 -54.081 81.260 1.723 1.00 0.00 C ATOM 0 H VAL A 104 -54.597 81.213 4.390 1.00 0.00 H new ATOM 0 HA VAL A 104 -53.031 83.502 3.436 1.00 0.00 H new ATOM 0 HB VAL A 104 -55.653 82.506 2.328 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -54.791 83.358 0.185 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -54.874 84.607 1.450 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -53.307 83.885 1.014 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -54.518 81.025 0.752 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -52.995 81.281 1.636 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -54.372 80.498 2.446 1.00 0.00 H new ATOM 1566 N PHE A 105 -54.956 85.187 3.872 1.00 0.00 N ATOM 1567 CA PHE A 105 -55.890 86.152 4.329 1.00 0.00 C ATOM 1568 C PHE A 105 -56.423 86.893 3.127 1.00 0.00 C ATOM 1569 O PHE A 105 -55.697 87.680 2.504 1.00 0.00 O ATOM 1570 CB PHE A 105 -55.204 87.143 5.233 1.00 0.00 C ATOM 1571 CG PHE A 105 -54.590 86.565 6.467 1.00 0.00 C ATOM 1572 CD1 PHE A 105 -53.220 86.403 6.560 1.00 0.00 C ATOM 1573 CD2 PHE A 105 -55.377 86.192 7.530 1.00 0.00 C ATOM 1574 CE1 PHE A 105 -52.649 85.880 7.692 1.00 0.00 C ATOM 1575 CE2 PHE A 105 -54.814 85.666 8.668 1.00 0.00 C ATOM 1576 CZ PHE A 105 -53.445 85.511 8.748 1.00 0.00 C ATOM 0 H PHE A 105 -54.219 85.574 3.283 1.00 0.00 H new ATOM 0 HA PHE A 105 -56.693 85.658 4.876 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -54.425 87.651 4.664 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -55.929 87.902 5.529 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -52.592 86.692 5.731 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -56.449 86.313 7.471 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -51.578 85.759 7.752 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -55.441 85.375 9.498 1.00 0.00 H new ATOM 0 HZ PHE A 105 -53.000 85.099 9.642 1.00 0.00 H new ATOM 1586 N LYS A 106 -57.615 86.588 2.744 1.00 0.00 N ATOM 1587 CA LYS A 106 -58.251 87.280 1.655 1.00 0.00 C ATOM 1588 C LYS A 106 -59.127 88.352 2.244 1.00 0.00 C ATOM 1589 O LYS A 106 -58.677 89.488 2.380 1.00 0.00 O ATOM 1590 CB LYS A 106 -59.111 86.348 0.807 1.00 0.00 C ATOM 1591 CG LYS A 106 -58.437 85.080 0.351 1.00 0.00 C ATOM 1592 CD LYS A 106 -59.345 84.316 -0.594 1.00 0.00 C ATOM 1593 CE LYS A 106 -58.663 83.092 -1.166 1.00 0.00 C ATOM 1594 NZ LYS A 106 -59.536 82.380 -2.119 1.00 0.00 N1+ ATOM 1595 OXT LYS A 106 -60.263 88.042 2.638 1.00 0.00 O ATOM 0 H LYS A 106 -58.183 85.855 3.170 1.00 0.00 H new ATOM 0 HA LYS A 106 -57.480 87.696 1.006 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -60.000 86.081 1.379 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -59.450 86.895 -0.073 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -57.498 85.318 -0.148 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -58.192 84.459 1.213 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -60.248 84.014 -0.064 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -59.656 84.971 -1.407 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -57.742 83.389 -1.667 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -58.382 82.419 -0.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -59.037 81.547 -2.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -60.404 82.075 -1.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -59.783 83.015 -2.905 1.00 0.00 H new TER 1609 LYS A 106