USER MOD reduce.3.24.130724 H: found=0, std=0, add=1111, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1106 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 47 TYR OH : rot 180:sc= 0.0633 USER MOD Set 1.2: A 98 LYS NZ :NH3+ -109:sc= 0.0571 (180deg=0) USER MOD Set 2.1: A 16 THR OG1 : rot -88:sc= 0.0269 USER MOD Set 2.2: A 31 HIS : no HD1:sc= 0.018 X(o=0.034,f=-0.33) USER MOD Set 2.3: A 128 THR OG1 : rot 180:sc= -0.0107 USER MOD Single : A 1 GLY N :NH3+ -116:sc= 0.101 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc=-0.00695 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot -150:sc= 0.401 USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 GLN : amide:sc= -2.43 K(o=-2.4,f=-3.4) USER MOD Single : A 19 HIS : no HD1:sc= 0.644 K(o=0.65,f=-4.3!) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 180:sc= -0.115 USER MOD Single : A 22 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 ASN : amide:sc= -4.94! C(o=-4.9!,f=-6.1!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 CYS SG : rot 180:sc= -0.903 USER MOD Single : A 35 ASN : amide:sc= -0.0105 X(o=-0.011,f=0) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot -140:sc= 0 USER MOD Single : A 50 MET CE :methyl -124:sc= -0.0178 (180deg=-1.11) USER MOD Single : A 51 TYR OH : rot 180:sc= -0.439 USER MOD Single : A 56 LYS NZ :NH3+ -164:sc= 0.018 (180deg=0.00341) USER MOD Single : A 59 SER OG : rot 180:sc= 0.0357 USER MOD Single : A 63 LYS NZ :NH3+ -126:sc= 0.0755 (180deg=0) USER MOD Single : A 64 THR OG1 : rot 148:sc= 1.17 USER MOD Single : A 65 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= -0.387 K(o=-0.39,f=-1.6!) USER MOD Single : A 77 GLN :FLIP amide:sc= 0 F(o=-0.58,f=0) USER MOD Single : A 78 SER OG : rot 180:sc= -0.217 USER MOD Single : A 82 SER OG : rot 50:sc= 0.552 USER MOD Single : A 84 SER OG : rot 180:sc= 0.0083 USER MOD Single : A 89 GLN : amide:sc= -4.89! C(o=-4.9!,f=-5.9!) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 ASN : amide:sc= -1.11 K(o=-1.1,f=-4.3!) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ 142:sc= -0.423 (180deg=-2.41!) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 GLN : amide:sc= -0.674 X(o=-0.67,f=-1.1) USER MOD Single : A 131 TYR OH : rot 150:sc= 0.677 USER MOD Single : A 134 THR OG1 : rot -14:sc= 0.157 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 140 SER OG : rot 6:sc= 0.0629 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 5.631 1.373 12.313 1.00 0.00 N ATOM 2 CA GLY A 1 6.322 2.526 12.860 1.00 0.00 C ATOM 3 C GLY A 1 6.030 3.797 12.086 1.00 0.00 C ATOM 4 O GLY A 1 5.352 3.765 11.060 1.00 0.00 O ATOM 0 H1 GLY A 1 4.952 1.011 13.013 1.00 0.00 H new ATOM 0 H2 GLY A 1 5.123 1.650 11.449 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.322 0.630 12.085 1.00 0.00 H new ATOM 0 HA2 GLY A 1 6.028 2.662 13.901 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.396 2.339 12.854 1.00 0.00 H new ATOM 8 N SER A 2 6.543 4.919 12.581 1.00 0.00 N ATOM 9 CA SER A 2 6.329 6.208 11.932 1.00 0.00 C ATOM 10 C SER A 2 7.658 6.905 11.659 1.00 0.00 C ATOM 11 O SER A 2 7.717 8.129 11.544 1.00 0.00 O ATOM 12 CB SER A 2 5.441 7.100 12.802 1.00 0.00 C ATOM 13 OG SER A 2 5.771 6.965 14.174 1.00 0.00 O ATOM 0 H SER A 2 7.109 4.962 13.428 1.00 0.00 H new ATOM 0 HA SER A 2 5.830 6.029 10.980 1.00 0.00 H new ATOM 0 HB2 SER A 2 5.556 8.140 12.498 1.00 0.00 H new ATOM 0 HB3 SER A 2 4.394 6.837 12.649 1.00 0.00 H new ATOM 0 HG SER A 2 5.191 7.546 14.709 1.00 0.00 H new ATOM 19 N SER A 3 8.723 6.117 11.557 1.00 0.00 N ATOM 20 CA SER A 3 10.053 6.657 11.302 1.00 0.00 C ATOM 21 C SER A 3 10.932 5.628 10.597 1.00 0.00 C ATOM 22 O SER A 3 11.142 4.526 11.101 1.00 0.00 O ATOM 23 CB SER A 3 10.710 7.094 12.613 1.00 0.00 C ATOM 24 OG SER A 3 9.997 8.163 13.209 1.00 0.00 O ATOM 0 H SER A 3 8.691 5.102 11.647 1.00 0.00 H new ATOM 0 HA SER A 3 9.947 7.525 10.651 1.00 0.00 H new ATOM 0 HB2 SER A 3 10.750 6.250 13.302 1.00 0.00 H new ATOM 0 HB3 SER A 3 11.739 7.400 12.424 1.00 0.00 H new ATOM 0 HG SER A 3 10.436 8.423 14.046 1.00 0.00 H new ATOM 30 N GLY A 4 11.444 5.998 9.427 1.00 0.00 N ATOM 31 CA GLY A 4 12.294 5.097 8.671 1.00 0.00 C ATOM 32 C GLY A 4 12.212 5.340 7.177 1.00 0.00 C ATOM 33 O GLY A 4 11.139 5.624 6.644 1.00 0.00 O ATOM 0 H GLY A 4 11.285 6.906 8.989 1.00 0.00 H new ATOM 0 HA2 GLY A 4 13.327 5.216 8.999 1.00 0.00 H new ATOM 0 HA3 GLY A 4 12.008 4.067 8.885 1.00 0.00 H new ATOM 37 N SER A 5 13.350 5.231 6.498 1.00 0.00 N ATOM 38 CA SER A 5 13.404 5.447 5.057 1.00 0.00 C ATOM 39 C SER A 5 12.710 6.751 4.676 1.00 0.00 C ATOM 40 O SER A 5 12.030 6.829 3.653 1.00 0.00 O ATOM 41 CB SER A 5 12.753 4.275 4.320 1.00 0.00 C ATOM 42 OG SER A 5 13.683 3.228 4.103 1.00 0.00 O ATOM 0 H SER A 5 14.247 4.994 6.923 1.00 0.00 H new ATOM 0 HA SER A 5 14.452 5.515 4.764 1.00 0.00 H new ATOM 0 HB2 SER A 5 11.909 3.901 4.899 1.00 0.00 H new ATOM 0 HB3 SER A 5 12.357 4.618 3.364 1.00 0.00 H new ATOM 0 HG SER A 5 13.241 2.491 3.632 1.00 0.00 H new ATOM 48 N SER A 6 12.888 7.773 5.508 1.00 0.00 N ATOM 49 CA SER A 6 12.276 9.073 5.261 1.00 0.00 C ATOM 50 C SER A 6 13.185 9.947 4.403 1.00 0.00 C ATOM 51 O SER A 6 14.401 9.763 4.380 1.00 0.00 O ATOM 52 CB SER A 6 11.975 9.778 6.586 1.00 0.00 C ATOM 53 OG SER A 6 11.227 10.963 6.375 1.00 0.00 O ATOM 0 H SER A 6 13.450 7.726 6.358 1.00 0.00 H new ATOM 0 HA SER A 6 11.342 8.911 4.722 1.00 0.00 H new ATOM 0 HB2 SER A 6 11.421 9.106 7.241 1.00 0.00 H new ATOM 0 HB3 SER A 6 12.909 10.019 7.093 1.00 0.00 H new ATOM 0 HG SER A 6 11.046 11.394 7.237 1.00 0.00 H new ATOM 59 N GLY A 7 12.584 10.901 3.697 1.00 0.00 N ATOM 60 CA GLY A 7 13.353 11.790 2.846 1.00 0.00 C ATOM 61 C GLY A 7 12.928 11.713 1.393 1.00 0.00 C ATOM 62 O GLY A 7 13.734 11.395 0.519 1.00 0.00 O ATOM 0 H GLY A 7 11.579 11.074 3.700 1.00 0.00 H new ATOM 0 HA2 GLY A 7 13.241 12.815 3.200 1.00 0.00 H new ATOM 0 HA3 GLY A 7 14.411 11.539 2.926 1.00 0.00 H new ATOM 66 N SER A 8 11.657 12.003 1.134 1.00 0.00 N ATOM 67 CA SER A 8 11.124 11.961 -0.223 1.00 0.00 C ATOM 68 C SER A 8 10.498 13.299 -0.603 1.00 0.00 C ATOM 69 O SER A 8 9.530 13.756 0.006 1.00 0.00 O ATOM 70 CB SER A 8 10.086 10.844 -0.351 1.00 0.00 C ATOM 71 OG SER A 8 9.703 10.656 -1.702 1.00 0.00 O ATOM 0 H SER A 8 10.977 12.270 1.846 1.00 0.00 H new ATOM 0 HA SER A 8 11.950 11.760 -0.905 1.00 0.00 H new ATOM 0 HB2 SER A 8 10.496 9.915 0.047 1.00 0.00 H new ATOM 0 HB3 SER A 8 9.209 11.088 0.248 1.00 0.00 H new ATOM 0 HG SER A 8 8.777 10.336 -1.738 1.00 0.00 H new ATOM 77 N PRO A 9 11.062 13.943 -1.635 1.00 0.00 N ATOM 78 CA PRO A 9 10.575 15.238 -2.121 1.00 0.00 C ATOM 79 C PRO A 9 9.217 15.127 -2.806 1.00 0.00 C ATOM 80 O PRO A 9 8.445 16.086 -2.834 1.00 0.00 O ATOM 81 CB PRO A 9 11.648 15.665 -3.127 1.00 0.00 C ATOM 82 CG PRO A 9 12.265 14.389 -3.587 1.00 0.00 C ATOM 83 CD PRO A 9 12.217 13.457 -2.408 1.00 0.00 C ATOM 0 HA PRO A 9 10.426 15.949 -1.308 1.00 0.00 H new ATOM 0 HB2 PRO A 9 11.213 16.217 -3.960 1.00 0.00 H new ATOM 0 HB3 PRO A 9 12.388 16.318 -2.664 1.00 0.00 H new ATOM 0 HG2 PRO A 9 11.719 13.975 -4.434 1.00 0.00 H new ATOM 0 HG3 PRO A 9 13.292 14.549 -3.917 1.00 0.00 H new ATOM 0 HD2 PRO A 9 12.084 12.421 -2.720 1.00 0.00 H new ATOM 0 HD3 PRO A 9 13.137 13.499 -1.825 1.00 0.00 H new ATOM 91 N LEU A 10 8.932 13.953 -3.357 1.00 0.00 N ATOM 92 CA LEU A 10 7.666 13.716 -4.042 1.00 0.00 C ATOM 93 C LEU A 10 6.551 13.430 -3.041 1.00 0.00 C ATOM 94 O LEU A 10 5.493 14.057 -3.078 1.00 0.00 O ATOM 95 CB LEU A 10 7.802 12.547 -5.019 1.00 0.00 C ATOM 96 CG LEU A 10 8.817 12.731 -6.148 1.00 0.00 C ATOM 97 CD1 LEU A 10 8.980 11.440 -6.935 1.00 0.00 C ATOM 98 CD2 LEU A 10 8.393 13.868 -7.066 1.00 0.00 C ATOM 0 H LEU A 10 9.560 13.150 -3.343 1.00 0.00 H new ATOM 0 HA LEU A 10 7.408 14.617 -4.598 1.00 0.00 H new ATOM 0 HB2 LEU A 10 8.075 11.656 -4.453 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.825 12.355 -5.463 1.00 0.00 H new ATOM 0 HG LEU A 10 9.780 12.987 -5.707 1.00 0.00 H new ATOM 0 HD11 LEU A 10 9.706 11.590 -7.734 1.00 0.00 H new ATOM 0 HD12 LEU A 10 9.330 10.650 -6.270 1.00 0.00 H new ATOM 0 HD13 LEU A 10 8.021 11.153 -7.366 1.00 0.00 H new ATOM 0 HD21 LEU A 10 9.127 13.985 -7.863 1.00 0.00 H new ATOM 0 HD22 LEU A 10 7.419 13.642 -7.500 1.00 0.00 H new ATOM 0 HD23 LEU A 10 8.329 14.793 -6.493 1.00 0.00 H new ATOM 110 N GLY A 11 6.796 12.478 -2.145 1.00 0.00 N ATOM 111 CA GLY A 11 5.805 12.127 -1.146 1.00 0.00 C ATOM 112 C GLY A 11 5.929 10.687 -0.687 1.00 0.00 C ATOM 113 O GLY A 11 6.867 9.987 -1.068 1.00 0.00 O ATOM 0 H GLY A 11 7.664 11.944 -2.094 1.00 0.00 H new ATOM 0 HA2 GLY A 11 5.910 12.789 -0.287 1.00 0.00 H new ATOM 0 HA3 GLY A 11 4.808 12.290 -1.555 1.00 0.00 H new ATOM 117 N GLN A 12 4.982 10.246 0.135 1.00 0.00 N ATOM 118 CA GLN A 12 4.992 8.881 0.648 1.00 0.00 C ATOM 119 C GLN A 12 3.577 8.317 0.721 1.00 0.00 C ATOM 120 O GLN A 12 2.608 9.002 0.396 1.00 0.00 O ATOM 121 CB GLN A 12 5.643 8.839 2.032 1.00 0.00 C ATOM 122 CG GLN A 12 7.109 9.240 2.028 1.00 0.00 C ATOM 123 CD GLN A 12 7.701 9.304 3.422 1.00 0.00 C ATOM 124 OE1 GLN A 12 7.955 8.275 4.049 1.00 0.00 O ATOM 125 NE2 GLN A 12 7.924 10.517 3.915 1.00 0.00 N ATOM 0 H GLN A 12 4.199 10.813 0.460 1.00 0.00 H new ATOM 0 HA GLN A 12 5.574 8.266 -0.038 1.00 0.00 H new ATOM 0 HB2 GLN A 12 5.096 9.502 2.702 1.00 0.00 H new ATOM 0 HB3 GLN A 12 5.552 7.831 2.437 1.00 0.00 H new ATOM 0 HG2 GLN A 12 7.675 8.526 1.430 1.00 0.00 H new ATOM 0 HG3 GLN A 12 7.214 10.213 1.548 1.00 0.00 H new ATOM 0 HE21 GLN A 12 7.698 11.342 3.360 1.00 0.00 H new ATOM 0 HE22 GLN A 12 8.321 10.623 4.849 1.00 0.00 H new ATOM 134 N ILE A 13 3.467 7.063 1.149 1.00 0.00 N ATOM 135 CA ILE A 13 2.171 6.408 1.264 1.00 0.00 C ATOM 136 C ILE A 13 2.277 5.117 2.070 1.00 0.00 C ATOM 137 O ILE A 13 3.182 4.312 1.852 1.00 0.00 O ATOM 138 CB ILE A 13 1.576 6.088 -0.120 1.00 0.00 C ATOM 139 CG1 ILE A 13 0.179 5.481 0.029 1.00 0.00 C ATOM 140 CG2 ILE A 13 2.491 5.143 -0.884 1.00 0.00 C ATOM 141 CD1 ILE A 13 -0.531 5.268 -1.290 1.00 0.00 C ATOM 0 H ILE A 13 4.260 6.482 1.421 1.00 0.00 H new ATOM 0 HA ILE A 13 1.511 7.104 1.782 1.00 0.00 H new ATOM 0 HB ILE A 13 1.490 7.016 -0.686 1.00 0.00 H new ATOM 0 HG12 ILE A 13 0.260 4.525 0.547 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -0.427 6.134 0.657 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.057 4.926 -1.860 1.00 0.00 H new ATOM 0 HG22 ILE A 13 3.467 5.610 -1.016 1.00 0.00 H new ATOM 0 HG23 ILE A 13 2.605 4.215 -0.324 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -1.515 4.835 -1.108 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.644 6.224 -1.801 1.00 0.00 H new ATOM 0 HD13 ILE A 13 0.054 4.591 -1.913 1.00 0.00 H new ATOM 153 N GLN A 14 1.346 4.927 2.998 1.00 0.00 N ATOM 154 CA GLN A 14 1.335 3.733 3.835 1.00 0.00 C ATOM 155 C GLN A 14 0.331 2.711 3.312 1.00 0.00 C ATOM 156 O GLN A 14 -0.877 2.953 3.316 1.00 0.00 O ATOM 157 CB GLN A 14 0.999 4.101 5.282 1.00 0.00 C ATOM 158 CG GLN A 14 1.618 3.166 6.307 1.00 0.00 C ATOM 159 CD GLN A 14 1.423 3.649 7.731 1.00 0.00 C ATOM 160 OE1 GLN A 14 0.480 4.385 8.025 1.00 0.00 O ATOM 161 NE2 GLN A 14 2.314 3.237 8.624 1.00 0.00 N ATOM 0 H GLN A 14 0.590 5.584 3.190 1.00 0.00 H new ATOM 0 HA GLN A 14 2.330 3.288 3.802 1.00 0.00 H new ATOM 0 HB2 GLN A 14 1.339 5.118 5.478 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -0.084 4.098 5.407 1.00 0.00 H new ATOM 0 HG2 GLN A 14 1.179 2.174 6.200 1.00 0.00 H new ATOM 0 HG3 GLN A 14 2.684 3.066 6.104 1.00 0.00 H new ATOM 0 HE21 GLN A 14 3.080 2.628 8.337 1.00 0.00 H new ATOM 0 HE22 GLN A 14 2.233 3.530 9.598 1.00 0.00 H new ATOM 170 N LEU A 15 0.838 1.568 2.863 1.00 0.00 N ATOM 171 CA LEU A 15 -0.014 0.508 2.336 1.00 0.00 C ATOM 172 C LEU A 15 0.343 -0.838 2.958 1.00 0.00 C ATOM 173 O LEU A 15 1.505 -1.248 2.953 1.00 0.00 O ATOM 174 CB LEU A 15 0.118 0.430 0.814 1.00 0.00 C ATOM 175 CG LEU A 15 -0.154 1.726 0.049 1.00 0.00 C ATOM 176 CD1 LEU A 15 0.268 1.587 -1.405 1.00 0.00 C ATOM 177 CD2 LEU A 15 -1.625 2.104 0.146 1.00 0.00 C ATOM 0 H LEU A 15 1.835 1.352 2.853 1.00 0.00 H new ATOM 0 HA LEU A 15 -1.046 0.744 2.594 1.00 0.00 H new ATOM 0 HB2 LEU A 15 1.127 0.095 0.574 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.568 -0.335 0.449 1.00 0.00 H new ATOM 0 HG LEU A 15 0.436 2.523 0.502 1.00 0.00 H new ATOM 0 HD11 LEU A 15 0.067 2.519 -1.933 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.334 1.365 -1.455 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -0.294 0.777 -1.871 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -1.800 3.029 -0.404 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -2.234 1.307 -0.280 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -1.896 2.247 1.192 1.00 0.00 H new ATOM 189 N THR A 16 -0.663 -1.524 3.492 1.00 0.00 N ATOM 190 CA THR A 16 -0.455 -2.824 4.117 1.00 0.00 C ATOM 191 C THR A 16 -0.776 -3.957 3.148 1.00 0.00 C ATOM 192 O THR A 16 -1.942 -4.269 2.907 1.00 0.00 O ATOM 193 CB THR A 16 -1.321 -2.984 5.381 1.00 0.00 C ATOM 194 OG1 THR A 16 -1.172 -1.838 6.226 1.00 0.00 O ATOM 195 CG2 THR A 16 -0.933 -4.240 6.147 1.00 0.00 C ATOM 0 H THR A 16 -1.630 -1.200 3.504 1.00 0.00 H new ATOM 0 HA THR A 16 0.597 -2.876 4.397 1.00 0.00 H new ATOM 0 HB THR A 16 -2.363 -3.073 5.072 1.00 0.00 H new ATOM 0 HG1 THR A 16 -0.412 -1.974 6.830 1.00 0.00 H new ATOM 0 HG21 THR A 16 -1.558 -4.332 7.035 1.00 0.00 H new ATOM 0 HG22 THR A 16 -1.076 -5.113 5.511 1.00 0.00 H new ATOM 0 HG23 THR A 16 0.114 -4.176 6.445 1.00 0.00 H new ATOM 203 N ILE A 17 0.267 -4.569 2.597 1.00 0.00 N ATOM 204 CA ILE A 17 0.095 -5.669 1.656 1.00 0.00 C ATOM 205 C ILE A 17 0.217 -7.017 2.358 1.00 0.00 C ATOM 206 O ILE A 17 1.215 -7.294 3.024 1.00 0.00 O ATOM 207 CB ILE A 17 1.129 -5.601 0.516 1.00 0.00 C ATOM 208 CG1 ILE A 17 1.011 -4.271 -0.231 1.00 0.00 C ATOM 209 CG2 ILE A 17 0.941 -6.770 -0.439 1.00 0.00 C ATOM 210 CD1 ILE A 17 2.113 -4.046 -1.242 1.00 0.00 C ATOM 0 H ILE A 17 1.239 -4.322 2.786 1.00 0.00 H new ATOM 0 HA ILE A 17 -0.906 -5.571 1.235 1.00 0.00 H new ATOM 0 HB ILE A 17 2.128 -5.666 0.947 1.00 0.00 H new ATOM 0 HG12 ILE A 17 0.048 -4.234 -0.741 1.00 0.00 H new ATOM 0 HG13 ILE A 17 1.020 -3.455 0.492 1.00 0.00 H new ATOM 0 HG21 ILE A 17 1.679 -6.708 -1.239 1.00 0.00 H new ATOM 0 HG22 ILE A 17 1.071 -7.707 0.103 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -0.061 -6.734 -0.866 1.00 0.00 H new ATOM 0 HD11 ILE A 17 1.965 -3.084 -1.733 1.00 0.00 H new ATOM 0 HD12 ILE A 17 3.078 -4.050 -0.735 1.00 0.00 H new ATOM 0 HD13 ILE A 17 2.091 -4.841 -1.987 1.00 0.00 H new ATOM 222 N ARG A 18 -0.805 -7.853 2.203 1.00 0.00 N ATOM 223 CA ARG A 18 -0.812 -9.174 2.822 1.00 0.00 C ATOM 224 C ARG A 18 -1.726 -10.127 2.058 1.00 0.00 C ATOM 225 O ARG A 18 -2.939 -9.920 1.990 1.00 0.00 O ATOM 226 CB ARG A 18 -1.265 -9.074 4.280 1.00 0.00 C ATOM 227 CG ARG A 18 -1.418 -10.423 4.963 1.00 0.00 C ATOM 228 CD ARG A 18 -2.455 -10.370 6.074 1.00 0.00 C ATOM 229 NE ARG A 18 -2.094 -9.410 7.114 1.00 0.00 N ATOM 230 CZ ARG A 18 -2.877 -9.114 8.145 1.00 0.00 C ATOM 231 NH1 ARG A 18 -4.060 -9.700 8.273 1.00 0.00 N ATOM 232 NH2 ARG A 18 -2.478 -8.230 9.050 1.00 0.00 N ATOM 0 H ARG A 18 -1.638 -7.639 1.655 1.00 0.00 H new ATOM 0 HA ARG A 18 0.203 -9.569 2.790 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -0.544 -8.474 4.836 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -2.217 -8.545 4.320 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -1.709 -11.173 4.228 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -0.458 -10.735 5.374 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -3.424 -10.101 5.653 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -2.563 -11.360 6.516 1.00 0.00 H new ATOM 0 HE ARG A 18 -1.191 -8.941 7.045 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -4.370 -10.380 7.579 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -4.659 -9.471 9.066 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -1.569 -7.777 8.954 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -3.080 -8.003 9.842 1.00 0.00 H new ATOM 246 N HIS A 19 -1.137 -11.171 1.483 1.00 0.00 N ATOM 247 CA HIS A 19 -1.899 -12.156 0.724 1.00 0.00 C ATOM 248 C HIS A 19 -2.217 -13.376 1.583 1.00 0.00 C ATOM 249 O HIS A 19 -1.341 -14.194 1.866 1.00 0.00 O ATOM 250 CB HIS A 19 -1.121 -12.583 -0.521 1.00 0.00 C ATOM 251 CG HIS A 19 -1.785 -13.681 -1.295 1.00 0.00 C ATOM 252 ND1 HIS A 19 -1.665 -15.014 -0.964 1.00 0.00 N ATOM 253 CD2 HIS A 19 -2.582 -13.636 -2.388 1.00 0.00 C ATOM 254 CE1 HIS A 19 -2.357 -15.742 -1.822 1.00 0.00 C ATOM 255 NE2 HIS A 19 -2.923 -14.930 -2.696 1.00 0.00 N ATOM 0 H HIS A 19 -0.135 -11.356 1.528 1.00 0.00 H new ATOM 0 HA HIS A 19 -2.838 -11.695 0.417 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -0.990 -11.719 -1.172 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -0.125 -12.911 -0.223 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -2.892 -12.748 -2.919 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -2.445 -16.818 -1.811 1.00 0.00 H new ATOM 0 HE2 HIS A 19 -3.517 -15.217 -3.474 1.00 0.00 H new ATOM 263 N SER A 20 -3.476 -13.492 1.995 1.00 0.00 N ATOM 264 CA SER A 20 -3.909 -14.609 2.825 1.00 0.00 C ATOM 265 C SER A 20 -3.891 -15.913 2.034 1.00 0.00 C ATOM 266 O SER A 20 -4.499 -16.013 0.968 1.00 0.00 O ATOM 267 CB SER A 20 -5.313 -14.351 3.373 1.00 0.00 C ATOM 268 OG SER A 20 -5.260 -13.645 4.601 1.00 0.00 O ATOM 0 H SER A 20 -4.214 -12.825 1.767 1.00 0.00 H new ATOM 0 HA SER A 20 -3.213 -14.701 3.659 1.00 0.00 H new ATOM 0 HB2 SER A 20 -5.891 -13.780 2.646 1.00 0.00 H new ATOM 0 HB3 SER A 20 -5.830 -15.299 3.517 1.00 0.00 H new ATOM 0 HG SER A 20 -6.170 -13.491 4.929 1.00 0.00 H new ATOM 274 N SER A 21 -3.190 -16.910 2.563 1.00 0.00 N ATOM 275 CA SER A 21 -3.089 -18.208 1.905 1.00 0.00 C ATOM 276 C SER A 21 -4.441 -18.913 1.885 1.00 0.00 C ATOM 277 O SER A 21 -4.933 -19.304 0.827 1.00 0.00 O ATOM 278 CB SER A 21 -2.054 -19.084 2.614 1.00 0.00 C ATOM 279 OG SER A 21 -2.385 -19.259 3.981 1.00 0.00 O ATOM 0 H SER A 21 -2.683 -16.844 3.446 1.00 0.00 H new ATOM 0 HA SER A 21 -2.770 -18.042 0.876 1.00 0.00 H new ATOM 0 HB2 SER A 21 -1.998 -20.055 2.123 1.00 0.00 H new ATOM 0 HB3 SER A 21 -1.068 -18.627 2.531 1.00 0.00 H new ATOM 0 HG SER A 21 -1.710 -19.824 4.411 1.00 0.00 H new ATOM 285 N GLN A 22 -5.036 -19.073 3.063 1.00 0.00 N ATOM 286 CA GLN A 22 -6.331 -19.732 3.181 1.00 0.00 C ATOM 287 C GLN A 22 -7.370 -19.054 2.294 1.00 0.00 C ATOM 288 O GLN A 22 -8.149 -19.721 1.613 1.00 0.00 O ATOM 289 CB GLN A 22 -6.802 -19.721 4.637 1.00 0.00 C ATOM 290 CG GLN A 22 -7.796 -20.823 4.963 1.00 0.00 C ATOM 291 CD GLN A 22 -7.917 -21.079 6.452 1.00 0.00 C ATOM 292 OE1 GLN A 22 -6.984 -21.573 7.086 1.00 0.00 O ATOM 293 NE2 GLN A 22 -9.069 -20.743 7.020 1.00 0.00 N ATOM 0 H GLN A 22 -4.642 -18.755 3.949 1.00 0.00 H new ATOM 0 HA GLN A 22 -6.216 -20.764 2.851 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -5.936 -19.819 5.291 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -7.258 -18.755 4.855 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -8.774 -20.554 4.564 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -7.490 -21.742 4.464 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -9.816 -20.336 6.457 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -9.207 -20.892 8.020 1.00 0.00 H new ATOM 302 N ARG A 23 -7.376 -17.725 2.308 1.00 0.00 N ATOM 303 CA ARG A 23 -8.320 -16.957 1.505 1.00 0.00 C ATOM 304 C ARG A 23 -7.795 -16.761 0.086 1.00 0.00 C ATOM 305 O ARG A 23 -8.551 -16.433 -0.827 1.00 0.00 O ATOM 306 CB ARG A 23 -8.587 -15.598 2.155 1.00 0.00 C ATOM 307 CG ARG A 23 -9.505 -15.669 3.363 1.00 0.00 C ATOM 308 CD ARG A 23 -10.965 -15.766 2.948 1.00 0.00 C ATOM 309 NE ARG A 23 -11.867 -15.690 4.094 1.00 0.00 N ATOM 310 CZ ARG A 23 -13.184 -15.831 4.004 1.00 0.00 C ATOM 311 NH1 ARG A 23 -13.751 -16.056 2.827 1.00 0.00 N ATOM 312 NH2 ARG A 23 -13.938 -15.749 5.093 1.00 0.00 N ATOM 0 H ARG A 23 -6.738 -17.158 2.866 1.00 0.00 H new ATOM 0 HA ARG A 23 -9.254 -17.517 1.453 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -7.637 -15.157 2.457 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -9.027 -14.931 1.414 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -9.241 -16.533 3.972 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -9.360 -14.785 3.984 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -11.197 -14.962 2.250 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -11.130 -16.705 2.419 1.00 0.00 H new ATOM 0 HE ARG A 23 -11.463 -15.519 5.015 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -13.175 -16.121 1.988 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -14.763 -16.164 2.761 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -13.506 -15.577 6.001 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -14.950 -15.858 5.022 1.00 0.00 H new ATOM 326 N ASN A 24 -6.493 -16.963 -0.090 1.00 0.00 N ATOM 327 CA ASN A 24 -5.866 -16.808 -1.397 1.00 0.00 C ATOM 328 C ASN A 24 -6.315 -15.512 -2.066 1.00 0.00 C ATOM 329 O ASN A 24 -6.626 -15.490 -3.257 1.00 0.00 O ATOM 330 CB ASN A 24 -6.203 -18.001 -2.294 1.00 0.00 C ATOM 331 CG ASN A 24 -7.697 -18.242 -2.397 1.00 0.00 C ATOM 332 OD1 ASN A 24 -8.300 -18.856 -1.517 1.00 0.00 O ATOM 333 ND2 ASN A 24 -8.301 -17.758 -3.476 1.00 0.00 N ATOM 0 H ASN A 24 -5.852 -17.234 0.656 1.00 0.00 H new ATOM 0 HA ASN A 24 -4.787 -16.766 -1.251 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -5.796 -17.830 -3.290 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -5.719 -18.896 -1.901 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -9.305 -17.889 -3.600 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -7.761 -17.255 -4.180 1.00 0.00 H new ATOM 340 N LYS A 25 -6.347 -14.433 -1.291 1.00 0.00 N ATOM 341 CA LYS A 25 -6.756 -13.132 -1.807 1.00 0.00 C ATOM 342 C LYS A 25 -5.697 -12.074 -1.515 1.00 0.00 C ATOM 343 O LYS A 25 -4.897 -12.220 -0.590 1.00 0.00 O ATOM 344 CB LYS A 25 -8.093 -12.714 -1.191 1.00 0.00 C ATOM 345 CG LYS A 25 -9.263 -13.575 -1.636 1.00 0.00 C ATOM 346 CD LYS A 25 -10.559 -12.782 -1.666 1.00 0.00 C ATOM 347 CE LYS A 25 -11.764 -13.673 -1.406 1.00 0.00 C ATOM 348 NZ LYS A 25 -13.009 -13.108 -1.996 1.00 0.00 N ATOM 0 H LYS A 25 -6.094 -14.434 -0.303 1.00 0.00 H new ATOM 0 HA LYS A 25 -6.871 -13.217 -2.888 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.013 -12.758 -0.105 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.296 -11.676 -1.454 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -9.061 -13.981 -2.627 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -9.370 -14.423 -0.960 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.521 -11.992 -0.916 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.667 -12.296 -2.636 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.581 -14.663 -1.824 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -11.897 -13.800 -0.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.807 -13.744 -1.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.198 -12.174 -1.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.892 -13.010 -3.025 1.00 0.00 H new ATOM 362 N LEU A 26 -5.699 -11.008 -2.308 1.00 0.00 N ATOM 363 CA LEU A 26 -4.739 -9.923 -2.134 1.00 0.00 C ATOM 364 C LEU A 26 -5.380 -8.738 -1.418 1.00 0.00 C ATOM 365 O LEU A 26 -6.127 -7.967 -2.021 1.00 0.00 O ATOM 366 CB LEU A 26 -4.190 -9.479 -3.491 1.00 0.00 C ATOM 367 CG LEU A 26 -3.047 -8.463 -3.452 1.00 0.00 C ATOM 368 CD1 LEU A 26 -1.748 -9.137 -3.040 1.00 0.00 C ATOM 369 CD2 LEU A 26 -2.892 -7.784 -4.805 1.00 0.00 C ATOM 0 H LEU A 26 -6.354 -10.872 -3.078 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.917 -10.292 -1.520 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -3.846 -10.363 -4.028 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -5.009 -9.053 -4.070 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.288 -7.701 -2.711 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -0.946 -8.399 -3.018 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -1.864 -9.576 -2.049 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -1.501 -9.920 -3.757 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -2.075 -7.064 -4.759 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -2.673 -8.534 -5.565 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.817 -7.267 -5.061 1.00 0.00 H new ATOM 381 N ILE A 27 -5.081 -8.599 -0.131 1.00 0.00 N ATOM 382 CA ILE A 27 -5.625 -7.506 0.665 1.00 0.00 C ATOM 383 C ILE A 27 -4.683 -6.307 0.669 1.00 0.00 C ATOM 384 O ILE A 27 -3.488 -6.443 0.931 1.00 0.00 O ATOM 385 CB ILE A 27 -5.888 -7.944 2.118 1.00 0.00 C ATOM 386 CG1 ILE A 27 -6.921 -9.071 2.155 1.00 0.00 C ATOM 387 CG2 ILE A 27 -6.356 -6.760 2.951 1.00 0.00 C ATOM 388 CD1 ILE A 27 -6.328 -10.443 1.920 1.00 0.00 C ATOM 0 H ILE A 27 -4.465 -9.229 0.383 1.00 0.00 H new ATOM 0 HA ILE A 27 -6.571 -7.220 0.204 1.00 0.00 H new ATOM 0 HB ILE A 27 -4.957 -8.317 2.544 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -7.422 -9.062 3.123 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -7.683 -8.879 1.400 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -6.538 -7.085 3.975 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -5.588 -5.986 2.947 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -7.277 -6.359 2.528 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -7.118 -11.193 1.960 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -5.851 -10.470 0.940 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -5.587 -10.656 2.690 1.00 0.00 H new ATOM 400 N VAL A 28 -5.230 -5.130 0.379 1.00 0.00 N ATOM 401 CA VAL A 28 -4.440 -3.905 0.352 1.00 0.00 C ATOM 402 C VAL A 28 -5.179 -2.759 1.033 1.00 0.00 C ATOM 403 O VAL A 28 -6.135 -2.210 0.485 1.00 0.00 O ATOM 404 CB VAL A 28 -4.093 -3.493 -1.091 1.00 0.00 C ATOM 405 CG1 VAL A 28 -3.173 -2.282 -1.093 1.00 0.00 C ATOM 406 CG2 VAL A 28 -3.459 -4.655 -1.839 1.00 0.00 C ATOM 0 H VAL A 28 -6.218 -5.000 0.159 1.00 0.00 H new ATOM 0 HA VAL A 28 -3.518 -4.111 0.895 1.00 0.00 H new ATOM 0 HB VAL A 28 -5.015 -3.220 -1.604 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -2.938 -2.005 -2.121 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -3.669 -1.448 -0.596 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -2.252 -2.524 -0.563 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -3.220 -4.346 -2.857 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -2.545 -4.961 -1.329 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -4.156 -5.493 -1.868 1.00 0.00 H new ATOM 416 N VAL A 29 -4.730 -2.402 2.232 1.00 0.00 N ATOM 417 CA VAL A 29 -5.348 -1.320 2.989 1.00 0.00 C ATOM 418 C VAL A 29 -4.632 0.003 2.741 1.00 0.00 C ATOM 419 O VAL A 29 -3.403 0.056 2.691 1.00 0.00 O ATOM 420 CB VAL A 29 -5.344 -1.617 4.500 1.00 0.00 C ATOM 421 CG1 VAL A 29 -6.155 -0.573 5.252 1.00 0.00 C ATOM 422 CG2 VAL A 29 -5.880 -3.016 4.769 1.00 0.00 C ATOM 0 H VAL A 29 -3.940 -2.846 2.700 1.00 0.00 H new ATOM 0 HA VAL A 29 -6.379 -1.243 2.645 1.00 0.00 H new ATOM 0 HB VAL A 29 -4.316 -1.571 4.859 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -6.141 -0.800 6.318 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -5.722 0.413 5.085 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -7.184 -0.584 4.893 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -5.870 -3.209 5.842 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -6.901 -3.092 4.396 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -5.253 -3.750 4.262 1.00 0.00 H new ATOM 432 N VAL A 30 -5.408 1.070 2.585 1.00 0.00 N ATOM 433 CA VAL A 30 -4.848 2.395 2.344 1.00 0.00 C ATOM 434 C VAL A 30 -5.199 3.355 3.475 1.00 0.00 C ATOM 435 O VAL A 30 -6.282 3.942 3.492 1.00 0.00 O ATOM 436 CB VAL A 30 -5.351 2.982 1.012 1.00 0.00 C ATOM 437 CG1 VAL A 30 -4.592 4.255 0.669 1.00 0.00 C ATOM 438 CG2 VAL A 30 -5.221 1.957 -0.105 1.00 0.00 C ATOM 0 H VAL A 30 -6.427 1.043 2.621 1.00 0.00 H new ATOM 0 HA VAL A 30 -3.765 2.277 2.295 1.00 0.00 H new ATOM 0 HB VAL A 30 -6.406 3.234 1.122 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -4.961 4.655 -0.275 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.741 4.992 1.459 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -3.529 4.031 0.578 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -5.581 2.389 -1.039 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -4.175 1.671 -0.217 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -5.814 1.075 0.139 1.00 0.00 H new ATOM 448 N HIS A 31 -4.277 3.511 4.419 1.00 0.00 N ATOM 449 CA HIS A 31 -4.489 4.401 5.555 1.00 0.00 C ATOM 450 C HIS A 31 -4.641 5.847 5.091 1.00 0.00 C ATOM 451 O HIS A 31 -5.744 6.393 5.081 1.00 0.00 O ATOM 452 CB HIS A 31 -3.326 4.290 6.541 1.00 0.00 C ATOM 453 CG HIS A 31 -3.108 2.901 7.056 1.00 0.00 C ATOM 454 ND1 HIS A 31 -3.869 2.344 8.062 1.00 0.00 N ATOM 455 CD2 HIS A 31 -2.210 1.954 6.698 1.00 0.00 C ATOM 456 CE1 HIS A 31 -3.447 1.115 8.301 1.00 0.00 C ATOM 457 NE2 HIS A 31 -2.441 0.854 7.486 1.00 0.00 N ATOM 0 H HIS A 31 -3.376 3.033 4.420 1.00 0.00 H new ATOM 0 HA HIS A 31 -5.409 4.099 6.055 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -2.414 4.636 6.055 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -3.510 4.956 7.384 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -1.452 2.047 5.934 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -3.855 0.439 9.038 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -1.920 -0.022 7.448 1.00 0.00 H new ATOM 465 N ALA A 32 -3.526 6.461 4.708 1.00 0.00 N ATOM 466 CA ALA A 32 -3.537 7.842 4.242 1.00 0.00 C ATOM 467 C ALA A 32 -2.176 8.243 3.682 1.00 0.00 C ATOM 468 O ALA A 32 -1.168 7.587 3.947 1.00 0.00 O ATOM 469 CB ALA A 32 -3.941 8.777 5.372 1.00 0.00 C ATOM 0 H ALA A 32 -2.604 6.024 4.711 1.00 0.00 H new ATOM 0 HA ALA A 32 -4.270 7.923 3.439 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -3.945 9.805 5.010 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -4.938 8.513 5.724 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -3.230 8.684 6.193 1.00 0.00 H new ATOM 475 N CYS A 33 -2.154 9.321 2.907 1.00 0.00 N ATOM 476 CA CYS A 33 -0.917 9.808 2.309 1.00 0.00 C ATOM 477 C CYS A 33 -0.436 11.075 3.009 1.00 0.00 C ATOM 478 O CYS A 33 -1.168 11.679 3.793 1.00 0.00 O ATOM 479 CB CYS A 33 -1.120 10.081 0.817 1.00 0.00 C ATOM 480 SG CYS A 33 -1.096 8.596 -0.214 1.00 0.00 S ATOM 0 H CYS A 33 -2.979 9.875 2.678 1.00 0.00 H new ATOM 0 HA CYS A 33 -0.156 9.037 2.430 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -2.073 10.591 0.678 1.00 0.00 H new ATOM 0 HB3 CYS A 33 -0.341 10.762 0.474 1.00 0.00 H new ATOM 0 HG CYS A 33 -1.278 8.928 -1.458 1.00 0.00 H new ATOM 486 N ARG A 34 0.800 11.471 2.721 1.00 0.00 N ATOM 487 CA ARG A 34 1.380 12.664 3.325 1.00 0.00 C ATOM 488 C ARG A 34 2.488 13.236 2.445 1.00 0.00 C ATOM 489 O ARG A 34 3.187 12.498 1.752 1.00 0.00 O ATOM 490 CB ARG A 34 1.933 12.341 4.714 1.00 0.00 C ATOM 491 CG ARG A 34 2.973 11.232 4.712 1.00 0.00 C ATOM 492 CD ARG A 34 3.334 10.806 6.127 1.00 0.00 C ATOM 493 NE ARG A 34 4.618 10.111 6.178 1.00 0.00 N ATOM 494 CZ ARG A 34 5.283 9.878 7.303 1.00 0.00 C ATOM 495 NH1 ARG A 34 4.788 10.280 8.466 1.00 0.00 N ATOM 496 NH2 ARG A 34 6.446 9.239 7.268 1.00 0.00 N ATOM 0 H ARG A 34 1.418 10.983 2.073 1.00 0.00 H new ATOM 0 HA ARG A 34 0.593 13.412 3.420 1.00 0.00 H new ATOM 0 HB2 ARG A 34 2.376 13.242 5.138 1.00 0.00 H new ATOM 0 HB3 ARG A 34 1.108 12.053 5.366 1.00 0.00 H new ATOM 0 HG2 ARG A 34 2.591 10.374 4.159 1.00 0.00 H new ATOM 0 HG3 ARG A 34 3.869 11.573 4.193 1.00 0.00 H new ATOM 0 HD2 ARG A 34 3.371 11.684 6.772 1.00 0.00 H new ATOM 0 HD3 ARG A 34 2.553 10.155 6.520 1.00 0.00 H new ATOM 0 HE ARG A 34 5.026 9.787 5.301 1.00 0.00 H new ATOM 0 HH11 ARG A 34 3.894 10.770 8.498 1.00 0.00 H new ATOM 0 HH12 ARG A 34 5.301 10.099 9.329 1.00 0.00 H new ATOM 0 HH21 ARG A 34 6.830 8.926 6.376 1.00 0.00 H new ATOM 0 HH22 ARG A 34 6.956 9.061 8.133 1.00 0.00 H new ATOM 510 N ASN A 35 2.640 14.556 2.477 1.00 0.00 N ATOM 511 CA ASN A 35 3.662 15.227 1.681 1.00 0.00 C ATOM 512 C ASN A 35 3.442 14.977 0.192 1.00 0.00 C ATOM 513 O ASN A 35 4.348 14.533 -0.514 1.00 0.00 O ATOM 514 CB ASN A 35 5.055 14.744 2.091 1.00 0.00 C ATOM 515 CG ASN A 35 5.417 15.156 3.505 1.00 0.00 C ATOM 516 OD1 ASN A 35 5.678 16.328 3.774 1.00 0.00 O ATOM 517 ND2 ASN A 35 5.434 14.189 4.416 1.00 0.00 N ATOM 0 H ASN A 35 2.069 15.182 3.045 1.00 0.00 H new ATOM 0 HA ASN A 35 3.587 16.299 1.866 1.00 0.00 H new ATOM 0 HB2 ASN A 35 5.099 13.658 2.010 1.00 0.00 H new ATOM 0 HB3 ASN A 35 5.794 15.145 1.398 1.00 0.00 H new ATOM 0 HD21 ASN A 35 5.670 14.405 5.384 1.00 0.00 H new ATOM 0 HD22 ASN A 35 5.211 13.231 4.147 1.00 0.00 H new ATOM 524 N LEU A 36 2.235 15.267 -0.279 1.00 0.00 N ATOM 525 CA LEU A 36 1.895 15.076 -1.685 1.00 0.00 C ATOM 526 C LEU A 36 1.977 16.393 -2.449 1.00 0.00 C ATOM 527 O LEU A 36 0.984 17.110 -2.577 1.00 0.00 O ATOM 528 CB LEU A 36 0.491 14.484 -1.814 1.00 0.00 C ATOM 529 CG LEU A 36 0.340 13.017 -1.407 1.00 0.00 C ATOM 530 CD1 LEU A 36 -1.099 12.560 -1.582 1.00 0.00 C ATOM 531 CD2 LEU A 36 1.283 12.140 -2.218 1.00 0.00 C ATOM 0 H LEU A 36 1.474 15.636 0.292 1.00 0.00 H new ATOM 0 HA LEU A 36 2.616 14.382 -2.117 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -0.190 15.080 -1.207 1.00 0.00 H new ATOM 0 HB3 LEU A 36 0.169 14.588 -2.850 1.00 0.00 H new ATOM 0 HG LEU A 36 0.603 12.923 -0.353 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -1.187 11.514 -1.288 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -1.753 13.169 -0.958 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -1.391 12.669 -2.627 1.00 0.00 H new ATOM 0 HD21 LEU A 36 1.163 11.100 -1.916 1.00 0.00 H new ATOM 0 HD22 LEU A 36 1.050 12.239 -3.278 1.00 0.00 H new ATOM 0 HD23 LEU A 36 2.312 12.452 -2.042 1.00 0.00 H new ATOM 543 N ILE A 37 3.165 16.704 -2.956 1.00 0.00 N ATOM 544 CA ILE A 37 3.374 17.934 -3.711 1.00 0.00 C ATOM 545 C ILE A 37 2.122 18.321 -4.489 1.00 0.00 C ATOM 546 O ILE A 37 1.422 17.463 -5.026 1.00 0.00 O ATOM 547 CB ILE A 37 4.554 17.798 -4.692 1.00 0.00 C ATOM 548 CG1 ILE A 37 4.268 16.699 -5.717 1.00 0.00 C ATOM 549 CG2 ILE A 37 5.841 17.503 -3.936 1.00 0.00 C ATOM 550 CD1 ILE A 37 3.570 17.200 -6.962 1.00 0.00 C ATOM 0 H ILE A 37 3.997 16.122 -2.858 1.00 0.00 H new ATOM 0 HA ILE A 37 3.603 18.715 -2.986 1.00 0.00 H new ATOM 0 HB ILE A 37 4.677 18.742 -5.223 1.00 0.00 H new ATOM 0 HG12 ILE A 37 5.208 16.226 -6.003 1.00 0.00 H new ATOM 0 HG13 ILE A 37 3.653 15.929 -5.250 1.00 0.00 H new ATOM 0 HG21 ILE A 37 6.665 17.410 -4.643 1.00 0.00 H new ATOM 0 HG22 ILE A 37 6.049 18.316 -3.241 1.00 0.00 H new ATOM 0 HG23 ILE A 37 5.732 16.571 -3.381 1.00 0.00 H new ATOM 0 HD11 ILE A 37 3.399 16.367 -7.644 1.00 0.00 H new ATOM 0 HD12 ILE A 37 2.614 17.647 -6.688 1.00 0.00 H new ATOM 0 HD13 ILE A 37 4.193 17.948 -7.452 1.00 0.00 H new ATOM 562 N ALA A 38 1.846 19.620 -4.548 1.00 0.00 N ATOM 563 CA ALA A 38 0.680 20.122 -5.264 1.00 0.00 C ATOM 564 C ALA A 38 1.095 20.970 -6.462 1.00 0.00 C ATOM 565 O ALA A 38 1.672 22.046 -6.303 1.00 0.00 O ATOM 566 CB ALA A 38 -0.208 20.927 -4.328 1.00 0.00 C ATOM 0 H ALA A 38 2.415 20.344 -4.108 1.00 0.00 H new ATOM 0 HA ALA A 38 0.116 19.266 -5.635 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -1.075 21.296 -4.876 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -0.541 20.292 -3.507 1.00 0.00 H new ATOM 0 HB3 ALA A 38 0.355 21.771 -3.929 1.00 0.00 H new ATOM 572 N PHE A 39 0.798 20.479 -7.660 1.00 0.00 N ATOM 573 CA PHE A 39 1.142 21.191 -8.885 1.00 0.00 C ATOM 574 C PHE A 39 0.948 22.695 -8.713 1.00 0.00 C ATOM 575 O PHE A 39 1.712 23.496 -9.251 1.00 0.00 O ATOM 576 CB PHE A 39 0.289 20.686 -10.051 1.00 0.00 C ATOM 577 CG PHE A 39 0.967 20.804 -11.386 1.00 0.00 C ATOM 578 CD1 PHE A 39 1.033 22.024 -12.039 1.00 0.00 C ATOM 579 CD2 PHE A 39 1.540 19.695 -11.987 1.00 0.00 C ATOM 580 CE1 PHE A 39 1.656 22.135 -13.267 1.00 0.00 C ATOM 581 CE2 PHE A 39 2.165 19.800 -13.216 1.00 0.00 C ATOM 582 CZ PHE A 39 2.224 21.022 -13.856 1.00 0.00 C ATOM 0 H PHE A 39 0.320 19.591 -7.809 1.00 0.00 H new ATOM 0 HA PHE A 39 2.193 21.000 -9.103 1.00 0.00 H new ATOM 0 HB2 PHE A 39 0.030 19.642 -9.875 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -0.645 21.247 -10.076 1.00 0.00 H new ATOM 0 HD1 PHE A 39 0.592 22.898 -11.583 1.00 0.00 H new ATOM 0 HD2 PHE A 39 1.498 18.737 -11.490 1.00 0.00 H new ATOM 0 HE1 PHE A 39 1.699 23.092 -13.766 1.00 0.00 H new ATOM 0 HE2 PHE A 39 2.606 18.927 -13.675 1.00 0.00 H new ATOM 0 HZ PHE A 39 2.713 21.108 -14.815 1.00 0.00 H new ATOM 592 N SER A 40 -0.080 23.070 -7.959 1.00 0.00 N ATOM 593 CA SER A 40 -0.378 24.477 -7.718 1.00 0.00 C ATOM 594 C SER A 40 -0.786 24.705 -6.266 1.00 0.00 C ATOM 595 O SER A 40 -1.744 24.107 -5.778 1.00 0.00 O ATOM 596 CB SER A 40 -1.492 24.951 -8.653 1.00 0.00 C ATOM 597 OG SER A 40 -1.840 26.299 -8.389 1.00 0.00 O ATOM 0 H SER A 40 -0.721 22.419 -7.504 1.00 0.00 H new ATOM 0 HA SER A 40 0.525 25.054 -7.918 1.00 0.00 H new ATOM 0 HB2 SER A 40 -1.168 24.852 -9.689 1.00 0.00 H new ATOM 0 HB3 SER A 40 -2.369 24.315 -8.531 1.00 0.00 H new ATOM 0 HG SER A 40 -2.553 26.579 -9.001 1.00 0.00 H new ATOM 603 N GLU A 41 -0.050 25.575 -5.581 1.00 0.00 N ATOM 604 CA GLU A 41 -0.335 25.882 -4.184 1.00 0.00 C ATOM 605 C GLU A 41 -1.836 26.036 -3.955 1.00 0.00 C ATOM 606 O GLU A 41 -2.337 25.776 -2.861 1.00 0.00 O ATOM 607 CB GLU A 41 0.390 27.162 -3.762 1.00 0.00 C ATOM 608 CG GLU A 41 0.046 28.368 -4.620 1.00 0.00 C ATOM 609 CD GLU A 41 0.438 29.679 -3.968 1.00 0.00 C ATOM 610 OE1 GLU A 41 0.295 29.793 -2.733 1.00 0.00 O ATOM 611 OE2 GLU A 41 0.888 30.592 -4.693 1.00 0.00 O ATOM 0 H GLU A 41 0.747 26.079 -5.970 1.00 0.00 H new ATOM 0 HA GLU A 41 0.024 25.052 -3.576 1.00 0.00 H new ATOM 0 HB2 GLU A 41 0.144 27.383 -2.724 1.00 0.00 H new ATOM 0 HB3 GLU A 41 1.466 26.991 -3.805 1.00 0.00 H new ATOM 0 HG2 GLU A 41 0.550 28.280 -5.582 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -1.025 28.373 -4.821 1.00 0.00 H new ATOM 618 N ASP A 42 -2.546 26.460 -4.995 1.00 0.00 N ATOM 619 CA ASP A 42 -3.989 26.648 -4.908 1.00 0.00 C ATOM 620 C ASP A 42 -4.671 25.389 -4.383 1.00 0.00 C ATOM 621 O ASP A 42 -5.567 25.460 -3.543 1.00 0.00 O ATOM 622 CB ASP A 42 -4.560 27.019 -6.279 1.00 0.00 C ATOM 623 CG ASP A 42 -6.069 27.154 -6.260 1.00 0.00 C ATOM 624 OD1 ASP A 42 -6.758 26.113 -6.231 1.00 0.00 O ATOM 625 OD2 ASP A 42 -6.563 28.301 -6.276 1.00 0.00 O ATOM 0 H ASP A 42 -2.146 26.680 -5.907 1.00 0.00 H new ATOM 0 HA ASP A 42 -4.183 27.462 -4.210 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -4.118 27.958 -6.611 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -4.275 26.258 -7.006 1.00 0.00 H new ATOM 630 N GLY A 43 -4.241 24.235 -4.886 1.00 0.00 N ATOM 631 CA GLY A 43 -4.822 22.977 -4.458 1.00 0.00 C ATOM 632 C GLY A 43 -4.866 21.949 -5.571 1.00 0.00 C ATOM 633 O GLY A 43 -5.313 22.244 -6.680 1.00 0.00 O ATOM 0 H GLY A 43 -3.501 24.150 -5.582 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -4.245 22.579 -3.623 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -5.833 23.154 -4.091 1.00 0.00 H new ATOM 637 N SER A 44 -4.400 20.740 -5.277 1.00 0.00 N ATOM 638 CA SER A 44 -4.383 19.666 -6.264 1.00 0.00 C ATOM 639 C SER A 44 -5.402 18.587 -5.910 1.00 0.00 C ATOM 640 O SER A 44 -6.042 18.642 -4.860 1.00 0.00 O ATOM 641 CB SER A 44 -2.985 19.053 -6.358 1.00 0.00 C ATOM 642 OG SER A 44 -2.193 19.732 -7.317 1.00 0.00 O ATOM 0 H SER A 44 -4.029 20.479 -4.363 1.00 0.00 H new ATOM 0 HA SER A 44 -4.651 20.091 -7.232 1.00 0.00 H new ATOM 0 HB2 SER A 44 -2.499 19.097 -5.383 1.00 0.00 H new ATOM 0 HB3 SER A 44 -3.064 18.000 -6.627 1.00 0.00 H new ATOM 0 HG SER A 44 -1.660 19.082 -7.820 1.00 0.00 H new ATOM 648 N ASP A 45 -5.546 17.606 -6.794 1.00 0.00 N ATOM 649 CA ASP A 45 -6.485 16.512 -6.576 1.00 0.00 C ATOM 650 C ASP A 45 -5.747 15.187 -6.408 1.00 0.00 C ATOM 651 O ASP A 45 -5.672 14.370 -7.326 1.00 0.00 O ATOM 652 CB ASP A 45 -7.470 16.417 -7.743 1.00 0.00 C ATOM 653 CG ASP A 45 -7.810 17.775 -8.325 1.00 0.00 C ATOM 654 OD1 ASP A 45 -7.843 18.759 -7.557 1.00 0.00 O ATOM 655 OD2 ASP A 45 -8.044 17.854 -9.549 1.00 0.00 O ATOM 0 H ASP A 45 -5.024 17.546 -7.668 1.00 0.00 H new ATOM 0 HA ASP A 45 -7.038 16.718 -5.659 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -7.044 15.787 -8.524 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -8.385 15.931 -7.404 1.00 0.00 H new ATOM 660 N PRO A 46 -5.189 14.969 -5.209 1.00 0.00 N ATOM 661 CA PRO A 46 -4.447 13.745 -4.892 1.00 0.00 C ATOM 662 C PRO A 46 -5.355 12.523 -4.801 1.00 0.00 C ATOM 663 O PRO A 46 -6.415 12.571 -4.178 1.00 0.00 O ATOM 664 CB PRO A 46 -3.824 14.051 -3.528 1.00 0.00 C ATOM 665 CG PRO A 46 -4.720 15.075 -2.923 1.00 0.00 C ATOM 666 CD PRO A 46 -5.240 15.899 -4.068 1.00 0.00 C ATOM 0 HA PRO A 46 -3.717 13.500 -5.664 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -3.770 13.156 -2.908 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -2.807 14.428 -3.633 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -5.538 14.604 -2.378 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -4.177 15.696 -2.210 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -6.255 16.251 -3.882 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -4.623 16.781 -4.241 1.00 0.00 H new ATOM 674 N TYR A 47 -4.932 11.430 -5.427 1.00 0.00 N ATOM 675 CA TYR A 47 -5.708 10.196 -5.418 1.00 0.00 C ATOM 676 C TYR A 47 -4.833 8.999 -5.777 1.00 0.00 C ATOM 677 O TYR A 47 -4.027 9.061 -6.706 1.00 0.00 O ATOM 678 CB TYR A 47 -6.879 10.298 -6.397 1.00 0.00 C ATOM 679 CG TYR A 47 -6.556 9.788 -7.783 1.00 0.00 C ATOM 680 CD1 TYR A 47 -5.799 10.549 -8.666 1.00 0.00 C ATOM 681 CD2 TYR A 47 -7.006 8.545 -8.209 1.00 0.00 C ATOM 682 CE1 TYR A 47 -5.502 10.087 -9.933 1.00 0.00 C ATOM 683 CE2 TYR A 47 -6.713 8.074 -9.475 1.00 0.00 C ATOM 684 CZ TYR A 47 -5.961 8.849 -10.333 1.00 0.00 C ATOM 685 OH TYR A 47 -5.666 8.385 -11.594 1.00 0.00 O ATOM 0 H TYR A 47 -4.056 11.374 -5.947 1.00 0.00 H new ATOM 0 HA TYR A 47 -6.097 10.049 -4.410 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -7.724 9.735 -6.000 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -7.194 11.339 -6.466 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -5.437 11.518 -8.356 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -7.595 7.936 -7.539 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -4.914 10.692 -10.607 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -7.071 7.105 -9.790 1.00 0.00 H new ATOM 0 HH TYR A 47 -6.063 7.497 -11.717 1.00 0.00 H new ATOM 695 N VAL A 48 -4.999 7.909 -5.035 1.00 0.00 N ATOM 696 CA VAL A 48 -4.227 6.696 -5.275 1.00 0.00 C ATOM 697 C VAL A 48 -4.912 5.802 -6.302 1.00 0.00 C ATOM 698 O VAL A 48 -6.115 5.920 -6.539 1.00 0.00 O ATOM 699 CB VAL A 48 -4.017 5.898 -3.975 1.00 0.00 C ATOM 700 CG1 VAL A 48 -3.084 4.720 -4.215 1.00 0.00 C ATOM 701 CG2 VAL A 48 -3.476 6.801 -2.877 1.00 0.00 C ATOM 0 H VAL A 48 -5.661 7.841 -4.262 1.00 0.00 H new ATOM 0 HA VAL A 48 -3.257 7.010 -5.661 1.00 0.00 H new ATOM 0 HB VAL A 48 -4.981 5.507 -3.651 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -2.948 4.168 -3.285 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -3.516 4.061 -4.968 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.119 5.086 -4.564 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -3.334 6.220 -1.966 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -2.522 7.224 -3.191 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.185 7.607 -2.687 1.00 0.00 H new ATOM 711 N ARG A 49 -4.140 4.907 -6.909 1.00 0.00 N ATOM 712 CA ARG A 49 -4.673 3.993 -7.912 1.00 0.00 C ATOM 713 C ARG A 49 -3.979 2.636 -7.834 1.00 0.00 C ATOM 714 O ARG A 49 -2.751 2.556 -7.815 1.00 0.00 O ATOM 715 CB ARG A 49 -4.504 4.584 -9.313 1.00 0.00 C ATOM 716 CG ARG A 49 -4.752 3.584 -10.430 1.00 0.00 C ATOM 717 CD ARG A 49 -4.135 4.048 -11.740 1.00 0.00 C ATOM 718 NE ARG A 49 -5.041 4.907 -12.498 1.00 0.00 N ATOM 719 CZ ARG A 49 -4.910 5.148 -13.797 1.00 0.00 C ATOM 720 NH1 ARG A 49 -3.917 4.597 -14.481 1.00 0.00 N ATOM 721 NH2 ARG A 49 -5.775 5.942 -14.416 1.00 0.00 N ATOM 0 H ARG A 49 -3.143 4.795 -6.724 1.00 0.00 H new ATOM 0 HA ARG A 49 -5.735 3.851 -7.710 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -5.190 5.423 -9.429 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -3.494 4.982 -9.411 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -4.335 2.616 -10.153 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -5.825 3.443 -10.562 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -3.211 4.588 -11.534 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -3.869 3.180 -12.343 1.00 0.00 H new ATOM 0 HE ARG A 49 -5.817 5.346 -12.002 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -3.251 3.986 -14.009 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -3.820 4.784 -15.479 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -6.541 6.367 -13.894 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -5.674 6.127 -15.414 1.00 0.00 H new ATOM 735 N MET A 50 -4.774 1.572 -7.789 1.00 0.00 N ATOM 736 CA MET A 50 -4.236 0.219 -7.714 1.00 0.00 C ATOM 737 C MET A 50 -4.557 -0.565 -8.983 1.00 0.00 C ATOM 738 O MET A 50 -5.639 -0.424 -9.553 1.00 0.00 O ATOM 739 CB MET A 50 -4.800 -0.510 -6.493 1.00 0.00 C ATOM 740 CG MET A 50 -4.120 -0.126 -5.189 1.00 0.00 C ATOM 741 SD MET A 50 -4.641 -1.158 -3.805 1.00 0.00 S ATOM 742 CE MET A 50 -6.213 -0.405 -3.394 1.00 0.00 C ATOM 0 H MET A 50 -5.793 1.621 -7.803 1.00 0.00 H new ATOM 0 HA MET A 50 -3.153 0.290 -7.617 1.00 0.00 H new ATOM 0 HB2 MET A 50 -5.866 -0.298 -6.414 1.00 0.00 H new ATOM 0 HB3 MET A 50 -4.699 -1.585 -6.643 1.00 0.00 H new ATOM 0 HG2 MET A 50 -3.040 -0.205 -5.310 1.00 0.00 H new ATOM 0 HG3 MET A 50 -4.340 0.917 -4.962 1.00 0.00 H new ATOM 0 HE1 MET A 50 -6.210 -0.106 -2.346 1.00 0.00 H new ATOM 0 HE2 MET A 50 -6.371 0.473 -4.021 1.00 0.00 H new ATOM 0 HE3 MET A 50 -7.016 -1.122 -3.565 1.00 0.00 H new ATOM 752 N TYR A 51 -3.611 -1.390 -9.418 1.00 0.00 N ATOM 753 CA TYR A 51 -3.793 -2.194 -10.621 1.00 0.00 C ATOM 754 C TYR A 51 -2.989 -3.488 -10.538 1.00 0.00 C ATOM 755 O TYR A 51 -1.785 -3.469 -10.277 1.00 0.00 O ATOM 756 CB TYR A 51 -3.376 -1.399 -11.859 1.00 0.00 C ATOM 757 CG TYR A 51 -4.508 -0.619 -12.488 1.00 0.00 C ATOM 758 CD1 TYR A 51 -5.448 -1.248 -13.295 1.00 0.00 C ATOM 759 CD2 TYR A 51 -4.639 0.748 -12.274 1.00 0.00 C ATOM 760 CE1 TYR A 51 -6.483 -0.539 -13.873 1.00 0.00 C ATOM 761 CE2 TYR A 51 -5.672 1.465 -12.846 1.00 0.00 C ATOM 762 CZ TYR A 51 -6.591 0.817 -13.645 1.00 0.00 C ATOM 763 OH TYR A 51 -7.622 1.526 -14.217 1.00 0.00 O ATOM 0 H TYR A 51 -2.711 -1.520 -8.956 1.00 0.00 H new ATOM 0 HA TYR A 51 -4.850 -2.449 -10.701 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -2.578 -0.708 -11.585 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -2.964 -2.085 -12.599 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -5.368 -2.310 -13.474 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -3.921 1.259 -11.650 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -7.203 -1.043 -14.500 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -5.760 2.527 -12.669 1.00 0.00 H new ATOM 0 HH TYR A 51 -7.555 2.468 -13.956 1.00 0.00 H new ATOM 773 N LEU A 52 -3.662 -4.611 -10.763 1.00 0.00 N ATOM 774 CA LEU A 52 -3.012 -5.915 -10.715 1.00 0.00 C ATOM 775 C LEU A 52 -2.341 -6.239 -12.047 1.00 0.00 C ATOM 776 O LEU A 52 -2.950 -6.845 -12.929 1.00 0.00 O ATOM 777 CB LEU A 52 -4.030 -7.002 -10.367 1.00 0.00 C ATOM 778 CG LEU A 52 -3.461 -8.286 -9.760 1.00 0.00 C ATOM 779 CD1 LEU A 52 -2.682 -7.977 -8.491 1.00 0.00 C ATOM 780 CD2 LEU A 52 -4.576 -9.281 -9.475 1.00 0.00 C ATOM 0 H LEU A 52 -4.658 -4.644 -10.981 1.00 0.00 H new ATOM 0 HA LEU A 52 -2.245 -5.882 -9.941 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -4.754 -6.583 -9.668 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -4.576 -7.263 -11.273 1.00 0.00 H new ATOM 0 HG LEU A 52 -2.777 -8.734 -10.481 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -2.285 -8.902 -8.073 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -1.859 -7.302 -8.725 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -3.343 -7.505 -7.764 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -4.153 -10.188 -9.044 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -5.285 -8.842 -8.773 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -5.090 -9.527 -10.404 1.00 0.00 H new ATOM 792 N LEU A 53 -1.084 -5.832 -12.184 1.00 0.00 N ATOM 793 CA LEU A 53 -0.329 -6.081 -13.407 1.00 0.00 C ATOM 794 C LEU A 53 -0.067 -7.572 -13.592 1.00 0.00 C ATOM 795 O LEU A 53 -0.059 -8.349 -12.637 1.00 0.00 O ATOM 796 CB LEU A 53 0.997 -5.319 -13.376 1.00 0.00 C ATOM 797 CG LEU A 53 0.919 -3.824 -13.690 1.00 0.00 C ATOM 798 CD1 LEU A 53 0.303 -3.598 -15.062 1.00 0.00 C ATOM 799 CD2 LEU A 53 0.123 -3.094 -12.618 1.00 0.00 C ATOM 0 H LEU A 53 -0.566 -5.328 -11.464 1.00 0.00 H new ATOM 0 HA LEU A 53 -0.924 -5.728 -14.249 1.00 0.00 H new ATOM 0 HB2 LEU A 53 1.440 -5.440 -12.387 1.00 0.00 H new ATOM 0 HB3 LEU A 53 1.678 -5.785 -14.089 1.00 0.00 H new ATOM 0 HG LEU A 53 1.932 -3.421 -13.699 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.256 -2.529 -15.268 1.00 0.00 H new ATOM 0 HD12 LEU A 53 0.914 -4.087 -15.820 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -0.703 -4.016 -15.082 1.00 0.00 H new ATOM 0 HD21 LEU A 53 0.078 -2.032 -12.858 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -0.888 -3.500 -12.576 1.00 0.00 H new ATOM 0 HD23 LEU A 53 0.608 -3.227 -11.651 1.00 0.00 H new ATOM 811 N PRO A 54 0.154 -7.983 -14.850 1.00 0.00 N ATOM 812 CA PRO A 54 0.146 -7.067 -15.995 1.00 0.00 C ATOM 813 C PRO A 54 -1.252 -6.543 -16.308 1.00 0.00 C ATOM 814 O PRO A 54 -1.446 -5.342 -16.497 1.00 0.00 O ATOM 815 CB PRO A 54 0.662 -7.934 -17.146 1.00 0.00 C ATOM 816 CG PRO A 54 0.323 -9.330 -16.750 1.00 0.00 C ATOM 817 CD PRO A 54 0.428 -9.373 -15.251 1.00 0.00 C ATOM 0 HA PRO A 54 0.748 -6.178 -15.810 1.00 0.00 H new ATOM 0 HB2 PRO A 54 0.187 -7.664 -18.089 1.00 0.00 H new ATOM 0 HB3 PRO A 54 1.736 -7.811 -17.283 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -0.682 -9.596 -17.078 1.00 0.00 H new ATOM 0 HG3 PRO A 54 1.007 -10.043 -17.210 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -0.293 -10.066 -14.817 1.00 0.00 H new ATOM 0 HD3 PRO A 54 1.417 -9.697 -14.927 1.00 0.00 H new ATOM 825 N ASP A 55 -2.221 -7.450 -16.360 1.00 0.00 N ATOM 826 CA ASP A 55 -3.601 -7.079 -16.649 1.00 0.00 C ATOM 827 C ASP A 55 -3.947 -5.737 -16.011 1.00 0.00 C ATOM 828 O ASP A 55 -3.847 -5.570 -14.795 1.00 0.00 O ATOM 829 CB ASP A 55 -4.559 -8.159 -16.144 1.00 0.00 C ATOM 830 CG ASP A 55 -4.183 -9.542 -16.638 1.00 0.00 C ATOM 831 OD1 ASP A 55 -3.399 -10.227 -15.946 1.00 0.00 O ATOM 832 OD2 ASP A 55 -4.672 -9.941 -17.715 1.00 0.00 O ATOM 0 H ASP A 55 -2.076 -8.448 -16.206 1.00 0.00 H new ATOM 0 HA ASP A 55 -3.708 -6.987 -17.730 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -4.565 -8.155 -15.054 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -5.572 -7.923 -16.469 1.00 0.00 H new ATOM 837 N LYS A 56 -4.354 -4.781 -16.840 1.00 0.00 N ATOM 838 CA LYS A 56 -4.716 -3.453 -16.358 1.00 0.00 C ATOM 839 C LYS A 56 -6.176 -3.140 -16.669 1.00 0.00 C ATOM 840 O LYS A 56 -6.547 -1.980 -16.849 1.00 0.00 O ATOM 841 CB LYS A 56 -3.810 -2.394 -16.992 1.00 0.00 C ATOM 842 CG LYS A 56 -2.422 -2.335 -16.378 1.00 0.00 C ATOM 843 CD LYS A 56 -1.739 -1.009 -16.672 1.00 0.00 C ATOM 844 CE LYS A 56 -2.249 0.095 -15.760 1.00 0.00 C ATOM 845 NZ LYS A 56 -1.492 0.151 -14.479 1.00 0.00 N ATOM 0 H LYS A 56 -4.441 -4.901 -17.849 1.00 0.00 H new ATOM 0 HA LYS A 56 -4.582 -3.437 -15.276 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -3.718 -2.598 -18.059 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -4.283 -1.417 -16.894 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -2.494 -2.477 -15.300 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -1.815 -3.152 -16.768 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -0.662 -1.118 -16.546 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -1.912 -0.732 -17.712 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -2.169 1.054 -16.271 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -3.306 -0.067 -15.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -2.024 0.714 -13.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -1.358 -0.813 -14.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -0.564 0.591 -14.643 1.00 0.00 H new ATOM 859 N ARG A 57 -6.999 -4.182 -16.730 1.00 0.00 N ATOM 860 CA ARG A 57 -8.419 -4.017 -17.019 1.00 0.00 C ATOM 861 C ARG A 57 -9.014 -2.881 -16.193 1.00 0.00 C ATOM 862 O ARG A 57 -8.739 -2.758 -14.999 1.00 0.00 O ATOM 863 CB ARG A 57 -9.173 -5.318 -16.735 1.00 0.00 C ATOM 864 CG ARG A 57 -8.694 -6.494 -17.570 1.00 0.00 C ATOM 865 CD ARG A 57 -9.129 -6.361 -19.021 1.00 0.00 C ATOM 866 NE ARG A 57 -8.146 -5.638 -19.823 1.00 0.00 N ATOM 867 CZ ARG A 57 -7.040 -6.193 -20.307 1.00 0.00 C ATOM 868 NH1 ARG A 57 -6.778 -7.471 -20.071 1.00 0.00 N ATOM 869 NH2 ARG A 57 -6.193 -5.469 -21.028 1.00 0.00 N ATOM 0 H ARG A 57 -6.707 -5.148 -16.583 1.00 0.00 H new ATOM 0 HA ARG A 57 -8.523 -3.768 -18.075 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -9.067 -5.566 -15.679 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -10.235 -5.160 -16.921 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -7.607 -6.559 -17.519 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -9.088 -7.421 -17.154 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -9.284 -7.353 -19.445 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -10.086 -5.842 -19.066 1.00 0.00 H new ATOM 0 HE ARG A 57 -8.318 -4.653 -20.023 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -7.426 -8.031 -19.517 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -5.928 -7.895 -20.444 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -6.391 -4.485 -21.211 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -5.344 -5.896 -21.399 1.00 0.00 H new ATOM 883 N ARG A 58 -9.830 -2.053 -16.836 1.00 0.00 N ATOM 884 CA ARG A 58 -10.462 -0.926 -16.162 1.00 0.00 C ATOM 885 C ARG A 58 -11.842 -1.311 -15.636 1.00 0.00 C ATOM 886 O ARG A 58 -12.392 -0.643 -14.760 1.00 0.00 O ATOM 887 CB ARG A 58 -10.582 0.265 -17.115 1.00 0.00 C ATOM 888 CG ARG A 58 -11.668 0.097 -18.165 1.00 0.00 C ATOM 889 CD ARG A 58 -13.012 0.601 -17.663 1.00 0.00 C ATOM 890 NE ARG A 58 -13.981 0.748 -18.746 1.00 0.00 N ATOM 891 CZ ARG A 58 -15.284 0.917 -18.548 1.00 0.00 C ATOM 892 NH1 ARG A 58 -15.770 0.961 -17.316 1.00 0.00 N ATOM 893 NH2 ARG A 58 -16.102 1.043 -19.585 1.00 0.00 N ATOM 0 H ARG A 58 -10.069 -2.142 -17.824 1.00 0.00 H new ATOM 0 HA ARG A 58 -9.835 -0.644 -15.316 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -10.785 1.165 -16.535 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -9.625 0.418 -17.615 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -11.389 0.640 -19.068 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -11.752 -0.955 -18.438 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -13.403 -0.092 -16.918 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -12.876 1.561 -17.165 1.00 0.00 H new ATOM 0 HE ARG A 58 -13.639 0.719 -19.706 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -15.143 0.865 -16.517 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -16.771 1.091 -17.167 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -15.731 1.010 -20.534 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -17.102 1.173 -19.433 1.00 0.00 H new ATOM 907 N SER A 59 -12.394 -2.392 -16.176 1.00 0.00 N ATOM 908 CA SER A 59 -13.711 -2.865 -15.765 1.00 0.00 C ATOM 909 C SER A 59 -13.664 -3.446 -14.355 1.00 0.00 C ATOM 910 O SER A 59 -14.693 -3.591 -13.696 1.00 0.00 O ATOM 911 CB SER A 59 -14.228 -3.918 -16.746 1.00 0.00 C ATOM 912 OG SER A 59 -13.193 -4.804 -17.135 1.00 0.00 O ATOM 0 H SER A 59 -11.950 -2.957 -16.900 1.00 0.00 H new ATOM 0 HA SER A 59 -14.392 -2.014 -15.766 1.00 0.00 H new ATOM 0 HB2 SER A 59 -15.039 -4.482 -16.285 1.00 0.00 H new ATOM 0 HB3 SER A 59 -14.641 -3.427 -17.627 1.00 0.00 H new ATOM 0 HG SER A 59 -13.549 -5.469 -17.761 1.00 0.00 H new ATOM 918 N GLY A 60 -12.460 -3.778 -13.898 1.00 0.00 N ATOM 919 CA GLY A 60 -12.299 -4.340 -12.570 1.00 0.00 C ATOM 920 C GLY A 60 -11.268 -3.595 -11.746 1.00 0.00 C ATOM 921 O GLY A 60 -10.697 -4.148 -10.806 1.00 0.00 O ATOM 0 H GLY A 60 -11.593 -3.668 -14.424 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -13.258 -4.319 -12.052 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -12.005 -5.386 -12.655 1.00 0.00 H new ATOM 925 N ARG A 61 -11.028 -2.336 -12.099 1.00 0.00 N ATOM 926 CA ARG A 61 -10.056 -1.515 -11.387 1.00 0.00 C ATOM 927 C ARG A 61 -10.578 -1.131 -10.005 1.00 0.00 C ATOM 928 O ARG A 61 -11.786 -1.016 -9.796 1.00 0.00 O ATOM 929 CB ARG A 61 -9.736 -0.254 -12.191 1.00 0.00 C ATOM 930 CG ARG A 61 -8.951 0.786 -11.407 1.00 0.00 C ATOM 931 CD ARG A 61 -9.875 1.740 -10.667 1.00 0.00 C ATOM 932 NE ARG A 61 -10.271 2.874 -11.499 1.00 0.00 N ATOM 933 CZ ARG A 61 -9.424 3.806 -11.921 1.00 0.00 C ATOM 934 NH1 ARG A 61 -8.141 3.740 -11.591 1.00 0.00 N ATOM 935 NH2 ARG A 61 -9.860 4.808 -12.675 1.00 0.00 N ATOM 0 H ARG A 61 -11.493 -1.863 -12.874 1.00 0.00 H new ATOM 0 HA ARG A 61 -9.145 -2.100 -11.263 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -9.167 -0.533 -13.078 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -10.668 0.192 -12.538 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -8.295 0.287 -10.694 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -8.313 1.350 -12.087 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -10.765 1.202 -10.340 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -9.376 2.106 -9.770 1.00 0.00 H new ATOM 0 HE ARG A 61 -11.251 2.954 -11.770 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -7.802 2.972 -11.012 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -7.493 4.457 -11.917 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -10.846 4.862 -12.931 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -9.209 5.523 -12.999 1.00 0.00 H new ATOM 949 N ARG A 62 -9.659 -0.935 -9.065 1.00 0.00 N ATOM 950 CA ARG A 62 -10.026 -0.566 -7.703 1.00 0.00 C ATOM 951 C ARG A 62 -9.098 0.520 -7.165 1.00 0.00 C ATOM 952 O ARG A 62 -7.922 0.271 -6.898 1.00 0.00 O ATOM 953 CB ARG A 62 -9.978 -1.792 -6.790 1.00 0.00 C ATOM 954 CG ARG A 62 -10.998 -2.860 -7.149 1.00 0.00 C ATOM 955 CD ARG A 62 -12.372 -2.529 -6.587 1.00 0.00 C ATOM 956 NE ARG A 62 -13.444 -3.140 -7.368 1.00 0.00 N ATOM 957 CZ ARG A 62 -14.707 -3.200 -6.962 1.00 0.00 C ATOM 958 NH1 ARG A 62 -15.054 -2.688 -5.789 1.00 0.00 N ATOM 959 NH2 ARG A 62 -15.626 -3.772 -7.729 1.00 0.00 N ATOM 0 H ARG A 62 -8.655 -1.026 -9.222 1.00 0.00 H new ATOM 0 HA ARG A 62 -11.043 -0.174 -7.720 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -8.979 -2.227 -6.832 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -10.144 -1.474 -5.761 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -11.060 -2.955 -8.233 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -10.668 -3.824 -6.763 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -12.434 -2.873 -5.555 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -12.506 -1.447 -6.571 1.00 0.00 H new ATOM 0 HE ARG A 62 -13.210 -3.543 -8.275 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -14.350 -2.247 -5.197 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -16.025 -2.735 -5.479 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -15.363 -4.167 -8.632 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -16.596 -3.817 -7.416 1.00 0.00 H new ATOM 973 N LYS A 63 -9.634 1.725 -7.009 1.00 0.00 N ATOM 974 CA LYS A 63 -8.856 2.850 -6.503 1.00 0.00 C ATOM 975 C LYS A 63 -9.555 3.503 -5.315 1.00 0.00 C ATOM 976 O LYS A 63 -10.702 3.183 -5.002 1.00 0.00 O ATOM 977 CB LYS A 63 -8.635 3.883 -7.610 1.00 0.00 C ATOM 978 CG LYS A 63 -9.910 4.571 -8.064 1.00 0.00 C ATOM 979 CD LYS A 63 -9.633 5.971 -8.585 1.00 0.00 C ATOM 980 CE LYS A 63 -10.923 6.713 -8.903 1.00 0.00 C ATOM 981 NZ LYS A 63 -11.441 7.456 -7.722 1.00 0.00 N ATOM 0 H LYS A 63 -10.605 1.948 -7.226 1.00 0.00 H new ATOM 0 HA LYS A 63 -7.889 2.471 -6.170 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -7.932 4.637 -7.257 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -8.172 3.392 -8.466 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -10.386 3.979 -8.845 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -10.612 4.624 -7.232 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -9.064 6.531 -7.843 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -9.016 5.911 -9.481 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -10.748 7.410 -9.723 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -11.676 6.002 -9.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -12.427 7.179 -7.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -10.862 7.230 -6.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -11.396 8.478 -7.908 1.00 0.00 H new ATOM 995 N THR A 64 -8.857 4.424 -4.657 1.00 0.00 N ATOM 996 CA THR A 64 -9.410 5.123 -3.504 1.00 0.00 C ATOM 997 C THR A 64 -9.979 6.480 -3.905 1.00 0.00 C ATOM 998 O THR A 64 -9.687 6.992 -4.986 1.00 0.00 O ATOM 999 CB THR A 64 -8.347 5.328 -2.408 1.00 0.00 C ATOM 1000 OG1 THR A 64 -7.292 6.163 -2.899 1.00 0.00 O ATOM 1001 CG2 THR A 64 -7.775 3.994 -1.953 1.00 0.00 C ATOM 0 H THR A 64 -7.907 4.703 -4.903 1.00 0.00 H new ATOM 0 HA THR A 64 -10.211 4.498 -3.110 1.00 0.00 H new ATOM 0 HB THR A 64 -8.824 5.810 -1.555 1.00 0.00 H new ATOM 0 HG1 THR A 64 -6.924 6.693 -2.161 1.00 0.00 H new ATOM 0 HG21 THR A 64 -7.027 4.164 -1.179 1.00 0.00 H new ATOM 0 HG22 THR A 64 -8.576 3.372 -1.553 1.00 0.00 H new ATOM 0 HG23 THR A 64 -7.312 3.489 -2.801 1.00 0.00 H new ATOM 1009 N HIS A 65 -10.792 7.058 -3.026 1.00 0.00 N ATOM 1010 CA HIS A 65 -11.401 8.357 -3.289 1.00 0.00 C ATOM 1011 C HIS A 65 -10.334 9.436 -3.442 1.00 0.00 C ATOM 1012 O HIS A 65 -9.207 9.281 -2.971 1.00 0.00 O ATOM 1013 CB HIS A 65 -12.362 8.730 -2.160 1.00 0.00 C ATOM 1014 CG HIS A 65 -13.653 7.972 -2.196 1.00 0.00 C ATOM 1015 ND1 HIS A 65 -14.656 8.237 -3.105 1.00 0.00 N ATOM 1016 CD2 HIS A 65 -14.102 6.950 -1.431 1.00 0.00 C ATOM 1017 CE1 HIS A 65 -15.667 7.412 -2.895 1.00 0.00 C ATOM 1018 NE2 HIS A 65 -15.355 6.620 -1.885 1.00 0.00 N ATOM 0 H HIS A 65 -11.044 6.648 -2.127 1.00 0.00 H new ATOM 0 HA HIS A 65 -11.959 8.288 -4.223 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -11.872 8.551 -1.203 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -12.576 9.798 -2.214 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -13.573 6.481 -0.615 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -16.591 7.389 -3.454 1.00 0.00 H new ATOM 0 HE2 HIS A 65 -15.949 5.883 -1.504 1.00 0.00 H new ATOM 1026 N VAL A 66 -10.696 10.530 -4.105 1.00 0.00 N ATOM 1027 CA VAL A 66 -9.770 11.635 -4.321 1.00 0.00 C ATOM 1028 C VAL A 66 -10.188 12.865 -3.522 1.00 0.00 C ATOM 1029 O VAL A 66 -11.253 13.436 -3.754 1.00 0.00 O ATOM 1030 CB VAL A 66 -9.681 12.010 -5.812 1.00 0.00 C ATOM 1031 CG1 VAL A 66 -11.072 12.126 -6.417 1.00 0.00 C ATOM 1032 CG2 VAL A 66 -8.904 13.306 -5.989 1.00 0.00 C ATOM 0 H VAL A 66 -11.624 10.674 -4.502 1.00 0.00 H new ATOM 0 HA VAL A 66 -8.791 11.299 -3.980 1.00 0.00 H new ATOM 0 HB VAL A 66 -9.147 11.218 -6.337 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -10.989 12.392 -7.471 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -11.590 11.172 -6.323 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -11.634 12.898 -5.891 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -8.851 13.556 -7.049 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -9.408 14.109 -5.451 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -7.896 13.182 -5.594 1.00 0.00 H new ATOM 1042 N SER A 67 -9.340 13.269 -2.582 1.00 0.00 N ATOM 1043 CA SER A 67 -9.622 14.431 -1.746 1.00 0.00 C ATOM 1044 C SER A 67 -8.901 15.667 -2.274 1.00 0.00 C ATOM 1045 O SER A 67 -7.671 15.726 -2.286 1.00 0.00 O ATOM 1046 CB SER A 67 -9.202 14.159 -0.300 1.00 0.00 C ATOM 1047 OG SER A 67 -10.137 13.319 0.353 1.00 0.00 O ATOM 0 H SER A 67 -8.452 12.809 -2.380 1.00 0.00 H new ATOM 0 HA SER A 67 -10.695 14.618 -1.775 1.00 0.00 H new ATOM 0 HB2 SER A 67 -8.217 13.692 -0.286 1.00 0.00 H new ATOM 0 HB3 SER A 67 -9.116 15.102 0.240 1.00 0.00 H new ATOM 0 HG SER A 67 -9.845 13.159 1.275 1.00 0.00 H new ATOM 1053 N LYS A 68 -9.675 16.655 -2.709 1.00 0.00 N ATOM 1054 CA LYS A 68 -9.113 17.893 -3.237 1.00 0.00 C ATOM 1055 C LYS A 68 -8.821 18.881 -2.112 1.00 0.00 C ATOM 1056 O LYS A 68 -9.408 18.801 -1.033 1.00 0.00 O ATOM 1057 CB LYS A 68 -10.074 18.523 -4.248 1.00 0.00 C ATOM 1058 CG LYS A 68 -10.499 17.575 -5.356 1.00 0.00 C ATOM 1059 CD LYS A 68 -11.796 16.862 -5.013 1.00 0.00 C ATOM 1060 CE LYS A 68 -12.367 16.132 -6.219 1.00 0.00 C ATOM 1061 NZ LYS A 68 -13.771 15.692 -5.989 1.00 0.00 N ATOM 0 H LYS A 68 -10.694 16.623 -2.706 1.00 0.00 H new ATOM 0 HA LYS A 68 -8.175 17.653 -3.738 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -10.962 18.875 -3.722 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -9.599 19.398 -4.692 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -10.624 18.132 -6.285 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -9.713 16.840 -5.528 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -11.619 16.151 -4.206 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -12.524 17.585 -4.646 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -12.330 16.786 -7.090 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -11.747 15.264 -6.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -14.123 15.199 -6.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -13.804 15.048 -5.173 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -14.368 16.522 -5.799 1.00 0.00 H new ATOM 1075 N LYS A 69 -7.912 19.815 -2.372 1.00 0.00 N ATOM 1076 CA LYS A 69 -7.544 20.821 -1.384 1.00 0.00 C ATOM 1077 C LYS A 69 -6.953 20.169 -0.138 1.00 0.00 C ATOM 1078 O LYS A 69 -7.422 20.397 0.978 1.00 0.00 O ATOM 1079 CB LYS A 69 -8.765 21.661 -1.002 1.00 0.00 C ATOM 1080 CG LYS A 69 -9.356 22.438 -2.166 1.00 0.00 C ATOM 1081 CD LYS A 69 -8.668 23.780 -2.349 1.00 0.00 C ATOM 1082 CE LYS A 69 -9.503 24.723 -3.200 1.00 0.00 C ATOM 1083 NZ LYS A 69 -9.046 26.135 -3.075 1.00 0.00 N ATOM 0 H LYS A 69 -7.416 19.896 -3.260 1.00 0.00 H new ATOM 0 HA LYS A 69 -6.788 21.470 -1.827 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -9.531 21.006 -0.587 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -8.483 22.360 -0.215 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -9.262 21.852 -3.080 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -10.421 22.595 -1.996 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -8.486 24.233 -1.374 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -7.695 23.630 -2.818 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -9.448 24.415 -4.244 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -10.549 24.652 -2.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -9.641 26.746 -3.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -9.122 26.438 -2.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -8.056 26.208 -3.384 1.00 0.00 H new ATOM 1097 N THR A 70 -5.918 19.358 -0.334 1.00 0.00 N ATOM 1098 CA THR A 70 -5.262 18.674 0.773 1.00 0.00 C ATOM 1099 C THR A 70 -4.036 17.905 0.296 1.00 0.00 C ATOM 1100 O THR A 70 -4.027 17.351 -0.805 1.00 0.00 O ATOM 1101 CB THR A 70 -6.223 17.698 1.478 1.00 0.00 C ATOM 1102 OG1 THR A 70 -5.524 16.971 2.495 1.00 0.00 O ATOM 1103 CG2 THR A 70 -6.833 16.724 0.481 1.00 0.00 C ATOM 0 H THR A 70 -5.516 19.159 -1.250 1.00 0.00 H new ATOM 0 HA THR A 70 -4.952 19.443 1.480 1.00 0.00 H new ATOM 0 HB THR A 70 -7.026 18.279 1.933 1.00 0.00 H new ATOM 0 HG1 THR A 70 -6.142 16.354 2.940 1.00 0.00 H new ATOM 0 HG21 THR A 70 -7.508 16.045 1.002 1.00 0.00 H new ATOM 0 HG22 THR A 70 -7.389 17.278 -0.276 1.00 0.00 H new ATOM 0 HG23 THR A 70 -6.040 16.150 0.001 1.00 0.00 H new ATOM 1111 N LEU A 71 -3.001 17.874 1.129 1.00 0.00 N ATOM 1112 CA LEU A 71 -1.768 17.172 0.792 1.00 0.00 C ATOM 1113 C LEU A 71 -1.664 15.856 1.556 1.00 0.00 C ATOM 1114 O LEU A 71 -0.964 14.936 1.135 1.00 0.00 O ATOM 1115 CB LEU A 71 -0.556 18.052 1.102 1.00 0.00 C ATOM 1116 CG LEU A 71 -0.038 18.911 -0.052 1.00 0.00 C ATOM 1117 CD1 LEU A 71 -1.174 19.701 -0.682 1.00 0.00 C ATOM 1118 CD2 LEU A 71 1.060 19.848 0.432 1.00 0.00 C ATOM 0 H LEU A 71 -2.992 18.327 2.043 1.00 0.00 H new ATOM 0 HA LEU A 71 -1.785 16.951 -0.275 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -0.813 18.710 1.932 1.00 0.00 H new ATOM 0 HB3 LEU A 71 0.256 17.410 1.444 1.00 0.00 H new ATOM 0 HG LEU A 71 0.382 18.250 -0.810 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -0.786 20.306 -1.501 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -1.927 19.013 -1.065 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -1.624 20.351 0.068 1.00 0.00 H new ATOM 0 HD21 LEU A 71 1.417 20.452 -0.402 1.00 0.00 H new ATOM 0 HD22 LEU A 71 0.664 20.501 1.210 1.00 0.00 H new ATOM 0 HD23 LEU A 71 1.886 19.263 0.836 1.00 0.00 H new ATOM 1130 N ASN A 72 -2.368 15.773 2.680 1.00 0.00 N ATOM 1131 CA ASN A 72 -2.357 14.569 3.502 1.00 0.00 C ATOM 1132 C ASN A 72 -3.753 13.961 3.597 1.00 0.00 C ATOM 1133 O ASN A 72 -4.382 13.949 4.656 1.00 0.00 O ATOM 1134 CB ASN A 72 -1.832 14.888 4.904 1.00 0.00 C ATOM 1135 CG ASN A 72 -0.715 15.914 4.883 1.00 0.00 C ATOM 1136 OD1 ASN A 72 -0.930 17.074 4.533 1.00 0.00 O ATOM 1137 ND2 ASN A 72 0.486 15.489 5.258 1.00 0.00 N ATOM 0 H ASN A 72 -2.953 16.526 3.042 1.00 0.00 H new ATOM 0 HA ASN A 72 -1.695 13.843 3.029 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -2.651 15.259 5.520 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -1.471 13.972 5.371 1.00 0.00 H new ATOM 0 HD21 ASN A 72 1.276 16.134 5.264 1.00 0.00 H new ATOM 0 HD22 ASN A 72 0.618 14.518 5.541 1.00 0.00 H new ATOM 1144 N PRO A 73 -4.251 13.445 2.464 1.00 0.00 N ATOM 1145 CA PRO A 73 -5.578 12.825 2.393 1.00 0.00 C ATOM 1146 C PRO A 73 -5.638 11.497 3.140 1.00 0.00 C ATOM 1147 O PRO A 73 -4.607 10.917 3.480 1.00 0.00 O ATOM 1148 CB PRO A 73 -5.786 12.604 0.892 1.00 0.00 C ATOM 1149 CG PRO A 73 -4.410 12.511 0.328 1.00 0.00 C ATOM 1150 CD PRO A 73 -3.558 13.425 1.165 1.00 0.00 C ATOM 0 HA PRO A 73 -6.344 13.447 2.857 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -6.354 11.694 0.701 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -6.343 13.427 0.444 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -4.040 11.487 0.368 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -4.396 12.814 -0.719 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -2.539 13.050 1.259 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -3.491 14.422 0.730 1.00 0.00 H new ATOM 1158 N VAL A 74 -6.853 11.020 3.393 1.00 0.00 N ATOM 1159 CA VAL A 74 -7.047 9.759 4.099 1.00 0.00 C ATOM 1160 C VAL A 74 -8.324 9.063 3.640 1.00 0.00 C ATOM 1161 O VAL A 74 -9.368 9.697 3.487 1.00 0.00 O ATOM 1162 CB VAL A 74 -7.112 9.973 5.623 1.00 0.00 C ATOM 1163 CG1 VAL A 74 -8.169 11.010 5.972 1.00 0.00 C ATOM 1164 CG2 VAL A 74 -7.389 8.658 6.334 1.00 0.00 C ATOM 0 H VAL A 74 -7.717 11.488 3.120 1.00 0.00 H new ATOM 0 HA VAL A 74 -6.189 9.130 3.864 1.00 0.00 H new ATOM 0 HB VAL A 74 -6.145 10.346 5.962 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -8.201 11.148 7.053 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -7.922 11.957 5.492 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -9.143 10.669 5.621 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -7.432 8.828 7.410 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -8.342 8.253 5.993 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -6.592 7.948 6.110 1.00 0.00 H new ATOM 1174 N PHE A 75 -8.233 7.756 3.422 1.00 0.00 N ATOM 1175 CA PHE A 75 -9.381 6.973 2.980 1.00 0.00 C ATOM 1176 C PHE A 75 -9.657 5.821 3.942 1.00 0.00 C ATOM 1177 O PHE A 75 -10.809 5.447 4.165 1.00 0.00 O ATOM 1178 CB PHE A 75 -9.141 6.428 1.570 1.00 0.00 C ATOM 1179 CG PHE A 75 -8.290 7.325 0.718 1.00 0.00 C ATOM 1180 CD1 PHE A 75 -8.782 8.536 0.258 1.00 0.00 C ATOM 1181 CD2 PHE A 75 -6.999 6.957 0.376 1.00 0.00 C ATOM 1182 CE1 PHE A 75 -8.001 9.364 -0.527 1.00 0.00 C ATOM 1183 CE2 PHE A 75 -6.214 7.781 -0.408 1.00 0.00 C ATOM 1184 CZ PHE A 75 -6.716 8.986 -0.861 1.00 0.00 C ATOM 0 H PHE A 75 -7.376 7.216 3.544 1.00 0.00 H new ATOM 0 HA PHE A 75 -10.252 7.628 2.966 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -8.664 5.450 1.643 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -10.102 6.278 1.078 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -9.787 8.836 0.516 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -6.602 6.016 0.726 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -8.396 10.306 -0.879 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -5.209 7.483 -0.667 1.00 0.00 H new ATOM 0 HZ PHE A 75 -6.104 9.631 -1.475 1.00 0.00 H new ATOM 1194 N ASP A 76 -8.593 5.264 4.509 1.00 0.00 N ATOM 1195 CA ASP A 76 -8.719 4.155 5.448 1.00 0.00 C ATOM 1196 C ASP A 76 -9.599 3.051 4.870 1.00 0.00 C ATOM 1197 O ASP A 76 -10.384 2.431 5.587 1.00 0.00 O ATOM 1198 CB ASP A 76 -9.301 4.646 6.774 1.00 0.00 C ATOM 1199 CG ASP A 76 -9.020 3.692 7.918 1.00 0.00 C ATOM 1200 OD1 ASP A 76 -7.831 3.489 8.243 1.00 0.00 O ATOM 1201 OD2 ASP A 76 -9.989 3.149 8.489 1.00 0.00 O ATOM 0 H ASP A 76 -7.633 5.562 4.335 1.00 0.00 H new ATOM 0 HA ASP A 76 -7.724 3.746 5.626 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -8.884 5.625 7.010 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -10.378 4.775 6.669 1.00 0.00 H new ATOM 1206 N GLN A 77 -9.462 2.812 3.569 1.00 0.00 N ATOM 1207 CA GLN A 77 -10.246 1.784 2.895 1.00 0.00 C ATOM 1208 C GLN A 77 -9.389 0.562 2.585 1.00 0.00 C ATOM 1209 O GLN A 77 -8.186 0.678 2.350 1.00 0.00 O ATOM 1210 CB GLN A 77 -10.852 2.339 1.605 1.00 0.00 C ATOM 1211 CG GLN A 77 -12.211 2.990 1.801 1.00 0.00 C ATOM 1212 CD GLN A 77 -12.718 3.672 0.546 1.00 0.00 C ATOM 1213 OE1 GLN A 77 -11.884 4.518 -0.047 1.00 0.00 O flip ATOM 1214 NE2 GLN A 77 -13.848 3.441 0.113 1.00 0.00 N flip ATOM 0 H GLN A 77 -8.816 3.316 2.962 1.00 0.00 H new ATOM 0 HA GLN A 77 -11.051 1.479 3.564 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -10.167 3.071 1.177 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -10.947 1.530 0.881 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -12.930 2.233 2.114 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -12.146 3.721 2.607 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -14.456 2.783 0.600 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -14.175 3.908 -0.733 1.00 0.00 H new ATOM 1223 N SER A 78 -10.016 -0.610 2.585 1.00 0.00 N ATOM 1224 CA SER A 78 -9.309 -1.855 2.308 1.00 0.00 C ATOM 1225 C SER A 78 -9.966 -2.607 1.154 1.00 0.00 C ATOM 1226 O SER A 78 -11.187 -2.756 1.110 1.00 0.00 O ATOM 1227 CB SER A 78 -9.279 -2.739 3.556 1.00 0.00 C ATOM 1228 OG SER A 78 -8.775 -4.029 3.256 1.00 0.00 O ATOM 0 H SER A 78 -11.012 -0.723 2.774 1.00 0.00 H new ATOM 0 HA SER A 78 -8.286 -1.607 2.023 1.00 0.00 H new ATOM 0 HB2 SER A 78 -8.659 -2.272 4.321 1.00 0.00 H new ATOM 0 HB3 SER A 78 -10.284 -2.825 3.969 1.00 0.00 H new ATOM 0 HG SER A 78 -8.765 -4.574 4.071 1.00 0.00 H new ATOM 1234 N PHE A 79 -9.146 -3.080 0.221 1.00 0.00 N ATOM 1235 CA PHE A 79 -9.646 -3.815 -0.934 1.00 0.00 C ATOM 1236 C PHE A 79 -9.142 -5.256 -0.921 1.00 0.00 C ATOM 1237 O PHE A 79 -8.265 -5.611 -0.134 1.00 0.00 O ATOM 1238 CB PHE A 79 -9.216 -3.125 -2.230 1.00 0.00 C ATOM 1239 CG PHE A 79 -9.581 -1.669 -2.284 1.00 0.00 C ATOM 1240 CD1 PHE A 79 -8.984 -0.759 -1.426 1.00 0.00 C ATOM 1241 CD2 PHE A 79 -10.522 -1.210 -3.192 1.00 0.00 C ATOM 1242 CE1 PHE A 79 -9.319 0.581 -1.472 1.00 0.00 C ATOM 1243 CE2 PHE A 79 -10.861 0.129 -3.243 1.00 0.00 C ATOM 1244 CZ PHE A 79 -10.258 1.026 -2.382 1.00 0.00 C ATOM 0 H PHE A 79 -8.132 -2.967 0.243 1.00 0.00 H new ATOM 0 HA PHE A 79 -10.735 -3.828 -0.881 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -8.137 -3.225 -2.345 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -9.675 -3.638 -3.075 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -8.248 -1.101 -0.713 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -10.996 -1.907 -3.868 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -8.847 1.280 -0.797 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -11.596 0.474 -3.955 1.00 0.00 H new ATOM 0 HZ PHE A 79 -10.520 2.073 -2.421 1.00 0.00 H new ATOM 1254 N ASP A 80 -9.704 -6.081 -1.798 1.00 0.00 N ATOM 1255 CA ASP A 80 -9.313 -7.482 -1.889 1.00 0.00 C ATOM 1256 C ASP A 80 -9.568 -8.028 -3.290 1.00 0.00 C ATOM 1257 O ASP A 80 -10.503 -7.607 -3.971 1.00 0.00 O ATOM 1258 CB ASP A 80 -10.076 -8.315 -0.857 1.00 0.00 C ATOM 1259 CG ASP A 80 -11.510 -7.854 -0.688 1.00 0.00 C ATOM 1260 OD1 ASP A 80 -11.729 -6.840 0.008 1.00 0.00 O ATOM 1261 OD2 ASP A 80 -12.414 -8.506 -1.251 1.00 0.00 O ATOM 0 H ASP A 80 -10.432 -5.803 -2.456 1.00 0.00 H new ATOM 0 HA ASP A 80 -8.245 -7.549 -1.681 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -10.067 -9.362 -1.161 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -9.563 -8.257 0.103 1.00 0.00 H new ATOM 1266 N PHE A 81 -8.729 -8.967 -3.716 1.00 0.00 N ATOM 1267 CA PHE A 81 -8.861 -9.569 -5.037 1.00 0.00 C ATOM 1268 C PHE A 81 -8.603 -11.071 -4.979 1.00 0.00 C ATOM 1269 O PHE A 81 -7.615 -11.520 -4.397 1.00 0.00 O ATOM 1270 CB PHE A 81 -7.891 -8.911 -6.021 1.00 0.00 C ATOM 1271 CG PHE A 81 -7.749 -7.429 -5.822 1.00 0.00 C ATOM 1272 CD1 PHE A 81 -6.939 -6.926 -4.816 1.00 0.00 C ATOM 1273 CD2 PHE A 81 -8.425 -6.539 -6.641 1.00 0.00 C ATOM 1274 CE1 PHE A 81 -6.808 -5.563 -4.630 1.00 0.00 C ATOM 1275 CE2 PHE A 81 -8.296 -5.174 -6.460 1.00 0.00 C ATOM 1276 CZ PHE A 81 -7.486 -4.686 -5.454 1.00 0.00 C ATOM 0 H PHE A 81 -7.950 -9.327 -3.165 1.00 0.00 H new ATOM 0 HA PHE A 81 -9.882 -9.407 -5.381 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -6.911 -9.379 -5.921 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -8.233 -9.102 -7.038 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -6.404 -7.607 -4.170 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -9.060 -6.915 -7.430 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -6.176 -5.184 -3.841 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -8.828 -4.490 -7.105 1.00 0.00 H new ATOM 0 HZ PHE A 81 -7.383 -3.620 -5.312 1.00 0.00 H new ATOM 1286 N SER A 82 -9.498 -11.844 -5.586 1.00 0.00 N ATOM 1287 CA SER A 82 -9.370 -13.296 -5.600 1.00 0.00 C ATOM 1288 C SER A 82 -8.258 -13.735 -6.548 1.00 0.00 C ATOM 1289 O SER A 82 -8.485 -13.928 -7.743 1.00 0.00 O ATOM 1290 CB SER A 82 -10.694 -13.942 -6.015 1.00 0.00 C ATOM 1291 OG SER A 82 -11.145 -13.427 -7.256 1.00 0.00 O ATOM 0 H SER A 82 -10.320 -11.488 -6.075 1.00 0.00 H new ATOM 0 HA SER A 82 -9.114 -13.623 -4.592 1.00 0.00 H new ATOM 0 HB2 SER A 82 -10.568 -15.022 -6.090 1.00 0.00 H new ATOM 0 HB3 SER A 82 -11.447 -13.762 -5.248 1.00 0.00 H new ATOM 0 HG SER A 82 -10.416 -13.463 -7.910 1.00 0.00 H new ATOM 1297 N VAL A 83 -7.054 -13.890 -6.006 1.00 0.00 N ATOM 1298 CA VAL A 83 -5.906 -14.307 -6.802 1.00 0.00 C ATOM 1299 C VAL A 83 -4.991 -15.231 -6.005 1.00 0.00 C ATOM 1300 O VAL A 83 -4.685 -14.966 -4.843 1.00 0.00 O ATOM 1301 CB VAL A 83 -5.092 -13.094 -7.291 1.00 0.00 C ATOM 1302 CG1 VAL A 83 -4.666 -12.228 -6.116 1.00 0.00 C ATOM 1303 CG2 VAL A 83 -3.883 -13.552 -8.092 1.00 0.00 C ATOM 0 H VAL A 83 -6.849 -13.733 -5.019 1.00 0.00 H new ATOM 0 HA VAL A 83 -6.298 -14.845 -7.665 1.00 0.00 H new ATOM 0 HB VAL A 83 -5.725 -12.493 -7.944 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.092 -11.376 -6.481 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -5.550 -11.871 -5.588 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -4.050 -12.816 -5.435 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -3.319 -12.682 -8.430 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -3.246 -14.176 -7.465 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -4.216 -14.127 -8.956 1.00 0.00 H new ATOM 1313 N SER A 84 -4.557 -16.315 -6.639 1.00 0.00 N ATOM 1314 CA SER A 84 -3.680 -17.281 -5.988 1.00 0.00 C ATOM 1315 C SER A 84 -2.256 -16.741 -5.889 1.00 0.00 C ATOM 1316 O SER A 84 -1.814 -15.963 -6.736 1.00 0.00 O ATOM 1317 CB SER A 84 -3.683 -18.604 -6.757 1.00 0.00 C ATOM 1318 OG SER A 84 -4.946 -18.845 -7.352 1.00 0.00 O ATOM 0 H SER A 84 -4.798 -16.547 -7.603 1.00 0.00 H new ATOM 0 HA SER A 84 -4.056 -17.454 -4.980 1.00 0.00 H new ATOM 0 HB2 SER A 84 -2.913 -18.582 -7.528 1.00 0.00 H new ATOM 0 HB3 SER A 84 -3.434 -19.422 -6.081 1.00 0.00 H new ATOM 0 HG SER A 84 -4.921 -19.695 -7.839 1.00 0.00 H new ATOM 1324 N LEU A 85 -1.543 -17.159 -4.849 1.00 0.00 N ATOM 1325 CA LEU A 85 -0.169 -16.718 -4.637 1.00 0.00 C ATOM 1326 C LEU A 85 0.677 -16.954 -5.884 1.00 0.00 C ATOM 1327 O LEU A 85 1.450 -16.096 -6.312 1.00 0.00 O ATOM 1328 CB LEU A 85 0.445 -17.453 -3.444 1.00 0.00 C ATOM 1329 CG LEU A 85 1.972 -17.520 -3.411 1.00 0.00 C ATOM 1330 CD1 LEU A 85 2.552 -16.225 -2.865 1.00 0.00 C ATOM 1331 CD2 LEU A 85 2.436 -18.707 -2.578 1.00 0.00 C ATOM 0 H LEU A 85 -1.894 -17.803 -4.140 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.185 -15.648 -4.428 1.00 0.00 H new ATOM 0 HB2 LEU A 85 0.103 -16.969 -2.529 1.00 0.00 H new ATOM 0 HB3 LEU A 85 0.056 -18.471 -3.431 1.00 0.00 H new ATOM 0 HG LEU A 85 2.332 -17.654 -4.431 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.640 -16.292 -2.849 1.00 0.00 H new ATOM 0 HD12 LEU A 85 2.249 -15.394 -3.501 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.184 -16.060 -1.852 1.00 0.00 H new ATOM 0 HD21 LEU A 85 3.525 -18.739 -2.566 1.00 0.00 H new ATOM 0 HD22 LEU A 85 2.064 -18.604 -1.559 1.00 0.00 H new ATOM 0 HD23 LEU A 85 2.051 -19.629 -3.013 1.00 0.00 H new ATOM 1343 N PRO A 86 0.528 -18.144 -6.484 1.00 0.00 N ATOM 1344 CA PRO A 86 1.268 -18.520 -7.693 1.00 0.00 C ATOM 1345 C PRO A 86 1.223 -17.433 -8.761 1.00 0.00 C ATOM 1346 O PRO A 86 2.225 -17.156 -9.420 1.00 0.00 O ATOM 1347 CB PRO A 86 0.542 -19.777 -8.177 1.00 0.00 C ATOM 1348 CG PRO A 86 -0.071 -20.357 -6.950 1.00 0.00 C ATOM 1349 CD PRO A 86 -0.375 -19.215 -6.029 1.00 0.00 C ATOM 0 HA PRO A 86 2.328 -18.675 -7.491 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -0.216 -19.534 -8.921 1.00 0.00 H new ATOM 0 HB3 PRO A 86 1.234 -20.479 -8.644 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -0.980 -20.906 -7.196 1.00 0.00 H new ATOM 0 HG3 PRO A 86 0.610 -21.064 -6.476 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -1.420 -18.913 -6.098 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -0.188 -19.480 -4.988 1.00 0.00 H new ATOM 1357 N GLU A 87 0.055 -16.821 -8.927 1.00 0.00 N ATOM 1358 CA GLU A 87 -0.119 -15.764 -9.917 1.00 0.00 C ATOM 1359 C GLU A 87 0.366 -14.423 -9.372 1.00 0.00 C ATOM 1360 O GLU A 87 1.244 -13.785 -9.953 1.00 0.00 O ATOM 1361 CB GLU A 87 -1.588 -15.658 -10.330 1.00 0.00 C ATOM 1362 CG GLU A 87 -2.030 -16.750 -11.290 1.00 0.00 C ATOM 1363 CD GLU A 87 -1.880 -18.140 -10.703 1.00 0.00 C ATOM 1364 OE1 GLU A 87 -2.812 -18.595 -10.008 1.00 0.00 O ATOM 1365 OE2 GLU A 87 -0.829 -18.772 -10.939 1.00 0.00 O ATOM 0 H GLU A 87 -0.784 -17.038 -8.390 1.00 0.00 H new ATOM 0 HA GLU A 87 0.479 -16.019 -10.792 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -2.212 -15.697 -9.437 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -1.757 -14.687 -10.795 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -3.072 -16.587 -11.565 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -1.444 -16.682 -12.206 1.00 0.00 H new ATOM 1372 N VAL A 88 -0.214 -14.002 -8.253 1.00 0.00 N ATOM 1373 CA VAL A 88 0.157 -12.738 -7.629 1.00 0.00 C ATOM 1374 C VAL A 88 1.671 -12.615 -7.495 1.00 0.00 C ATOM 1375 O VAL A 88 2.219 -11.513 -7.529 1.00 0.00 O ATOM 1376 CB VAL A 88 -0.484 -12.590 -6.236 1.00 0.00 C ATOM 1377 CG1 VAL A 88 0.400 -13.221 -5.171 1.00 0.00 C ATOM 1378 CG2 VAL A 88 -0.745 -11.124 -5.923 1.00 0.00 C ATOM 0 H VAL A 88 -0.943 -14.518 -7.760 1.00 0.00 H new ATOM 0 HA VAL A 88 -0.214 -11.944 -8.278 1.00 0.00 H new ATOM 0 HB VAL A 88 -1.440 -13.114 -6.238 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -0.069 -13.106 -4.194 1.00 0.00 H new ATOM 0 HG12 VAL A 88 0.531 -14.281 -5.388 1.00 0.00 H new ATOM 0 HG13 VAL A 88 1.372 -12.728 -5.166 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -1.198 -11.038 -4.935 1.00 0.00 H new ATOM 0 HG22 VAL A 88 0.197 -10.575 -5.939 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -1.421 -10.707 -6.670 1.00 0.00 H new ATOM 1388 N GLN A 89 2.340 -13.753 -7.342 1.00 0.00 N ATOM 1389 CA GLN A 89 3.792 -13.772 -7.203 1.00 0.00 C ATOM 1390 C GLN A 89 4.461 -13.077 -8.384 1.00 0.00 C ATOM 1391 O GLN A 89 5.243 -12.144 -8.205 1.00 0.00 O ATOM 1392 CB GLN A 89 4.295 -15.212 -7.091 1.00 0.00 C ATOM 1393 CG GLN A 89 4.239 -15.769 -5.678 1.00 0.00 C ATOM 1394 CD GLN A 89 4.414 -17.274 -5.636 1.00 0.00 C ATOM 1395 OE1 GLN A 89 4.161 -17.968 -6.621 1.00 0.00 O ATOM 1396 NE2 GLN A 89 4.850 -17.787 -4.491 1.00 0.00 N ATOM 0 H GLN A 89 1.901 -14.673 -7.311 1.00 0.00 H new ATOM 0 HA GLN A 89 4.052 -13.232 -6.293 1.00 0.00 H new ATOM 0 HB2 GLN A 89 3.700 -15.848 -7.747 1.00 0.00 H new ATOM 0 HB3 GLN A 89 5.323 -15.258 -7.450 1.00 0.00 H new ATOM 0 HG2 GLN A 89 5.017 -15.300 -5.076 1.00 0.00 H new ATOM 0 HG3 GLN A 89 3.283 -15.506 -5.225 1.00 0.00 H new ATOM 0 HE21 GLN A 89 5.047 -17.174 -3.700 1.00 0.00 H new ATOM 0 HE22 GLN A 89 4.988 -18.794 -4.403 1.00 0.00 H new ATOM 1405 N ARG A 90 4.149 -13.539 -9.591 1.00 0.00 N ATOM 1406 CA ARG A 90 4.721 -12.962 -10.801 1.00 0.00 C ATOM 1407 C ARG A 90 4.121 -11.589 -11.086 1.00 0.00 C ATOM 1408 O ARG A 90 4.725 -10.767 -11.776 1.00 0.00 O ATOM 1409 CB ARG A 90 4.487 -13.890 -11.994 1.00 0.00 C ATOM 1410 CG ARG A 90 3.036 -13.949 -12.444 1.00 0.00 C ATOM 1411 CD ARG A 90 2.920 -14.373 -13.899 1.00 0.00 C ATOM 1412 NE ARG A 90 1.569 -14.183 -14.419 1.00 0.00 N ATOM 1413 CZ ARG A 90 1.219 -14.453 -15.672 1.00 0.00 C ATOM 1414 NH1 ARG A 90 2.115 -14.923 -16.528 1.00 0.00 N ATOM 1415 NH2 ARG A 90 -0.032 -14.254 -16.070 1.00 0.00 N ATOM 0 H ARG A 90 3.503 -14.311 -9.756 1.00 0.00 H new ATOM 0 HA ARG A 90 5.793 -12.845 -10.645 1.00 0.00 H new ATOM 0 HB2 ARG A 90 5.104 -13.558 -12.829 1.00 0.00 H new ATOM 0 HB3 ARG A 90 4.819 -14.895 -11.733 1.00 0.00 H new ATOM 0 HG2 ARG A 90 2.487 -14.650 -11.815 1.00 0.00 H new ATOM 0 HG3 ARG A 90 2.573 -12.971 -12.311 1.00 0.00 H new ATOM 0 HD2 ARG A 90 3.624 -13.799 -14.501 1.00 0.00 H new ATOM 0 HD3 ARG A 90 3.201 -15.422 -13.994 1.00 0.00 H new ATOM 0 HE ARG A 90 0.855 -13.823 -13.786 1.00 0.00 H new ATOM 0 HH11 ARG A 90 3.077 -15.079 -16.226 1.00 0.00 H new ATOM 0 HH12 ARG A 90 1.843 -15.129 -17.489 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -0.725 -13.894 -15.414 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -0.300 -14.461 -17.032 1.00 0.00 H new ATOM 1429 N ARG A 91 2.930 -11.347 -10.549 1.00 0.00 N ATOM 1430 CA ARG A 91 2.247 -10.074 -10.747 1.00 0.00 C ATOM 1431 C ARG A 91 2.887 -8.977 -9.901 1.00 0.00 C ATOM 1432 O ARG A 91 3.769 -9.242 -9.084 1.00 0.00 O ATOM 1433 CB ARG A 91 0.764 -10.206 -10.394 1.00 0.00 C ATOM 1434 CG ARG A 91 0.009 -11.176 -11.287 1.00 0.00 C ATOM 1435 CD ARG A 91 -1.451 -10.780 -11.432 1.00 0.00 C ATOM 1436 NE ARG A 91 -2.241 -11.824 -12.078 1.00 0.00 N ATOM 1437 CZ ARG A 91 -3.476 -11.638 -12.530 1.00 0.00 C ATOM 1438 NH1 ARG A 91 -4.060 -10.454 -12.407 1.00 0.00 N ATOM 1439 NH2 ARG A 91 -4.130 -12.638 -13.108 1.00 0.00 N ATOM 0 H ARG A 91 2.418 -12.015 -9.973 1.00 0.00 H new ATOM 0 HA ARG A 91 2.340 -9.800 -11.798 1.00 0.00 H new ATOM 0 HB2 ARG A 91 0.674 -10.533 -9.358 1.00 0.00 H new ATOM 0 HB3 ARG A 91 0.295 -9.224 -10.460 1.00 0.00 H new ATOM 0 HG2 ARG A 91 0.478 -11.207 -12.270 1.00 0.00 H new ATOM 0 HG3 ARG A 91 0.075 -12.181 -10.871 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -1.868 -10.567 -10.448 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -1.521 -9.861 -12.014 1.00 0.00 H new ATOM 0 HE ARG A 91 -1.821 -12.747 -12.188 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -3.561 -9.683 -11.964 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -5.009 -10.315 -12.755 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -3.684 -13.550 -13.205 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -5.078 -12.494 -13.455 1.00 0.00 H new ATOM 1453 N THR A 92 2.436 -7.742 -10.103 1.00 0.00 N ATOM 1454 CA THR A 92 2.965 -6.605 -9.361 1.00 0.00 C ATOM 1455 C THR A 92 1.865 -5.600 -9.038 1.00 0.00 C ATOM 1456 O THR A 92 0.971 -5.359 -9.851 1.00 0.00 O ATOM 1457 CB THR A 92 4.081 -5.892 -10.146 1.00 0.00 C ATOM 1458 OG1 THR A 92 5.062 -6.843 -10.577 1.00 0.00 O ATOM 1459 CG2 THR A 92 4.746 -4.823 -9.292 1.00 0.00 C ATOM 0 H THR A 92 1.706 -7.505 -10.774 1.00 0.00 H new ATOM 0 HA THR A 92 3.379 -6.998 -8.432 1.00 0.00 H new ATOM 0 HB THR A 92 3.633 -5.413 -11.016 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.767 -6.382 -11.077 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.531 -4.333 -9.868 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.003 -4.085 -8.990 1.00 0.00 H new ATOM 0 HG23 THR A 92 5.181 -5.284 -8.405 1.00 0.00 H new ATOM 1467 N LEU A 93 1.936 -5.015 -7.847 1.00 0.00 N ATOM 1468 CA LEU A 93 0.946 -4.034 -7.417 1.00 0.00 C ATOM 1469 C LEU A 93 1.339 -2.630 -7.867 1.00 0.00 C ATOM 1470 O LEU A 93 2.191 -1.987 -7.254 1.00 0.00 O ATOM 1471 CB LEU A 93 0.792 -4.069 -5.895 1.00 0.00 C ATOM 1472 CG LEU A 93 -0.577 -3.660 -5.349 1.00 0.00 C ATOM 1473 CD1 LEU A 93 -1.524 -4.849 -5.335 1.00 0.00 C ATOM 1474 CD2 LEU A 93 -0.439 -3.069 -3.954 1.00 0.00 C ATOM 0 H LEU A 93 2.668 -5.203 -7.162 1.00 0.00 H new ATOM 0 HA LEU A 93 -0.007 -4.290 -7.879 1.00 0.00 H new ATOM 0 HB2 LEU A 93 1.011 -5.080 -5.551 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.546 -3.414 -5.458 1.00 0.00 H new ATOM 0 HG LEU A 93 -0.996 -2.897 -6.006 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -2.493 -4.538 -4.943 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -1.647 -5.228 -6.350 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -1.112 -5.635 -4.702 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -1.423 -2.783 -3.581 1.00 0.00 H new ATOM 0 HD22 LEU A 93 0.001 -3.810 -3.287 1.00 0.00 H new ATOM 0 HD23 LEU A 93 0.203 -2.189 -3.993 1.00 0.00 H new ATOM 1486 N ASP A 94 0.709 -2.161 -8.938 1.00 0.00 N ATOM 1487 CA ASP A 94 0.991 -0.831 -9.469 1.00 0.00 C ATOM 1488 C ASP A 94 0.352 0.247 -8.599 1.00 0.00 C ATOM 1489 O ASP A 94 -0.835 0.547 -8.734 1.00 0.00 O ATOM 1490 CB ASP A 94 0.480 -0.714 -10.905 1.00 0.00 C ATOM 1491 CG ASP A 94 0.071 0.702 -11.260 1.00 0.00 C ATOM 1492 OD1 ASP A 94 0.910 1.616 -11.120 1.00 0.00 O ATOM 1493 OD2 ASP A 94 -1.089 0.896 -11.680 1.00 0.00 O ATOM 0 H ASP A 94 0.000 -2.681 -9.456 1.00 0.00 H new ATOM 0 HA ASP A 94 2.071 -0.685 -9.463 1.00 0.00 H new ATOM 0 HB2 ASP A 94 1.257 -1.048 -11.593 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -0.372 -1.380 -11.040 1.00 0.00 H new ATOM 1498 N VAL A 95 1.146 0.826 -7.705 1.00 0.00 N ATOM 1499 CA VAL A 95 0.659 1.871 -6.812 1.00 0.00 C ATOM 1500 C VAL A 95 1.210 3.236 -7.211 1.00 0.00 C ATOM 1501 O VAL A 95 2.356 3.566 -6.908 1.00 0.00 O ATOM 1502 CB VAL A 95 1.041 1.583 -5.348 1.00 0.00 C ATOM 1503 CG1 VAL A 95 0.323 2.541 -4.410 1.00 0.00 C ATOM 1504 CG2 VAL A 95 0.728 0.138 -4.991 1.00 0.00 C ATOM 0 H VAL A 95 2.130 0.589 -7.579 1.00 0.00 H new ATOM 0 HA VAL A 95 -0.427 1.881 -6.900 1.00 0.00 H new ATOM 0 HB VAL A 95 2.114 1.737 -5.233 1.00 0.00 H new ATOM 0 HG11 VAL A 95 0.605 2.322 -3.380 1.00 0.00 H new ATOM 0 HG12 VAL A 95 0.603 3.566 -4.653 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -0.755 2.422 -4.524 1.00 0.00 H new ATOM 0 HG21 VAL A 95 1.004 -0.048 -3.953 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -0.338 -0.046 -5.122 1.00 0.00 H new ATOM 0 HG23 VAL A 95 1.294 -0.528 -5.642 1.00 0.00 H new ATOM 1514 N ALA A 96 0.386 4.025 -7.893 1.00 0.00 N ATOM 1515 CA ALA A 96 0.791 5.355 -8.331 1.00 0.00 C ATOM 1516 C ALA A 96 -0.144 6.424 -7.775 1.00 0.00 C ATOM 1517 O ALA A 96 -1.366 6.297 -7.855 1.00 0.00 O ATOM 1518 CB ALA A 96 0.827 5.421 -9.850 1.00 0.00 C ATOM 0 H ALA A 96 -0.565 3.766 -8.154 1.00 0.00 H new ATOM 0 HA ALA A 96 1.792 5.549 -7.946 1.00 0.00 H new ATOM 0 HB1 ALA A 96 1.131 6.420 -10.164 1.00 0.00 H new ATOM 0 HB2 ALA A 96 1.540 4.689 -10.229 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -0.164 5.202 -10.247 1.00 0.00 H new ATOM 1524 N VAL A 97 0.438 7.477 -7.210 1.00 0.00 N ATOM 1525 CA VAL A 97 -0.343 8.568 -6.640 1.00 0.00 C ATOM 1526 C VAL A 97 -0.137 9.859 -7.424 1.00 0.00 C ATOM 1527 O VAL A 97 0.876 10.541 -7.264 1.00 0.00 O ATOM 1528 CB VAL A 97 0.025 8.812 -5.165 1.00 0.00 C ATOM 1529 CG1 VAL A 97 -0.781 9.970 -4.597 1.00 0.00 C ATOM 1530 CG2 VAL A 97 -0.192 7.548 -4.346 1.00 0.00 C ATOM 0 H VAL A 97 1.448 7.597 -7.135 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.390 8.272 -6.701 1.00 0.00 H new ATOM 0 HB VAL A 97 1.081 9.076 -5.111 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -0.507 10.127 -3.554 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.570 10.874 -5.168 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -1.844 9.740 -4.662 1.00 0.00 H new ATOM 0 HG21 VAL A 97 0.073 7.738 -3.306 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.239 7.251 -4.405 1.00 0.00 H new ATOM 0 HG23 VAL A 97 0.435 6.748 -4.739 1.00 0.00 H new ATOM 1540 N LYS A 98 -1.103 10.190 -8.273 1.00 0.00 N ATOM 1541 CA LYS A 98 -1.030 11.401 -9.082 1.00 0.00 C ATOM 1542 C LYS A 98 -2.324 12.203 -8.981 1.00 0.00 C ATOM 1543 O LYS A 98 -3.242 11.827 -8.254 1.00 0.00 O ATOM 1544 CB LYS A 98 -0.752 11.046 -10.545 1.00 0.00 C ATOM 1545 CG LYS A 98 -1.769 10.090 -11.143 1.00 0.00 C ATOM 1546 CD LYS A 98 -1.149 9.219 -12.222 1.00 0.00 C ATOM 1547 CE LYS A 98 -2.065 8.066 -12.603 1.00 0.00 C ATOM 1548 NZ LYS A 98 -3.090 8.479 -13.602 1.00 0.00 N ATOM 0 H LYS A 98 -1.947 9.636 -8.419 1.00 0.00 H new ATOM 0 HA LYS A 98 -0.213 12.013 -8.700 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -0.736 11.962 -11.136 1.00 0.00 H new ATOM 0 HB3 LYS A 98 0.240 10.601 -10.620 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -2.182 9.458 -10.357 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -2.599 10.657 -11.564 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -0.939 9.825 -13.104 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -0.195 8.826 -11.870 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -1.470 7.248 -13.010 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -2.561 7.686 -11.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -4.025 8.510 -13.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -2.853 9.421 -13.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -3.108 7.794 -14.384 1.00 0.00 H new ATOM 1562 N ASN A 99 -2.389 13.308 -9.715 1.00 0.00 N ATOM 1563 CA ASN A 99 -3.571 14.162 -9.708 1.00 0.00 C ATOM 1564 C ASN A 99 -4.602 13.673 -10.721 1.00 0.00 C ATOM 1565 O ASN A 99 -4.300 13.519 -11.904 1.00 0.00 O ATOM 1566 CB ASN A 99 -3.183 15.609 -10.018 1.00 0.00 C ATOM 1567 CG ASN A 99 -2.396 15.733 -11.309 1.00 0.00 C ATOM 1568 OD1 ASN A 99 -1.287 15.213 -11.425 1.00 0.00 O ATOM 1569 ND2 ASN A 99 -2.970 16.425 -12.286 1.00 0.00 N ATOM 0 H ASN A 99 -1.637 13.634 -10.322 1.00 0.00 H new ATOM 0 HA ASN A 99 -4.014 14.117 -8.713 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -4.085 16.218 -10.086 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -2.590 16.008 -9.195 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -2.489 16.543 -13.178 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -3.892 16.839 -12.145 1.00 0.00 H new ATOM 1576 N SER A 100 -5.820 13.430 -10.247 1.00 0.00 N ATOM 1577 CA SER A 100 -6.895 12.955 -11.110 1.00 0.00 C ATOM 1578 C SER A 100 -7.006 13.817 -12.364 1.00 0.00 C ATOM 1579 O SER A 100 -7.260 13.312 -13.457 1.00 0.00 O ATOM 1580 CB SER A 100 -8.225 12.963 -10.354 1.00 0.00 C ATOM 1581 OG SER A 100 -9.321 13.040 -11.250 1.00 0.00 O ATOM 0 H SER A 100 -6.087 13.554 -9.270 1.00 0.00 H new ATOM 0 HA SER A 100 -6.662 11.934 -11.411 1.00 0.00 H new ATOM 0 HB2 SER A 100 -8.308 12.060 -9.749 1.00 0.00 H new ATOM 0 HB3 SER A 100 -8.252 13.810 -9.668 1.00 0.00 H new ATOM 0 HG SER A 100 -10.159 13.042 -10.742 1.00 0.00 H new ATOM 1587 N GLY A 101 -6.813 15.122 -12.198 1.00 0.00 N ATOM 1588 CA GLY A 101 -6.895 16.033 -13.324 1.00 0.00 C ATOM 1589 C GLY A 101 -6.940 17.486 -12.892 1.00 0.00 C ATOM 1590 O GLY A 101 -6.589 17.815 -11.760 1.00 0.00 O ATOM 0 H GLY A 101 -6.601 15.564 -11.304 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -6.036 15.878 -13.977 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -7.785 15.803 -13.909 1.00 0.00 H new ATOM 1594 N GLY A 102 -7.372 18.358 -13.798 1.00 0.00 N ATOM 1595 CA GLY A 102 -7.452 19.773 -13.486 1.00 0.00 C ATOM 1596 C GLY A 102 -8.007 20.589 -14.637 1.00 0.00 C ATOM 1597 O GLY A 102 -9.030 21.259 -14.495 1.00 0.00 O ATOM 0 H GLY A 102 -7.668 18.110 -14.742 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -8.082 19.913 -12.608 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -6.459 20.142 -13.228 1.00 0.00 H new ATOM 1601 N PHE A 103 -7.329 20.536 -15.779 1.00 0.00 N ATOM 1602 CA PHE A 103 -7.759 21.279 -16.957 1.00 0.00 C ATOM 1603 C PHE A 103 -8.936 20.586 -17.638 1.00 0.00 C ATOM 1604 O PHE A 103 -9.267 19.444 -17.319 1.00 0.00 O ATOM 1605 CB PHE A 103 -6.599 21.427 -17.944 1.00 0.00 C ATOM 1606 CG PHE A 103 -6.946 22.236 -19.161 1.00 0.00 C ATOM 1607 CD1 PHE A 103 -7.364 23.552 -19.038 1.00 0.00 C ATOM 1608 CD2 PHE A 103 -6.854 21.683 -20.428 1.00 0.00 C ATOM 1609 CE1 PHE A 103 -7.685 24.299 -20.155 1.00 0.00 C ATOM 1610 CE2 PHE A 103 -7.173 22.425 -21.549 1.00 0.00 C ATOM 1611 CZ PHE A 103 -7.588 23.735 -21.413 1.00 0.00 C ATOM 0 H PHE A 103 -6.480 19.987 -15.913 1.00 0.00 H new ATOM 0 HA PHE A 103 -8.081 22.269 -16.634 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -5.757 21.895 -17.435 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -6.271 20.436 -18.258 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -7.440 23.999 -18.058 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -6.529 20.659 -20.541 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -8.011 25.323 -20.045 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -7.098 21.981 -22.531 1.00 0.00 H new ATOM 0 HZ PHE A 103 -7.836 24.318 -22.288 1.00 0.00 H new ATOM 1621 N LEU A 104 -9.563 21.285 -18.577 1.00 0.00 N ATOM 1622 CA LEU A 104 -10.704 20.738 -19.304 1.00 0.00 C ATOM 1623 C LEU A 104 -10.388 19.348 -19.847 1.00 0.00 C ATOM 1624 O LEU A 104 -11.084 18.379 -19.542 1.00 0.00 O ATOM 1625 CB LEU A 104 -11.096 21.669 -20.453 1.00 0.00 C ATOM 1626 CG LEU A 104 -11.608 23.053 -20.050 1.00 0.00 C ATOM 1627 CD1 LEU A 104 -11.700 23.962 -21.266 1.00 0.00 C ATOM 1628 CD2 LEU A 104 -12.960 22.942 -19.361 1.00 0.00 C ATOM 0 H LEU A 104 -9.301 22.231 -18.853 1.00 0.00 H new ATOM 0 HA LEU A 104 -11.540 20.656 -18.609 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -10.229 21.799 -21.101 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -11.867 21.177 -21.046 1.00 0.00 H new ATOM 0 HG LEU A 104 -10.900 23.491 -19.347 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -12.066 24.942 -20.961 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -10.713 24.067 -21.717 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -12.387 23.529 -21.993 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -13.309 23.936 -19.081 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -13.678 22.483 -20.041 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -12.863 22.327 -18.467 1.00 0.00 H new ATOM 1640 N SER A 105 -9.334 19.257 -20.651 1.00 0.00 N ATOM 1641 CA SER A 105 -8.926 17.986 -21.237 1.00 0.00 C ATOM 1642 C SER A 105 -8.150 17.146 -20.228 1.00 0.00 C ATOM 1643 O SER A 105 -7.683 17.654 -19.208 1.00 0.00 O ATOM 1644 CB SER A 105 -8.072 18.225 -22.483 1.00 0.00 C ATOM 1645 OG SER A 105 -8.803 18.924 -23.476 1.00 0.00 O ATOM 0 H SER A 105 -8.747 20.049 -20.912 1.00 0.00 H new ATOM 0 HA SER A 105 -9.826 17.441 -21.521 1.00 0.00 H new ATOM 0 HB2 SER A 105 -7.182 18.794 -22.214 1.00 0.00 H new ATOM 0 HB3 SER A 105 -7.731 17.270 -22.883 1.00 0.00 H new ATOM 0 HG SER A 105 -8.235 19.066 -24.262 1.00 0.00 H new ATOM 1651 N LYS A 106 -8.015 15.857 -20.519 1.00 0.00 N ATOM 1652 CA LYS A 106 -7.294 14.944 -19.640 1.00 0.00 C ATOM 1653 C LYS A 106 -5.829 15.352 -19.514 1.00 0.00 C ATOM 1654 O LYS A 106 -5.362 16.246 -20.220 1.00 0.00 O ATOM 1655 CB LYS A 106 -7.392 13.511 -20.167 1.00 0.00 C ATOM 1656 CG LYS A 106 -8.819 13.010 -20.306 1.00 0.00 C ATOM 1657 CD LYS A 106 -9.478 12.823 -18.950 1.00 0.00 C ATOM 1658 CE LYS A 106 -8.973 11.569 -18.253 1.00 0.00 C ATOM 1659 NZ LYS A 106 -9.272 11.587 -16.794 1.00 0.00 N ATOM 0 H LYS A 106 -8.396 15.420 -21.358 1.00 0.00 H new ATOM 0 HA LYS A 106 -7.753 14.993 -18.652 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -6.900 13.456 -21.138 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -6.847 12.848 -19.495 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -9.398 13.718 -20.899 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -8.822 12.064 -20.847 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -9.279 13.693 -18.325 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -10.559 12.761 -19.075 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -9.432 10.691 -18.707 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -7.897 11.479 -18.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -8.912 10.716 -16.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -8.813 12.411 -16.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -10.300 11.647 -16.651 1.00 0.00 H new ATOM 1673 N ASP A 107 -5.111 14.691 -18.614 1.00 0.00 N ATOM 1674 CA ASP A 107 -3.699 14.983 -18.398 1.00 0.00 C ATOM 1675 C ASP A 107 -2.982 13.783 -17.788 1.00 0.00 C ATOM 1676 O ASP A 107 -3.585 12.986 -17.068 1.00 0.00 O ATOM 1677 CB ASP A 107 -3.541 16.204 -17.490 1.00 0.00 C ATOM 1678 CG ASP A 107 -2.089 16.513 -17.182 1.00 0.00 C ATOM 1679 OD1 ASP A 107 -1.266 16.488 -18.121 1.00 0.00 O ATOM 1680 OD2 ASP A 107 -1.776 16.779 -16.003 1.00 0.00 O ATOM 0 H ASP A 107 -5.483 13.949 -18.022 1.00 0.00 H new ATOM 0 HA ASP A 107 -3.247 15.199 -19.366 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -4.000 17.070 -17.967 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -4.078 16.032 -16.557 1.00 0.00 H new ATOM 1685 N LYS A 108 -1.692 13.659 -18.080 1.00 0.00 N ATOM 1686 CA LYS A 108 -0.892 12.556 -17.560 1.00 0.00 C ATOM 1687 C LYS A 108 0.079 13.045 -16.490 1.00 0.00 C ATOM 1688 O LYS A 108 1.038 12.356 -16.146 1.00 0.00 O ATOM 1689 CB LYS A 108 -0.118 11.881 -18.695 1.00 0.00 C ATOM 1690 CG LYS A 108 -0.989 11.028 -19.602 1.00 0.00 C ATOM 1691 CD LYS A 108 -1.270 9.668 -18.986 1.00 0.00 C ATOM 1692 CE LYS A 108 -1.717 8.662 -20.036 1.00 0.00 C ATOM 1693 NZ LYS A 108 -0.566 8.110 -20.801 1.00 0.00 N ATOM 0 H LYS A 108 -1.178 14.309 -18.674 1.00 0.00 H new ATOM 0 HA LYS A 108 -1.569 11.831 -17.108 1.00 0.00 H new ATOM 0 HB2 LYS A 108 0.374 12.647 -19.294 1.00 0.00 H new ATOM 0 HB3 LYS A 108 0.667 11.257 -18.267 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -1.930 11.543 -19.794 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -0.495 10.897 -20.565 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -0.373 9.301 -18.487 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -2.042 9.766 -18.222 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -2.256 7.847 -19.552 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -2.414 9.141 -20.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -0.913 7.429 -21.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -0.067 8.884 -21.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 0.087 7.631 -20.148 1.00 0.00 H new ATOM 1707 N GLY A 109 -0.179 14.240 -15.965 1.00 0.00 N ATOM 1708 CA GLY A 109 0.681 14.800 -14.939 1.00 0.00 C ATOM 1709 C GLY A 109 0.887 13.851 -13.775 1.00 0.00 C ATOM 1710 O GLY A 109 0.110 13.850 -12.819 1.00 0.00 O ATOM 0 H GLY A 109 -0.968 14.829 -16.232 1.00 0.00 H new ATOM 0 HA2 GLY A 109 1.648 15.050 -15.376 1.00 0.00 H new ATOM 0 HA3 GLY A 109 0.247 15.730 -14.573 1.00 0.00 H new ATOM 1714 N LEU A 110 1.936 13.039 -13.854 1.00 0.00 N ATOM 1715 CA LEU A 110 2.242 12.079 -12.799 1.00 0.00 C ATOM 1716 C LEU A 110 3.089 12.722 -11.706 1.00 0.00 C ATOM 1717 O LEU A 110 4.184 13.222 -11.968 1.00 0.00 O ATOM 1718 CB LEU A 110 2.973 10.868 -13.381 1.00 0.00 C ATOM 1719 CG LEU A 110 3.753 10.012 -12.383 1.00 0.00 C ATOM 1720 CD1 LEU A 110 2.804 9.168 -11.547 1.00 0.00 C ATOM 1721 CD2 LEU A 110 4.757 9.128 -13.109 1.00 0.00 C ATOM 0 H LEU A 110 2.589 13.026 -14.638 1.00 0.00 H new ATOM 0 HA LEU A 110 1.301 11.750 -12.357 1.00 0.00 H new ATOM 0 HB2 LEU A 110 2.242 10.233 -13.880 1.00 0.00 H new ATOM 0 HB3 LEU A 110 3.665 11.220 -14.146 1.00 0.00 H new ATOM 0 HG LEU A 110 4.300 10.676 -11.714 1.00 0.00 H new ATOM 0 HD11 LEU A 110 3.377 8.566 -10.843 1.00 0.00 H new ATOM 0 HD12 LEU A 110 2.125 9.820 -10.998 1.00 0.00 H new ATOM 0 HD13 LEU A 110 2.228 8.512 -12.200 1.00 0.00 H new ATOM 0 HD21 LEU A 110 5.303 8.526 -12.383 1.00 0.00 H new ATOM 0 HD22 LEU A 110 4.230 8.472 -13.802 1.00 0.00 H new ATOM 0 HD23 LEU A 110 5.458 9.753 -13.663 1.00 0.00 H new ATOM 1733 N LEU A 111 2.577 12.705 -10.480 1.00 0.00 N ATOM 1734 CA LEU A 111 3.288 13.285 -9.346 1.00 0.00 C ATOM 1735 C LEU A 111 4.300 12.297 -8.775 1.00 0.00 C ATOM 1736 O LEU A 111 5.490 12.597 -8.679 1.00 0.00 O ATOM 1737 CB LEU A 111 2.298 13.703 -8.258 1.00 0.00 C ATOM 1738 CG LEU A 111 1.072 14.485 -8.731 1.00 0.00 C ATOM 1739 CD1 LEU A 111 0.138 14.770 -7.565 1.00 0.00 C ATOM 1740 CD2 LEU A 111 1.495 15.781 -9.407 1.00 0.00 C ATOM 0 H LEU A 111 1.672 12.296 -10.246 1.00 0.00 H new ATOM 0 HA LEU A 111 3.826 14.166 -9.698 1.00 0.00 H new ATOM 0 HB2 LEU A 111 1.955 12.806 -7.743 1.00 0.00 H new ATOM 0 HB3 LEU A 111 2.830 14.309 -7.524 1.00 0.00 H new ATOM 0 HG LEU A 111 0.535 13.877 -9.459 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.729 15.327 -7.921 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -0.191 13.829 -7.124 1.00 0.00 H new ATOM 0 HD13 LEU A 111 0.664 15.358 -6.813 1.00 0.00 H new ATOM 0 HD21 LEU A 111 0.610 16.325 -9.737 1.00 0.00 H new ATOM 0 HD22 LEU A 111 2.055 16.394 -8.701 1.00 0.00 H new ATOM 0 HD23 LEU A 111 2.124 15.554 -10.268 1.00 0.00 H new ATOM 1752 N GLY A 112 3.820 11.115 -8.400 1.00 0.00 N ATOM 1753 CA GLY A 112 4.697 10.100 -7.846 1.00 0.00 C ATOM 1754 C GLY A 112 4.095 8.710 -7.921 1.00 0.00 C ATOM 1755 O GLY A 112 2.874 8.555 -7.955 1.00 0.00 O ATOM 0 H GLY A 112 2.840 10.842 -8.470 1.00 0.00 H new ATOM 0 HA2 GLY A 112 5.646 10.111 -8.383 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.916 10.342 -6.806 1.00 0.00 H new ATOM 1759 N LYS A 113 4.954 7.697 -7.950 1.00 0.00 N ATOM 1760 CA LYS A 113 4.501 6.312 -8.023 1.00 0.00 C ATOM 1761 C LYS A 113 5.558 5.365 -7.463 1.00 0.00 C ATOM 1762 O LYS A 113 6.736 5.712 -7.381 1.00 0.00 O ATOM 1763 CB LYS A 113 4.178 5.935 -9.470 1.00 0.00 C ATOM 1764 CG LYS A 113 5.401 5.862 -10.368 1.00 0.00 C ATOM 1765 CD LYS A 113 5.020 5.558 -11.807 1.00 0.00 C ATOM 1766 CE LYS A 113 4.752 4.075 -12.011 1.00 0.00 C ATOM 1767 NZ LYS A 113 3.321 3.733 -11.778 1.00 0.00 N ATOM 0 H LYS A 113 5.968 7.808 -7.924 1.00 0.00 H new ATOM 0 HA LYS A 113 3.598 6.218 -7.420 1.00 0.00 H new ATOM 0 HB2 LYS A 113 3.672 4.970 -9.481 1.00 0.00 H new ATOM 0 HB3 LYS A 113 3.480 6.665 -9.880 1.00 0.00 H new ATOM 0 HG2 LYS A 113 5.941 6.808 -10.326 1.00 0.00 H new ATOM 0 HG3 LYS A 113 6.078 5.091 -10.000 1.00 0.00 H new ATOM 0 HD2 LYS A 113 4.133 6.130 -12.078 1.00 0.00 H new ATOM 0 HD3 LYS A 113 5.822 5.879 -12.472 1.00 0.00 H new ATOM 0 HE2 LYS A 113 5.033 3.791 -13.025 1.00 0.00 H new ATOM 0 HE3 LYS A 113 5.379 3.496 -11.333 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 3.019 3.014 -12.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 3.206 3.359 -10.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 2.737 4.587 -11.890 1.00 0.00 H new ATOM 1781 N VAL A 114 5.129 4.166 -7.081 1.00 0.00 N ATOM 1782 CA VAL A 114 6.038 3.168 -6.532 1.00 0.00 C ATOM 1783 C VAL A 114 5.551 1.755 -6.836 1.00 0.00 C ATOM 1784 O VAL A 114 4.360 1.461 -6.732 1.00 0.00 O ATOM 1785 CB VAL A 114 6.194 3.328 -5.008 1.00 0.00 C ATOM 1786 CG1 VAL A 114 4.857 3.134 -4.311 1.00 0.00 C ATOM 1787 CG2 VAL A 114 7.231 2.352 -4.474 1.00 0.00 C ATOM 0 H VAL A 114 4.157 3.863 -7.142 1.00 0.00 H new ATOM 0 HA VAL A 114 7.006 3.326 -7.007 1.00 0.00 H new ATOM 0 HB VAL A 114 6.541 4.340 -4.800 1.00 0.00 H new ATOM 0 HG11 VAL A 114 4.987 3.251 -3.235 1.00 0.00 H new ATOM 0 HG12 VAL A 114 4.147 3.877 -4.673 1.00 0.00 H new ATOM 0 HG13 VAL A 114 4.477 2.135 -4.524 1.00 0.00 H new ATOM 0 HG21 VAL A 114 7.329 2.479 -3.396 1.00 0.00 H new ATOM 0 HG22 VAL A 114 6.917 1.331 -4.693 1.00 0.00 H new ATOM 0 HG23 VAL A 114 8.192 2.545 -4.950 1.00 0.00 H new ATOM 1797 N LEU A 115 6.481 0.883 -7.211 1.00 0.00 N ATOM 1798 CA LEU A 115 6.147 -0.501 -7.530 1.00 0.00 C ATOM 1799 C LEU A 115 6.493 -1.426 -6.367 1.00 0.00 C ATOM 1800 O LEU A 115 7.445 -1.180 -5.626 1.00 0.00 O ATOM 1801 CB LEU A 115 6.890 -0.948 -8.790 1.00 0.00 C ATOM 1802 CG LEU A 115 6.291 -0.489 -10.120 1.00 0.00 C ATOM 1803 CD1 LEU A 115 4.984 -1.216 -10.396 1.00 0.00 C ATOM 1804 CD2 LEU A 115 6.076 1.017 -10.117 1.00 0.00 C ATOM 0 H LEU A 115 7.471 1.110 -7.302 1.00 0.00 H new ATOM 0 HA LEU A 115 5.073 -0.558 -7.709 1.00 0.00 H new ATOM 0 HB2 LEU A 115 7.916 -0.584 -8.731 1.00 0.00 H new ATOM 0 HB3 LEU A 115 6.938 -2.037 -8.792 1.00 0.00 H new ATOM 0 HG LEU A 115 6.994 -0.733 -10.917 1.00 0.00 H new ATOM 0 HD11 LEU A 115 4.572 -0.876 -11.346 1.00 0.00 H new ATOM 0 HD12 LEU A 115 5.168 -2.289 -10.443 1.00 0.00 H new ATOM 0 HD13 LEU A 115 4.274 -1.004 -9.597 1.00 0.00 H new ATOM 0 HD21 LEU A 115 5.649 1.326 -11.071 1.00 0.00 H new ATOM 0 HD22 LEU A 115 5.394 1.286 -9.311 1.00 0.00 H new ATOM 0 HD23 LEU A 115 7.031 1.521 -9.967 1.00 0.00 H new ATOM 1816 N VAL A 116 5.714 -2.492 -6.214 1.00 0.00 N ATOM 1817 CA VAL A 116 5.939 -3.456 -5.144 1.00 0.00 C ATOM 1818 C VAL A 116 5.888 -4.886 -5.672 1.00 0.00 C ATOM 1819 O VAL A 116 4.894 -5.303 -6.267 1.00 0.00 O ATOM 1820 CB VAL A 116 4.900 -3.299 -4.019 1.00 0.00 C ATOM 1821 CG1 VAL A 116 4.979 -4.470 -3.051 1.00 0.00 C ATOM 1822 CG2 VAL A 116 5.101 -1.979 -3.289 1.00 0.00 C ATOM 0 H VAL A 116 4.921 -2.710 -6.818 1.00 0.00 H new ATOM 0 HA VAL A 116 6.932 -3.255 -4.742 1.00 0.00 H new ATOM 0 HB VAL A 116 3.905 -3.294 -4.465 1.00 0.00 H new ATOM 0 HG11 VAL A 116 4.237 -4.341 -2.263 1.00 0.00 H new ATOM 0 HG12 VAL A 116 4.782 -5.399 -3.587 1.00 0.00 H new ATOM 0 HG13 VAL A 116 5.975 -4.510 -2.609 1.00 0.00 H new ATOM 0 HG21 VAL A 116 4.358 -1.884 -2.497 1.00 0.00 H new ATOM 0 HG22 VAL A 116 6.100 -1.952 -2.854 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.989 -1.154 -3.992 1.00 0.00 H new ATOM 1832 N ALA A 117 6.965 -5.632 -5.451 1.00 0.00 N ATOM 1833 CA ALA A 117 7.042 -7.015 -5.902 1.00 0.00 C ATOM 1834 C ALA A 117 6.317 -7.948 -4.938 1.00 0.00 C ATOM 1835 O ALA A 117 6.759 -8.154 -3.807 1.00 0.00 O ATOM 1836 CB ALA A 117 8.495 -7.440 -6.059 1.00 0.00 C ATOM 0 H ALA A 117 7.797 -5.301 -4.962 1.00 0.00 H new ATOM 0 HA ALA A 117 6.549 -7.082 -6.872 1.00 0.00 H new ATOM 0 HB1 ALA A 117 8.537 -8.476 -6.396 1.00 0.00 H new ATOM 0 HB2 ALA A 117 8.984 -6.799 -6.793 1.00 0.00 H new ATOM 0 HB3 ALA A 117 9.006 -7.350 -5.100 1.00 0.00 H new ATOM 1842 N LEU A 118 5.203 -8.511 -5.392 1.00 0.00 N ATOM 1843 CA LEU A 118 4.416 -9.422 -4.568 1.00 0.00 C ATOM 1844 C LEU A 118 4.962 -10.843 -4.654 1.00 0.00 C ATOM 1845 O LEU A 118 4.262 -11.808 -4.348 1.00 0.00 O ATOM 1846 CB LEU A 118 2.950 -9.400 -5.006 1.00 0.00 C ATOM 1847 CG LEU A 118 2.334 -8.017 -5.219 1.00 0.00 C ATOM 1848 CD1 LEU A 118 0.905 -8.141 -5.723 1.00 0.00 C ATOM 1849 CD2 LEU A 118 2.379 -7.209 -3.931 1.00 0.00 C ATOM 0 H LEU A 118 4.824 -8.353 -6.326 1.00 0.00 H new ATOM 0 HA LEU A 118 4.485 -9.088 -3.533 1.00 0.00 H new ATOM 0 HB2 LEU A 118 2.861 -9.962 -5.935 1.00 0.00 H new ATOM 0 HB3 LEU A 118 2.360 -9.927 -4.256 1.00 0.00 H new ATOM 0 HG LEU A 118 2.919 -7.492 -5.974 1.00 0.00 H new ATOM 0 HD11 LEU A 118 0.483 -7.147 -5.869 1.00 0.00 H new ATOM 0 HD12 LEU A 118 0.899 -8.680 -6.670 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.307 -8.685 -4.992 1.00 0.00 H new ATOM 0 HD21 LEU A 118 1.936 -6.228 -4.101 1.00 0.00 H new ATOM 0 HD22 LEU A 118 1.818 -7.730 -3.155 1.00 0.00 H new ATOM 0 HD23 LEU A 118 3.415 -7.090 -3.612 1.00 0.00 H new ATOM 1861 N ALA A 119 6.219 -10.964 -5.071 1.00 0.00 N ATOM 1862 CA ALA A 119 6.861 -12.267 -5.193 1.00 0.00 C ATOM 1863 C ALA A 119 7.551 -12.663 -3.891 1.00 0.00 C ATOM 1864 O ALA A 119 8.473 -13.478 -3.890 1.00 0.00 O ATOM 1865 CB ALA A 119 7.860 -12.258 -6.340 1.00 0.00 C ATOM 0 H ALA A 119 6.812 -10.176 -5.330 1.00 0.00 H new ATOM 0 HA ALA A 119 6.089 -13.007 -5.404 1.00 0.00 H new ATOM 0 HB1 ALA A 119 8.332 -13.237 -6.419 1.00 0.00 H new ATOM 0 HB2 ALA A 119 7.343 -12.028 -7.271 1.00 0.00 H new ATOM 0 HB3 ALA A 119 8.623 -11.502 -6.152 1.00 0.00 H new ATOM 1871 N SER A 120 7.099 -12.080 -2.786 1.00 0.00 N ATOM 1872 CA SER A 120 7.676 -12.368 -1.479 1.00 0.00 C ATOM 1873 C SER A 120 6.793 -13.336 -0.696 1.00 0.00 C ATOM 1874 O SER A 120 5.571 -13.328 -0.837 1.00 0.00 O ATOM 1875 CB SER A 120 7.863 -11.075 -0.683 1.00 0.00 C ATOM 1876 OG SER A 120 8.273 -11.348 0.645 1.00 0.00 O ATOM 0 H SER A 120 6.334 -11.405 -2.770 1.00 0.00 H new ATOM 0 HA SER A 120 8.649 -12.834 -1.635 1.00 0.00 H new ATOM 0 HB2 SER A 120 8.606 -10.446 -1.174 1.00 0.00 H new ATOM 0 HB3 SER A 120 6.929 -10.514 -0.670 1.00 0.00 H new ATOM 0 HG SER A 120 8.387 -10.505 1.132 1.00 0.00 H new ATOM 1882 N GLU A 121 7.423 -14.168 0.127 1.00 0.00 N ATOM 1883 CA GLU A 121 6.694 -15.143 0.931 1.00 0.00 C ATOM 1884 C GLU A 121 6.108 -14.489 2.179 1.00 0.00 C ATOM 1885 O GLU A 121 5.050 -14.891 2.663 1.00 0.00 O ATOM 1886 CB GLU A 121 7.616 -16.297 1.332 1.00 0.00 C ATOM 1887 CG GLU A 121 7.864 -17.294 0.213 1.00 0.00 C ATOM 1888 CD GLU A 121 6.611 -18.050 -0.183 1.00 0.00 C ATOM 1889 OE1 GLU A 121 6.231 -18.992 0.543 1.00 0.00 O ATOM 1890 OE2 GLU A 121 6.010 -17.700 -1.221 1.00 0.00 O ATOM 0 H GLU A 121 8.435 -14.187 0.255 1.00 0.00 H new ATOM 0 HA GLU A 121 5.875 -15.534 0.328 1.00 0.00 H new ATOM 0 HB2 GLU A 121 8.571 -15.890 1.663 1.00 0.00 H new ATOM 0 HB3 GLU A 121 7.181 -16.820 2.183 1.00 0.00 H new ATOM 0 HG2 GLU A 121 8.256 -16.768 -0.657 1.00 0.00 H new ATOM 0 HG3 GLU A 121 8.628 -18.005 0.527 1.00 0.00 H new ATOM 1897 N GLU A 122 6.802 -13.479 2.693 1.00 0.00 N ATOM 1898 CA GLU A 122 6.351 -12.771 3.885 1.00 0.00 C ATOM 1899 C GLU A 122 4.865 -12.435 3.789 1.00 0.00 C ATOM 1900 O GLU A 122 4.197 -12.226 4.802 1.00 0.00 O ATOM 1901 CB GLU A 122 7.163 -11.489 4.082 1.00 0.00 C ATOM 1902 CG GLU A 122 8.631 -11.739 4.384 1.00 0.00 C ATOM 1903 CD GLU A 122 9.455 -10.467 4.364 1.00 0.00 C ATOM 1904 OE1 GLU A 122 9.798 -9.998 3.258 1.00 0.00 O ATOM 1905 OE2 GLU A 122 9.758 -9.939 5.454 1.00 0.00 O ATOM 0 H GLU A 122 7.678 -13.133 2.303 1.00 0.00 H new ATOM 0 HA GLU A 122 6.503 -13.425 4.744 1.00 0.00 H new ATOM 0 HB2 GLU A 122 7.085 -10.878 3.183 1.00 0.00 H new ATOM 0 HB3 GLU A 122 6.726 -10.914 4.898 1.00 0.00 H new ATOM 0 HG2 GLU A 122 8.722 -12.211 5.362 1.00 0.00 H new ATOM 0 HG3 GLU A 122 9.034 -12.440 3.653 1.00 0.00 H new ATOM 1912 N LEU A 123 4.355 -12.386 2.563 1.00 0.00 N ATOM 1913 CA LEU A 123 2.948 -12.075 2.332 1.00 0.00 C ATOM 1914 C LEU A 123 2.054 -12.853 3.293 1.00 0.00 C ATOM 1915 O LEU A 123 1.131 -12.296 3.885 1.00 0.00 O ATOM 1916 CB LEU A 123 2.565 -12.396 0.887 1.00 0.00 C ATOM 1917 CG LEU A 123 2.896 -11.322 -0.150 1.00 0.00 C ATOM 1918 CD1 LEU A 123 2.835 -11.900 -1.555 1.00 0.00 C ATOM 1919 CD2 LEU A 123 1.946 -10.141 -0.015 1.00 0.00 C ATOM 0 H LEU A 123 4.894 -12.557 1.714 1.00 0.00 H new ATOM 0 HA LEU A 123 2.802 -11.010 2.511 1.00 0.00 H new ATOM 0 HB2 LEU A 123 3.065 -13.320 0.596 1.00 0.00 H new ATOM 0 HB3 LEU A 123 1.493 -12.589 0.851 1.00 0.00 H new ATOM 0 HG LEU A 123 3.911 -10.969 0.031 1.00 0.00 H new ATOM 0 HD11 LEU A 123 3.073 -11.121 -2.279 1.00 0.00 H new ATOM 0 HD12 LEU A 123 3.556 -12.713 -1.646 1.00 0.00 H new ATOM 0 HD13 LEU A 123 1.832 -12.281 -1.749 1.00 0.00 H new ATOM 0 HD21 LEU A 123 2.196 -9.386 -0.761 1.00 0.00 H new ATOM 0 HD22 LEU A 123 0.921 -10.479 -0.170 1.00 0.00 H new ATOM 0 HD23 LEU A 123 2.039 -9.711 0.982 1.00 0.00 H new ATOM 1931 N ALA A 124 2.336 -14.143 3.442 1.00 0.00 N ATOM 1932 CA ALA A 124 1.561 -14.996 4.333 1.00 0.00 C ATOM 1933 C ALA A 124 1.221 -14.270 5.631 1.00 0.00 C ATOM 1934 O ALA A 124 0.148 -14.468 6.202 1.00 0.00 O ATOM 1935 CB ALA A 124 2.321 -16.281 4.629 1.00 0.00 C ATOM 0 H ALA A 124 3.096 -14.620 2.957 1.00 0.00 H new ATOM 0 HA ALA A 124 0.626 -15.247 3.832 1.00 0.00 H new ATOM 0 HB1 ALA A 124 1.729 -16.908 5.296 1.00 0.00 H new ATOM 0 HB2 ALA A 124 2.507 -16.816 3.698 1.00 0.00 H new ATOM 0 HB3 ALA A 124 3.271 -16.040 5.105 1.00 0.00 H new ATOM 1941 N LYS A 125 2.141 -13.430 6.091 1.00 0.00 N ATOM 1942 CA LYS A 125 1.940 -12.673 7.321 1.00 0.00 C ATOM 1943 C LYS A 125 1.577 -11.224 7.015 1.00 0.00 C ATOM 1944 O LYS A 125 0.638 -10.675 7.590 1.00 0.00 O ATOM 1945 CB LYS A 125 3.201 -12.722 8.187 1.00 0.00 C ATOM 1946 CG LYS A 125 3.460 -14.084 8.808 1.00 0.00 C ATOM 1947 CD LYS A 125 4.805 -14.128 9.513 1.00 0.00 C ATOM 1948 CE LYS A 125 5.273 -15.559 9.732 1.00 0.00 C ATOM 1949 NZ LYS A 125 6.530 -15.616 10.528 1.00 0.00 N ATOM 0 H LYS A 125 3.034 -13.256 5.630 1.00 0.00 H new ATOM 0 HA LYS A 125 1.114 -13.129 7.867 1.00 0.00 H new ATOM 0 HB2 LYS A 125 4.060 -12.440 7.579 1.00 0.00 H new ATOM 0 HB3 LYS A 125 3.115 -11.980 8.981 1.00 0.00 H new ATOM 0 HG2 LYS A 125 2.668 -14.317 9.519 1.00 0.00 H new ATOM 0 HG3 LYS A 125 3.429 -14.850 8.033 1.00 0.00 H new ATOM 0 HD2 LYS A 125 5.545 -13.589 8.922 1.00 0.00 H new ATOM 0 HD3 LYS A 125 4.731 -13.617 10.473 1.00 0.00 H new ATOM 0 HE2 LYS A 125 4.493 -16.122 10.245 1.00 0.00 H new ATOM 0 HE3 LYS A 125 5.432 -16.041 8.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 6.816 -16.608 10.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 7.282 -15.101 10.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 6.372 -15.179 11.459 1.00 0.00 H new ATOM 1963 N GLY A 126 2.326 -10.610 6.105 1.00 0.00 N ATOM 1964 CA GLY A 126 2.066 -9.230 5.737 1.00 0.00 C ATOM 1965 C GLY A 126 3.042 -8.265 6.380 1.00 0.00 C ATOM 1966 O GLY A 126 3.654 -8.579 7.401 1.00 0.00 O ATOM 0 H GLY A 126 3.109 -11.043 5.615 1.00 0.00 H new ATOM 0 HA2 GLY A 126 2.121 -9.130 4.653 1.00 0.00 H new ATOM 0 HA3 GLY A 126 1.050 -8.964 6.030 1.00 0.00 H new ATOM 1970 N TRP A 127 3.190 -7.089 5.781 1.00 0.00 N ATOM 1971 CA TRP A 127 4.100 -6.076 6.302 1.00 0.00 C ATOM 1972 C TRP A 127 3.553 -4.674 6.056 1.00 0.00 C ATOM 1973 O TRP A 127 2.770 -4.455 5.131 1.00 0.00 O ATOM 1974 CB TRP A 127 5.479 -6.219 5.655 1.00 0.00 C ATOM 1975 CG TRP A 127 5.499 -5.831 4.207 1.00 0.00 C ATOM 1976 CD1 TRP A 127 5.689 -4.578 3.697 1.00 0.00 C ATOM 1977 CD2 TRP A 127 5.320 -6.701 3.084 1.00 0.00 C ATOM 1978 NE1 TRP A 127 5.639 -4.618 2.324 1.00 0.00 N ATOM 1979 CE2 TRP A 127 5.415 -5.908 1.924 1.00 0.00 C ATOM 1980 CE3 TRP A 127 5.092 -8.073 2.946 1.00 0.00 C ATOM 1981 CZ2 TRP A 127 5.288 -6.443 0.645 1.00 0.00 C ATOM 1982 CZ3 TRP A 127 4.965 -8.602 1.676 1.00 0.00 C ATOM 1983 CH2 TRP A 127 5.064 -7.789 0.539 1.00 0.00 C ATOM 0 H TRP A 127 2.692 -6.814 4.935 1.00 0.00 H new ATOM 0 HA TRP A 127 4.193 -6.226 7.378 1.00 0.00 H new ATOM 0 HB2 TRP A 127 6.194 -5.601 6.199 1.00 0.00 H new ATOM 0 HB3 TRP A 127 5.812 -7.252 5.752 1.00 0.00 H new ATOM 0 HD1 TRP A 127 5.854 -3.688 4.286 1.00 0.00 H new ATOM 0 HE1 TRP A 127 5.751 -3.816 1.703 1.00 0.00 H new ATOM 0 HE3 TRP A 127 5.016 -8.708 3.816 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 5.364 -5.818 -0.233 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 4.786 -9.661 1.558 1.00 0.00 H new ATOM 0 HH2 TRP A 127 4.962 -8.233 -0.440 1.00 0.00 H new ATOM 1994 N THR A 128 3.969 -3.726 6.889 1.00 0.00 N ATOM 1995 CA THR A 128 3.519 -2.345 6.762 1.00 0.00 C ATOM 1996 C THR A 128 4.702 -1.389 6.657 1.00 0.00 C ATOM 1997 O THR A 128 5.614 -1.424 7.482 1.00 0.00 O ATOM 1998 CB THR A 128 2.642 -1.928 7.958 1.00 0.00 C ATOM 1999 OG1 THR A 128 1.500 -2.787 8.050 1.00 0.00 O ATOM 2000 CG2 THR A 128 2.186 -0.484 7.817 1.00 0.00 C ATOM 0 H THR A 128 4.617 -3.889 7.659 1.00 0.00 H new ATOM 0 HA THR A 128 2.927 -2.288 5.849 1.00 0.00 H new ATOM 0 HB THR A 128 3.238 -2.017 8.866 1.00 0.00 H new ATOM 0 HG1 THR A 128 0.948 -2.517 8.813 1.00 0.00 H new ATOM 0 HG21 THR A 128 1.568 -0.212 8.673 1.00 0.00 H new ATOM 0 HG22 THR A 128 3.057 0.170 7.776 1.00 0.00 H new ATOM 0 HG23 THR A 128 1.606 -0.374 6.901 1.00 0.00 H new ATOM 2008 N GLN A 129 4.678 -0.536 5.638 1.00 0.00 N ATOM 2009 CA GLN A 129 5.750 0.429 5.425 1.00 0.00 C ATOM 2010 C GLN A 129 5.295 1.552 4.499 1.00 0.00 C ATOM 2011 O GLN A 129 4.373 1.377 3.702 1.00 0.00 O ATOM 2012 CB GLN A 129 6.981 -0.264 4.840 1.00 0.00 C ATOM 2013 CG GLN A 129 6.814 -0.676 3.386 1.00 0.00 C ATOM 2014 CD GLN A 129 8.088 -1.240 2.789 1.00 0.00 C ATOM 2015 OE1 GLN A 129 9.085 -0.533 2.643 1.00 0.00 O ATOM 2016 NE2 GLN A 129 8.061 -2.521 2.440 1.00 0.00 N ATOM 0 H GLN A 129 3.928 -0.494 4.947 1.00 0.00 H new ATOM 0 HA GLN A 129 6.011 0.862 6.390 1.00 0.00 H new ATOM 0 HB2 GLN A 129 7.838 0.404 4.923 1.00 0.00 H new ATOM 0 HB3 GLN A 129 7.207 -1.148 5.436 1.00 0.00 H new ATOM 0 HG2 GLN A 129 6.022 -1.421 3.312 1.00 0.00 H new ATOM 0 HG3 GLN A 129 6.495 0.187 2.802 1.00 0.00 H new ATOM 0 HE21 GLN A 129 7.212 -3.070 2.579 1.00 0.00 H new ATOM 0 HE22 GLN A 129 8.889 -2.956 2.033 1.00 0.00 H new ATOM 2025 N TRP A 130 5.947 2.704 4.610 1.00 0.00 N ATOM 2026 CA TRP A 130 5.609 3.856 3.781 1.00 0.00 C ATOM 2027 C TRP A 130 6.396 3.838 2.476 1.00 0.00 C ATOM 2028 O TRP A 130 7.600 4.098 2.462 1.00 0.00 O ATOM 2029 CB TRP A 130 5.886 5.155 4.541 1.00 0.00 C ATOM 2030 CG TRP A 130 4.893 5.429 5.630 1.00 0.00 C ATOM 2031 CD1 TRP A 130 4.970 5.021 6.931 1.00 0.00 C ATOM 2032 CD2 TRP A 130 3.674 6.171 5.511 1.00 0.00 C ATOM 2033 NE1 TRP A 130 3.873 5.464 7.628 1.00 0.00 N ATOM 2034 CE2 TRP A 130 3.063 6.172 6.780 1.00 0.00 C ATOM 2035 CE3 TRP A 130 3.041 6.834 4.458 1.00 0.00 C ATOM 2036 CZ2 TRP A 130 1.849 6.811 7.021 1.00 0.00 C ATOM 2037 CZ3 TRP A 130 1.836 7.468 4.698 1.00 0.00 C ATOM 2038 CH2 TRP A 130 1.251 7.454 5.971 1.00 0.00 C ATOM 0 H TRP A 130 6.712 2.865 5.265 1.00 0.00 H new ATOM 0 HA TRP A 130 4.547 3.802 3.543 1.00 0.00 H new ATOM 0 HB2 TRP A 130 6.885 5.108 4.974 1.00 0.00 H new ATOM 0 HB3 TRP A 130 5.882 5.987 3.837 1.00 0.00 H new ATOM 0 HD1 TRP A 130 5.775 4.436 7.350 1.00 0.00 H new ATOM 0 HE1 TRP A 130 3.691 5.294 8.617 1.00 0.00 H new ATOM 0 HE3 TRP A 130 3.485 6.851 3.473 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 1.396 6.800 8.001 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 1.337 7.983 3.890 1.00 0.00 H new ATOM 0 HH2 TRP A 130 0.310 7.960 6.127 1.00 0.00 H new ATOM 2049 N TYR A 131 5.711 3.529 1.381 1.00 0.00 N ATOM 2050 CA TYR A 131 6.348 3.475 0.070 1.00 0.00 C ATOM 2051 C TYR A 131 6.576 4.879 -0.483 1.00 0.00 C ATOM 2052 O TYR A 131 5.640 5.542 -0.930 1.00 0.00 O ATOM 2053 CB TYR A 131 5.491 2.665 -0.903 1.00 0.00 C ATOM 2054 CG TYR A 131 5.269 1.234 -0.468 1.00 0.00 C ATOM 2055 CD1 TYR A 131 6.337 0.430 -0.087 1.00 0.00 C ATOM 2056 CD2 TYR A 131 3.993 0.686 -0.438 1.00 0.00 C ATOM 2057 CE1 TYR A 131 6.139 -0.878 0.311 1.00 0.00 C ATOM 2058 CE2 TYR A 131 3.786 -0.621 -0.041 1.00 0.00 C ATOM 2059 CZ TYR A 131 4.862 -1.399 0.332 1.00 0.00 C ATOM 2060 OH TYR A 131 4.661 -2.702 0.729 1.00 0.00 O ATOM 0 H TYR A 131 4.714 3.312 1.375 1.00 0.00 H new ATOM 0 HA TYR A 131 7.316 2.987 0.184 1.00 0.00 H new ATOM 0 HB2 TYR A 131 4.524 3.155 -1.017 1.00 0.00 H new ATOM 0 HB3 TYR A 131 5.968 2.668 -1.883 1.00 0.00 H new ATOM 0 HD1 TYR A 131 7.338 0.835 -0.102 1.00 0.00 H new ATOM 0 HD2 TYR A 131 3.148 1.292 -0.730 1.00 0.00 H new ATOM 0 HE1 TYR A 131 6.980 -1.489 0.604 1.00 0.00 H new ATOM 0 HE2 TYR A 131 2.787 -1.031 -0.023 1.00 0.00 H new ATOM 0 HH TYR A 131 3.777 -2.785 1.143 1.00 0.00 H new ATOM 2070 N ASP A 132 7.827 5.325 -0.449 1.00 0.00 N ATOM 2071 CA ASP A 132 8.181 6.648 -0.948 1.00 0.00 C ATOM 2072 C ASP A 132 7.900 6.758 -2.443 1.00 0.00 C ATOM 2073 O ASP A 132 8.507 6.056 -3.253 1.00 0.00 O ATOM 2074 CB ASP A 132 9.655 6.944 -0.670 1.00 0.00 C ATOM 2075 CG ASP A 132 10.570 6.382 -1.740 1.00 0.00 C ATOM 2076 OD1 ASP A 132 10.856 5.168 -1.698 1.00 0.00 O ATOM 2077 OD2 ASP A 132 11.000 7.157 -2.620 1.00 0.00 O ATOM 0 H ASP A 132 8.613 4.789 -0.081 1.00 0.00 H new ATOM 0 HA ASP A 132 7.567 7.382 -0.426 1.00 0.00 H new ATOM 0 HB2 ASP A 132 9.800 8.022 -0.602 1.00 0.00 H new ATOM 0 HB3 ASP A 132 9.931 6.524 0.297 1.00 0.00 H new ATOM 2082 N LEU A 133 6.976 7.643 -2.803 1.00 0.00 N ATOM 2083 CA LEU A 133 6.613 7.844 -4.201 1.00 0.00 C ATOM 2084 C LEU A 133 7.786 8.417 -4.991 1.00 0.00 C ATOM 2085 O LEU A 133 8.337 9.460 -4.637 1.00 0.00 O ATOM 2086 CB LEU A 133 5.407 8.780 -4.306 1.00 0.00 C ATOM 2087 CG LEU A 133 4.088 8.238 -3.755 1.00 0.00 C ATOM 2088 CD1 LEU A 133 3.049 9.345 -3.673 1.00 0.00 C ATOM 2089 CD2 LEU A 133 3.581 7.091 -4.617 1.00 0.00 C ATOM 0 H LEU A 133 6.465 8.232 -2.146 1.00 0.00 H new ATOM 0 HA LEU A 133 6.351 6.875 -4.626 1.00 0.00 H new ATOM 0 HB2 LEU A 133 5.644 9.706 -3.782 1.00 0.00 H new ATOM 0 HB3 LEU A 133 5.261 9.036 -5.355 1.00 0.00 H new ATOM 0 HG LEU A 133 4.265 7.859 -2.749 1.00 0.00 H new ATOM 0 HD11 LEU A 133 2.117 8.941 -3.279 1.00 0.00 H new ATOM 0 HD12 LEU A 133 3.410 10.134 -3.014 1.00 0.00 H new ATOM 0 HD13 LEU A 133 2.875 9.755 -4.668 1.00 0.00 H new ATOM 0 HD21 LEU A 133 2.641 6.718 -4.210 1.00 0.00 H new ATOM 0 HD22 LEU A 133 3.420 7.445 -5.635 1.00 0.00 H new ATOM 0 HD23 LEU A 133 4.318 6.288 -4.624 1.00 0.00 H new ATOM 2101 N THR A 134 8.162 7.730 -6.065 1.00 0.00 N ATOM 2102 CA THR A 134 9.268 8.170 -6.906 1.00 0.00 C ATOM 2103 C THR A 134 8.786 8.523 -8.308 1.00 0.00 C ATOM 2104 O THR A 134 7.673 8.172 -8.698 1.00 0.00 O ATOM 2105 CB THR A 134 10.361 7.090 -7.008 1.00 0.00 C ATOM 2106 OG1 THR A 134 9.826 5.908 -7.614 1.00 0.00 O ATOM 2107 CG2 THR A 134 10.919 6.753 -5.633 1.00 0.00 C ATOM 0 H THR A 134 7.716 6.866 -6.373 1.00 0.00 H new ATOM 0 HA THR A 134 9.689 9.058 -6.435 1.00 0.00 H new ATOM 0 HB THR A 134 11.170 7.480 -7.625 1.00 0.00 H new ATOM 0 HG1 THR A 134 8.847 5.959 -7.623 1.00 0.00 H new ATOM 0 HG21 THR A 134 11.689 5.988 -5.730 1.00 0.00 H new ATOM 0 HG22 THR A 134 11.351 7.648 -5.186 1.00 0.00 H new ATOM 0 HG23 THR A 134 10.117 6.381 -4.996 1.00 0.00 H new ATOM 2115 N GLU A 135 9.631 9.220 -9.061 1.00 0.00 N ATOM 2116 CA GLU A 135 9.289 9.620 -10.421 1.00 0.00 C ATOM 2117 C GLU A 135 9.266 8.413 -11.354 1.00 0.00 C ATOM 2118 O GLU A 135 9.916 7.400 -11.093 1.00 0.00 O ATOM 2119 CB GLU A 135 10.288 10.658 -10.937 1.00 0.00 C ATOM 2120 CG GLU A 135 10.309 11.940 -10.122 1.00 0.00 C ATOM 2121 CD GLU A 135 11.289 12.961 -10.666 1.00 0.00 C ATOM 2122 OE1 GLU A 135 10.908 13.724 -11.578 1.00 0.00 O ATOM 2123 OE2 GLU A 135 12.438 12.998 -10.178 1.00 0.00 O ATOM 0 H GLU A 135 10.556 9.519 -8.753 1.00 0.00 H new ATOM 0 HA GLU A 135 8.293 10.062 -10.403 1.00 0.00 H new ATOM 0 HB2 GLU A 135 11.286 10.221 -10.936 1.00 0.00 H new ATOM 0 HB3 GLU A 135 10.046 10.899 -11.972 1.00 0.00 H new ATOM 0 HG2 GLU A 135 9.309 12.373 -10.108 1.00 0.00 H new ATOM 0 HG3 GLU A 135 10.570 11.706 -9.090 1.00 0.00 H new ATOM 2130 N ASP A 136 8.513 8.528 -12.442 1.00 0.00 N ATOM 2131 CA ASP A 136 8.405 7.447 -13.415 1.00 0.00 C ATOM 2132 C ASP A 136 9.784 6.919 -13.797 1.00 0.00 C ATOM 2133 O ASP A 136 10.612 7.652 -14.339 1.00 0.00 O ATOM 2134 CB ASP A 136 7.666 7.928 -14.665 1.00 0.00 C ATOM 2135 CG ASP A 136 7.875 7.009 -15.852 1.00 0.00 C ATOM 2136 OD1 ASP A 136 7.659 5.788 -15.702 1.00 0.00 O ATOM 2137 OD2 ASP A 136 8.253 7.510 -16.931 1.00 0.00 O ATOM 0 H ASP A 136 7.968 9.359 -12.673 1.00 0.00 H new ATOM 0 HA ASP A 136 7.839 6.636 -12.957 1.00 0.00 H new ATOM 0 HB2 ASP A 136 6.600 8.000 -14.448 1.00 0.00 H new ATOM 0 HB3 ASP A 136 8.007 8.931 -14.922 1.00 0.00 H new ATOM 2142 N SER A 137 10.025 5.644 -13.510 1.00 0.00 N ATOM 2143 CA SER A 137 11.306 5.020 -13.819 1.00 0.00 C ATOM 2144 C SER A 137 11.213 4.192 -15.097 1.00 0.00 C ATOM 2145 O SER A 137 11.720 3.073 -15.164 1.00 0.00 O ATOM 2146 CB SER A 137 11.759 4.134 -12.656 1.00 0.00 C ATOM 2147 OG SER A 137 13.164 3.953 -12.671 1.00 0.00 O ATOM 0 H SER A 137 9.350 5.023 -13.064 1.00 0.00 H new ATOM 0 HA SER A 137 12.040 5.811 -13.972 1.00 0.00 H new ATOM 0 HB2 SER A 137 11.457 4.586 -11.711 1.00 0.00 H new ATOM 0 HB3 SER A 137 11.264 3.165 -12.718 1.00 0.00 H new ATOM 0 HG SER A 137 13.429 3.385 -11.918 1.00 0.00 H new ATOM 2153 N GLY A 138 10.560 4.752 -16.111 1.00 0.00 N ATOM 2154 CA GLY A 138 10.411 4.053 -17.374 1.00 0.00 C ATOM 2155 C GLY A 138 11.253 4.665 -18.477 1.00 0.00 C ATOM 2156 O GLY A 138 11.774 5.773 -18.349 1.00 0.00 O ATOM 0 H GLY A 138 10.132 5.677 -16.080 1.00 0.00 H new ATOM 0 HA2 GLY A 138 10.693 3.008 -17.243 1.00 0.00 H new ATOM 0 HA3 GLY A 138 9.362 4.066 -17.672 1.00 0.00 H new ATOM 2160 N PRO A 139 11.396 3.932 -19.592 1.00 0.00 N ATOM 2161 CA PRO A 139 12.180 4.389 -20.743 1.00 0.00 C ATOM 2162 C PRO A 139 11.515 5.550 -21.474 1.00 0.00 C ATOM 2163 O PRO A 139 12.190 6.454 -21.966 1.00 0.00 O ATOM 2164 CB PRO A 139 12.239 3.153 -21.645 1.00 0.00 C ATOM 2165 CG PRO A 139 11.031 2.361 -21.281 1.00 0.00 C ATOM 2166 CD PRO A 139 10.803 2.603 -19.814 1.00 0.00 C ATOM 0 HA PRO A 139 13.159 4.764 -20.446 1.00 0.00 H new ATOM 0 HB2 PRO A 139 12.227 3.431 -22.699 1.00 0.00 H new ATOM 0 HB3 PRO A 139 13.152 2.583 -21.476 1.00 0.00 H new ATOM 0 HG2 PRO A 139 10.167 2.675 -21.867 1.00 0.00 H new ATOM 0 HG3 PRO A 139 11.184 1.301 -21.482 1.00 0.00 H new ATOM 0 HD2 PRO A 139 9.742 2.590 -19.565 1.00 0.00 H new ATOM 0 HD3 PRO A 139 11.284 1.841 -19.201 1.00 0.00 H new ATOM 2174 N SER A 140 10.188 5.518 -21.542 1.00 0.00 N ATOM 2175 CA SER A 140 9.432 6.567 -22.216 1.00 0.00 C ATOM 2176 C SER A 140 8.122 6.847 -21.486 1.00 0.00 C ATOM 2177 O SER A 140 7.550 5.960 -20.852 1.00 0.00 O ATOM 2178 CB SER A 140 9.147 6.168 -23.665 1.00 0.00 C ATOM 2179 OG SER A 140 10.311 6.281 -24.464 1.00 0.00 O ATOM 0 H SER A 140 9.614 4.777 -21.139 1.00 0.00 H new ATOM 0 HA SER A 140 10.033 7.476 -22.209 1.00 0.00 H new ATOM 0 HB2 SER A 140 8.778 5.143 -23.697 1.00 0.00 H new ATOM 0 HB3 SER A 140 8.360 6.803 -24.072 1.00 0.00 H new ATOM 0 HG SER A 140 11.078 6.500 -23.895 1.00 0.00 H new ATOM 2185 N SER A 141 7.652 8.087 -21.581 1.00 0.00 N ATOM 2186 CA SER A 141 6.411 8.486 -20.927 1.00 0.00 C ATOM 2187 C SER A 141 5.215 8.259 -21.847 1.00 0.00 C ATOM 2188 O SER A 141 5.370 7.847 -22.996 1.00 0.00 O ATOM 2189 CB SER A 141 6.479 9.958 -20.514 1.00 0.00 C ATOM 2190 OG SER A 141 7.533 10.181 -19.593 1.00 0.00 O ATOM 0 H SER A 141 8.112 8.832 -22.104 1.00 0.00 H new ATOM 0 HA SER A 141 6.284 7.871 -20.036 1.00 0.00 H new ATOM 0 HB2 SER A 141 6.626 10.580 -21.397 1.00 0.00 H new ATOM 0 HB3 SER A 141 5.531 10.258 -20.067 1.00 0.00 H new ATOM 0 HG SER A 141 7.556 11.129 -19.346 1.00 0.00 H new ATOM 2196 N GLY A 142 4.020 8.531 -21.331 1.00 0.00 N ATOM 2197 CA GLY A 142 2.814 8.351 -22.118 1.00 0.00 C ATOM 2198 C GLY A 142 2.271 9.660 -22.655 1.00 0.00 C ATOM 2199 O GLY A 142 2.332 9.919 -23.857 1.00 0.00 O ATOM 0 H GLY A 142 3.866 8.873 -20.382 1.00 0.00 H new ATOM 0 HA2 GLY A 142 3.024 7.680 -22.951 1.00 0.00 H new ATOM 0 HA3 GLY A 142 2.052 7.870 -21.505 1.00 0.00 H new TER 2203 GLY A 142