USER MOD reduce.3.24.130724 H: found=0, std=0, add=756, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 754 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 77 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 90 GLN : amide:sc= -0.551 K(o=-0.55,f=0.92) USER MOD Set 2.1: A 30 CYS SG : rot 172:sc= -0.381 USER MOD Set 2.2: A 80 CYS SG : rot 102:sc= 1.69 USER MOD Set 3.1: A 25 THR OG1 : rot -41:sc= 0.484 USER MOD Set 3.2: A 68 SER OG : rot 180:sc= -0.0356 USER MOD Single : A 1 GLY N :NH3+ 137:sc= 0.00394 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot -59:sc= 0.00412 USER MOD Single : A 5 SER OG : rot 180:sc= -0.0125 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= -2.43! C(o=-2.4!,f=-12!) USER MOD Single : A 10 CYS SG : rot 22:sc= 0.315 USER MOD Single : A 12 THR OG1 : rot -150:sc= -1.08 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= 0.329 K(o=0.33,f=-5.5!) USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.0462 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 THR OG1 : rot 120:sc= 0.775 USER MOD Single : A 34 HIS : no HD1:sc= -1.43 K(o=-1.4,f=-0.77) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 135:sc= 0.182 (180deg=0) USER MOD Single : A 51 SER OG : rot 26:sc= 0.0601 USER MOD Single : A 53 LYS NZ :NH3+ 150:sc= 1.16 (180deg=-0.796) USER MOD Single : A 54 HIS : no HE2:sc= -2.51! K(o=-2.5!,f=-1.1) USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 SER OG : rot 180:sc= 0.00453 USER MOD Single : A 58 GLN : amide:sc= -1.61! X(o=-1.6!,f=-1.9) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot 180:sc= 0.0605 USER MOD Single : A 78 TYR OH : rot -4:sc= 1.29 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= -0.0559 K(o=-0.056,f=-0.76) USER MOD Single : A 86 GLN : amide:sc= -1.26 K(o=-1.3,f=-3!) USER MOD Single : A 87 SER OG : rot 120:sc= -0.196 USER MOD Single : A 94 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 13.769 28.285 -0.371 1.00 0.00 N ATOM 2 CA GLY A 1 13.728 29.086 -1.580 1.00 0.00 C ATOM 3 C GLY A 1 12.618 30.118 -1.556 1.00 0.00 C ATOM 4 O GLY A 1 11.500 29.827 -1.131 1.00 0.00 O ATOM 0 H1 GLY A 1 13.922 27.287 -0.621 1.00 0.00 H new ATOM 0 H2 GLY A 1 14.547 28.613 0.236 1.00 0.00 H new ATOM 0 H3 GLY A 1 12.868 28.380 0.139 1.00 0.00 H new ATOM 0 HA2 GLY A 1 14.686 29.590 -1.710 1.00 0.00 H new ATOM 0 HA3 GLY A 1 13.593 28.432 -2.441 1.00 0.00 H new ATOM 8 N SER A 2 12.927 31.328 -2.011 1.00 0.00 N ATOM 9 CA SER A 2 11.948 32.409 -2.035 1.00 0.00 C ATOM 10 C SER A 2 11.550 32.750 -3.468 1.00 0.00 C ATOM 11 O SER A 2 12.365 32.669 -4.386 1.00 0.00 O ATOM 12 CB SER A 2 12.511 33.650 -1.341 1.00 0.00 C ATOM 13 OG SER A 2 12.478 33.506 0.068 1.00 0.00 O ATOM 0 H SER A 2 13.847 31.585 -2.368 1.00 0.00 H new ATOM 0 HA SER A 2 11.060 32.074 -1.500 1.00 0.00 H new ATOM 0 HB2 SER A 2 13.537 33.820 -1.668 1.00 0.00 H new ATOM 0 HB3 SER A 2 11.934 34.527 -1.634 1.00 0.00 H new ATOM 0 HG SER A 2 12.845 34.312 0.488 1.00 0.00 H new ATOM 19 N SER A 3 10.290 33.131 -3.650 1.00 0.00 N ATOM 20 CA SER A 3 9.780 33.481 -4.971 1.00 0.00 C ATOM 21 C SER A 3 9.953 32.320 -5.945 1.00 0.00 C ATOM 22 O SER A 3 10.288 32.518 -7.112 1.00 0.00 O ATOM 23 CB SER A 3 10.499 34.721 -5.505 1.00 0.00 C ATOM 24 OG SER A 3 9.719 35.377 -6.491 1.00 0.00 O ATOM 0 H SER A 3 9.603 33.205 -2.900 1.00 0.00 H new ATOM 0 HA SER A 3 8.716 33.698 -4.877 1.00 0.00 H new ATOM 0 HB2 SER A 3 10.706 35.407 -4.684 1.00 0.00 H new ATOM 0 HB3 SER A 3 11.461 34.433 -5.930 1.00 0.00 H new ATOM 0 HG SER A 3 9.536 34.758 -7.228 1.00 0.00 H new ATOM 30 N GLY A 4 9.723 31.105 -5.455 1.00 0.00 N ATOM 31 CA GLY A 4 9.858 29.929 -6.294 1.00 0.00 C ATOM 32 C GLY A 4 8.544 29.196 -6.481 1.00 0.00 C ATOM 33 O GLY A 4 7.633 29.324 -5.664 1.00 0.00 O ATOM 0 H GLY A 4 9.446 30.915 -4.492 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.248 30.224 -7.268 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.588 29.252 -5.851 1.00 0.00 H new ATOM 37 N SER A 5 8.446 28.426 -7.560 1.00 0.00 N ATOM 38 CA SER A 5 7.232 27.674 -7.855 1.00 0.00 C ATOM 39 C SER A 5 7.331 26.250 -7.316 1.00 0.00 C ATOM 40 O SER A 5 6.518 25.827 -6.495 1.00 0.00 O ATOM 41 CB SER A 5 6.979 27.644 -9.363 1.00 0.00 C ATOM 42 OG SER A 5 8.142 27.247 -10.068 1.00 0.00 O ATOM 0 H SER A 5 9.193 28.307 -8.244 1.00 0.00 H new ATOM 0 HA SER A 5 6.397 28.173 -7.364 1.00 0.00 H new ATOM 0 HB2 SER A 5 6.163 26.956 -9.584 1.00 0.00 H new ATOM 0 HB3 SER A 5 6.664 28.631 -9.702 1.00 0.00 H new ATOM 0 HG SER A 5 7.953 27.234 -11.030 1.00 0.00 H new ATOM 48 N SER A 6 8.335 25.515 -7.785 1.00 0.00 N ATOM 49 CA SER A 6 8.539 24.137 -7.354 1.00 0.00 C ATOM 50 C SER A 6 9.194 24.090 -5.977 1.00 0.00 C ATOM 51 O SER A 6 10.163 24.801 -5.713 1.00 0.00 O ATOM 52 CB SER A 6 9.404 23.386 -8.369 1.00 0.00 C ATOM 53 OG SER A 6 10.665 24.014 -8.527 1.00 0.00 O ATOM 0 H SER A 6 9.019 25.851 -8.463 1.00 0.00 H new ATOM 0 HA SER A 6 7.564 23.654 -7.290 1.00 0.00 H new ATOM 0 HB2 SER A 6 9.545 22.356 -8.040 1.00 0.00 H new ATOM 0 HB3 SER A 6 8.891 23.346 -9.330 1.00 0.00 H new ATOM 0 HG SER A 6 11.200 23.515 -9.179 1.00 0.00 H new ATOM 59 N GLY A 7 8.657 23.245 -5.102 1.00 0.00 N ATOM 60 CA GLY A 7 9.201 23.120 -3.762 1.00 0.00 C ATOM 61 C GLY A 7 9.128 21.700 -3.237 1.00 0.00 C ATOM 62 O GLY A 7 8.076 21.065 -3.290 1.00 0.00 O ATOM 0 H GLY A 7 7.855 22.645 -5.297 1.00 0.00 H new ATOM 0 HA2 GLY A 7 10.240 23.451 -3.762 1.00 0.00 H new ATOM 0 HA3 GLY A 7 8.656 23.782 -3.089 1.00 0.00 H new ATOM 66 N ALA A 8 10.250 21.200 -2.730 1.00 0.00 N ATOM 67 CA ALA A 8 10.309 19.846 -2.194 1.00 0.00 C ATOM 68 C ALA A 8 9.092 19.546 -1.326 1.00 0.00 C ATOM 69 O ALA A 8 8.651 20.388 -0.546 1.00 0.00 O ATOM 70 CB ALA A 8 11.590 19.650 -1.396 1.00 0.00 C ATOM 0 H ALA A 8 11.130 21.712 -2.679 1.00 0.00 H new ATOM 0 HA ALA A 8 10.306 19.149 -3.032 1.00 0.00 H new ATOM 0 HB1 ALA A 8 11.621 18.634 -1.001 1.00 0.00 H new ATOM 0 HB2 ALA A 8 12.451 19.814 -2.044 1.00 0.00 H new ATOM 0 HB3 ALA A 8 11.617 20.361 -0.570 1.00 0.00 H new ATOM 76 N ASN A 9 8.552 18.340 -1.470 1.00 0.00 N ATOM 77 CA ASN A 9 7.384 17.929 -0.699 1.00 0.00 C ATOM 78 C ASN A 9 7.764 16.893 0.355 1.00 0.00 C ATOM 79 O ASN A 9 8.818 16.262 0.268 1.00 0.00 O ATOM 80 CB ASN A 9 6.310 17.357 -1.628 1.00 0.00 C ATOM 81 CG ASN A 9 4.908 17.577 -1.094 1.00 0.00 C ATOM 82 OD1 ASN A 9 4.720 17.872 0.086 1.00 0.00 O ATOM 83 ND2 ASN A 9 3.915 17.433 -1.964 1.00 0.00 N ATOM 0 H ASN A 9 8.904 17.631 -2.113 1.00 0.00 H new ATOM 0 HA ASN A 9 6.987 18.808 -0.192 1.00 0.00 H new ATOM 0 HB2 ASN A 9 6.399 17.821 -2.610 1.00 0.00 H new ATOM 0 HB3 ASN A 9 6.481 16.289 -1.763 1.00 0.00 H new ATOM 0 HD21 ASN A 9 2.950 17.568 -1.663 1.00 0.00 H new ATOM 0 HD22 ASN A 9 4.118 17.188 -2.933 1.00 0.00 H new ATOM 90 N CYS A 10 6.899 16.724 1.349 1.00 0.00 N ATOM 91 CA CYS A 10 7.143 15.766 2.420 1.00 0.00 C ATOM 92 C CYS A 10 5.832 15.189 2.944 1.00 0.00 C ATOM 93 O CYS A 10 4.750 15.650 2.580 1.00 0.00 O ATOM 94 CB CYS A 10 7.913 16.431 3.562 1.00 0.00 C ATOM 95 SG CYS A 10 9.698 16.529 3.290 1.00 0.00 S ATOM 0 H CYS A 10 6.022 17.238 1.435 1.00 0.00 H new ATOM 0 HA CYS A 10 7.741 14.950 2.014 1.00 0.00 H new ATOM 0 HB2 CYS A 10 7.523 17.438 3.711 1.00 0.00 H new ATOM 0 HB3 CYS A 10 7.726 15.878 4.482 1.00 0.00 H new ATOM 0 HG CYS A 10 9.948 16.455 2.016 1.00 0.00 H new ATOM 101 N PHE A 11 5.936 14.176 3.798 1.00 0.00 N ATOM 102 CA PHE A 11 4.758 13.534 4.369 1.00 0.00 C ATOM 103 C PHE A 11 4.552 13.965 5.818 1.00 0.00 C ATOM 104 O PHE A 11 5.410 13.743 6.673 1.00 0.00 O ATOM 105 CB PHE A 11 4.894 12.011 4.293 1.00 0.00 C ATOM 106 CG PHE A 11 4.691 11.460 2.910 1.00 0.00 C ATOM 107 CD1 PHE A 11 5.658 11.632 1.933 1.00 0.00 C ATOM 108 CD2 PHE A 11 3.534 10.770 2.588 1.00 0.00 C ATOM 109 CE1 PHE A 11 5.476 11.126 0.660 1.00 0.00 C ATOM 110 CE2 PHE A 11 3.346 10.261 1.317 1.00 0.00 C ATOM 111 CZ PHE A 11 4.317 10.440 0.351 1.00 0.00 C ATOM 0 H PHE A 11 6.824 13.782 4.110 1.00 0.00 H new ATOM 0 HA PHE A 11 3.889 13.844 3.789 1.00 0.00 H new ATOM 0 HB2 PHE A 11 5.884 11.724 4.648 1.00 0.00 H new ATOM 0 HB3 PHE A 11 4.169 11.555 4.967 1.00 0.00 H new ATOM 0 HD1 PHE A 11 6.565 12.168 2.169 1.00 0.00 H new ATOM 0 HD2 PHE A 11 2.770 10.628 3.338 1.00 0.00 H new ATOM 0 HE1 PHE A 11 6.238 11.266 -0.092 1.00 0.00 H new ATOM 0 HE2 PHE A 11 2.440 9.723 1.079 1.00 0.00 H new ATOM 0 HZ PHE A 11 4.171 10.045 -0.643 1.00 0.00 H new ATOM 121 N THR A 12 3.407 14.585 6.088 1.00 0.00 N ATOM 122 CA THR A 12 3.088 15.050 7.431 1.00 0.00 C ATOM 123 C THR A 12 2.621 13.899 8.315 1.00 0.00 C ATOM 124 O THR A 12 2.909 13.867 9.511 1.00 0.00 O ATOM 125 CB THR A 12 1.997 16.137 7.405 1.00 0.00 C ATOM 126 OG1 THR A 12 0.778 15.596 6.883 1.00 0.00 O ATOM 127 CG2 THR A 12 2.435 17.323 6.559 1.00 0.00 C ATOM 0 H THR A 12 2.685 14.776 5.393 1.00 0.00 H new ATOM 0 HA THR A 12 4.003 15.474 7.844 1.00 0.00 H new ATOM 0 HB THR A 12 1.833 16.480 8.426 1.00 0.00 H new ATOM 0 HG1 THR A 12 0.273 16.304 6.430 1.00 0.00 H new ATOM 0 HG21 THR A 12 1.649 18.078 6.556 1.00 0.00 H new ATOM 0 HG22 THR A 12 3.347 17.751 6.976 1.00 0.00 H new ATOM 0 HG23 THR A 12 2.624 16.992 5.538 1.00 0.00 H new ATOM 135 N GLU A 13 1.901 12.955 7.718 1.00 0.00 N ATOM 136 CA GLU A 13 1.395 11.801 8.453 1.00 0.00 C ATOM 137 C GLU A 13 1.709 10.504 7.713 1.00 0.00 C ATOM 138 O GLU A 13 1.010 10.129 6.773 1.00 0.00 O ATOM 139 CB GLU A 13 -0.116 11.927 8.665 1.00 0.00 C ATOM 140 CG GLU A 13 -0.492 12.640 9.953 1.00 0.00 C ATOM 141 CD GLU A 13 -1.989 12.656 10.195 1.00 0.00 C ATOM 142 OE1 GLU A 13 -2.570 11.567 10.385 1.00 0.00 O ATOM 143 OE2 GLU A 13 -2.579 13.756 10.194 1.00 0.00 O ATOM 0 H GLU A 13 1.655 12.966 6.728 1.00 0.00 H new ATOM 0 HA GLU A 13 1.891 11.774 9.423 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -0.549 12.465 7.822 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -0.558 10.931 8.669 1.00 0.00 H new ATOM 0 HG2 GLU A 13 0.003 12.151 10.792 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -0.122 13.665 9.918 1.00 0.00 H new ATOM 150 N GLU A 14 2.767 9.825 8.146 1.00 0.00 N ATOM 151 CA GLU A 14 3.175 8.571 7.524 1.00 0.00 C ATOM 152 C GLU A 14 2.069 7.525 7.632 1.00 0.00 C ATOM 153 O GLU A 14 1.201 7.610 8.501 1.00 0.00 O ATOM 154 CB GLU A 14 4.455 8.045 8.177 1.00 0.00 C ATOM 155 CG GLU A 14 5.700 8.826 7.792 1.00 0.00 C ATOM 156 CD GLU A 14 6.779 8.765 8.856 1.00 0.00 C ATOM 157 OE1 GLU A 14 6.633 9.454 9.888 1.00 0.00 O ATOM 158 OE2 GLU A 14 7.768 8.029 8.657 1.00 0.00 O ATOM 0 H GLU A 14 3.356 10.122 8.924 1.00 0.00 H new ATOM 0 HA GLU A 14 3.367 8.764 6.469 1.00 0.00 H new ATOM 0 HB2 GLU A 14 4.339 8.074 9.260 1.00 0.00 H new ATOM 0 HB3 GLU A 14 4.592 7.000 7.899 1.00 0.00 H new ATOM 0 HG2 GLU A 14 6.096 8.433 6.856 1.00 0.00 H new ATOM 0 HG3 GLU A 14 5.430 9.867 7.612 1.00 0.00 H new ATOM 165 N LEU A 15 2.107 6.539 6.743 1.00 0.00 N ATOM 166 CA LEU A 15 1.108 5.475 6.736 1.00 0.00 C ATOM 167 C LEU A 15 1.084 4.743 8.075 1.00 0.00 C ATOM 168 O LEU A 15 1.776 5.127 9.018 1.00 0.00 O ATOM 169 CB LEU A 15 1.396 4.485 5.606 1.00 0.00 C ATOM 170 CG LEU A 15 1.121 4.987 4.188 1.00 0.00 C ATOM 171 CD1 LEU A 15 2.040 4.300 3.191 1.00 0.00 C ATOM 172 CD2 LEU A 15 -0.337 4.762 3.816 1.00 0.00 C ATOM 0 H LEU A 15 2.819 6.454 6.017 1.00 0.00 H new ATOM 0 HA LEU A 15 0.131 5.929 6.572 1.00 0.00 H new ATOM 0 HB2 LEU A 15 2.443 4.188 5.668 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.800 3.588 5.775 1.00 0.00 H new ATOM 0 HG LEU A 15 1.322 6.058 4.157 1.00 0.00 H new ATOM 0 HD11 LEU A 15 1.830 4.670 2.187 1.00 0.00 H new ATOM 0 HD12 LEU A 15 3.078 4.513 3.446 1.00 0.00 H new ATOM 0 HD13 LEU A 15 1.872 3.223 3.223 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -0.514 5.125 2.804 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -0.565 3.697 3.865 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -0.978 5.302 4.513 1.00 0.00 H new ATOM 184 N THR A 16 0.282 3.685 8.150 1.00 0.00 N ATOM 185 CA THR A 16 0.168 2.899 9.371 1.00 0.00 C ATOM 186 C THR A 16 -0.097 1.430 9.057 1.00 0.00 C ATOM 187 O THR A 16 -1.142 1.081 8.511 1.00 0.00 O ATOM 188 CB THR A 16 -0.960 3.429 10.277 1.00 0.00 C ATOM 189 OG1 THR A 16 -0.899 2.792 11.558 1.00 0.00 O ATOM 190 CG2 THR A 16 -2.322 3.183 9.647 1.00 0.00 C ATOM 0 H THR A 16 -0.298 3.353 7.379 1.00 0.00 H new ATOM 0 HA THR A 16 1.119 2.990 9.895 1.00 0.00 H new ATOM 0 HB THR A 16 -0.823 4.504 10.399 1.00 0.00 H new ATOM 0 HG1 THR A 16 -1.618 3.135 12.129 1.00 0.00 H new ATOM 0 HG21 THR A 16 -3.102 3.566 10.305 1.00 0.00 H new ATOM 0 HG22 THR A 16 -2.376 3.694 8.686 1.00 0.00 H new ATOM 0 HG23 THR A 16 -2.466 2.113 9.498 1.00 0.00 H new ATOM 198 N ASN A 17 0.858 0.574 9.406 1.00 0.00 N ATOM 199 CA ASN A 17 0.728 -0.857 9.161 1.00 0.00 C ATOM 200 C ASN A 17 -0.715 -1.314 9.359 1.00 0.00 C ATOM 201 O ASN A 17 -1.340 -1.011 10.376 1.00 0.00 O ATOM 202 CB ASN A 17 1.655 -1.642 10.092 1.00 0.00 C ATOM 203 CG ASN A 17 3.059 -1.070 10.126 1.00 0.00 C ATOM 204 OD1 ASN A 17 3.633 -0.742 9.087 1.00 0.00 O ATOM 205 ND2 ASN A 17 3.619 -0.947 11.324 1.00 0.00 N ATOM 0 H ASN A 17 1.730 0.847 9.859 1.00 0.00 H new ATOM 0 HA ASN A 17 1.014 -1.050 8.127 1.00 0.00 H new ATOM 0 HB2 ASN A 17 1.240 -1.640 11.100 1.00 0.00 H new ATOM 0 HB3 ASN A 17 1.697 -2.682 9.767 1.00 0.00 H new ATOM 0 HD21 ASN A 17 4.562 -0.568 11.410 1.00 0.00 H new ATOM 0 HD22 ASN A 17 3.106 -1.232 12.158 1.00 0.00 H new ATOM 212 N LEU A 18 -1.237 -2.045 8.380 1.00 0.00 N ATOM 213 CA LEU A 18 -2.606 -2.545 8.446 1.00 0.00 C ATOM 214 C LEU A 18 -2.624 -4.058 8.642 1.00 0.00 C ATOM 215 O LEU A 18 -1.681 -4.753 8.266 1.00 0.00 O ATOM 216 CB LEU A 18 -3.367 -2.175 7.171 1.00 0.00 C ATOM 217 CG LEU A 18 -3.241 -0.722 6.713 1.00 0.00 C ATOM 218 CD1 LEU A 18 -3.728 -0.570 5.280 1.00 0.00 C ATOM 219 CD2 LEU A 18 -4.018 0.199 7.643 1.00 0.00 C ATOM 0 H LEU A 18 -0.733 -2.304 7.532 1.00 0.00 H new ATOM 0 HA LEU A 18 -3.096 -2.080 9.302 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -3.020 -2.821 6.364 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -4.423 -2.396 7.325 1.00 0.00 H new ATOM 0 HG LEU A 18 -2.189 -0.439 6.749 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -3.631 0.471 4.971 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -3.129 -1.201 4.623 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -4.774 -0.871 5.217 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -3.917 1.229 7.302 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -5.071 -0.083 7.639 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.623 0.111 8.655 1.00 0.00 H new ATOM 231 N GLN A 19 -3.705 -4.560 9.231 1.00 0.00 N ATOM 232 CA GLN A 19 -3.846 -5.990 9.475 1.00 0.00 C ATOM 233 C GLN A 19 -5.285 -6.442 9.247 1.00 0.00 C ATOM 234 O GLN A 19 -6.183 -6.100 10.017 1.00 0.00 O ATOM 235 CB GLN A 19 -3.412 -6.331 10.901 1.00 0.00 C ATOM 236 CG GLN A 19 -1.936 -6.674 11.022 1.00 0.00 C ATOM 237 CD GLN A 19 -1.361 -6.310 12.377 1.00 0.00 C ATOM 238 OE1 GLN A 19 -1.636 -6.973 13.378 1.00 0.00 O ATOM 239 NE2 GLN A 19 -0.559 -5.253 12.416 1.00 0.00 N ATOM 0 H GLN A 19 -4.495 -3.998 9.548 1.00 0.00 H new ATOM 0 HA GLN A 19 -3.203 -6.518 8.771 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -3.634 -5.485 11.552 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -4.003 -7.174 11.260 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -1.800 -7.741 10.849 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -1.380 -6.151 10.244 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -0.359 -4.733 11.562 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -0.143 -4.961 13.300 1.00 0.00 H new ATOM 248 N VAL A 20 -5.498 -7.212 8.185 1.00 0.00 N ATOM 249 CA VAL A 20 -6.828 -7.711 7.856 1.00 0.00 C ATOM 250 C VAL A 20 -6.753 -9.087 7.205 1.00 0.00 C ATOM 251 O VAL A 20 -5.674 -9.554 6.840 1.00 0.00 O ATOM 252 CB VAL A 20 -7.571 -6.748 6.912 1.00 0.00 C ATOM 253 CG1 VAL A 20 -9.074 -6.969 6.997 1.00 0.00 C ATOM 254 CG2 VAL A 20 -7.217 -5.305 7.237 1.00 0.00 C ATOM 0 H VAL A 20 -4.766 -7.504 7.537 1.00 0.00 H new ATOM 0 HA VAL A 20 -7.379 -7.786 8.794 1.00 0.00 H new ATOM 0 HB VAL A 20 -7.255 -6.954 5.889 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -9.582 -6.279 6.323 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -9.308 -7.994 6.711 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -9.411 -6.792 8.018 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -7.751 -4.638 6.560 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -7.502 -5.083 8.265 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -6.143 -5.158 7.119 1.00 0.00 H new ATOM 264 N GLU A 21 -7.906 -9.732 7.062 1.00 0.00 N ATOM 265 CA GLU A 21 -7.971 -11.056 6.454 1.00 0.00 C ATOM 266 C GLU A 21 -7.916 -10.959 4.932 1.00 0.00 C ATOM 267 O GLU A 21 -8.135 -9.892 4.360 1.00 0.00 O ATOM 268 CB GLU A 21 -9.249 -11.778 6.885 1.00 0.00 C ATOM 269 CG GLU A 21 -9.460 -11.796 8.390 1.00 0.00 C ATOM 270 CD GLU A 21 -9.966 -10.469 8.923 1.00 0.00 C ATOM 271 OE1 GLU A 21 -11.188 -10.225 8.845 1.00 0.00 O ATOM 272 OE2 GLU A 21 -9.138 -9.676 9.419 1.00 0.00 O ATOM 0 H GLU A 21 -8.808 -9.359 7.359 1.00 0.00 H new ATOM 0 HA GLU A 21 -7.108 -11.627 6.796 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -10.105 -11.297 6.412 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -9.218 -12.804 6.519 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -10.172 -12.581 8.644 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -8.520 -12.047 8.882 1.00 0.00 H new ATOM 279 N GLU A 22 -7.623 -12.082 4.284 1.00 0.00 N ATOM 280 CA GLU A 22 -7.539 -12.123 2.829 1.00 0.00 C ATOM 281 C GLU A 22 -8.901 -11.852 2.197 1.00 0.00 C ATOM 282 O GLU A 22 -9.941 -12.148 2.785 1.00 0.00 O ATOM 283 CB GLU A 22 -7.010 -13.482 2.364 1.00 0.00 C ATOM 284 CG GLU A 22 -8.042 -14.595 2.442 1.00 0.00 C ATOM 285 CD GLU A 22 -7.648 -15.814 1.630 1.00 0.00 C ATOM 286 OE1 GLU A 22 -6.454 -16.179 1.651 1.00 0.00 O ATOM 287 OE2 GLU A 22 -8.533 -16.402 0.974 1.00 0.00 O ATOM 0 H GLU A 22 -7.440 -12.974 4.743 1.00 0.00 H new ATOM 0 HA GLU A 22 -6.848 -11.343 2.509 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.660 -13.394 1.336 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -6.147 -13.754 2.972 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -8.179 -14.886 3.484 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -9.002 -14.221 2.086 1.00 0.00 H new ATOM 294 N LYS A 23 -8.887 -11.286 0.995 1.00 0.00 N ATOM 295 CA LYS A 23 -10.119 -10.975 0.281 1.00 0.00 C ATOM 296 C LYS A 23 -10.940 -9.936 1.039 1.00 0.00 C ATOM 297 O LYS A 23 -12.167 -9.917 0.953 1.00 0.00 O ATOM 298 CB LYS A 23 -10.949 -12.244 0.075 1.00 0.00 C ATOM 299 CG LYS A 23 -10.169 -13.385 -0.556 1.00 0.00 C ATOM 300 CD LYS A 23 -10.226 -13.327 -2.074 1.00 0.00 C ATOM 301 CE LYS A 23 -11.461 -14.032 -2.612 1.00 0.00 C ATOM 302 NZ LYS A 23 -11.242 -15.496 -2.766 1.00 0.00 N ATOM 0 H LYS A 23 -8.035 -11.033 0.495 1.00 0.00 H new ATOM 0 HA LYS A 23 -9.851 -10.562 -0.691 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -11.341 -12.572 1.038 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -11.807 -12.009 -0.555 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -9.130 -13.342 -0.228 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -10.573 -14.337 -0.212 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -10.229 -12.287 -2.400 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -9.331 -13.789 -2.491 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -12.300 -13.859 -1.938 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -11.733 -13.602 -3.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -12.107 -15.940 -3.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -10.458 -15.662 -3.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -11.007 -15.911 -1.842 1.00 0.00 H new ATOM 316 N GLY A 24 -10.253 -9.073 1.781 1.00 0.00 N ATOM 317 CA GLY A 24 -10.935 -8.043 2.543 1.00 0.00 C ATOM 318 C GLY A 24 -10.876 -6.687 1.867 1.00 0.00 C ATOM 319 O GLY A 24 -11.314 -6.533 0.727 1.00 0.00 O ATOM 0 H GLY A 24 -9.237 -9.069 1.868 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -11.977 -8.330 2.685 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -10.487 -7.971 3.534 1.00 0.00 H new ATOM 323 N THR A 25 -10.333 -5.699 2.572 1.00 0.00 N ATOM 324 CA THR A 25 -10.220 -4.349 2.035 1.00 0.00 C ATOM 325 C THR A 25 -9.263 -3.504 2.868 1.00 0.00 C ATOM 326 O THR A 25 -9.597 -3.080 3.975 1.00 0.00 O ATOM 327 CB THR A 25 -11.591 -3.650 1.982 1.00 0.00 C ATOM 328 OG1 THR A 25 -12.584 -4.554 1.484 1.00 0.00 O ATOM 329 CG2 THR A 25 -11.534 -2.414 1.096 1.00 0.00 C ATOM 0 H THR A 25 -9.965 -5.809 3.517 1.00 0.00 H new ATOM 0 HA THR A 25 -9.829 -4.443 1.022 1.00 0.00 H new ATOM 0 HB THR A 25 -11.856 -3.342 2.993 1.00 0.00 H new ATOM 0 HG1 THR A 25 -12.213 -5.069 0.737 1.00 0.00 H new ATOM 0 HG21 THR A 25 -12.514 -1.937 1.074 1.00 0.00 H new ATOM 0 HG22 THR A 25 -10.799 -1.715 1.494 1.00 0.00 H new ATOM 0 HG23 THR A 25 -11.249 -2.704 0.085 1.00 0.00 H new ATOM 337 N ALA A 26 -8.073 -3.262 2.330 1.00 0.00 N ATOM 338 CA ALA A 26 -7.069 -2.465 3.024 1.00 0.00 C ATOM 339 C ALA A 26 -6.899 -1.100 2.364 1.00 0.00 C ATOM 340 O ALA A 26 -6.581 -1.008 1.178 1.00 0.00 O ATOM 341 CB ALA A 26 -5.740 -3.205 3.059 1.00 0.00 C ATOM 0 H ALA A 26 -7.780 -3.606 1.416 1.00 0.00 H new ATOM 0 HA ALA A 26 -7.411 -2.305 4.047 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -4.999 -2.598 3.580 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -5.865 -4.153 3.582 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -5.402 -3.394 2.040 1.00 0.00 H new ATOM 347 N VAL A 27 -7.115 -0.042 3.139 1.00 0.00 N ATOM 348 CA VAL A 27 -6.986 1.318 2.630 1.00 0.00 C ATOM 349 C VAL A 27 -5.835 2.052 3.309 1.00 0.00 C ATOM 350 O VAL A 27 -5.964 2.517 4.442 1.00 0.00 O ATOM 351 CB VAL A 27 -8.285 2.120 2.836 1.00 0.00 C ATOM 352 CG1 VAL A 27 -8.121 3.542 2.321 1.00 0.00 C ATOM 353 CG2 VAL A 27 -9.452 1.426 2.151 1.00 0.00 C ATOM 0 H VAL A 27 -7.380 -0.101 4.122 1.00 0.00 H new ATOM 0 HA VAL A 27 -6.783 1.238 1.562 1.00 0.00 H new ATOM 0 HB VAL A 27 -8.498 2.169 3.904 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -9.048 4.094 2.475 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -7.312 4.034 2.862 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -7.885 3.519 1.257 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -10.362 2.006 2.306 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -9.251 1.345 1.083 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -9.581 0.429 2.572 1.00 0.00 H new ATOM 363 N PHE A 28 -4.710 2.153 2.609 1.00 0.00 N ATOM 364 CA PHE A 28 -3.535 2.831 3.145 1.00 0.00 C ATOM 365 C PHE A 28 -3.732 4.344 3.144 1.00 0.00 C ATOM 366 O PHE A 28 -3.561 5.004 2.118 1.00 0.00 O ATOM 367 CB PHE A 28 -2.293 2.466 2.328 1.00 0.00 C ATOM 368 CG PHE A 28 -1.593 1.232 2.820 1.00 0.00 C ATOM 369 CD1 PHE A 28 -1.296 1.078 4.165 1.00 0.00 C ATOM 370 CD2 PHE A 28 -1.231 0.227 1.938 1.00 0.00 C ATOM 371 CE1 PHE A 28 -0.651 -0.056 4.621 1.00 0.00 C ATOM 372 CE2 PHE A 28 -0.587 -0.910 2.389 1.00 0.00 C ATOM 373 CZ PHE A 28 -0.296 -1.051 3.732 1.00 0.00 C ATOM 0 H PHE A 28 -4.587 1.774 1.670 1.00 0.00 H new ATOM 0 HA PHE A 28 -3.394 2.502 4.175 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -2.583 2.319 1.288 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -1.595 3.303 2.349 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -1.572 1.853 4.865 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -1.454 0.333 0.887 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -0.425 -0.164 5.672 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -0.312 -1.688 1.692 1.00 0.00 H new ATOM 0 HZ PHE A 28 0.208 -1.938 4.086 1.00 0.00 H new ATOM 383 N THR A 29 -4.094 4.888 4.301 1.00 0.00 N ATOM 384 CA THR A 29 -4.317 6.322 4.435 1.00 0.00 C ATOM 385 C THR A 29 -3.027 7.047 4.799 1.00 0.00 C ATOM 386 O THR A 29 -2.285 6.610 5.681 1.00 0.00 O ATOM 387 CB THR A 29 -5.384 6.628 5.503 1.00 0.00 C ATOM 388 OG1 THR A 29 -5.286 5.685 6.577 1.00 0.00 O ATOM 389 CG2 THR A 29 -6.781 6.579 4.903 1.00 0.00 C ATOM 0 H THR A 29 -4.239 4.357 5.160 1.00 0.00 H new ATOM 0 HA THR A 29 -4.670 6.678 3.467 1.00 0.00 H new ATOM 0 HB THR A 29 -5.206 7.633 5.885 1.00 0.00 H new ATOM 0 HG1 THR A 29 -5.966 5.887 7.253 1.00 0.00 H new ATOM 0 HG21 THR A 29 -7.517 6.798 5.676 1.00 0.00 H new ATOM 0 HG22 THR A 29 -6.861 7.318 4.106 1.00 0.00 H new ATOM 0 HG23 THR A 29 -6.968 5.585 4.496 1.00 0.00 H new ATOM 397 N CYS A 30 -2.764 8.157 4.118 1.00 0.00 N ATOM 398 CA CYS A 30 -1.562 8.943 4.370 1.00 0.00 C ATOM 399 C CYS A 30 -1.840 10.432 4.196 1.00 0.00 C ATOM 400 O CYS A 30 -2.948 10.831 3.836 1.00 0.00 O ATOM 401 CB CYS A 30 -0.437 8.509 3.430 1.00 0.00 C ATOM 402 SG CYS A 30 -0.988 8.105 1.756 1.00 0.00 S ATOM 0 H CYS A 30 -3.368 8.533 3.387 1.00 0.00 H new ATOM 0 HA CYS A 30 -1.253 8.767 5.400 1.00 0.00 H new ATOM 0 HB2 CYS A 30 0.304 9.307 3.375 1.00 0.00 H new ATOM 0 HB3 CYS A 30 0.063 7.639 3.856 1.00 0.00 H new ATOM 0 HG CYS A 30 0.047 7.926 0.990 1.00 0.00 H new ATOM 408 N LYS A 31 -0.827 11.252 4.455 1.00 0.00 N ATOM 409 CA LYS A 31 -0.961 12.699 4.328 1.00 0.00 C ATOM 410 C LYS A 31 0.311 13.314 3.753 1.00 0.00 C ATOM 411 O LYS A 31 1.364 12.676 3.723 1.00 0.00 O ATOM 412 CB LYS A 31 -1.272 13.324 5.690 1.00 0.00 C ATOM 413 CG LYS A 31 -2.116 14.584 5.601 1.00 0.00 C ATOM 414 CD LYS A 31 -2.331 15.208 6.970 1.00 0.00 C ATOM 415 CE LYS A 31 -2.975 16.582 6.861 1.00 0.00 C ATOM 416 NZ LYS A 31 -2.958 17.307 8.162 1.00 0.00 N ATOM 0 H LYS A 31 0.097 10.939 4.754 1.00 0.00 H new ATOM 0 HA LYS A 31 -1.784 12.905 3.644 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -1.792 12.591 6.307 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -0.335 13.559 6.195 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -1.628 15.304 4.944 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -3.081 14.346 5.153 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -2.962 14.556 7.573 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -1.375 15.293 7.487 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -2.449 17.171 6.110 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -4.004 16.475 6.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -3.406 18.239 8.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -3.482 16.757 8.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -1.975 17.432 8.477 1.00 0.00 H new ATOM 430 N THR A 32 0.207 14.559 3.298 1.00 0.00 N ATOM 431 CA THR A 32 1.348 15.261 2.724 1.00 0.00 C ATOM 432 C THR A 32 1.295 16.751 3.044 1.00 0.00 C ATOM 433 O THR A 32 0.226 17.299 3.311 1.00 0.00 O ATOM 434 CB THR A 32 1.411 15.077 1.196 1.00 0.00 C ATOM 435 OG1 THR A 32 0.159 15.445 0.607 1.00 0.00 O ATOM 436 CG2 THR A 32 1.742 13.636 0.838 1.00 0.00 C ATOM 0 H THR A 32 -0.656 15.102 3.316 1.00 0.00 H new ATOM 0 HA THR A 32 2.243 14.828 3.171 1.00 0.00 H new ATOM 0 HB THR A 32 2.199 15.721 0.806 1.00 0.00 H new ATOM 0 HG1 THR A 32 0.298 16.185 -0.021 1.00 0.00 H new ATOM 0 HG21 THR A 32 1.781 13.530 -0.246 1.00 0.00 H new ATOM 0 HG22 THR A 32 2.709 13.368 1.264 1.00 0.00 H new ATOM 0 HG23 THR A 32 0.973 12.976 1.239 1.00 0.00 H new ATOM 444 N GLU A 33 2.454 17.400 3.013 1.00 0.00 N ATOM 445 CA GLU A 33 2.538 18.827 3.299 1.00 0.00 C ATOM 446 C GLU A 33 1.996 19.649 2.133 1.00 0.00 C ATOM 447 O GLU A 33 1.487 20.754 2.321 1.00 0.00 O ATOM 448 CB GLU A 33 3.986 19.228 3.590 1.00 0.00 C ATOM 449 CG GLU A 33 4.284 20.688 3.296 1.00 0.00 C ATOM 450 CD GLU A 33 5.639 21.124 3.819 1.00 0.00 C ATOM 451 OE1 GLU A 33 6.614 20.362 3.648 1.00 0.00 O ATOM 452 OE2 GLU A 33 5.725 22.227 4.398 1.00 0.00 O ATOM 0 H GLU A 33 3.348 16.960 2.793 1.00 0.00 H new ATOM 0 HA GLU A 33 1.928 19.031 4.179 1.00 0.00 H new ATOM 0 HB2 GLU A 33 4.207 19.025 4.638 1.00 0.00 H new ATOM 0 HB3 GLU A 33 4.653 18.603 2.997 1.00 0.00 H new ATOM 0 HG2 GLU A 33 4.244 20.853 2.219 1.00 0.00 H new ATOM 0 HG3 GLU A 33 3.509 21.310 3.743 1.00 0.00 H new ATOM 459 N HIS A 34 2.109 19.100 0.927 1.00 0.00 N ATOM 460 CA HIS A 34 1.630 19.782 -0.270 1.00 0.00 C ATOM 461 C HIS A 34 0.791 18.842 -1.131 1.00 0.00 C ATOM 462 O HIS A 34 0.952 17.622 -1.100 1.00 0.00 O ATOM 463 CB HIS A 34 2.809 20.319 -1.082 1.00 0.00 C ATOM 464 CG HIS A 34 3.521 21.459 -0.422 1.00 0.00 C ATOM 465 ND1 HIS A 34 2.887 22.624 -0.042 1.00 0.00 N ATOM 466 CD2 HIS A 34 4.820 21.608 -0.071 1.00 0.00 C ATOM 467 CE1 HIS A 34 3.766 23.440 0.511 1.00 0.00 C ATOM 468 NE2 HIS A 34 4.947 22.848 0.506 1.00 0.00 N ATOM 0 H HIS A 34 2.527 18.186 0.753 1.00 0.00 H new ATOM 0 HA HIS A 34 1.003 20.617 0.043 1.00 0.00 H new ATOM 0 HB2 HIS A 34 3.518 19.510 -1.256 1.00 0.00 H new ATOM 0 HB3 HIS A 34 2.449 20.643 -2.059 1.00 0.00 H new ATOM 0 HD2 HIS A 34 5.610 20.886 -0.217 1.00 0.00 H new ATOM 0 HE1 HIS A 34 3.555 24.425 0.901 1.00 0.00 H new ATOM 0 HE2 HIS A 34 5.812 23.247 0.871 1.00 0.00 H new ATOM 477 N PRO A 35 -0.128 19.422 -1.918 1.00 0.00 N ATOM 478 CA PRO A 35 -1.010 18.655 -2.802 1.00 0.00 C ATOM 479 C PRO A 35 -0.259 18.030 -3.973 1.00 0.00 C ATOM 480 O PRO A 35 -0.125 18.641 -5.033 1.00 0.00 O ATOM 481 CB PRO A 35 -2.007 19.703 -3.304 1.00 0.00 C ATOM 482 CG PRO A 35 -1.279 20.998 -3.201 1.00 0.00 C ATOM 483 CD PRO A 35 -0.374 20.871 -2.006 1.00 0.00 C ATOM 0 HA PRO A 35 -1.476 17.816 -2.284 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -2.311 19.500 -4.331 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -2.913 19.709 -2.699 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -0.705 21.196 -4.106 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -1.975 21.828 -3.077 1.00 0.00 H new ATOM 0 HD2 PRO A 35 0.553 21.428 -2.142 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -0.846 21.254 -1.101 1.00 0.00 H new ATOM 491 N ALA A 36 0.230 16.811 -3.773 1.00 0.00 N ATOM 492 CA ALA A 36 0.965 16.103 -4.813 1.00 0.00 C ATOM 493 C ALA A 36 0.159 16.032 -6.105 1.00 0.00 C ATOM 494 O ALA A 36 -0.931 15.462 -6.137 1.00 0.00 O ATOM 495 CB ALA A 36 1.333 14.704 -4.341 1.00 0.00 C ATOM 0 H ALA A 36 0.130 16.293 -2.900 1.00 0.00 H new ATOM 0 HA ALA A 36 1.880 16.658 -5.017 1.00 0.00 H new ATOM 0 HB1 ALA A 36 1.882 14.187 -5.128 1.00 0.00 H new ATOM 0 HB2 ALA A 36 1.956 14.773 -3.449 1.00 0.00 H new ATOM 0 HB3 ALA A 36 0.425 14.148 -4.107 1.00 0.00 H new ATOM 501 N ALA A 37 0.701 16.616 -7.169 1.00 0.00 N ATOM 502 CA ALA A 37 0.032 16.618 -8.464 1.00 0.00 C ATOM 503 C ALA A 37 -0.129 15.200 -9.001 1.00 0.00 C ATOM 504 O ALA A 37 -0.998 14.934 -9.833 1.00 0.00 O ATOM 505 CB ALA A 37 0.804 17.475 -9.456 1.00 0.00 C ATOM 0 H ALA A 37 1.602 17.094 -7.159 1.00 0.00 H new ATOM 0 HA ALA A 37 -0.963 17.043 -8.330 1.00 0.00 H new ATOM 0 HB1 ALA A 37 0.293 17.467 -10.419 1.00 0.00 H new ATOM 0 HB2 ALA A 37 0.863 18.498 -9.085 1.00 0.00 H new ATOM 0 HB3 ALA A 37 1.811 17.075 -9.577 1.00 0.00 H new ATOM 511 N THR A 38 0.713 14.290 -8.520 1.00 0.00 N ATOM 512 CA THR A 38 0.665 12.900 -8.953 1.00 0.00 C ATOM 513 C THR A 38 1.145 11.964 -7.849 1.00 0.00 C ATOM 514 O THR A 38 1.981 12.336 -7.026 1.00 0.00 O ATOM 515 CB THR A 38 1.523 12.673 -10.212 1.00 0.00 C ATOM 516 OG1 THR A 38 1.195 11.413 -10.808 1.00 0.00 O ATOM 517 CG2 THR A 38 3.005 12.707 -9.870 1.00 0.00 C ATOM 0 H THR A 38 1.437 14.492 -7.830 1.00 0.00 H new ATOM 0 HA THR A 38 -0.376 12.678 -9.188 1.00 0.00 H new ATOM 0 HB THR A 38 1.311 13.475 -10.919 1.00 0.00 H new ATOM 0 HG1 THR A 38 1.744 11.277 -11.609 1.00 0.00 H new ATOM 0 HG21 THR A 38 3.591 12.544 -10.775 1.00 0.00 H new ATOM 0 HG22 THR A 38 3.258 13.678 -9.443 1.00 0.00 H new ATOM 0 HG23 THR A 38 3.230 11.923 -9.146 1.00 0.00 H new ATOM 525 N VAL A 39 0.611 10.746 -7.839 1.00 0.00 N ATOM 526 CA VAL A 39 0.987 9.756 -6.837 1.00 0.00 C ATOM 527 C VAL A 39 1.186 8.383 -7.469 1.00 0.00 C ATOM 528 O VAL A 39 0.284 7.846 -8.113 1.00 0.00 O ATOM 529 CB VAL A 39 -0.077 9.648 -5.728 1.00 0.00 C ATOM 530 CG1 VAL A 39 0.388 8.701 -4.632 1.00 0.00 C ATOM 531 CG2 VAL A 39 -0.392 11.022 -5.158 1.00 0.00 C ATOM 0 H VAL A 39 -0.083 10.422 -8.513 1.00 0.00 H new ATOM 0 HA VAL A 39 1.927 10.091 -6.398 1.00 0.00 H new ATOM 0 HB VAL A 39 -0.990 9.242 -6.163 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -0.376 8.637 -3.858 1.00 0.00 H new ATOM 0 HG12 VAL A 39 0.559 7.711 -5.055 1.00 0.00 H new ATOM 0 HG13 VAL A 39 1.315 9.075 -4.197 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -1.145 10.927 -4.376 1.00 0.00 H new ATOM 0 HG22 VAL A 39 0.514 11.458 -4.738 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -0.771 11.667 -5.951 1.00 0.00 H new ATOM 541 N THR A 40 2.375 7.818 -7.282 1.00 0.00 N ATOM 542 CA THR A 40 2.695 6.508 -7.834 1.00 0.00 C ATOM 543 C THR A 40 2.951 5.492 -6.727 1.00 0.00 C ATOM 544 O THR A 40 4.039 5.447 -6.153 1.00 0.00 O ATOM 545 CB THR A 40 3.929 6.571 -8.753 1.00 0.00 C ATOM 546 OG1 THR A 40 3.701 7.503 -9.816 1.00 0.00 O ATOM 547 CG2 THR A 40 4.244 5.200 -9.332 1.00 0.00 C ATOM 0 H THR A 40 3.133 8.248 -6.752 1.00 0.00 H new ATOM 0 HA THR A 40 1.831 6.193 -8.420 1.00 0.00 H new ATOM 0 HB THR A 40 4.781 6.900 -8.158 1.00 0.00 H new ATOM 0 HG1 THR A 40 4.491 7.539 -10.395 1.00 0.00 H new ATOM 0 HG21 THR A 40 5.119 5.270 -9.978 1.00 0.00 H new ATOM 0 HG22 THR A 40 4.446 4.500 -8.521 1.00 0.00 H new ATOM 0 HG23 THR A 40 3.392 4.846 -9.913 1.00 0.00 H new ATOM 555 N TRP A 41 1.943 4.679 -6.432 1.00 0.00 N ATOM 556 CA TRP A 41 2.061 3.662 -5.393 1.00 0.00 C ATOM 557 C TRP A 41 2.893 2.481 -5.879 1.00 0.00 C ATOM 558 O TRP A 41 2.866 2.135 -7.060 1.00 0.00 O ATOM 559 CB TRP A 41 0.674 3.182 -4.961 1.00 0.00 C ATOM 560 CG TRP A 41 -0.143 4.249 -4.297 1.00 0.00 C ATOM 561 CD1 TRP A 41 -0.775 5.295 -4.907 1.00 0.00 C ATOM 562 CD2 TRP A 41 -0.416 4.373 -2.898 1.00 0.00 C ATOM 563 NE1 TRP A 41 -1.424 6.063 -3.970 1.00 0.00 N ATOM 564 CE2 TRP A 41 -1.220 5.518 -2.730 1.00 0.00 C ATOM 565 CE3 TRP A 41 -0.061 3.629 -1.770 1.00 0.00 C ATOM 566 CZ2 TRP A 41 -1.671 5.934 -1.480 1.00 0.00 C ATOM 567 CZ3 TRP A 41 -0.510 4.042 -0.530 1.00 0.00 C ATOM 568 CH2 TRP A 41 -1.309 5.186 -0.393 1.00 0.00 C ATOM 0 H TRP A 41 1.036 4.704 -6.897 1.00 0.00 H new ATOM 0 HA TRP A 41 2.566 4.109 -4.537 1.00 0.00 H new ATOM 0 HB2 TRP A 41 0.136 2.813 -5.835 1.00 0.00 H new ATOM 0 HB3 TRP A 41 0.785 2.341 -4.277 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -0.766 5.490 -5.969 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -1.969 6.903 -4.166 1.00 0.00 H new ATOM 0 HE3 TRP A 41 0.554 2.746 -1.865 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 -2.285 6.816 -1.372 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 -0.241 3.474 0.348 1.00 0.00 H new ATOM 0 HH2 TRP A 41 -1.645 5.483 0.590 1.00 0.00 H new ATOM 579 N ARG A 42 3.631 1.865 -4.961 1.00 0.00 N ATOM 580 CA ARG A 42 4.471 0.722 -5.297 1.00 0.00 C ATOM 581 C ARG A 42 4.216 -0.441 -4.343 1.00 0.00 C ATOM 582 O ARG A 42 4.160 -0.260 -3.127 1.00 0.00 O ATOM 583 CB ARG A 42 5.949 1.117 -5.252 1.00 0.00 C ATOM 584 CG ARG A 42 6.899 -0.054 -5.438 1.00 0.00 C ATOM 585 CD ARG A 42 8.273 0.245 -4.861 1.00 0.00 C ATOM 586 NE ARG A 42 8.969 1.284 -5.615 1.00 0.00 N ATOM 587 CZ ARG A 42 10.289 1.433 -5.615 1.00 0.00 C ATOM 588 NH1 ARG A 42 11.052 0.614 -4.905 1.00 0.00 N ATOM 589 NH2 ARG A 42 10.848 2.403 -6.328 1.00 0.00 N ATOM 0 H ARG A 42 3.664 2.139 -3.979 1.00 0.00 H new ATOM 0 HA ARG A 42 4.217 0.402 -6.308 1.00 0.00 H new ATOM 0 HB2 ARG A 42 6.142 1.857 -6.028 1.00 0.00 H new ATOM 0 HB3 ARG A 42 6.159 1.596 -4.296 1.00 0.00 H new ATOM 0 HG2 ARG A 42 6.485 -0.939 -4.955 1.00 0.00 H new ATOM 0 HG3 ARG A 42 6.991 -0.284 -6.500 1.00 0.00 H new ATOM 0 HD2 ARG A 42 8.169 0.559 -3.822 1.00 0.00 H new ATOM 0 HD3 ARG A 42 8.872 -0.666 -4.861 1.00 0.00 H new ATOM 0 HE ARG A 42 8.411 1.931 -6.172 1.00 0.00 H new ATOM 0 HH11 ARG A 42 10.626 -0.133 -4.357 1.00 0.00 H new ATOM 0 HH12 ARG A 42 12.065 0.731 -4.907 1.00 0.00 H new ATOM 0 HH21 ARG A 42 10.264 3.034 -6.876 1.00 0.00 H new ATOM 0 HH22 ARG A 42 11.862 2.517 -6.328 1.00 0.00 H new ATOM 603 N LYS A 43 4.059 -1.636 -4.903 1.00 0.00 N ATOM 604 CA LYS A 43 3.810 -2.829 -4.104 1.00 0.00 C ATOM 605 C LYS A 43 4.894 -3.877 -4.337 1.00 0.00 C ATOM 606 O LYS A 43 5.061 -4.374 -5.450 1.00 0.00 O ATOM 607 CB LYS A 43 2.437 -3.416 -4.440 1.00 0.00 C ATOM 608 CG LYS A 43 2.187 -4.776 -3.813 1.00 0.00 C ATOM 609 CD LYS A 43 0.949 -5.439 -4.394 1.00 0.00 C ATOM 610 CE LYS A 43 0.979 -6.947 -4.195 1.00 0.00 C ATOM 611 NZ LYS A 43 -0.213 -7.609 -4.793 1.00 0.00 N ATOM 0 H LYS A 43 4.100 -1.803 -5.908 1.00 0.00 H new ATOM 0 HA LYS A 43 3.828 -2.541 -3.053 1.00 0.00 H new ATOM 0 HB2 LYS A 43 1.664 -2.724 -4.106 1.00 0.00 H new ATOM 0 HB3 LYS A 43 2.343 -3.502 -5.523 1.00 0.00 H new ATOM 0 HG2 LYS A 43 3.054 -5.417 -3.974 1.00 0.00 H new ATOM 0 HG3 LYS A 43 2.069 -4.665 -2.735 1.00 0.00 H new ATOM 0 HD2 LYS A 43 0.058 -5.026 -3.921 1.00 0.00 H new ATOM 0 HD3 LYS A 43 0.879 -5.213 -5.458 1.00 0.00 H new ATOM 0 HE2 LYS A 43 1.884 -7.355 -4.644 1.00 0.00 H new ATOM 0 HE3 LYS A 43 1.023 -7.172 -3.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 0.087 -8.452 -5.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -0.870 -7.890 -4.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -0.690 -6.947 -5.438 1.00 0.00 H new ATOM 625 N GLY A 44 5.627 -4.210 -3.279 1.00 0.00 N ATOM 626 CA GLY A 44 6.685 -5.197 -3.391 1.00 0.00 C ATOM 627 C GLY A 44 7.594 -4.943 -4.577 1.00 0.00 C ATOM 628 O GLY A 44 7.629 -5.732 -5.522 1.00 0.00 O ATOM 0 H GLY A 44 5.507 -3.814 -2.347 1.00 0.00 H new ATOM 0 HA2 GLY A 44 7.278 -5.195 -2.476 1.00 0.00 H new ATOM 0 HA3 GLY A 44 6.243 -6.189 -3.482 1.00 0.00 H new ATOM 632 N LEU A 45 8.329 -3.838 -4.529 1.00 0.00 N ATOM 633 CA LEU A 45 9.242 -3.479 -5.609 1.00 0.00 C ATOM 634 C LEU A 45 8.530 -3.511 -6.958 1.00 0.00 C ATOM 635 O LEU A 45 9.128 -3.846 -7.981 1.00 0.00 O ATOM 636 CB LEU A 45 10.438 -4.433 -5.630 1.00 0.00 C ATOM 637 CG LEU A 45 11.523 -4.171 -4.584 1.00 0.00 C ATOM 638 CD1 LEU A 45 12.361 -5.420 -4.360 1.00 0.00 C ATOM 639 CD2 LEU A 45 12.404 -3.005 -5.010 1.00 0.00 C ATOM 0 H LEU A 45 8.311 -3.175 -3.754 1.00 0.00 H new ATOM 0 HA LEU A 45 9.596 -2.464 -5.429 1.00 0.00 H new ATOM 0 HB2 LEU A 45 10.069 -5.450 -5.495 1.00 0.00 H new ATOM 0 HB3 LEU A 45 10.896 -4.389 -6.618 1.00 0.00 H new ATOM 0 HG LEU A 45 11.038 -3.910 -3.643 1.00 0.00 H new ATOM 0 HD11 LEU A 45 13.128 -5.215 -3.613 1.00 0.00 H new ATOM 0 HD12 LEU A 45 11.721 -6.230 -4.010 1.00 0.00 H new ATOM 0 HD13 LEU A 45 12.836 -5.712 -5.296 1.00 0.00 H new ATOM 0 HD21 LEU A 45 13.170 -2.833 -4.254 1.00 0.00 H new ATOM 0 HD22 LEU A 45 12.880 -3.238 -5.963 1.00 0.00 H new ATOM 0 HD23 LEU A 45 11.794 -2.109 -5.119 1.00 0.00 H new ATOM 651 N LEU A 46 7.249 -3.157 -6.952 1.00 0.00 N ATOM 652 CA LEU A 46 6.455 -3.142 -8.175 1.00 0.00 C ATOM 653 C LEU A 46 5.640 -1.856 -8.280 1.00 0.00 C ATOM 654 O LEU A 46 5.212 -1.299 -7.270 1.00 0.00 O ATOM 655 CB LEU A 46 5.523 -4.354 -8.217 1.00 0.00 C ATOM 656 CG LEU A 46 5.015 -4.764 -9.600 1.00 0.00 C ATOM 657 CD1 LEU A 46 4.591 -6.224 -9.601 1.00 0.00 C ATOM 658 CD2 LEU A 46 3.861 -3.871 -10.030 1.00 0.00 C ATOM 0 H LEU A 46 6.739 -2.877 -6.114 1.00 0.00 H new ATOM 0 HA LEU A 46 7.139 -3.188 -9.023 1.00 0.00 H new ATOM 0 HB2 LEU A 46 6.045 -5.204 -7.777 1.00 0.00 H new ATOM 0 HB3 LEU A 46 4.661 -4.146 -7.583 1.00 0.00 H new ATOM 0 HG LEU A 46 5.828 -4.643 -10.316 1.00 0.00 H new ATOM 0 HD11 LEU A 46 4.232 -6.498 -10.593 1.00 0.00 H new ATOM 0 HD12 LEU A 46 5.443 -6.851 -9.337 1.00 0.00 H new ATOM 0 HD13 LEU A 46 3.793 -6.372 -8.873 1.00 0.00 H new ATOM 0 HD21 LEU A 46 3.512 -4.177 -11.016 1.00 0.00 H new ATOM 0 HD22 LEU A 46 3.045 -3.960 -9.313 1.00 0.00 H new ATOM 0 HD23 LEU A 46 4.198 -2.835 -10.070 1.00 0.00 H new ATOM 670 N GLU A 47 5.429 -1.394 -9.508 1.00 0.00 N ATOM 671 CA GLU A 47 4.664 -0.175 -9.743 1.00 0.00 C ATOM 672 C GLU A 47 3.171 -0.477 -9.828 1.00 0.00 C ATOM 673 O GLU A 47 2.738 -1.307 -10.629 1.00 0.00 O ATOM 674 CB GLU A 47 5.131 0.507 -11.031 1.00 0.00 C ATOM 675 CG GLU A 47 4.566 1.904 -11.220 1.00 0.00 C ATOM 676 CD GLU A 47 5.488 2.803 -12.020 1.00 0.00 C ATOM 677 OE1 GLU A 47 6.627 3.040 -11.567 1.00 0.00 O ATOM 678 OE2 GLU A 47 5.070 3.270 -13.101 1.00 0.00 O ATOM 0 H GLU A 47 5.776 -1.845 -10.355 1.00 0.00 H new ATOM 0 HA GLU A 47 4.834 0.497 -8.902 1.00 0.00 H new ATOM 0 HB2 GLU A 47 6.220 0.562 -11.029 1.00 0.00 H new ATOM 0 HB3 GLU A 47 4.845 -0.110 -11.883 1.00 0.00 H new ATOM 0 HG2 GLU A 47 3.602 1.837 -11.725 1.00 0.00 H new ATOM 0 HG3 GLU A 47 4.384 2.353 -10.244 1.00 0.00 H new ATOM 685 N LEU A 48 2.388 0.202 -8.997 1.00 0.00 N ATOM 686 CA LEU A 48 0.942 0.006 -8.976 1.00 0.00 C ATOM 687 C LEU A 48 0.245 0.997 -9.903 1.00 0.00 C ATOM 688 O LEU A 48 0.801 2.042 -10.241 1.00 0.00 O ATOM 689 CB LEU A 48 0.407 0.161 -7.551 1.00 0.00 C ATOM 690 CG LEU A 48 1.004 -0.780 -6.504 1.00 0.00 C ATOM 691 CD1 LEU A 48 0.335 -0.570 -5.155 1.00 0.00 C ATOM 692 CD2 LEU A 48 0.868 -2.229 -6.949 1.00 0.00 C ATOM 0 H LEU A 48 2.730 0.893 -8.329 1.00 0.00 H new ATOM 0 HA LEU A 48 0.732 -1.004 -9.329 1.00 0.00 H new ATOM 0 HB2 LEU A 48 0.581 1.188 -7.229 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -0.673 0.012 -7.571 1.00 0.00 H new ATOM 0 HG LEU A 48 2.065 -0.551 -6.400 1.00 0.00 H new ATOM 0 HD11 LEU A 48 0.773 -1.248 -4.422 1.00 0.00 H new ATOM 0 HD12 LEU A 48 0.485 0.460 -4.831 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -0.733 -0.771 -5.243 1.00 0.00 H new ATOM 0 HD21 LEU A 48 1.298 -2.884 -6.192 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -0.186 -2.471 -7.082 1.00 0.00 H new ATOM 0 HD23 LEU A 48 1.395 -2.371 -7.893 1.00 0.00 H new ATOM 704 N ARG A 49 -0.975 0.661 -10.310 1.00 0.00 N ATOM 705 CA ARG A 49 -1.748 1.522 -11.197 1.00 0.00 C ATOM 706 C ARG A 49 -3.235 1.454 -10.861 1.00 0.00 C ATOM 707 O ARG A 49 -3.756 0.392 -10.521 1.00 0.00 O ATOM 708 CB ARG A 49 -1.525 1.118 -12.656 1.00 0.00 C ATOM 709 CG ARG A 49 -2.263 -0.148 -13.057 1.00 0.00 C ATOM 710 CD ARG A 49 -1.523 -1.394 -12.595 1.00 0.00 C ATOM 711 NE ARG A 49 -2.039 -2.604 -13.229 1.00 0.00 N ATOM 712 CZ ARG A 49 -1.629 -3.829 -12.918 1.00 0.00 C ATOM 713 NH1 ARG A 49 -0.703 -4.005 -11.986 1.00 0.00 N ATOM 714 NH2 ARG A 49 -2.147 -4.881 -13.539 1.00 0.00 N ATOM 0 H ARG A 49 -1.449 -0.201 -10.040 1.00 0.00 H new ATOM 0 HA ARG A 49 -1.407 2.548 -11.055 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -1.844 1.935 -13.303 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -0.458 0.975 -12.826 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -3.265 -0.138 -12.627 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -2.381 -0.174 -14.140 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -0.462 -1.290 -12.822 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -1.610 -1.487 -11.512 1.00 0.00 H new ATOM 0 HE ARG A 49 -2.753 -2.503 -13.950 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -0.303 -3.199 -11.506 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -0.390 -4.947 -11.749 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -2.861 -4.750 -14.256 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -1.832 -5.821 -13.300 1.00 0.00 H new ATOM 728 N ALA A 50 -3.911 2.594 -10.958 1.00 0.00 N ATOM 729 CA ALA A 50 -5.338 2.663 -10.666 1.00 0.00 C ATOM 730 C ALA A 50 -6.093 1.525 -11.345 1.00 0.00 C ATOM 731 O ALA A 50 -6.317 1.551 -12.555 1.00 0.00 O ATOM 732 CB ALA A 50 -5.901 4.007 -11.103 1.00 0.00 C ATOM 0 H ALA A 50 -3.494 3.482 -11.236 1.00 0.00 H new ATOM 0 HA ALA A 50 -5.469 2.559 -9.589 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -6.967 4.045 -10.879 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -5.389 4.807 -10.568 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -5.751 4.133 -12.175 1.00 0.00 H new ATOM 738 N SER A 51 -6.482 0.527 -10.558 1.00 0.00 N ATOM 739 CA SER A 51 -7.208 -0.623 -11.084 1.00 0.00 C ATOM 740 C SER A 51 -8.209 -1.148 -10.060 1.00 0.00 C ATOM 741 O SER A 51 -8.262 -0.673 -8.926 1.00 0.00 O ATOM 742 CB SER A 51 -6.231 -1.734 -11.476 1.00 0.00 C ATOM 743 OG SER A 51 -5.764 -1.557 -12.802 1.00 0.00 O ATOM 0 H SER A 51 -6.307 0.492 -9.554 1.00 0.00 H new ATOM 0 HA SER A 51 -7.756 -0.302 -11.970 1.00 0.00 H new ATOM 0 HB2 SER A 51 -5.386 -1.740 -10.787 1.00 0.00 H new ATOM 0 HB3 SER A 51 -6.722 -2.703 -11.386 1.00 0.00 H new ATOM 0 HG SER A 51 -5.817 -0.609 -13.044 1.00 0.00 H new ATOM 749 N GLY A 52 -9.002 -2.134 -10.468 1.00 0.00 N ATOM 750 CA GLY A 52 -9.992 -2.709 -9.575 1.00 0.00 C ATOM 751 C GLY A 52 -9.406 -3.089 -8.230 1.00 0.00 C ATOM 752 O GLY A 52 -10.122 -3.159 -7.230 1.00 0.00 O ATOM 0 H GLY A 52 -8.977 -2.545 -11.401 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -10.802 -1.995 -9.427 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -10.428 -3.593 -10.041 1.00 0.00 H new ATOM 756 N LYS A 53 -8.102 -3.337 -8.203 1.00 0.00 N ATOM 757 CA LYS A 53 -7.419 -3.714 -6.970 1.00 0.00 C ATOM 758 C LYS A 53 -6.909 -2.480 -6.233 1.00 0.00 C ATOM 759 O LYS A 53 -7.326 -2.200 -5.108 1.00 0.00 O ATOM 760 CB LYS A 53 -6.253 -4.657 -7.276 1.00 0.00 C ATOM 761 CG LYS A 53 -5.745 -5.409 -6.059 1.00 0.00 C ATOM 762 CD LYS A 53 -6.482 -6.724 -5.868 1.00 0.00 C ATOM 763 CE LYS A 53 -5.858 -7.557 -4.759 1.00 0.00 C ATOM 764 NZ LYS A 53 -6.031 -9.017 -4.997 1.00 0.00 N ATOM 0 H LYS A 53 -7.495 -3.284 -9.021 1.00 0.00 H new ATOM 0 HA LYS A 53 -8.135 -4.229 -6.329 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -6.567 -5.376 -8.032 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -5.433 -4.081 -7.705 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -4.678 -5.602 -6.169 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -5.868 -4.790 -5.170 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -7.527 -6.525 -5.631 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -6.468 -7.289 -6.800 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -4.796 -7.325 -4.684 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -6.311 -7.289 -3.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -5.233 -9.534 -4.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -6.919 -9.337 -4.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -6.062 -9.201 -6.020 1.00 0.00 H new ATOM 778 N HIS A 54 -6.005 -1.745 -6.873 1.00 0.00 N ATOM 779 CA HIS A 54 -5.440 -0.539 -6.278 1.00 0.00 C ATOM 780 C HIS A 54 -6.104 0.711 -6.847 1.00 0.00 C ATOM 781 O HIS A 54 -5.760 1.164 -7.939 1.00 0.00 O ATOM 782 CB HIS A 54 -3.931 -0.485 -6.520 1.00 0.00 C ATOM 783 CG HIS A 54 -3.224 -1.762 -6.185 1.00 0.00 C ATOM 784 ND1 HIS A 54 -2.992 -2.758 -7.109 1.00 0.00 N ATOM 785 CD2 HIS A 54 -2.696 -2.202 -5.019 1.00 0.00 C ATOM 786 CE1 HIS A 54 -2.353 -3.757 -6.526 1.00 0.00 C ATOM 787 NE2 HIS A 54 -2.161 -3.444 -5.257 1.00 0.00 N ATOM 0 H HIS A 54 -5.648 -1.963 -7.803 1.00 0.00 H new ATOM 0 HA HIS A 54 -5.628 -0.571 -5.205 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -3.748 -0.242 -7.567 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -3.505 0.323 -5.926 1.00 0.00 H new ATOM 0 HD1 HIS A 54 -3.270 -2.729 -8.090 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -2.696 -1.674 -4.077 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -2.041 -4.673 -7.005 1.00 0.00 H new ATOM 796 N GLN A 55 -7.056 1.262 -6.101 1.00 0.00 N ATOM 797 CA GLN A 55 -7.768 2.458 -6.534 1.00 0.00 C ATOM 798 C GLN A 55 -7.437 3.644 -5.634 1.00 0.00 C ATOM 799 O GLN A 55 -8.143 3.939 -4.669 1.00 0.00 O ATOM 800 CB GLN A 55 -9.277 2.208 -6.532 1.00 0.00 C ATOM 801 CG GLN A 55 -10.090 3.382 -7.052 1.00 0.00 C ATOM 802 CD GLN A 55 -10.017 3.520 -8.560 1.00 0.00 C ATOM 803 OE1 GLN A 55 -10.732 2.836 -9.293 1.00 0.00 O ATOM 804 NE2 GLN A 55 -9.150 4.408 -9.033 1.00 0.00 N ATOM 0 H GLN A 55 -7.352 0.899 -5.195 1.00 0.00 H new ATOM 0 HA GLN A 55 -7.447 2.694 -7.549 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -9.492 1.330 -7.141 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -9.597 1.977 -5.516 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -11.131 3.260 -6.752 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -9.731 4.301 -6.589 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -8.577 4.954 -8.390 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -9.057 4.544 -10.040 1.00 0.00 H new ATOM 813 N PRO A 56 -6.337 4.342 -5.954 1.00 0.00 N ATOM 814 CA PRO A 56 -5.887 5.507 -5.187 1.00 0.00 C ATOM 815 C PRO A 56 -6.815 6.705 -5.355 1.00 0.00 C ATOM 816 O PRO A 56 -7.757 6.666 -6.146 1.00 0.00 O ATOM 817 CB PRO A 56 -4.508 5.810 -5.778 1.00 0.00 C ATOM 818 CG PRO A 56 -4.559 5.258 -7.161 1.00 0.00 C ATOM 819 CD PRO A 56 -5.448 4.047 -7.090 1.00 0.00 C ATOM 0 HA PRO A 56 -5.872 5.309 -4.115 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -4.308 6.881 -5.787 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -3.715 5.342 -5.194 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -4.956 5.993 -7.861 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -3.562 4.991 -7.512 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -6.010 3.906 -8.014 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -4.873 3.136 -6.924 1.00 0.00 H new ATOM 827 N SER A 57 -6.541 7.770 -4.607 1.00 0.00 N ATOM 828 CA SER A 57 -7.354 8.979 -4.672 1.00 0.00 C ATOM 829 C SER A 57 -6.552 10.196 -4.221 1.00 0.00 C ATOM 830 O SER A 57 -5.397 10.076 -3.815 1.00 0.00 O ATOM 831 CB SER A 57 -8.603 8.826 -3.803 1.00 0.00 C ATOM 832 OG SER A 57 -9.632 9.701 -4.231 1.00 0.00 O ATOM 0 H SER A 57 -5.763 7.820 -3.950 1.00 0.00 H new ATOM 0 HA SER A 57 -7.658 9.129 -5.708 1.00 0.00 H new ATOM 0 HB2 SER A 57 -8.956 7.796 -3.846 1.00 0.00 H new ATOM 0 HB3 SER A 57 -8.354 9.034 -2.762 1.00 0.00 H new ATOM 0 HG SER A 57 -10.420 9.583 -3.661 1.00 0.00 H new ATOM 838 N GLN A 58 -7.176 11.368 -4.296 1.00 0.00 N ATOM 839 CA GLN A 58 -6.521 12.608 -3.897 1.00 0.00 C ATOM 840 C GLN A 58 -7.530 13.594 -3.318 1.00 0.00 C ATOM 841 O GLN A 58 -8.388 14.110 -4.034 1.00 0.00 O ATOM 842 CB GLN A 58 -5.802 13.237 -5.091 1.00 0.00 C ATOM 843 CG GLN A 58 -5.048 14.511 -4.745 1.00 0.00 C ATOM 844 CD GLN A 58 -4.203 15.020 -5.896 1.00 0.00 C ATOM 845 OE1 GLN A 58 -4.382 14.607 -7.043 1.00 0.00 O ATOM 846 NE2 GLN A 58 -3.276 15.923 -5.597 1.00 0.00 N ATOM 0 H GLN A 58 -8.133 11.484 -4.629 1.00 0.00 H new ATOM 0 HA GLN A 58 -5.788 12.371 -3.125 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -5.102 12.512 -5.506 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -6.532 13.457 -5.870 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -5.761 15.283 -4.453 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -4.407 14.327 -3.883 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -3.162 16.237 -4.633 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -2.678 16.302 -6.331 1.00 0.00 H new ATOM 855 N GLU A 59 -7.421 13.851 -2.018 1.00 0.00 N ATOM 856 CA GLU A 59 -8.326 14.774 -1.344 1.00 0.00 C ATOM 857 C GLU A 59 -7.554 15.934 -0.721 1.00 0.00 C ATOM 858 O GLU A 59 -7.539 16.101 0.498 1.00 0.00 O ATOM 859 CB GLU A 59 -9.126 14.043 -0.265 1.00 0.00 C ATOM 860 CG GLU A 59 -10.346 13.313 -0.802 1.00 0.00 C ATOM 861 CD GLU A 59 -10.722 12.108 0.039 1.00 0.00 C ATOM 862 OE1 GLU A 59 -9.812 11.493 0.633 1.00 0.00 O ATOM 863 OE2 GLU A 59 -11.925 11.780 0.101 1.00 0.00 O ATOM 0 H GLU A 59 -6.715 13.433 -1.411 1.00 0.00 H new ATOM 0 HA GLU A 59 -9.015 15.175 -2.088 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -8.475 13.326 0.235 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -9.446 14.763 0.488 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -11.190 14.002 -0.840 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -10.151 12.991 -1.825 1.00 0.00 H new ATOM 870 N GLY A 60 -6.913 16.734 -1.569 1.00 0.00 N ATOM 871 CA GLY A 60 -6.147 17.867 -1.084 1.00 0.00 C ATOM 872 C GLY A 60 -4.802 17.458 -0.516 1.00 0.00 C ATOM 873 O GLY A 60 -3.864 17.177 -1.263 1.00 0.00 O ATOM 0 H GLY A 60 -6.911 16.617 -2.582 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -5.994 18.574 -1.900 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -6.720 18.386 -0.316 1.00 0.00 H new ATOM 877 N LEU A 61 -4.707 17.426 0.809 1.00 0.00 N ATOM 878 CA LEU A 61 -3.466 17.050 1.477 1.00 0.00 C ATOM 879 C LEU A 61 -3.575 15.654 2.083 1.00 0.00 C ATOM 880 O LEU A 61 -2.713 15.230 2.853 1.00 0.00 O ATOM 881 CB LEU A 61 -3.123 18.066 2.568 1.00 0.00 C ATOM 882 CG LEU A 61 -2.723 19.461 2.085 1.00 0.00 C ATOM 883 CD1 LEU A 61 -2.266 20.320 3.253 1.00 0.00 C ATOM 884 CD2 LEU A 61 -1.629 19.366 1.030 1.00 0.00 C ATOM 0 H LEU A 61 -5.474 17.656 1.441 1.00 0.00 H new ATOM 0 HA LEU A 61 -2.670 17.042 0.733 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -3.985 18.165 3.228 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -2.307 17.663 3.168 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.596 19.933 1.634 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -1.986 21.309 2.890 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.078 20.415 3.974 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -1.407 19.853 3.734 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -1.356 20.368 0.697 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -0.754 18.875 1.456 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -1.992 18.788 0.180 1.00 0.00 H new ATOM 896 N THR A 62 -4.640 14.942 1.728 1.00 0.00 N ATOM 897 CA THR A 62 -4.862 13.594 2.235 1.00 0.00 C ATOM 898 C THR A 62 -4.984 12.591 1.094 1.00 0.00 C ATOM 899 O THR A 62 -5.774 12.781 0.168 1.00 0.00 O ATOM 900 CB THR A 62 -6.131 13.522 3.105 1.00 0.00 C ATOM 901 OG1 THR A 62 -6.167 14.631 4.010 1.00 0.00 O ATOM 902 CG2 THR A 62 -6.177 12.219 3.888 1.00 0.00 C ATOM 0 H THR A 62 -5.363 15.277 1.091 1.00 0.00 H new ATOM 0 HA THR A 62 -3.997 13.340 2.847 1.00 0.00 H new ATOM 0 HB THR A 62 -6.999 13.562 2.447 1.00 0.00 H new ATOM 0 HG1 THR A 62 -6.977 14.579 4.559 1.00 0.00 H new ATOM 0 HG21 THR A 62 -7.082 12.191 4.495 1.00 0.00 H new ATOM 0 HG22 THR A 62 -6.179 11.378 3.195 1.00 0.00 H new ATOM 0 HG23 THR A 62 -5.303 12.153 4.536 1.00 0.00 H new ATOM 910 N LEU A 63 -4.199 11.522 1.166 1.00 0.00 N ATOM 911 CA LEU A 63 -4.220 10.486 0.138 1.00 0.00 C ATOM 912 C LEU A 63 -4.594 9.134 0.735 1.00 0.00 C ATOM 913 O LEU A 63 -4.404 8.897 1.928 1.00 0.00 O ATOM 914 CB LEU A 63 -2.856 10.394 -0.549 1.00 0.00 C ATOM 915 CG LEU A 63 -2.308 11.698 -1.131 1.00 0.00 C ATOM 916 CD1 LEU A 63 -0.812 11.586 -1.375 1.00 0.00 C ATOM 917 CD2 LEU A 63 -3.035 12.053 -2.420 1.00 0.00 C ATOM 0 H LEU A 63 -3.540 11.349 1.925 1.00 0.00 H new ATOM 0 HA LEU A 63 -4.974 10.757 -0.601 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -2.134 10.009 0.171 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -2.925 9.661 -1.353 1.00 0.00 H new ATOM 0 HG LEU A 63 -2.479 12.496 -0.409 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -0.440 12.523 -1.789 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -0.304 11.378 -0.433 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -0.618 10.776 -2.078 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -2.632 12.983 -2.820 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -2.895 11.254 -3.148 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -4.099 12.176 -2.216 1.00 0.00 H new ATOM 929 N ARG A 64 -5.124 8.249 -0.103 1.00 0.00 N ATOM 930 CA ARG A 64 -5.524 6.919 0.343 1.00 0.00 C ATOM 931 C ARG A 64 -5.640 5.962 -0.840 1.00 0.00 C ATOM 932 O ARG A 64 -6.032 6.360 -1.938 1.00 0.00 O ATOM 933 CB ARG A 64 -6.856 6.987 1.091 1.00 0.00 C ATOM 934 CG ARG A 64 -8.058 7.168 0.178 1.00 0.00 C ATOM 935 CD ARG A 64 -9.306 7.533 0.967 1.00 0.00 C ATOM 936 NE ARG A 64 -10.521 7.380 0.171 1.00 0.00 N ATOM 937 CZ ARG A 64 -11.746 7.527 0.663 1.00 0.00 C ATOM 938 NH1 ARG A 64 -11.918 7.829 1.943 1.00 0.00 N ATOM 939 NH2 ARG A 64 -12.802 7.372 -0.125 1.00 0.00 N ATOM 0 H ARG A 64 -5.286 8.428 -1.094 1.00 0.00 H new ATOM 0 HA ARG A 64 -4.756 6.543 1.019 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -6.985 6.073 1.670 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -6.822 7.813 1.802 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -7.847 7.949 -0.553 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -8.235 6.248 -0.380 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -9.372 6.902 1.854 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -9.227 8.563 1.314 1.00 0.00 H new ATOM 0 HE ARG A 64 -10.423 7.147 -0.817 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -11.109 7.949 2.552 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -12.860 7.941 2.318 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -12.674 7.140 -1.110 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -13.742 7.485 0.254 1.00 0.00 H new ATOM 953 N LEU A 65 -5.298 4.700 -0.609 1.00 0.00 N ATOM 954 CA LEU A 65 -5.364 3.685 -1.655 1.00 0.00 C ATOM 955 C LEU A 65 -6.166 2.474 -1.189 1.00 0.00 C ATOM 956 O LEU A 65 -5.715 1.707 -0.337 1.00 0.00 O ATOM 957 CB LEU A 65 -3.955 3.252 -2.063 1.00 0.00 C ATOM 958 CG LEU A 65 -3.867 2.052 -3.006 1.00 0.00 C ATOM 959 CD1 LEU A 65 -4.364 2.427 -4.394 1.00 0.00 C ATOM 960 CD2 LEU A 65 -2.440 1.528 -3.072 1.00 0.00 C ATOM 0 H LEU A 65 -4.972 4.354 0.294 1.00 0.00 H new ATOM 0 HA LEU A 65 -5.867 4.121 -2.518 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -3.460 4.099 -2.538 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -3.392 3.020 -1.159 1.00 0.00 H new ATOM 0 HG LEU A 65 -4.505 1.260 -2.615 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -4.294 1.561 -5.052 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -5.402 2.753 -4.333 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -3.752 3.236 -4.793 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -2.397 0.674 -3.748 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -1.780 2.314 -3.438 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -2.119 1.220 -2.077 1.00 0.00 H new ATOM 972 N THR A 66 -7.357 2.306 -1.755 1.00 0.00 N ATOM 973 CA THR A 66 -8.221 1.187 -1.399 1.00 0.00 C ATOM 974 C THR A 66 -7.768 -0.097 -2.084 1.00 0.00 C ATOM 975 O THR A 66 -7.673 -0.158 -3.310 1.00 0.00 O ATOM 976 CB THR A 66 -9.687 1.468 -1.778 1.00 0.00 C ATOM 977 OG1 THR A 66 -10.058 2.786 -1.360 1.00 0.00 O ATOM 978 CG2 THR A 66 -10.616 0.447 -1.138 1.00 0.00 C ATOM 0 H THR A 66 -7.745 2.931 -2.462 1.00 0.00 H new ATOM 0 HA THR A 66 -8.150 1.063 -0.318 1.00 0.00 H new ATOM 0 HB THR A 66 -9.780 1.392 -2.861 1.00 0.00 H new ATOM 0 HG1 THR A 66 -10.991 2.957 -1.606 1.00 0.00 H new ATOM 0 HG21 THR A 66 -11.646 0.665 -1.420 1.00 0.00 H new ATOM 0 HG22 THR A 66 -10.350 -0.553 -1.482 1.00 0.00 H new ATOM 0 HG23 THR A 66 -10.518 0.496 -0.053 1.00 0.00 H new ATOM 986 N ILE A 67 -7.490 -1.122 -1.284 1.00 0.00 N ATOM 987 CA ILE A 67 -7.049 -2.406 -1.814 1.00 0.00 C ATOM 988 C ILE A 67 -8.042 -3.512 -1.473 1.00 0.00 C ATOM 989 O ILE A 67 -8.107 -3.972 -0.334 1.00 0.00 O ATOM 990 CB ILE A 67 -5.661 -2.792 -1.271 1.00 0.00 C ATOM 991 CG1 ILE A 67 -4.690 -1.618 -1.410 1.00 0.00 C ATOM 992 CG2 ILE A 67 -5.128 -4.016 -2.001 1.00 0.00 C ATOM 993 CD1 ILE A 67 -3.546 -1.660 -0.421 1.00 0.00 C ATOM 0 H ILE A 67 -7.563 -1.088 -0.267 1.00 0.00 H new ATOM 0 HA ILE A 67 -6.989 -2.297 -2.897 1.00 0.00 H new ATOM 0 HB ILE A 67 -5.757 -3.037 -0.213 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -4.285 -1.610 -2.422 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -5.239 -0.685 -1.279 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -4.146 -4.276 -1.606 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -5.811 -4.853 -1.855 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -5.044 -3.797 -3.065 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -2.898 -0.798 -0.577 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -3.942 -1.637 0.594 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -2.973 -2.576 -0.566 1.00 0.00 H new ATOM 1005 N SER A 68 -8.813 -3.935 -2.470 1.00 0.00 N ATOM 1006 CA SER A 68 -9.805 -4.986 -2.275 1.00 0.00 C ATOM 1007 C SER A 68 -9.307 -6.314 -2.838 1.00 0.00 C ATOM 1008 O SER A 68 -8.300 -6.362 -3.545 1.00 0.00 O ATOM 1009 CB SER A 68 -11.126 -4.600 -2.943 1.00 0.00 C ATOM 1010 OG SER A 68 -11.855 -3.688 -2.140 1.00 0.00 O ATOM 0 H SER A 68 -8.770 -3.566 -3.420 1.00 0.00 H new ATOM 0 HA SER A 68 -9.968 -5.103 -1.204 1.00 0.00 H new ATOM 0 HB2 SER A 68 -10.928 -4.154 -3.917 1.00 0.00 H new ATOM 0 HB3 SER A 68 -11.724 -5.494 -3.118 1.00 0.00 H new ATOM 0 HG SER A 68 -12.694 -3.455 -2.589 1.00 0.00 H new ATOM 1016 N ALA A 69 -10.019 -7.389 -2.520 1.00 0.00 N ATOM 1017 CA ALA A 69 -9.652 -8.718 -2.994 1.00 0.00 C ATOM 1018 C ALA A 69 -8.270 -9.118 -2.491 1.00 0.00 C ATOM 1019 O ALA A 69 -7.585 -9.934 -3.109 1.00 0.00 O ATOM 1020 CB ALA A 69 -9.696 -8.766 -4.515 1.00 0.00 C ATOM 0 H ALA A 69 -10.854 -7.366 -1.935 1.00 0.00 H new ATOM 0 HA ALA A 69 -10.375 -9.431 -2.597 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -9.420 -9.764 -4.856 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -10.704 -8.532 -4.857 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -8.996 -8.037 -4.922 1.00 0.00 H new ATOM 1026 N LEU A 70 -7.865 -8.539 -1.366 1.00 0.00 N ATOM 1027 CA LEU A 70 -6.562 -8.835 -0.779 1.00 0.00 C ATOM 1028 C LEU A 70 -6.265 -10.330 -0.838 1.00 0.00 C ATOM 1029 O LEU A 70 -7.162 -11.142 -1.064 1.00 0.00 O ATOM 1030 CB LEU A 70 -6.513 -8.351 0.672 1.00 0.00 C ATOM 1031 CG LEU A 70 -6.793 -6.864 0.893 1.00 0.00 C ATOM 1032 CD1 LEU A 70 -7.289 -6.620 2.310 1.00 0.00 C ATOM 1033 CD2 LEU A 70 -5.545 -6.039 0.613 1.00 0.00 C ATOM 0 H LEU A 70 -8.420 -7.862 -0.842 1.00 0.00 H new ATOM 0 HA LEU A 70 -5.802 -8.309 -1.357 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -7.236 -8.926 1.251 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -5.527 -8.579 1.077 1.00 0.00 H new ATOM 0 HG LEU A 70 -7.573 -6.553 0.198 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -7.483 -5.557 2.449 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -8.208 -7.181 2.475 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -6.531 -6.947 3.022 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -5.763 -4.983 0.775 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -4.744 -6.352 1.283 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.233 -6.190 -0.420 1.00 0.00 H new ATOM 1045 N GLU A 71 -5.001 -10.686 -0.632 1.00 0.00 N ATOM 1046 CA GLU A 71 -4.587 -12.083 -0.662 1.00 0.00 C ATOM 1047 C GLU A 71 -3.266 -12.275 0.077 1.00 0.00 C ATOM 1048 O GLU A 71 -2.550 -11.312 0.354 1.00 0.00 O ATOM 1049 CB GLU A 71 -4.451 -12.568 -2.107 1.00 0.00 C ATOM 1050 CG GLU A 71 -3.435 -11.782 -2.919 1.00 0.00 C ATOM 1051 CD GLU A 71 -3.563 -12.029 -4.409 1.00 0.00 C ATOM 1052 OE1 GLU A 71 -4.679 -11.867 -4.945 1.00 0.00 O ATOM 1053 OE2 GLU A 71 -2.546 -12.386 -5.040 1.00 0.00 O ATOM 0 H GLU A 71 -4.247 -10.026 -0.443 1.00 0.00 H new ATOM 0 HA GLU A 71 -5.354 -12.673 -0.160 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -4.165 -13.620 -2.103 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -5.423 -12.504 -2.596 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -3.560 -10.718 -2.719 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -2.430 -12.051 -2.595 1.00 0.00 H new ATOM 1060 N LYS A 72 -2.949 -13.526 0.396 1.00 0.00 N ATOM 1061 CA LYS A 72 -1.714 -13.846 1.102 1.00 0.00 C ATOM 1062 C LYS A 72 -0.514 -13.194 0.424 1.00 0.00 C ATOM 1063 O LYS A 72 0.462 -12.834 1.081 1.00 0.00 O ATOM 1064 CB LYS A 72 -1.517 -15.363 1.163 1.00 0.00 C ATOM 1065 CG LYS A 72 -2.229 -16.023 2.331 1.00 0.00 C ATOM 1066 CD LYS A 72 -1.759 -17.453 2.534 1.00 0.00 C ATOM 1067 CE LYS A 72 -2.370 -18.068 3.784 1.00 0.00 C ATOM 1068 NZ LYS A 72 -1.943 -19.483 3.971 1.00 0.00 N ATOM 0 H LYS A 72 -3.531 -14.335 0.177 1.00 0.00 H new ATOM 0 HA LYS A 72 -1.792 -13.454 2.116 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -1.875 -15.805 0.233 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -0.451 -15.580 1.229 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -2.050 -15.448 3.239 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -3.305 -16.014 2.155 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -2.027 -18.052 1.664 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -0.672 -17.472 2.612 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -2.079 -17.483 4.656 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -3.457 -18.022 3.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -2.380 -19.867 4.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -2.242 -20.047 3.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -0.908 -19.524 4.060 1.00 0.00 H new ATOM 1082 N ALA A 73 -0.595 -13.042 -0.894 1.00 0.00 N ATOM 1083 CA ALA A 73 0.483 -12.429 -1.660 1.00 0.00 C ATOM 1084 C ALA A 73 0.598 -10.940 -1.351 1.00 0.00 C ATOM 1085 O ALA A 73 1.686 -10.438 -1.067 1.00 0.00 O ATOM 1086 CB ALA A 73 0.262 -12.646 -3.149 1.00 0.00 C ATOM 0 H ALA A 73 -1.396 -13.335 -1.453 1.00 0.00 H new ATOM 0 HA ALA A 73 1.419 -12.907 -1.370 1.00 0.00 H new ATOM 0 HB1 ALA A 73 1.075 -12.183 -3.709 1.00 0.00 H new ATOM 0 HB2 ALA A 73 0.238 -13.715 -3.361 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -0.685 -12.196 -3.446 1.00 0.00 H new ATOM 1092 N ASP A 74 -0.529 -10.240 -1.409 1.00 0.00 N ATOM 1093 CA ASP A 74 -0.555 -8.808 -1.136 1.00 0.00 C ATOM 1094 C ASP A 74 0.382 -8.458 0.016 1.00 0.00 C ATOM 1095 O ASP A 74 0.946 -7.365 0.060 1.00 0.00 O ATOM 1096 CB ASP A 74 -1.978 -8.355 -0.807 1.00 0.00 C ATOM 1097 CG ASP A 74 -2.775 -8.001 -2.047 1.00 0.00 C ATOM 1098 OD1 ASP A 74 -2.626 -8.705 -3.068 1.00 0.00 O ATOM 1099 OD2 ASP A 74 -3.546 -7.020 -1.998 1.00 0.00 O ATOM 0 H ASP A 74 -1.437 -10.641 -1.643 1.00 0.00 H new ATOM 0 HA ASP A 74 -0.214 -8.287 -2.030 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -2.492 -9.148 -0.263 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -1.937 -7.489 -0.146 1.00 0.00 H new ATOM 1104 N SER A 75 0.543 -9.393 0.947 1.00 0.00 N ATOM 1105 CA SER A 75 1.408 -9.182 2.101 1.00 0.00 C ATOM 1106 C SER A 75 2.799 -8.733 1.664 1.00 0.00 C ATOM 1107 O SER A 75 3.604 -9.538 1.196 1.00 0.00 O ATOM 1108 CB SER A 75 1.511 -10.464 2.930 1.00 0.00 C ATOM 1109 OG SER A 75 0.287 -10.747 3.585 1.00 0.00 O ATOM 0 H SER A 75 0.085 -10.304 0.924 1.00 0.00 H new ATOM 0 HA SER A 75 0.967 -8.396 2.714 1.00 0.00 H new ATOM 0 HB2 SER A 75 1.782 -11.298 2.283 1.00 0.00 H new ATOM 0 HB3 SER A 75 2.307 -10.361 3.668 1.00 0.00 H new ATOM 0 HG SER A 75 0.378 -11.572 4.107 1.00 0.00 H new ATOM 1115 N ASP A 76 3.073 -7.442 1.819 1.00 0.00 N ATOM 1116 CA ASP A 76 4.366 -6.885 1.441 1.00 0.00 C ATOM 1117 C ASP A 76 4.477 -5.426 1.874 1.00 0.00 C ATOM 1118 O ASP A 76 3.548 -4.869 2.459 1.00 0.00 O ATOM 1119 CB ASP A 76 4.572 -6.997 -0.071 1.00 0.00 C ATOM 1120 CG ASP A 76 5.234 -8.302 -0.469 1.00 0.00 C ATOM 1121 OD1 ASP A 76 6.438 -8.469 -0.182 1.00 0.00 O ATOM 1122 OD2 ASP A 76 4.548 -9.156 -1.068 1.00 0.00 O ATOM 0 H ASP A 76 2.417 -6.762 2.204 1.00 0.00 H new ATOM 0 HA ASP A 76 5.142 -7.457 1.949 1.00 0.00 H new ATOM 0 HB2 ASP A 76 3.608 -6.914 -0.573 1.00 0.00 H new ATOM 0 HB3 ASP A 76 5.184 -6.163 -0.414 1.00 0.00 H new ATOM 1127 N THR A 77 5.620 -4.813 1.585 1.00 0.00 N ATOM 1128 CA THR A 77 5.854 -3.421 1.947 1.00 0.00 C ATOM 1129 C THR A 77 5.502 -2.487 0.794 1.00 0.00 C ATOM 1130 O THR A 77 6.147 -2.509 -0.254 1.00 0.00 O ATOM 1131 CB THR A 77 7.320 -3.185 2.355 1.00 0.00 C ATOM 1132 OG1 THR A 77 7.698 -4.110 3.380 1.00 0.00 O ATOM 1133 CG2 THR A 77 7.521 -1.761 2.851 1.00 0.00 C ATOM 0 H THR A 77 6.399 -5.259 1.101 1.00 0.00 H new ATOM 0 HA THR A 77 5.209 -3.203 2.798 1.00 0.00 H new ATOM 0 HB THR A 77 7.948 -3.339 1.477 1.00 0.00 H new ATOM 0 HG1 THR A 77 8.632 -3.954 3.633 1.00 0.00 H new ATOM 0 HG21 THR A 77 8.564 -1.618 3.133 1.00 0.00 H new ATOM 0 HG22 THR A 77 7.260 -1.059 2.059 1.00 0.00 H new ATOM 0 HG23 THR A 77 6.883 -1.584 3.717 1.00 0.00 H new ATOM 1141 N TYR A 78 4.477 -1.667 0.995 1.00 0.00 N ATOM 1142 CA TYR A 78 4.039 -0.726 -0.029 1.00 0.00 C ATOM 1143 C TYR A 78 4.705 0.634 0.160 1.00 0.00 C ATOM 1144 O TYR A 78 5.072 1.011 1.274 1.00 0.00 O ATOM 1145 CB TYR A 78 2.518 -0.570 0.009 1.00 0.00 C ATOM 1146 CG TYR A 78 1.771 -1.853 -0.277 1.00 0.00 C ATOM 1147 CD1 TYR A 78 1.952 -2.977 0.520 1.00 0.00 C ATOM 1148 CD2 TYR A 78 0.885 -1.942 -1.344 1.00 0.00 C ATOM 1149 CE1 TYR A 78 1.272 -4.152 0.262 1.00 0.00 C ATOM 1150 CE2 TYR A 78 0.200 -3.112 -1.608 1.00 0.00 C ATOM 1151 CZ TYR A 78 0.397 -4.214 -0.803 1.00 0.00 C ATOM 1152 OH TYR A 78 -0.283 -5.382 -1.063 1.00 0.00 O ATOM 0 H TYR A 78 3.934 -1.635 1.858 1.00 0.00 H new ATOM 0 HA TYR A 78 4.333 -1.123 -1.001 1.00 0.00 H new ATOM 0 HB2 TYR A 78 2.224 -0.199 0.991 1.00 0.00 H new ATOM 0 HB3 TYR A 78 2.220 0.184 -0.719 1.00 0.00 H new ATOM 0 HD1 TYR A 78 2.636 -2.931 1.355 1.00 0.00 H new ATOM 0 HD2 TYR A 78 0.729 -1.081 -1.978 1.00 0.00 H new ATOM 0 HE1 TYR A 78 1.425 -5.017 0.890 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -0.486 -3.163 -2.440 1.00 0.00 H new ATOM 0 HH TYR A 78 0.016 -6.080 -0.443 1.00 0.00 H new ATOM 1162 N THR A 79 4.858 1.368 -0.938 1.00 0.00 N ATOM 1163 CA THR A 79 5.480 2.686 -0.895 1.00 0.00 C ATOM 1164 C THR A 79 4.649 3.710 -1.659 1.00 0.00 C ATOM 1165 O THR A 79 4.451 3.586 -2.868 1.00 0.00 O ATOM 1166 CB THR A 79 6.903 2.654 -1.484 1.00 0.00 C ATOM 1167 OG1 THR A 79 7.724 1.751 -0.734 1.00 0.00 O ATOM 1168 CG2 THR A 79 7.525 4.042 -1.471 1.00 0.00 C ATOM 0 H THR A 79 4.560 1.072 -1.868 1.00 0.00 H new ATOM 0 HA THR A 79 5.535 2.977 0.154 1.00 0.00 H new ATOM 0 HB THR A 79 6.837 2.312 -2.517 1.00 0.00 H new ATOM 0 HG1 THR A 79 8.626 1.735 -1.116 1.00 0.00 H new ATOM 0 HG21 THR A 79 8.529 3.995 -1.892 1.00 0.00 H new ATOM 0 HG22 THR A 79 6.914 4.720 -2.067 1.00 0.00 H new ATOM 0 HG23 THR A 79 7.578 4.407 -0.445 1.00 0.00 H new ATOM 1176 N CYS A 80 4.167 4.723 -0.947 1.00 0.00 N ATOM 1177 CA CYS A 80 3.357 5.770 -1.559 1.00 0.00 C ATOM 1178 C CYS A 80 4.229 6.933 -2.019 1.00 0.00 C ATOM 1179 O CYS A 80 4.634 7.775 -1.217 1.00 0.00 O ATOM 1180 CB CYS A 80 2.301 6.269 -0.572 1.00 0.00 C ATOM 1181 SG CYS A 80 1.115 7.432 -1.285 1.00 0.00 S ATOM 0 H CYS A 80 4.323 4.841 0.054 1.00 0.00 H new ATOM 0 HA CYS A 80 2.858 5.346 -2.431 1.00 0.00 H new ATOM 0 HB2 CYS A 80 1.758 5.412 -0.173 1.00 0.00 H new ATOM 0 HB3 CYS A 80 2.803 6.748 0.269 1.00 0.00 H new ATOM 0 HG CYS A 80 -0.002 6.815 -1.532 1.00 0.00 H new ATOM 1187 N ASP A 81 4.517 6.973 -3.316 1.00 0.00 N ATOM 1188 CA ASP A 81 5.343 8.032 -3.884 1.00 0.00 C ATOM 1189 C ASP A 81 4.478 9.180 -4.396 1.00 0.00 C ATOM 1190 O ASP A 81 3.382 8.961 -4.914 1.00 0.00 O ATOM 1191 CB ASP A 81 6.206 7.482 -5.020 1.00 0.00 C ATOM 1192 CG ASP A 81 6.975 8.570 -5.742 1.00 0.00 C ATOM 1193 OD1 ASP A 81 7.791 9.254 -5.089 1.00 0.00 O ATOM 1194 OD2 ASP A 81 6.762 8.738 -6.961 1.00 0.00 O ATOM 0 H ASP A 81 4.190 6.284 -3.993 1.00 0.00 H new ATOM 0 HA ASP A 81 5.993 8.413 -3.097 1.00 0.00 H new ATOM 0 HB2 ASP A 81 6.908 6.751 -4.618 1.00 0.00 H new ATOM 0 HB3 ASP A 81 5.571 6.956 -5.733 1.00 0.00 H new ATOM 1199 N ILE A 82 4.976 10.402 -4.245 1.00 0.00 N ATOM 1200 CA ILE A 82 4.249 11.584 -4.693 1.00 0.00 C ATOM 1201 C ILE A 82 5.067 12.385 -5.699 1.00 0.00 C ATOM 1202 O ILE A 82 4.524 13.184 -6.461 1.00 0.00 O ATOM 1203 CB ILE A 82 3.875 12.496 -3.509 1.00 0.00 C ATOM 1204 CG1 ILE A 82 5.117 12.821 -2.676 1.00 0.00 C ATOM 1205 CG2 ILE A 82 2.810 11.836 -2.647 1.00 0.00 C ATOM 1206 CD1 ILE A 82 5.033 14.152 -1.961 1.00 0.00 C ATOM 0 H ILE A 82 5.880 10.600 -3.816 1.00 0.00 H new ATOM 0 HA ILE A 82 3.336 11.230 -5.172 1.00 0.00 H new ATOM 0 HB ILE A 82 3.469 13.428 -3.902 1.00 0.00 H new ATOM 0 HG12 ILE A 82 5.268 12.031 -1.940 1.00 0.00 H new ATOM 0 HG13 ILE A 82 5.991 12.822 -3.327 1.00 0.00 H new ATOM 0 HG21 ILE A 82 2.557 12.493 -1.815 1.00 0.00 H new ATOM 0 HG22 ILE A 82 1.919 11.651 -3.247 1.00 0.00 H new ATOM 0 HG23 ILE A 82 3.190 10.890 -2.260 1.00 0.00 H new ATOM 0 HD11 ILE A 82 5.947 14.317 -1.390 1.00 0.00 H new ATOM 0 HD12 ILE A 82 4.913 14.951 -2.693 1.00 0.00 H new ATOM 0 HD13 ILE A 82 4.179 14.148 -1.284 1.00 0.00 H new ATOM 1218 N GLY A 83 6.378 12.163 -5.698 1.00 0.00 N ATOM 1219 CA GLY A 83 7.251 12.871 -6.617 1.00 0.00 C ATOM 1220 C GLY A 83 8.504 13.391 -5.941 1.00 0.00 C ATOM 1221 O GLY A 83 9.547 13.532 -6.579 1.00 0.00 O ATOM 0 H GLY A 83 6.851 11.506 -5.078 1.00 0.00 H new ATOM 0 HA2 GLY A 83 7.532 12.205 -7.433 1.00 0.00 H new ATOM 0 HA3 GLY A 83 6.707 13.706 -7.060 1.00 0.00 H new ATOM 1225 N GLN A 84 8.401 13.679 -4.648 1.00 0.00 N ATOM 1226 CA GLN A 84 9.535 14.189 -3.887 1.00 0.00 C ATOM 1227 C GLN A 84 9.867 13.266 -2.719 1.00 0.00 C ATOM 1228 O GLN A 84 11.035 13.037 -2.409 1.00 0.00 O ATOM 1229 CB GLN A 84 9.238 15.598 -3.370 1.00 0.00 C ATOM 1230 CG GLN A 84 8.927 16.597 -4.473 1.00 0.00 C ATOM 1231 CD GLN A 84 10.096 16.810 -5.414 1.00 0.00 C ATOM 1232 OE1 GLN A 84 11.256 16.664 -5.026 1.00 0.00 O ATOM 1233 NE2 GLN A 84 9.798 17.157 -6.661 1.00 0.00 N ATOM 0 H GLN A 84 7.544 13.568 -4.106 1.00 0.00 H new ATOM 0 HA GLN A 84 10.398 14.228 -4.552 1.00 0.00 H new ATOM 0 HB2 GLN A 84 8.393 15.553 -2.683 1.00 0.00 H new ATOM 0 HB3 GLN A 84 10.095 15.955 -2.799 1.00 0.00 H new ATOM 0 HG2 GLN A 84 8.066 16.247 -5.043 1.00 0.00 H new ATOM 0 HG3 GLN A 84 8.647 17.551 -4.026 1.00 0.00 H new ATOM 0 HE21 GLN A 84 8.823 17.267 -6.941 1.00 0.00 H new ATOM 0 HE22 GLN A 84 10.544 17.313 -7.339 1.00 0.00 H new ATOM 1242 N ALA A 85 8.831 12.740 -2.074 1.00 0.00 N ATOM 1243 CA ALA A 85 9.012 11.841 -0.942 1.00 0.00 C ATOM 1244 C ALA A 85 8.220 10.552 -1.132 1.00 0.00 C ATOM 1245 O ALA A 85 7.358 10.466 -2.006 1.00 0.00 O ATOM 1246 CB ALA A 85 8.600 12.530 0.351 1.00 0.00 C ATOM 0 H ALA A 85 7.857 12.921 -2.317 1.00 0.00 H new ATOM 0 HA ALA A 85 10.069 11.582 -0.882 1.00 0.00 H new ATOM 0 HB1 ALA A 85 8.741 11.846 1.188 1.00 0.00 H new ATOM 0 HB2 ALA A 85 9.213 13.419 0.501 1.00 0.00 H new ATOM 0 HB3 ALA A 85 7.551 12.819 0.291 1.00 0.00 H new ATOM 1252 N GLN A 86 8.517 9.553 -0.307 1.00 0.00 N ATOM 1253 CA GLN A 86 7.833 8.268 -0.387 1.00 0.00 C ATOM 1254 C GLN A 86 7.640 7.667 1.002 1.00 0.00 C ATOM 1255 O GLN A 86 8.559 7.665 1.821 1.00 0.00 O ATOM 1256 CB GLN A 86 8.622 7.299 -1.270 1.00 0.00 C ATOM 1257 CG GLN A 86 8.953 7.861 -2.643 1.00 0.00 C ATOM 1258 CD GLN A 86 10.187 8.741 -2.632 1.00 0.00 C ATOM 1259 OE1 GLN A 86 11.114 8.520 -1.852 1.00 0.00 O ATOM 1260 NE2 GLN A 86 10.205 9.747 -3.499 1.00 0.00 N ATOM 0 H GLN A 86 9.226 9.609 0.424 1.00 0.00 H new ATOM 0 HA GLN A 86 6.852 8.435 -0.831 1.00 0.00 H new ATOM 0 HB2 GLN A 86 9.549 7.031 -0.763 1.00 0.00 H new ATOM 0 HB3 GLN A 86 8.048 6.381 -1.391 1.00 0.00 H new ATOM 0 HG2 GLN A 86 9.105 7.038 -3.341 1.00 0.00 H new ATOM 0 HG3 GLN A 86 8.104 8.437 -3.010 1.00 0.00 H new ATOM 0 HE21 GLN A 86 9.415 9.893 -4.127 1.00 0.00 H new ATOM 0 HE22 GLN A 86 11.009 10.373 -3.537 1.00 0.00 H new ATOM 1269 N SER A 87 6.440 7.158 1.260 1.00 0.00 N ATOM 1270 CA SER A 87 6.125 6.558 2.551 1.00 0.00 C ATOM 1271 C SER A 87 6.237 5.038 2.485 1.00 0.00 C ATOM 1272 O SER A 87 6.533 4.471 1.433 1.00 0.00 O ATOM 1273 CB SER A 87 4.717 6.958 2.994 1.00 0.00 C ATOM 1274 OG SER A 87 4.458 6.529 4.319 1.00 0.00 O ATOM 0 H SER A 87 5.669 7.149 0.592 1.00 0.00 H new ATOM 0 HA SER A 87 6.846 6.927 3.281 1.00 0.00 H new ATOM 0 HB2 SER A 87 4.606 8.041 2.931 1.00 0.00 H new ATOM 0 HB3 SER A 87 3.982 6.522 2.317 1.00 0.00 H new ATOM 0 HG SER A 87 4.262 7.307 4.882 1.00 0.00 H new ATOM 1280 N ARG A 88 5.997 4.383 3.617 1.00 0.00 N ATOM 1281 CA ARG A 88 6.072 2.929 3.689 1.00 0.00 C ATOM 1282 C ARG A 88 5.125 2.389 4.757 1.00 0.00 C ATOM 1283 O ARG A 88 4.936 3.007 5.804 1.00 0.00 O ATOM 1284 CB ARG A 88 7.505 2.485 3.991 1.00 0.00 C ATOM 1285 CG ARG A 88 8.435 2.573 2.792 1.00 0.00 C ATOM 1286 CD ARG A 88 9.636 1.654 2.950 1.00 0.00 C ATOM 1287 NE ARG A 88 10.675 1.937 1.964 1.00 0.00 N ATOM 1288 CZ ARG A 88 11.904 1.437 2.028 1.00 0.00 C ATOM 1289 NH1 ARG A 88 12.246 0.633 3.025 1.00 0.00 N ATOM 1290 NH2 ARG A 88 12.795 1.741 1.092 1.00 0.00 N ATOM 0 H ARG A 88 5.749 4.837 4.496 1.00 0.00 H new ATOM 0 HA ARG A 88 5.770 2.526 2.722 1.00 0.00 H new ATOM 0 HB2 ARG A 88 7.905 3.101 4.796 1.00 0.00 H new ATOM 0 HB3 ARG A 88 7.489 1.457 4.353 1.00 0.00 H new ATOM 0 HG2 ARG A 88 7.889 2.308 1.887 1.00 0.00 H new ATOM 0 HG3 ARG A 88 8.776 3.601 2.669 1.00 0.00 H new ATOM 0 HD2 ARG A 88 10.048 1.765 3.953 1.00 0.00 H new ATOM 0 HD3 ARG A 88 9.315 0.617 2.851 1.00 0.00 H new ATOM 0 HE ARG A 88 10.445 2.552 1.184 1.00 0.00 H new ATOM 0 HH11 ARG A 88 11.565 0.396 3.746 1.00 0.00 H new ATOM 0 HH12 ARG A 88 13.191 0.251 3.071 1.00 0.00 H new ATOM 0 HH21 ARG A 88 12.536 2.359 0.323 1.00 0.00 H new ATOM 0 HH22 ARG A 88 13.738 1.357 1.142 1.00 0.00 H new ATOM 1304 N ALA A 89 4.532 1.231 4.483 1.00 0.00 N ATOM 1305 CA ALA A 89 3.606 0.607 5.420 1.00 0.00 C ATOM 1306 C ALA A 89 3.561 -0.904 5.222 1.00 0.00 C ATOM 1307 O ALA A 89 3.661 -1.395 4.097 1.00 0.00 O ATOM 1308 CB ALA A 89 2.215 1.204 5.264 1.00 0.00 C ATOM 0 H ALA A 89 4.677 0.707 3.620 1.00 0.00 H new ATOM 0 HA ALA A 89 3.962 0.804 6.431 1.00 0.00 H new ATOM 0 HB1 ALA A 89 1.534 0.729 5.970 1.00 0.00 H new ATOM 0 HB2 ALA A 89 2.254 2.275 5.463 1.00 0.00 H new ATOM 0 HB3 ALA A 89 1.859 1.037 4.247 1.00 0.00 H new ATOM 1314 N GLN A 90 3.409 -1.636 6.321 1.00 0.00 N ATOM 1315 CA GLN A 90 3.352 -3.092 6.266 1.00 0.00 C ATOM 1316 C GLN A 90 1.907 -3.580 6.256 1.00 0.00 C ATOM 1317 O GLN A 90 1.056 -3.049 6.971 1.00 0.00 O ATOM 1318 CB GLN A 90 4.099 -3.698 7.456 1.00 0.00 C ATOM 1319 CG GLN A 90 5.602 -3.785 7.250 1.00 0.00 C ATOM 1320 CD GLN A 90 6.030 -5.093 6.615 1.00 0.00 C ATOM 1321 OE1 GLN A 90 6.588 -5.966 7.280 1.00 0.00 O ATOM 1322 NE2 GLN A 90 5.769 -5.236 5.321 1.00 0.00 N ATOM 0 H GLN A 90 3.323 -1.245 7.259 1.00 0.00 H new ATOM 0 HA GLN A 90 3.832 -3.415 5.342 1.00 0.00 H new ATOM 0 HB2 GLN A 90 3.896 -3.100 8.344 1.00 0.00 H new ATOM 0 HB3 GLN A 90 3.709 -4.697 7.649 1.00 0.00 H new ATOM 0 HG2 GLN A 90 5.927 -2.957 6.620 1.00 0.00 H new ATOM 0 HG3 GLN A 90 6.104 -3.671 8.211 1.00 0.00 H new ATOM 0 HE21 GLN A 90 5.305 -4.486 4.809 1.00 0.00 H new ATOM 0 HE22 GLN A 90 6.033 -6.096 4.839 1.00 0.00 H new ATOM 1331 N LEU A 91 1.636 -4.594 5.441 1.00 0.00 N ATOM 1332 CA LEU A 91 0.293 -5.154 5.337 1.00 0.00 C ATOM 1333 C LEU A 91 0.282 -6.622 5.754 1.00 0.00 C ATOM 1334 O LEU A 91 1.217 -7.368 5.463 1.00 0.00 O ATOM 1335 CB LEU A 91 -0.230 -5.014 3.907 1.00 0.00 C ATOM 1336 CG LEU A 91 -1.525 -5.763 3.589 1.00 0.00 C ATOM 1337 CD1 LEU A 91 -2.687 -5.176 4.375 1.00 0.00 C ATOM 1338 CD2 LEU A 91 -1.812 -5.721 2.095 1.00 0.00 C ATOM 0 H LEU A 91 2.328 -5.045 4.843 1.00 0.00 H new ATOM 0 HA LEU A 91 -0.359 -4.599 6.011 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -0.386 -3.955 3.701 1.00 0.00 H new ATOM 0 HB3 LEU A 91 0.544 -5.361 3.223 1.00 0.00 H new ATOM 0 HG LEU A 91 -1.403 -6.805 3.885 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -3.600 -5.721 4.136 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -2.483 -5.259 5.443 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -2.812 -4.126 4.110 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -2.737 -6.259 1.887 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -1.915 -4.685 1.773 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -0.990 -6.189 1.553 1.00 0.00 H new ATOM 1350 N LEU A 92 -0.784 -7.029 6.435 1.00 0.00 N ATOM 1351 CA LEU A 92 -0.919 -8.409 6.889 1.00 0.00 C ATOM 1352 C LEU A 92 -2.242 -9.009 6.423 1.00 0.00 C ATOM 1353 O LEU A 92 -3.314 -8.587 6.855 1.00 0.00 O ATOM 1354 CB LEU A 92 -0.826 -8.475 8.415 1.00 0.00 C ATOM 1355 CG LEU A 92 -0.894 -9.873 9.032 1.00 0.00 C ATOM 1356 CD1 LEU A 92 -0.062 -10.854 8.222 1.00 0.00 C ATOM 1357 CD2 LEU A 92 -0.427 -9.840 10.479 1.00 0.00 C ATOM 0 H LEU A 92 -1.566 -6.424 6.685 1.00 0.00 H new ATOM 0 HA LEU A 92 -0.105 -8.990 6.455 1.00 0.00 H new ATOM 0 HB2 LEU A 92 0.110 -8.009 8.722 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.633 -7.875 8.835 1.00 0.00 H new ATOM 0 HG LEU A 92 -1.931 -10.208 9.014 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -0.122 -11.843 8.676 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -0.443 -10.899 7.202 1.00 0.00 H new ATOM 0 HD13 LEU A 92 0.977 -10.524 8.207 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -0.482 -10.843 10.902 1.00 0.00 H new ATOM 0 HD22 LEU A 92 0.603 -9.484 10.521 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -1.066 -9.169 11.052 1.00 0.00 H new ATOM 1369 N VAL A 93 -2.158 -9.998 5.539 1.00 0.00 N ATOM 1370 CA VAL A 93 -3.347 -10.659 5.016 1.00 0.00 C ATOM 1371 C VAL A 93 -3.589 -11.991 5.718 1.00 0.00 C ATOM 1372 O VAL A 93 -3.079 -13.027 5.295 1.00 0.00 O ATOM 1373 CB VAL A 93 -3.232 -10.904 3.499 1.00 0.00 C ATOM 1374 CG1 VAL A 93 -4.481 -11.595 2.974 1.00 0.00 C ATOM 1375 CG2 VAL A 93 -2.989 -9.594 2.765 1.00 0.00 C ATOM 0 H VAL A 93 -1.278 -10.359 5.170 1.00 0.00 H new ATOM 0 HA VAL A 93 -4.189 -9.993 5.206 1.00 0.00 H new ATOM 0 HB VAL A 93 -2.380 -11.559 3.318 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -4.382 -11.760 1.901 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -4.606 -12.553 3.478 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -5.352 -10.968 3.166 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -2.910 -9.786 1.695 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -3.819 -8.913 2.952 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -2.063 -9.143 3.122 1.00 0.00 H new ATOM 1385 N GLN A 94 -4.372 -11.954 6.791 1.00 0.00 N ATOM 1386 CA GLN A 94 -4.682 -13.158 7.552 1.00 0.00 C ATOM 1387 C GLN A 94 -5.482 -14.145 6.708 1.00 0.00 C ATOM 1388 O GLN A 94 -5.764 -13.890 5.537 1.00 0.00 O ATOM 1389 CB GLN A 94 -5.464 -12.801 8.817 1.00 0.00 C ATOM 1390 CG GLN A 94 -4.766 -11.773 9.693 1.00 0.00 C ATOM 1391 CD GLN A 94 -5.467 -11.566 11.022 1.00 0.00 C ATOM 1392 OE1 GLN A 94 -6.458 -12.231 11.324 1.00 0.00 O ATOM 1393 NE2 GLN A 94 -4.955 -10.640 11.824 1.00 0.00 N ATOM 0 H GLN A 94 -4.803 -11.103 7.153 1.00 0.00 H new ATOM 0 HA GLN A 94 -3.741 -13.629 7.836 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -6.444 -12.418 8.533 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -5.632 -13.708 9.398 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -3.740 -12.092 9.874 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -4.715 -10.823 9.161 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -4.132 -10.112 11.533 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -5.385 -10.457 12.731 1.00 0.00 H new ATOM 1402 N GLY A 95 -5.845 -15.273 7.310 1.00 0.00 N ATOM 1403 CA GLY A 95 -6.609 -16.281 6.598 1.00 0.00 C ATOM 1404 C GLY A 95 -7.982 -16.502 7.201 1.00 0.00 C ATOM 1405 O GLY A 95 -8.129 -17.248 8.169 1.00 0.00 O ATOM 0 H GLY A 95 -5.624 -15.507 8.278 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -6.717 -15.981 5.556 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -6.058 -17.221 6.603 1.00 0.00 H new ATOM 1409 N ARG A 96 -8.989 -15.850 6.629 1.00 0.00 N ATOM 1410 CA ARG A 96 -10.357 -15.977 7.119 1.00 0.00 C ATOM 1411 C ARG A 96 -10.664 -17.421 7.504 1.00 0.00 C ATOM 1412 O ARG A 96 -11.519 -17.678 8.353 1.00 0.00 O ATOM 1413 CB ARG A 96 -11.348 -15.499 6.056 1.00 0.00 C ATOM 1414 CG ARG A 96 -11.381 -16.378 4.816 1.00 0.00 C ATOM 1415 CD ARG A 96 -12.407 -15.881 3.809 1.00 0.00 C ATOM 1416 NE ARG A 96 -13.728 -16.458 4.043 1.00 0.00 N ATOM 1417 CZ ARG A 96 -14.103 -17.647 3.585 1.00 0.00 C ATOM 1418 NH1 ARG A 96 -13.261 -18.382 2.872 1.00 0.00 N ATOM 1419 NH2 ARG A 96 -15.322 -18.103 3.840 1.00 0.00 N ATOM 0 H ARG A 96 -8.884 -15.229 5.827 1.00 0.00 H new ATOM 0 HA ARG A 96 -10.458 -15.353 8.007 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -12.346 -15.463 6.492 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -11.091 -14.481 5.763 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -10.394 -16.394 4.354 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -11.616 -17.403 5.101 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -12.471 -14.794 3.863 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -12.076 -16.131 2.801 1.00 0.00 H new ATOM 0 HE ARG A 96 -14.400 -15.918 4.588 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -12.323 -18.035 2.674 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -13.552 -19.295 2.522 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -15.973 -17.540 4.388 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -15.609 -19.016 3.488 1.00 0.00 H new ATOM 1433 N ARG A 97 -9.963 -18.358 6.875 1.00 0.00 N ATOM 1434 CA ARG A 97 -10.163 -19.776 7.151 1.00 0.00 C ATOM 1435 C ARG A 97 -8.852 -20.439 7.565 1.00 0.00 C ATOM 1436 O ARG A 97 -8.019 -20.770 6.721 1.00 0.00 O ATOM 1437 CB ARG A 97 -10.738 -20.481 5.921 1.00 0.00 C ATOM 1438 CG ARG A 97 -11.054 -21.949 6.153 1.00 0.00 C ATOM 1439 CD ARG A 97 -11.325 -22.674 4.844 1.00 0.00 C ATOM 1440 NE ARG A 97 -11.008 -24.097 4.930 1.00 0.00 N ATOM 1441 CZ ARG A 97 -11.268 -24.968 3.962 1.00 0.00 C ATOM 1442 NH1 ARG A 97 -11.847 -24.563 2.840 1.00 0.00 N ATOM 1443 NH2 ARG A 97 -10.949 -26.247 4.114 1.00 0.00 N ATOM 0 H ARG A 97 -9.252 -18.161 6.171 1.00 0.00 H new ATOM 0 HA ARG A 97 -10.871 -19.864 7.975 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -11.648 -19.967 5.610 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -10.027 -20.397 5.099 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -10.219 -22.425 6.668 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -11.923 -22.037 6.805 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -12.374 -22.552 4.573 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -10.735 -22.219 4.049 1.00 0.00 H new ATOM 0 HE ARG A 97 -10.562 -24.441 5.781 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -12.094 -23.581 2.719 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -12.046 -25.234 2.098 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -10.503 -26.563 4.976 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -11.150 -26.915 3.369 1.00 0.00 H new ATOM 1457 N SER A 98 -8.677 -20.630 8.869 1.00 0.00 N ATOM 1458 CA SER A 98 -7.467 -21.250 9.395 1.00 0.00 C ATOM 1459 C SER A 98 -7.730 -22.696 9.802 1.00 0.00 C ATOM 1460 O SER A 98 -7.940 -22.994 10.977 1.00 0.00 O ATOM 1461 CB SER A 98 -6.943 -20.458 10.594 1.00 0.00 C ATOM 1462 OG SER A 98 -6.201 -19.326 10.173 1.00 0.00 O ATOM 0 H SER A 98 -9.358 -20.364 9.580 1.00 0.00 H new ATOM 0 HA SER A 98 -6.714 -21.244 8.607 1.00 0.00 H new ATOM 0 HB2 SER A 98 -7.779 -20.138 11.216 1.00 0.00 H new ATOM 0 HB3 SER A 98 -6.314 -21.100 11.211 1.00 0.00 H new ATOM 0 HG SER A 98 -5.879 -18.836 10.958 1.00 0.00 H new ATOM 1468 N GLY A 99 -7.716 -23.593 8.820 1.00 0.00 N ATOM 1469 CA GLY A 99 -7.955 -24.998 9.094 1.00 0.00 C ATOM 1470 C GLY A 99 -6.673 -25.762 9.359 1.00 0.00 C ATOM 1471 O GLY A 99 -5.588 -25.362 8.936 1.00 0.00 O ATOM 0 H GLY A 99 -7.543 -23.371 7.839 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -8.614 -25.090 9.957 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -8.474 -25.447 8.247 1.00 0.00 H new ATOM 1475 N PRO A 100 -6.789 -26.890 10.075 1.00 0.00 N ATOM 1476 CA PRO A 100 -5.640 -27.736 10.412 1.00 0.00 C ATOM 1477 C PRO A 100 -5.070 -28.453 9.193 1.00 0.00 C ATOM 1478 O PRO A 100 -5.692 -29.366 8.651 1.00 0.00 O ATOM 1479 CB PRO A 100 -6.222 -28.746 11.404 1.00 0.00 C ATOM 1480 CG PRO A 100 -7.674 -28.807 11.074 1.00 0.00 C ATOM 1481 CD PRO A 100 -8.051 -27.427 10.611 1.00 0.00 C ATOM 0 HA PRO A 100 -4.810 -27.155 10.813 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -5.750 -29.723 11.297 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -6.063 -28.426 12.434 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -7.867 -29.546 10.296 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -8.260 -29.100 11.945 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -8.830 -27.458 9.849 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -8.431 -26.818 11.431 1.00 0.00 H new ATOM 1489 N SER A 101 -3.883 -28.034 8.767 1.00 0.00 N ATOM 1490 CA SER A 101 -3.230 -28.634 7.610 1.00 0.00 C ATOM 1491 C SER A 101 -2.948 -30.114 7.852 1.00 0.00 C ATOM 1492 O SER A 101 -3.363 -30.972 7.073 1.00 0.00 O ATOM 1493 CB SER A 101 -1.926 -27.899 7.295 1.00 0.00 C ATOM 1494 OG SER A 101 -2.163 -26.768 6.475 1.00 0.00 O ATOM 0 H SER A 101 -3.354 -27.281 9.206 1.00 0.00 H new ATOM 0 HA SER A 101 -3.903 -28.545 6.757 1.00 0.00 H new ATOM 0 HB2 SER A 101 -1.448 -27.585 8.223 1.00 0.00 H new ATOM 0 HB3 SER A 101 -1.235 -28.577 6.794 1.00 0.00 H new ATOM 0 HG SER A 101 -1.314 -26.315 6.290 1.00 0.00 H new ATOM 1500 N SER A 102 -2.239 -30.404 8.938 1.00 0.00 N ATOM 1501 CA SER A 102 -1.897 -31.779 9.282 1.00 0.00 C ATOM 1502 C SER A 102 -3.101 -32.506 9.875 1.00 0.00 C ATOM 1503 O SER A 102 -3.270 -32.561 11.092 1.00 0.00 O ATOM 1504 CB SER A 102 -0.733 -31.805 10.274 1.00 0.00 C ATOM 1505 OG SER A 102 0.513 -31.810 9.599 1.00 0.00 O ATOM 0 H SER A 102 -1.890 -29.706 9.595 1.00 0.00 H new ATOM 0 HA SER A 102 -1.598 -32.292 8.368 1.00 0.00 H new ATOM 0 HB2 SER A 102 -0.791 -30.937 10.930 1.00 0.00 H new ATOM 0 HB3 SER A 102 -0.811 -32.689 10.907 1.00 0.00 H new ATOM 0 HG SER A 102 1.241 -31.825 10.255 1.00 0.00 H new ATOM 1511 N GLY A 103 -3.935 -33.064 9.003 1.00 0.00 N ATOM 1512 CA GLY A 103 -5.113 -33.780 9.457 1.00 0.00 C ATOM 1513 C GLY A 103 -5.364 -35.047 8.663 1.00 0.00 C ATOM 1514 O GLY A 103 -5.558 -34.997 7.448 1.00 0.00 O ATOM 0 H GLY A 103 -3.816 -33.033 7.990 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -4.997 -34.033 10.511 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -5.983 -33.128 9.379 1.00 0.00 H new TER 1518 GLY A 103