USER MOD reduce.3.24.130724 H: found=0, std=0, add=756, rem=0, adj=30 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= -0.631 K(o=-0.63,f=0.29) USER MOD Set 2.1: A 30 CYS SG : rot -6:sc= -0.335 USER MOD Set 2.2: A 80 CYS SG : rot 116:sc= 1.35 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0622 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc=-0.00909 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= -1.01 K(o=-1,f=-0.19) USER MOD Single : A 10 CYS SG : rot 26:sc= 0.699 USER MOD Single : A 12 THR OG1 : rot -140:sc= -1.24 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -0.367 X(o=-0.37,f=-0.37) USER MOD Single : A 19 GLN : amide:sc= -0.0689 X(o=-0.069,f=-0.4) USER MOD Single : A 23 LYS NZ :NH3+ -159:sc= -0.0608 (180deg=-0.358) USER MOD Single : A 25 THR OG1 : rot -34:sc= 0.173 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.0235 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 THR OG1 : rot 113:sc= 0.62 USER MOD Single : A 34 HIS : no HD1:sc= -2.64! C(o=-2.6!,f=-2.3!) 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+ -169:sc= -0.877 (180deg=-1.03) USER MOD Single : A 51 SER OG : rot -170:sc= -0.563 USER MOD Single : A 53 LYS NZ :NH3+ 177:sc= 0.394 (180deg=0.388) USER MOD Single : A 54 HIS : no HD1:sc= -2.52! X(o=-2.5!,f=-2.1) USER MOD Single : A 55 GLN : amide:sc= -0.748 X(o=-0.75,f=-0.39) USER MOD Single : A 57 SER OG : rot 180:sc= 0.00535 USER MOD Single : A 58 GLN : amide:sc= -5.67! C(o=-5.7!,f=-6.3!) USER MOD Single : A 62 THR OG1 : rot 68:sc= 1 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 SER OG : 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 159:sc= 0.0762 USER MOD Single : A 78 TYR OH : rot -55:sc= 0.599 USER MOD Single : A 79 THR OG1 : rot 180:sc= -0.143 USER MOD Single : A 84 GLN : amide:sc= -1.96 K(o=-2,f=-5.1!) USER MOD Single : A 86 GLN : amide:sc= -6.51! C(o=-6.5!,f=-7.1!) USER MOD Single : A 87 SER OG : rot 100:sc= -0.522 USER MOD Single : A 94 GLN : amide:sc= -0.258 K(o=-0.26,f=-1.1) USER MOD Single : A 98 SER OG : rot -58:sc= 0.0338 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 0.136 32.240 -3.189 1.00 0.00 N ATOM 2 CA GLY A 1 1.581 32.125 -3.259 1.00 0.00 C ATOM 3 C GLY A 1 2.045 31.404 -4.510 1.00 0.00 C ATOM 4 O GLY A 1 1.725 30.233 -4.714 1.00 0.00 O ATOM 0 H1 GLY A 1 -0.131 32.740 -2.317 1.00 0.00 H new ATOM 0 H2 GLY A 1 -0.210 32.772 -4.013 1.00 0.00 H new ATOM 0 H3 GLY A 1 -0.288 31.290 -3.187 1.00 0.00 H new ATOM 0 HA2 GLY A 1 2.023 33.121 -3.232 1.00 0.00 H new ATOM 0 HA3 GLY A 1 1.943 31.591 -2.380 1.00 0.00 H new ATOM 8 N SER A 2 2.800 32.106 -5.349 1.00 0.00 N ATOM 9 CA SER A 2 3.304 31.527 -6.589 1.00 0.00 C ATOM 10 C SER A 2 4.829 31.515 -6.602 1.00 0.00 C ATOM 11 O SER A 2 5.452 30.465 -6.760 1.00 0.00 O ATOM 12 CB SER A 2 2.779 32.312 -7.793 1.00 0.00 C ATOM 13 OG SER A 2 3.054 33.695 -7.659 1.00 0.00 O ATOM 0 H SER A 2 3.076 33.075 -5.193 1.00 0.00 H new ATOM 0 HA SER A 2 2.949 30.498 -6.652 1.00 0.00 H new ATOM 0 HB2 SER A 2 3.238 31.934 -8.706 1.00 0.00 H new ATOM 0 HB3 SER A 2 1.704 32.159 -7.890 1.00 0.00 H new ATOM 0 HG SER A 2 2.710 34.174 -8.442 1.00 0.00 H new ATOM 19 N SER A 3 5.426 32.691 -6.434 1.00 0.00 N ATOM 20 CA SER A 3 6.879 32.818 -6.430 1.00 0.00 C ATOM 21 C SER A 3 7.503 31.878 -5.404 1.00 0.00 C ATOM 22 O SER A 3 7.506 32.161 -4.207 1.00 0.00 O ATOM 23 CB SER A 3 7.285 34.262 -6.129 1.00 0.00 C ATOM 24 OG SER A 3 8.692 34.418 -6.184 1.00 0.00 O ATOM 0 H SER A 3 4.926 33.570 -6.299 1.00 0.00 H new ATOM 0 HA SER A 3 7.246 32.544 -7.419 1.00 0.00 H new ATOM 0 HB2 SER A 3 6.813 34.933 -6.847 1.00 0.00 H new ATOM 0 HB3 SER A 3 6.923 34.547 -5.141 1.00 0.00 H new ATOM 0 HG SER A 3 8.926 35.350 -5.990 1.00 0.00 H new ATOM 30 N GLY A 4 8.031 30.755 -5.883 1.00 0.00 N ATOM 31 CA GLY A 4 8.651 29.789 -4.994 1.00 0.00 C ATOM 32 C GLY A 4 9.569 28.832 -5.729 1.00 0.00 C ATOM 33 O GLY A 4 9.147 27.755 -6.148 1.00 0.00 O ATOM 0 H GLY A 4 8.040 30.497 -6.870 1.00 0.00 H new ATOM 0 HA2 GLY A 4 9.219 30.317 -4.228 1.00 0.00 H new ATOM 0 HA3 GLY A 4 7.875 29.221 -4.481 1.00 0.00 H new ATOM 37 N SER A 5 10.829 29.227 -5.887 1.00 0.00 N ATOM 38 CA SER A 5 11.808 28.398 -6.581 1.00 0.00 C ATOM 39 C SER A 5 12.103 27.128 -5.789 1.00 0.00 C ATOM 40 O SER A 5 11.895 26.017 -6.276 1.00 0.00 O ATOM 41 CB SER A 5 13.101 29.183 -6.809 1.00 0.00 C ATOM 42 OG SER A 5 13.557 29.775 -5.605 1.00 0.00 O ATOM 0 H SER A 5 11.195 30.115 -5.544 1.00 0.00 H new ATOM 0 HA SER A 5 11.389 28.114 -7.546 1.00 0.00 H new ATOM 0 HB2 SER A 5 13.869 28.518 -7.205 1.00 0.00 H new ATOM 0 HB3 SER A 5 12.933 29.957 -7.558 1.00 0.00 H new ATOM 0 HG SER A 5 14.385 30.269 -5.777 1.00 0.00 H new ATOM 48 N SER A 6 12.590 27.301 -4.565 1.00 0.00 N ATOM 49 CA SER A 6 12.919 26.170 -3.705 1.00 0.00 C ATOM 50 C SER A 6 11.681 25.673 -2.964 1.00 0.00 C ATOM 51 O SER A 6 10.857 26.465 -2.508 1.00 0.00 O ATOM 52 CB SER A 6 14.005 26.563 -2.702 1.00 0.00 C ATOM 53 OG SER A 6 15.222 26.867 -3.361 1.00 0.00 O ATOM 0 H SER A 6 12.766 28.214 -4.146 1.00 0.00 H new ATOM 0 HA SER A 6 13.292 25.363 -4.335 1.00 0.00 H new ATOM 0 HB2 SER A 6 13.675 27.426 -2.124 1.00 0.00 H new ATOM 0 HB3 SER A 6 14.164 25.748 -1.996 1.00 0.00 H new ATOM 0 HG SER A 6 15.899 27.117 -2.698 1.00 0.00 H new ATOM 59 N GLY A 7 11.557 24.355 -2.848 1.00 0.00 N ATOM 60 CA GLY A 7 10.418 23.774 -2.162 1.00 0.00 C ATOM 61 C GLY A 7 10.288 22.284 -2.412 1.00 0.00 C ATOM 62 O GLY A 7 10.232 21.844 -3.560 1.00 0.00 O ATOM 0 H GLY A 7 12.225 23.679 -3.217 1.00 0.00 H new ATOM 0 HA2 GLY A 7 10.513 23.953 -1.091 1.00 0.00 H new ATOM 0 HA3 GLY A 7 9.507 24.275 -2.489 1.00 0.00 H new ATOM 66 N ALA A 8 10.242 21.507 -1.335 1.00 0.00 N ATOM 67 CA ALA A 8 10.118 20.059 -1.444 1.00 0.00 C ATOM 68 C ALA A 8 8.919 19.550 -0.651 1.00 0.00 C ATOM 69 O ALA A 8 8.578 20.097 0.396 1.00 0.00 O ATOM 70 CB ALA A 8 11.395 19.382 -0.966 1.00 0.00 C ATOM 0 H ALA A 8 10.289 21.856 -0.378 1.00 0.00 H new ATOM 0 HA ALA A 8 9.959 19.811 -2.493 1.00 0.00 H new ATOM 0 HB1 ALA A 8 11.288 18.301 -1.053 1.00 0.00 H new ATOM 0 HB2 ALA A 8 12.234 19.714 -1.578 1.00 0.00 H new ATOM 0 HB3 ALA A 8 11.579 19.646 0.076 1.00 0.00 H new ATOM 76 N ASN A 9 8.283 18.499 -1.158 1.00 0.00 N ATOM 77 CA ASN A 9 7.121 17.917 -0.498 1.00 0.00 C ATOM 78 C ASN A 9 7.547 16.980 0.629 1.00 0.00 C ATOM 79 O ASN A 9 8.691 16.525 0.672 1.00 0.00 O ATOM 80 CB ASN A 9 6.260 17.157 -1.509 1.00 0.00 C ATOM 81 CG ASN A 9 5.241 18.051 -2.189 1.00 0.00 C ATOM 82 OD1 ASN A 9 5.587 19.091 -2.750 1.00 0.00 O ATOM 83 ND2 ASN A 9 3.976 17.650 -2.140 1.00 0.00 N ATOM 0 H ASN A 9 8.553 18.033 -2.024 1.00 0.00 H new ATOM 0 HA ASN A 9 6.534 18.730 -0.069 1.00 0.00 H new ATOM 0 HB2 ASN A 9 6.904 16.706 -2.264 1.00 0.00 H new ATOM 0 HB3 ASN A 9 5.743 16.342 -1.002 1.00 0.00 H new ATOM 0 HD21 ASN A 9 3.246 18.211 -2.578 1.00 0.00 H new ATOM 0 HD22 ASN A 9 3.735 16.781 -1.664 1.00 0.00 H new ATOM 90 N CYS A 10 6.621 16.696 1.537 1.00 0.00 N ATOM 91 CA CYS A 10 6.900 15.814 2.665 1.00 0.00 C ATOM 92 C CYS A 10 5.611 15.216 3.219 1.00 0.00 C ATOM 93 O CYS A 10 4.530 15.780 3.051 1.00 0.00 O ATOM 94 CB CYS A 10 7.638 16.577 3.766 1.00 0.00 C ATOM 95 SG CYS A 10 9.380 16.898 3.402 1.00 0.00 S ATOM 0 H CYS A 10 5.670 17.064 1.515 1.00 0.00 H new ATOM 0 HA CYS A 10 7.533 15.001 2.311 1.00 0.00 H new ATOM 0 HB2 CYS A 10 7.132 17.528 3.936 1.00 0.00 H new ATOM 0 HB3 CYS A 10 7.570 16.010 4.694 1.00 0.00 H new ATOM 0 HG CYS A 10 9.555 16.930 2.114 1.00 0.00 H new ATOM 101 N PHE A 11 5.734 14.069 3.881 1.00 0.00 N ATOM 102 CA PHE A 11 4.579 13.393 4.458 1.00 0.00 C ATOM 103 C PHE A 11 4.375 13.810 5.912 1.00 0.00 C ATOM 104 O PHE A 11 5.145 13.428 6.794 1.00 0.00 O ATOM 105 CB PHE A 11 4.754 11.875 4.371 1.00 0.00 C ATOM 106 CG PHE A 11 4.575 11.330 2.983 1.00 0.00 C ATOM 107 CD1 PHE A 11 5.654 11.231 2.119 1.00 0.00 C ATOM 108 CD2 PHE A 11 3.328 10.917 2.541 1.00 0.00 C ATOM 109 CE1 PHE A 11 5.493 10.729 0.841 1.00 0.00 C ATOM 110 CE2 PHE A 11 3.161 10.415 1.265 1.00 0.00 C ATOM 111 CZ PHE A 11 4.245 10.322 0.413 1.00 0.00 C ATOM 0 H PHE A 11 6.622 13.589 4.030 1.00 0.00 H new ATOM 0 HA PHE A 11 3.697 13.684 3.888 1.00 0.00 H new ATOM 0 HB2 PHE A 11 5.748 11.611 4.731 1.00 0.00 H new ATOM 0 HB3 PHE A 11 4.036 11.396 5.036 1.00 0.00 H new ATOM 0 HD1 PHE A 11 6.632 11.550 2.448 1.00 0.00 H new ATOM 0 HD2 PHE A 11 2.477 10.989 3.202 1.00 0.00 H new ATOM 0 HE1 PHE A 11 6.342 10.655 0.178 1.00 0.00 H new ATOM 0 HE2 PHE A 11 2.184 10.095 0.934 1.00 0.00 H new ATOM 0 HZ PHE A 11 4.116 9.932 -0.586 1.00 0.00 H new ATOM 121 N THR A 12 3.331 14.597 6.154 1.00 0.00 N ATOM 122 CA THR A 12 3.026 15.068 7.499 1.00 0.00 C ATOM 123 C THR A 12 2.570 13.920 8.394 1.00 0.00 C ATOM 124 O THR A 12 2.775 13.948 9.606 1.00 0.00 O ATOM 125 CB THR A 12 1.933 16.153 7.480 1.00 0.00 C ATOM 126 OG1 THR A 12 0.756 15.653 6.835 1.00 0.00 O ATOM 127 CG2 THR A 12 2.422 17.400 6.757 1.00 0.00 C ATOM 0 H THR A 12 2.683 14.921 5.436 1.00 0.00 H new ATOM 0 HA THR A 12 3.945 15.495 7.900 1.00 0.00 H new ATOM 0 HB THR A 12 1.697 16.418 8.511 1.00 0.00 H new ATOM 0 HG1 THR A 12 0.367 16.356 6.274 1.00 0.00 H new ATOM 0 HG21 THR A 12 1.634 18.153 6.756 1.00 0.00 H new ATOM 0 HG22 THR A 12 3.300 17.795 7.267 1.00 0.00 H new ATOM 0 HG23 THR A 12 2.683 17.146 5.730 1.00 0.00 H new ATOM 135 N GLU A 13 1.951 12.912 7.786 1.00 0.00 N ATOM 136 CA GLU A 13 1.467 11.755 8.529 1.00 0.00 C ATOM 137 C GLU A 13 1.831 10.457 7.814 1.00 0.00 C ATOM 138 O GLU A 13 1.155 10.046 6.871 1.00 0.00 O ATOM 139 CB GLU A 13 -0.050 11.839 8.716 1.00 0.00 C ATOM 140 CG GLU A 13 -0.468 12.561 9.986 1.00 0.00 C ATOM 141 CD GLU A 13 -1.915 12.302 10.354 1.00 0.00 C ATOM 142 OE1 GLU A 13 -2.186 11.275 11.010 1.00 0.00 O ATOM 143 OE2 GLU A 13 -2.778 13.127 9.986 1.00 0.00 O ATOM 0 H GLU A 13 1.773 12.874 6.782 1.00 0.00 H new ATOM 0 HA GLU A 13 1.947 11.757 9.507 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -0.486 12.350 7.857 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -0.462 10.830 8.729 1.00 0.00 H new ATOM 0 HG2 GLU A 13 0.174 12.244 10.808 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -0.316 13.633 9.857 1.00 0.00 H new ATOM 150 N GLU A 14 2.905 9.819 8.269 1.00 0.00 N ATOM 151 CA GLU A 14 3.359 8.569 7.671 1.00 0.00 C ATOM 152 C GLU A 14 2.273 7.500 7.752 1.00 0.00 C ATOM 153 O GLU A 14 1.436 7.517 8.655 1.00 0.00 O ATOM 154 CB GLU A 14 4.629 8.076 8.369 1.00 0.00 C ATOM 155 CG GLU A 14 5.860 8.909 8.053 1.00 0.00 C ATOM 156 CD GLU A 14 6.921 8.813 9.132 1.00 0.00 C ATOM 157 OE1 GLU A 14 7.411 7.693 9.386 1.00 0.00 O ATOM 158 OE2 GLU A 14 7.262 9.860 9.723 1.00 0.00 O ATOM 0 H GLU A 14 3.476 10.147 9.048 1.00 0.00 H new ATOM 0 HA GLU A 14 3.580 8.758 6.620 1.00 0.00 H new ATOM 0 HB2 GLU A 14 4.466 8.079 9.447 1.00 0.00 H new ATOM 0 HB3 GLU A 14 4.816 7.042 8.078 1.00 0.00 H new ATOM 0 HG2 GLU A 14 6.282 8.581 7.103 1.00 0.00 H new ATOM 0 HG3 GLU A 14 5.567 9.951 7.929 1.00 0.00 H new ATOM 165 N LEU A 15 2.293 6.571 6.802 1.00 0.00 N ATOM 166 CA LEU A 15 1.311 5.494 6.765 1.00 0.00 C ATOM 167 C LEU A 15 1.350 4.676 8.052 1.00 0.00 C ATOM 168 O LEU A 15 2.234 4.857 8.889 1.00 0.00 O ATOM 169 CB LEU A 15 1.567 4.585 5.561 1.00 0.00 C ATOM 170 CG LEU A 15 1.226 5.173 4.192 1.00 0.00 C ATOM 171 CD1 LEU A 15 2.112 4.566 3.115 1.00 0.00 C ATOM 172 CD2 LEU A 15 -0.243 4.949 3.865 1.00 0.00 C ATOM 0 H LEU A 15 2.979 6.542 6.047 1.00 0.00 H new ATOM 0 HA LEU A 15 0.321 5.941 6.671 1.00 0.00 H new ATOM 0 HB2 LEU A 15 2.620 4.303 5.561 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.992 3.669 5.694 1.00 0.00 H new ATOM 0 HG LEU A 15 1.410 6.247 4.224 1.00 0.00 H new ATOM 0 HD11 LEU A 15 1.855 4.996 2.147 1.00 0.00 H new ATOM 0 HD12 LEU A 15 3.157 4.779 3.341 1.00 0.00 H new ATOM 0 HD13 LEU A 15 1.960 3.487 3.084 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -0.467 5.374 2.887 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -0.454 3.880 3.853 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -0.862 5.432 4.621 1.00 0.00 H new ATOM 184 N THR A 16 0.386 3.773 8.203 1.00 0.00 N ATOM 185 CA THR A 16 0.310 2.926 9.386 1.00 0.00 C ATOM 186 C THR A 16 0.177 1.457 9.003 1.00 0.00 C ATOM 187 O THR A 16 -0.445 1.122 7.996 1.00 0.00 O ATOM 188 CB THR A 16 -0.877 3.321 10.285 1.00 0.00 C ATOM 189 OG1 THR A 16 -1.026 2.370 11.345 1.00 0.00 O ATOM 190 CG2 THR A 16 -2.165 3.394 9.478 1.00 0.00 C ATOM 0 H THR A 16 -0.353 3.610 7.520 1.00 0.00 H new ATOM 0 HA THR A 16 1.238 3.071 9.939 1.00 0.00 H new ATOM 0 HB THR A 16 -0.674 4.305 10.707 1.00 0.00 H new ATOM 0 HG1 THR A 16 -1.781 2.629 11.913 1.00 0.00 H new ATOM 0 HG21 THR A 16 -2.990 3.675 10.133 1.00 0.00 H new ATOM 0 HG22 THR A 16 -2.059 4.139 8.689 1.00 0.00 H new ATOM 0 HG23 THR A 16 -2.371 2.421 9.032 1.00 0.00 H new ATOM 198 N ASN A 17 0.765 0.583 9.814 1.00 0.00 N ATOM 199 CA ASN A 17 0.711 -0.852 9.560 1.00 0.00 C ATOM 200 C ASN A 17 -0.732 -1.346 9.535 1.00 0.00 C ATOM 201 O ASN A 17 -1.455 -1.234 10.525 1.00 0.00 O ATOM 202 CB ASN A 17 1.503 -1.611 10.626 1.00 0.00 C ATOM 203 CG ASN A 17 2.665 -0.801 11.168 1.00 0.00 C ATOM 204 OD1 ASN A 17 2.719 -0.491 12.359 1.00 0.00 O ATOM 205 ND2 ASN A 17 3.603 -0.453 10.294 1.00 0.00 N ATOM 0 H ASN A 17 1.284 0.844 10.652 1.00 0.00 H new ATOM 0 HA ASN A 17 1.158 -1.039 8.584 1.00 0.00 H new ATOM 0 HB2 ASN A 17 0.838 -1.881 11.446 1.00 0.00 H new ATOM 0 HB3 ASN A 17 1.879 -2.542 10.202 1.00 0.00 H new ATOM 0 HD21 ASN A 17 4.408 0.093 10.600 1.00 0.00 H new ATOM 0 HD22 ASN A 17 3.518 -0.732 9.316 1.00 0.00 H new ATOM 212 N LEU A 18 -1.144 -1.894 8.397 1.00 0.00 N ATOM 213 CA LEU A 18 -2.501 -2.407 8.242 1.00 0.00 C ATOM 214 C LEU A 18 -2.544 -3.914 8.475 1.00 0.00 C ATOM 215 O LEU A 18 -1.579 -4.622 8.190 1.00 0.00 O ATOM 216 CB LEU A 18 -3.035 -2.080 6.846 1.00 0.00 C ATOM 217 CG LEU A 18 -3.264 -0.598 6.546 1.00 0.00 C ATOM 218 CD1 LEU A 18 -3.929 -0.425 5.189 1.00 0.00 C ATOM 219 CD2 LEU A 18 -4.103 0.045 7.640 1.00 0.00 C ATOM 0 H LEU A 18 -0.558 -1.995 7.568 1.00 0.00 H new ATOM 0 HA LEU A 18 -3.132 -1.925 8.988 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -2.336 -2.476 6.109 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -3.978 -2.609 6.706 1.00 0.00 H new ATOM 0 HG LEU A 18 -2.296 -0.099 6.519 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -4.084 0.636 4.992 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -3.290 -0.848 4.414 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -4.890 -0.939 5.187 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -4.255 1.099 7.409 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -5.069 -0.457 7.700 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.587 -0.046 8.596 1.00 0.00 H new ATOM 231 N GLN A 19 -3.669 -4.396 8.992 1.00 0.00 N ATOM 232 CA GLN A 19 -3.837 -5.819 9.261 1.00 0.00 C ATOM 233 C GLN A 19 -5.281 -6.251 9.025 1.00 0.00 C ATOM 234 O GLN A 19 -6.204 -5.739 9.658 1.00 0.00 O ATOM 235 CB GLN A 19 -3.426 -6.140 10.699 1.00 0.00 C ATOM 236 CG GLN A 19 -1.930 -6.352 10.870 1.00 0.00 C ATOM 237 CD GLN A 19 -1.433 -5.928 12.238 1.00 0.00 C ATOM 238 OE1 GLN A 19 -1.761 -4.843 12.721 1.00 0.00 O ATOM 239 NE2 GLN A 19 -0.638 -6.783 12.871 1.00 0.00 N ATOM 0 H GLN A 19 -4.477 -3.823 9.233 1.00 0.00 H new ATOM 0 HA GLN A 19 -3.194 -6.371 8.575 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -3.746 -5.327 11.350 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -3.952 -7.037 11.027 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -1.696 -7.405 10.713 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -1.397 -5.789 10.104 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -0.392 -7.671 12.433 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -0.273 -6.552 13.795 1.00 0.00 H new ATOM 248 N VAL A 20 -5.468 -7.196 8.109 1.00 0.00 N ATOM 249 CA VAL A 20 -6.800 -7.697 7.789 1.00 0.00 C ATOM 250 C VAL A 20 -6.730 -9.096 7.187 1.00 0.00 C ATOM 251 O VAL A 20 -5.652 -9.583 6.849 1.00 0.00 O ATOM 252 CB VAL A 20 -7.530 -6.763 6.807 1.00 0.00 C ATOM 253 CG1 VAL A 20 -9.023 -7.057 6.800 1.00 0.00 C ATOM 254 CG2 VAL A 20 -7.268 -5.307 7.162 1.00 0.00 C ATOM 0 H VAL A 20 -4.715 -7.630 7.576 1.00 0.00 H new ATOM 0 HA VAL A 20 -7.358 -7.735 8.725 1.00 0.00 H new ATOM 0 HB VAL A 20 -7.143 -6.945 5.804 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -9.522 -6.387 6.100 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -9.189 -8.090 6.495 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -9.429 -6.905 7.800 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -7.792 -4.661 6.457 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -7.627 -5.109 8.172 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -6.198 -5.107 7.111 1.00 0.00 H new ATOM 264 N GLU A 21 -7.888 -9.736 7.054 1.00 0.00 N ATOM 265 CA GLU A 21 -7.957 -11.079 6.492 1.00 0.00 C ATOM 266 C GLU A 21 -8.039 -11.029 4.969 1.00 0.00 C ATOM 267 O GLU A 21 -8.556 -10.069 4.397 1.00 0.00 O ATOM 268 CB GLU A 21 -9.167 -11.829 7.054 1.00 0.00 C ATOM 269 CG GLU A 21 -9.260 -11.786 8.570 1.00 0.00 C ATOM 270 CD GLU A 21 -8.546 -12.948 9.232 1.00 0.00 C ATOM 271 OE1 GLU A 21 -8.021 -13.816 8.503 1.00 0.00 O ATOM 272 OE2 GLU A 21 -8.512 -12.990 10.480 1.00 0.00 O ATOM 0 H GLU A 21 -8.790 -9.346 7.328 1.00 0.00 H new ATOM 0 HA GLU A 21 -7.047 -11.609 6.772 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -10.077 -11.403 6.630 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -9.121 -12.869 6.731 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -8.833 -10.850 8.930 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -10.309 -11.793 8.866 1.00 0.00 H new ATOM 279 N GLU A 22 -7.524 -12.068 4.320 1.00 0.00 N ATOM 280 CA GLU A 22 -7.538 -12.141 2.863 1.00 0.00 C ATOM 281 C GLU A 22 -8.947 -11.921 2.321 1.00 0.00 C ATOM 282 O GLU A 22 -9.935 -12.103 3.033 1.00 0.00 O ATOM 283 CB GLU A 22 -7.004 -13.496 2.394 1.00 0.00 C ATOM 284 CG GLU A 22 -7.946 -14.653 2.680 1.00 0.00 C ATOM 285 CD GLU A 22 -7.338 -15.999 2.338 1.00 0.00 C ATOM 286 OE1 GLU A 22 -7.020 -16.223 1.151 1.00 0.00 O ATOM 287 OE2 GLU A 22 -7.179 -16.829 3.258 1.00 0.00 O ATOM 0 H GLU A 22 -7.092 -12.870 4.779 1.00 0.00 H new ATOM 0 HA GLU A 22 -6.893 -11.351 2.478 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.813 -13.450 1.322 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -6.048 -13.688 2.880 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -8.221 -14.640 3.735 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -8.865 -14.518 2.109 1.00 0.00 H new ATOM 294 N LYS A 23 -9.032 -11.526 1.055 1.00 0.00 N ATOM 295 CA LYS A 23 -10.318 -11.281 0.414 1.00 0.00 C ATOM 296 C LYS A 23 -11.095 -10.195 1.151 1.00 0.00 C ATOM 297 O LYS A 23 -12.324 -10.158 1.106 1.00 0.00 O ATOM 298 CB LYS A 23 -11.142 -12.570 0.368 1.00 0.00 C ATOM 299 CG LYS A 23 -10.495 -13.677 -0.446 1.00 0.00 C ATOM 300 CD LYS A 23 -10.631 -13.425 -1.938 1.00 0.00 C ATOM 301 CE LYS A 23 -11.936 -13.988 -2.481 1.00 0.00 C ATOM 302 NZ LYS A 23 -11.951 -15.477 -2.456 1.00 0.00 N ATOM 0 H LYS A 23 -8.224 -11.369 0.452 1.00 0.00 H new ATOM 0 HA LYS A 23 -10.129 -10.941 -0.604 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -11.302 -12.925 1.386 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -12.124 -12.349 -0.051 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -9.440 -13.753 -0.184 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -10.956 -14.632 -0.194 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -10.587 -12.353 -2.133 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -9.791 -13.879 -2.463 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -12.769 -13.607 -1.891 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -12.084 -13.640 -3.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -12.659 -15.828 -3.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -11.012 -15.838 -2.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -12.192 -15.806 -1.499 1.00 0.00 H new ATOM 316 N GLY A 24 -10.369 -9.310 1.828 1.00 0.00 N ATOM 317 CA GLY A 24 -11.007 -8.235 2.564 1.00 0.00 C ATOM 318 C GLY A 24 -10.836 -6.889 1.888 1.00 0.00 C ATOM 319 O GLY A 24 -11.118 -6.742 0.698 1.00 0.00 O ATOM 0 H GLY A 24 -9.350 -9.319 1.880 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -12.070 -8.452 2.670 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -10.589 -8.189 3.570 1.00 0.00 H new ATOM 323 N THR A 25 -10.374 -5.901 2.648 1.00 0.00 N ATOM 324 CA THR A 25 -10.168 -4.559 2.116 1.00 0.00 C ATOM 325 C THR A 25 -9.195 -3.768 2.982 1.00 0.00 C ATOM 326 O THR A 25 -9.425 -3.579 4.177 1.00 0.00 O ATOM 327 CB THR A 25 -11.496 -3.785 2.017 1.00 0.00 C ATOM 328 OG1 THR A 25 -12.519 -4.633 1.484 1.00 0.00 O ATOM 329 CG2 THR A 25 -11.340 -2.554 1.136 1.00 0.00 C ATOM 0 H THR A 25 -10.135 -6.005 3.634 1.00 0.00 H new ATOM 0 HA THR A 25 -9.748 -4.675 1.117 1.00 0.00 H new ATOM 0 HB THR A 25 -11.779 -3.462 3.019 1.00 0.00 H new ATOM 0 HG1 THR A 25 -12.126 -5.251 0.833 1.00 0.00 H new ATOM 0 HG21 THR A 25 -12.290 -2.023 1.081 1.00 0.00 H new ATOM 0 HG22 THR A 25 -10.581 -1.896 1.561 1.00 0.00 H new ATOM 0 HG23 THR A 25 -11.036 -2.859 0.135 1.00 0.00 H new ATOM 337 N ALA A 26 -8.108 -3.306 2.373 1.00 0.00 N ATOM 338 CA ALA A 26 -7.101 -2.533 3.088 1.00 0.00 C ATOM 339 C ALA A 26 -6.792 -1.228 2.361 1.00 0.00 C ATOM 340 O ALA A 26 -6.293 -1.237 1.235 1.00 0.00 O ATOM 341 CB ALA A 26 -5.833 -3.353 3.266 1.00 0.00 C ATOM 0 H ALA A 26 -7.902 -3.454 1.385 1.00 0.00 H new ATOM 0 HA ALA A 26 -7.500 -2.285 4.071 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -5.090 -2.762 3.802 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -6.060 -4.254 3.836 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -5.439 -3.631 2.288 1.00 0.00 H new ATOM 347 N VAL A 27 -7.092 -0.108 3.011 1.00 0.00 N ATOM 348 CA VAL A 27 -6.846 1.204 2.426 1.00 0.00 C ATOM 349 C VAL A 27 -5.759 1.952 3.190 1.00 0.00 C ATOM 350 O VAL A 27 -5.933 2.298 4.359 1.00 0.00 O ATOM 351 CB VAL A 27 -8.126 2.060 2.408 1.00 0.00 C ATOM 352 CG1 VAL A 27 -8.905 1.884 3.703 1.00 0.00 C ATOM 353 CG2 VAL A 27 -7.785 3.524 2.177 1.00 0.00 C ATOM 0 H VAL A 27 -7.506 -0.083 3.943 1.00 0.00 H new ATOM 0 HA VAL A 27 -6.516 1.036 1.401 1.00 0.00 H new ATOM 0 HB VAL A 27 -8.755 1.723 1.584 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -9.806 2.497 3.672 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -9.182 0.837 3.821 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -8.286 2.193 4.545 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -8.702 4.114 2.167 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -7.135 3.877 2.978 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -7.274 3.632 1.220 1.00 0.00 H new ATOM 363 N PHE A 28 -4.637 2.198 2.523 1.00 0.00 N ATOM 364 CA PHE A 28 -3.520 2.905 3.139 1.00 0.00 C ATOM 365 C PHE A 28 -3.759 4.412 3.132 1.00 0.00 C ATOM 366 O PHE A 28 -3.700 5.057 2.084 1.00 0.00 O ATOM 367 CB PHE A 28 -2.216 2.580 2.407 1.00 0.00 C ATOM 368 CG PHE A 28 -1.562 1.314 2.881 1.00 0.00 C ATOM 369 CD1 PHE A 28 -1.142 1.185 4.195 1.00 0.00 C ATOM 370 CD2 PHE A 28 -1.365 0.253 2.012 1.00 0.00 C ATOM 371 CE1 PHE A 28 -0.540 0.021 4.634 1.00 0.00 C ATOM 372 CE2 PHE A 28 -0.763 -0.913 2.445 1.00 0.00 C ATOM 373 CZ PHE A 28 -0.349 -1.029 3.758 1.00 0.00 C ATOM 0 H PHE A 28 -4.477 1.918 1.555 1.00 0.00 H new ATOM 0 HA PHE A 28 -3.439 2.573 4.174 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -2.419 2.497 1.339 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -1.520 3.409 2.536 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -1.287 2.004 4.884 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -1.686 0.338 0.984 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -0.219 -0.067 5.661 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -0.616 -1.733 1.758 1.00 0.00 H new ATOM 0 HZ PHE A 28 0.123 -1.939 4.098 1.00 0.00 H new ATOM 383 N THR A 29 -4.029 4.968 4.309 1.00 0.00 N ATOM 384 CA THR A 29 -4.279 6.398 4.439 1.00 0.00 C ATOM 385 C THR A 29 -3.010 7.144 4.835 1.00 0.00 C ATOM 386 O THR A 29 -2.307 6.743 5.763 1.00 0.00 O ATOM 387 CB THR A 29 -5.375 6.684 5.482 1.00 0.00 C ATOM 388 OG1 THR A 29 -5.241 5.790 6.592 1.00 0.00 O ATOM 389 CG2 THR A 29 -6.759 6.533 4.868 1.00 0.00 C ATOM 0 H THR A 29 -4.080 4.449 5.186 1.00 0.00 H new ATOM 0 HA THR A 29 -4.615 6.750 3.464 1.00 0.00 H new ATOM 0 HB THR A 29 -5.257 7.711 5.827 1.00 0.00 H new ATOM 0 HG1 THR A 29 -5.941 5.980 7.251 1.00 0.00 H new ATOM 0 HG21 THR A 29 -7.517 6.740 5.624 1.00 0.00 H new ATOM 0 HG22 THR A 29 -6.869 7.235 4.042 1.00 0.00 H new ATOM 0 HG23 THR A 29 -6.884 5.515 4.498 1.00 0.00 H new ATOM 397 N CYS A 30 -2.722 8.230 4.126 1.00 0.00 N ATOM 398 CA CYS A 30 -1.536 9.032 4.404 1.00 0.00 C ATOM 399 C CYS A 30 -1.848 10.521 4.287 1.00 0.00 C ATOM 400 O CYS A 30 -2.974 10.908 3.974 1.00 0.00 O ATOM 401 CB CYS A 30 -0.406 8.659 3.443 1.00 0.00 C ATOM 402 SG CYS A 30 -0.926 8.492 1.720 1.00 0.00 S ATOM 0 H CYS A 30 -3.293 8.575 3.355 1.00 0.00 H new ATOM 0 HA CYS A 30 -1.218 8.824 5.426 1.00 0.00 H new ATOM 0 HB2 CYS A 30 0.374 9.418 3.504 1.00 0.00 H new ATOM 0 HB3 CYS A 30 0.039 7.719 3.770 1.00 0.00 H new ATOM 0 HG CYS A 30 -2.219 8.604 1.644 1.00 0.00 H new ATOM 408 N LYS A 31 -0.843 11.352 4.543 1.00 0.00 N ATOM 409 CA LYS A 31 -1.008 12.799 4.468 1.00 0.00 C ATOM 410 C LYS A 31 0.255 13.463 3.929 1.00 0.00 C ATOM 411 O LYS A 31 1.343 12.889 3.982 1.00 0.00 O ATOM 412 CB LYS A 31 -1.346 13.366 5.849 1.00 0.00 C ATOM 413 CG LYS A 31 -2.245 14.590 5.800 1.00 0.00 C ATOM 414 CD LYS A 31 -2.362 15.250 7.163 1.00 0.00 C ATOM 415 CE LYS A 31 -3.443 16.320 7.173 1.00 0.00 C ATOM 416 NZ LYS A 31 -3.994 16.540 8.539 1.00 0.00 N ATOM 0 H LYS A 31 0.095 11.048 4.804 1.00 0.00 H new ATOM 0 HA LYS A 31 -1.829 13.012 3.784 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -1.833 12.591 6.441 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -0.420 13.626 6.363 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -1.847 15.306 5.081 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -3.235 14.301 5.448 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -2.589 14.495 7.916 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -1.405 15.695 7.436 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -3.032 17.255 6.792 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -4.249 16.028 6.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -4.728 17.276 8.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -4.409 15.655 8.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -3.230 16.843 9.177 1.00 0.00 H new ATOM 430 N THR A 32 0.104 14.678 3.410 1.00 0.00 N ATOM 431 CA THR A 32 1.231 15.421 2.862 1.00 0.00 C ATOM 432 C THR A 32 1.079 16.916 3.114 1.00 0.00 C ATOM 433 O THR A 32 -0.035 17.436 3.166 1.00 0.00 O ATOM 434 CB THR A 32 1.380 15.179 1.348 1.00 0.00 C ATOM 435 OG1 THR A 32 0.124 15.388 0.693 1.00 0.00 O ATOM 436 CG2 THR A 32 1.873 13.767 1.071 1.00 0.00 C ATOM 0 H THR A 32 -0.789 15.168 3.358 1.00 0.00 H new ATOM 0 HA THR A 32 2.125 15.059 3.370 1.00 0.00 H new ATOM 0 HB THR A 32 2.114 15.885 0.960 1.00 0.00 H new ATOM 0 HG1 THR A 32 0.182 16.181 0.120 1.00 0.00 H new ATOM 0 HG21 THR A 32 1.970 13.620 -0.005 1.00 0.00 H new ATOM 0 HG22 THR A 32 2.843 13.620 1.546 1.00 0.00 H new ATOM 0 HG23 THR A 32 1.160 13.047 1.472 1.00 0.00 H new ATOM 444 N GLU A 33 2.207 17.603 3.269 1.00 0.00 N ATOM 445 CA GLU A 33 2.197 19.040 3.515 1.00 0.00 C ATOM 446 C GLU A 33 1.547 19.787 2.354 1.00 0.00 C ATOM 447 O GLU A 33 0.784 20.732 2.559 1.00 0.00 O ATOM 448 CB GLU A 33 3.623 19.553 3.732 1.00 0.00 C ATOM 449 CG GLU A 33 3.723 21.068 3.788 1.00 0.00 C ATOM 450 CD GLU A 33 3.195 21.639 5.090 1.00 0.00 C ATOM 451 OE1 GLU A 33 3.566 21.117 6.162 1.00 0.00 O ATOM 452 OE2 GLU A 33 2.410 22.609 5.036 1.00 0.00 O ATOM 0 H GLU A 33 3.138 17.188 3.229 1.00 0.00 H new ATOM 0 HA GLU A 33 1.611 19.224 4.416 1.00 0.00 H new ATOM 0 HB2 GLU A 33 4.012 19.137 4.661 1.00 0.00 H new ATOM 0 HB3 GLU A 33 4.259 19.185 2.927 1.00 0.00 H new ATOM 0 HG2 GLU A 33 4.764 21.365 3.661 1.00 0.00 H new ATOM 0 HG3 GLU A 33 3.166 21.496 2.955 1.00 0.00 H new ATOM 459 N HIS A 34 1.856 19.357 1.135 1.00 0.00 N ATOM 460 CA HIS A 34 1.302 19.985 -0.060 1.00 0.00 C ATOM 461 C HIS A 34 0.476 18.986 -0.865 1.00 0.00 C ATOM 462 O HIS A 34 0.742 17.784 -0.868 1.00 0.00 O ATOM 463 CB HIS A 34 2.424 20.554 -0.929 1.00 0.00 C ATOM 464 CG HIS A 34 3.452 21.320 -0.154 1.00 0.00 C ATOM 465 ND1 HIS A 34 3.133 22.342 0.714 1.00 0.00 N ATOM 466 CD2 HIS A 34 4.801 21.206 -0.119 1.00 0.00 C ATOM 467 CE1 HIS A 34 4.241 22.825 1.248 1.00 0.00 C ATOM 468 NE2 HIS A 34 5.267 22.152 0.760 1.00 0.00 N ATOM 0 H HIS A 34 2.486 18.577 0.948 1.00 0.00 H new ATOM 0 HA HIS A 34 0.649 20.799 0.256 1.00 0.00 H new ATOM 0 HB2 HIS A 34 2.914 19.736 -1.457 1.00 0.00 H new ATOM 0 HB3 HIS A 34 1.990 21.207 -1.686 1.00 0.00 H new ATOM 0 HD2 HIS A 34 5.399 20.502 -0.678 1.00 0.00 H new ATOM 0 HE1 HIS A 34 4.298 23.633 1.962 1.00 0.00 H new ATOM 0 HE2 HIS A 34 6.246 22.309 0.997 1.00 0.00 H new ATOM 477 N PRO A 35 -0.550 19.493 -1.563 1.00 0.00 N ATOM 478 CA PRO A 35 -1.436 18.663 -2.385 1.00 0.00 C ATOM 479 C PRO A 35 -0.735 18.117 -3.624 1.00 0.00 C ATOM 480 O PRO A 35 -0.717 18.761 -4.672 1.00 0.00 O ATOM 481 CB PRO A 35 -2.556 19.626 -2.785 1.00 0.00 C ATOM 482 CG PRO A 35 -1.933 20.978 -2.719 1.00 0.00 C ATOM 483 CD PRO A 35 -0.925 20.917 -1.606 1.00 0.00 C ATOM 0 HA PRO A 35 -1.785 17.783 -1.845 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -2.926 19.409 -3.787 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -3.406 19.548 -2.107 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -1.455 21.234 -3.665 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -2.683 21.744 -2.524 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -0.064 21.553 -1.809 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -1.351 21.249 -0.659 1.00 0.00 H new ATOM 491 N ALA A 36 -0.158 16.927 -3.496 1.00 0.00 N ATOM 492 CA ALA A 36 0.542 16.294 -4.607 1.00 0.00 C ATOM 493 C ALA A 36 -0.362 16.173 -5.829 1.00 0.00 C ATOM 494 O ALA A 36 -1.441 15.586 -5.758 1.00 0.00 O ATOM 495 CB ALA A 36 1.059 14.924 -4.193 1.00 0.00 C ATOM 0 H ALA A 36 -0.161 16.382 -2.634 1.00 0.00 H new ATOM 0 HA ALA A 36 1.390 16.924 -4.876 1.00 0.00 H new ATOM 0 HB1 ALA A 36 1.580 14.463 -5.032 1.00 0.00 H new ATOM 0 HB2 ALA A 36 1.747 15.033 -3.355 1.00 0.00 H new ATOM 0 HB3 ALA A 36 0.221 14.294 -3.895 1.00 0.00 H new ATOM 501 N ALA A 37 0.085 16.732 -6.948 1.00 0.00 N ATOM 502 CA ALA A 37 -0.684 16.686 -8.185 1.00 0.00 C ATOM 503 C ALA A 37 -0.703 15.276 -8.767 1.00 0.00 C ATOM 504 O ALA A 37 -1.554 14.945 -9.593 1.00 0.00 O ATOM 505 CB ALA A 37 -0.115 17.669 -9.198 1.00 0.00 C ATOM 0 H ALA A 37 0.976 17.222 -7.023 1.00 0.00 H new ATOM 0 HA ALA A 37 -1.711 16.971 -7.956 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -0.699 17.624 -10.117 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -0.159 18.679 -8.790 1.00 0.00 H new ATOM 0 HB3 ALA A 37 0.921 17.410 -9.414 1.00 0.00 H new ATOM 511 N THR A 38 0.241 14.448 -8.331 1.00 0.00 N ATOM 512 CA THR A 38 0.334 13.075 -8.810 1.00 0.00 C ATOM 513 C THR A 38 0.798 12.136 -7.701 1.00 0.00 C ATOM 514 O THR A 38 1.414 12.567 -6.726 1.00 0.00 O ATOM 515 CB THR A 38 1.301 12.959 -10.003 1.00 0.00 C ATOM 516 OG1 THR A 38 1.159 11.678 -10.627 1.00 0.00 O ATOM 517 CG2 THR A 38 2.741 13.153 -9.553 1.00 0.00 C ATOM 0 H THR A 38 0.952 14.705 -7.647 1.00 0.00 H new ATOM 0 HA THR A 38 -0.666 12.786 -9.134 1.00 0.00 H new ATOM 0 HB THR A 38 1.053 13.741 -10.721 1.00 0.00 H new ATOM 0 HG1 THR A 38 1.776 11.613 -11.386 1.00 0.00 H new ATOM 0 HG21 THR A 38 3.406 13.067 -10.413 1.00 0.00 H new ATOM 0 HG22 THR A 38 2.853 14.141 -9.106 1.00 0.00 H new ATOM 0 HG23 THR A 38 2.998 12.391 -8.818 1.00 0.00 H new ATOM 525 N VAL A 39 0.500 10.850 -7.858 1.00 0.00 N ATOM 526 CA VAL A 39 0.889 9.850 -6.870 1.00 0.00 C ATOM 527 C VAL A 39 1.006 8.469 -7.505 1.00 0.00 C ATOM 528 O VAL A 39 0.072 7.985 -8.145 1.00 0.00 O ATOM 529 CB VAL A 39 -0.121 9.785 -5.709 1.00 0.00 C ATOM 530 CG1 VAL A 39 0.288 8.719 -4.704 1.00 0.00 C ATOM 531 CG2 VAL A 39 -0.247 11.144 -5.037 1.00 0.00 C ATOM 0 H VAL A 39 -0.009 10.476 -8.659 1.00 0.00 H new ATOM 0 HA VAL A 39 1.861 10.152 -6.479 1.00 0.00 H new ATOM 0 HB VAL A 39 -1.096 9.513 -6.113 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -0.437 8.688 -3.891 1.00 0.00 H new ATOM 0 HG12 VAL A 39 0.322 7.748 -5.197 1.00 0.00 H new ATOM 0 HG13 VAL A 39 1.273 8.956 -4.302 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -0.965 11.080 -4.219 1.00 0.00 H new ATOM 0 HG22 VAL A 39 0.724 11.448 -4.645 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -0.591 11.879 -5.765 1.00 0.00 H new ATOM 541 N THR A 40 2.162 7.836 -7.323 1.00 0.00 N ATOM 542 CA THR A 40 2.403 6.511 -7.878 1.00 0.00 C ATOM 543 C THR A 40 2.753 5.511 -6.781 1.00 0.00 C ATOM 544 O THR A 40 3.893 5.456 -6.320 1.00 0.00 O ATOM 545 CB THR A 40 3.540 6.535 -8.917 1.00 0.00 C ATOM 546 OG1 THR A 40 3.233 7.469 -9.957 1.00 0.00 O ATOM 547 CG2 THR A 40 3.754 5.153 -9.516 1.00 0.00 C ATOM 0 H THR A 40 2.945 8.221 -6.795 1.00 0.00 H new ATOM 0 HA THR A 40 1.480 6.201 -8.368 1.00 0.00 H new ATOM 0 HB THR A 40 4.457 6.841 -8.413 1.00 0.00 H new ATOM 0 HG1 THR A 40 3.961 7.480 -10.613 1.00 0.00 H new ATOM 0 HG21 THR A 40 4.562 5.194 -10.247 1.00 0.00 H new ATOM 0 HG22 THR A 40 4.016 4.450 -8.725 1.00 0.00 H new ATOM 0 HG23 THR A 40 2.838 4.823 -10.006 1.00 0.00 H new ATOM 555 N TRP A 41 1.767 4.723 -6.369 1.00 0.00 N ATOM 556 CA TRP A 41 1.972 3.724 -5.326 1.00 0.00 C ATOM 557 C TRP A 41 2.819 2.566 -5.841 1.00 0.00 C ATOM 558 O TRP A 41 2.738 2.199 -7.013 1.00 0.00 O ATOM 559 CB TRP A 41 0.627 3.202 -4.819 1.00 0.00 C ATOM 560 CG TRP A 41 -0.223 4.264 -4.189 1.00 0.00 C ATOM 561 CD1 TRP A 41 -0.901 5.260 -4.831 1.00 0.00 C ATOM 562 CD2 TRP A 41 -0.483 4.435 -2.791 1.00 0.00 C ATOM 563 NE1 TRP A 41 -1.567 6.041 -3.917 1.00 0.00 N ATOM 564 CE2 TRP A 41 -1.328 5.555 -2.659 1.00 0.00 C ATOM 565 CE3 TRP A 41 -0.088 3.751 -1.639 1.00 0.00 C ATOM 566 CZ2 TRP A 41 -1.780 6.004 -1.421 1.00 0.00 C ATOM 567 CZ3 TRP A 41 -0.537 4.198 -0.411 1.00 0.00 C ATOM 568 CH2 TRP A 41 -1.377 5.315 -0.310 1.00 0.00 C ATOM 0 H TRP A 41 0.818 4.756 -6.741 1.00 0.00 H new ATOM 0 HA TRP A 41 2.503 4.200 -4.501 1.00 0.00 H new ATOM 0 HB2 TRP A 41 0.082 2.756 -5.651 1.00 0.00 H new ATOM 0 HB3 TRP A 41 0.804 2.409 -4.092 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -0.912 5.412 -5.900 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -2.145 6.851 -4.139 1.00 0.00 H new ATOM 0 HE3 TRP A 41 0.557 2.888 -1.707 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 -2.426 6.866 -1.341 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 -0.235 3.678 0.486 1.00 0.00 H new ATOM 0 HH2 TRP A 41 -1.713 5.638 0.664 1.00 0.00 H new ATOM 579 N ARG A 42 3.632 1.994 -4.958 1.00 0.00 N ATOM 580 CA ARG A 42 4.495 0.878 -5.324 1.00 0.00 C ATOM 581 C ARG A 42 4.338 -0.277 -4.339 1.00 0.00 C ATOM 582 O ARG A 42 4.028 -0.068 -3.166 1.00 0.00 O ATOM 583 CB ARG A 42 5.956 1.329 -5.370 1.00 0.00 C ATOM 584 CG ARG A 42 6.941 0.184 -5.536 1.00 0.00 C ATOM 585 CD ARG A 42 8.380 0.673 -5.470 1.00 0.00 C ATOM 586 NE ARG A 42 8.683 1.627 -6.534 1.00 0.00 N ATOM 587 CZ ARG A 42 9.914 2.024 -6.835 1.00 0.00 C ATOM 588 NH1 ARG A 42 10.951 1.553 -6.157 1.00 0.00 N ATOM 589 NH2 ARG A 42 10.109 2.895 -7.817 1.00 0.00 N ATOM 0 H ARG A 42 3.711 2.286 -3.984 1.00 0.00 H new ATOM 0 HA ARG A 42 4.198 0.531 -6.314 1.00 0.00 H new ATOM 0 HB2 ARG A 42 6.085 2.031 -6.194 1.00 0.00 H new ATOM 0 HB3 ARG A 42 6.190 1.868 -4.452 1.00 0.00 H new ATOM 0 HG2 ARG A 42 6.772 -0.559 -4.756 1.00 0.00 H new ATOM 0 HG3 ARG A 42 6.767 -0.311 -6.491 1.00 0.00 H new ATOM 0 HD2 ARG A 42 8.560 1.140 -4.502 1.00 0.00 H new ATOM 0 HD3 ARG A 42 9.056 -0.179 -5.543 1.00 0.00 H new ATOM 0 HE ARG A 42 7.907 2.009 -7.075 1.00 0.00 H new ATOM 0 HH11 ARG A 42 10.805 0.884 -5.401 1.00 0.00 H new ATOM 0 HH12 ARG A 42 11.895 1.860 -6.391 1.00 0.00 H new ATOM 0 HH21 ARG A 42 9.313 3.260 -8.341 1.00 0.00 H new ATOM 0 HH22 ARG A 42 11.055 3.200 -8.048 1.00 0.00 H new ATOM 603 N LYS A 43 4.555 -1.495 -4.823 1.00 0.00 N ATOM 604 CA LYS A 43 4.439 -2.683 -3.986 1.00 0.00 C ATOM 605 C LYS A 43 5.434 -3.754 -4.422 1.00 0.00 C ATOM 606 O LYS A 43 5.440 -4.175 -5.578 1.00 0.00 O ATOM 607 CB LYS A 43 3.015 -3.239 -4.049 1.00 0.00 C ATOM 608 CG LYS A 43 2.885 -4.645 -3.487 1.00 0.00 C ATOM 609 CD LYS A 43 1.434 -5.006 -3.218 1.00 0.00 C ATOM 610 CE LYS A 43 1.213 -6.509 -3.284 1.00 0.00 C ATOM 611 NZ LYS A 43 2.230 -7.255 -2.493 1.00 0.00 N ATOM 0 H LYS A 43 4.812 -1.685 -5.791 1.00 0.00 H new ATOM 0 HA LYS A 43 4.666 -2.397 -2.959 1.00 0.00 H new ATOM 0 HB2 LYS A 43 2.350 -2.574 -3.499 1.00 0.00 H new ATOM 0 HB3 LYS A 43 2.679 -3.239 -5.086 1.00 0.00 H new ATOM 0 HG2 LYS A 43 3.314 -5.360 -4.189 1.00 0.00 H new ATOM 0 HG3 LYS A 43 3.458 -4.723 -2.563 1.00 0.00 H new ATOM 0 HD2 LYS A 43 1.142 -4.637 -2.235 1.00 0.00 H new ATOM 0 HD3 LYS A 43 0.793 -4.510 -3.947 1.00 0.00 H new ATOM 0 HE2 LYS A 43 0.217 -6.746 -2.910 1.00 0.00 H new ATOM 0 HE3 LYS A 43 1.250 -6.836 -4.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 2.163 -8.270 -2.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 3.181 -6.911 -2.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 2.058 -7.106 -1.478 1.00 0.00 H new ATOM 625 N GLY A 44 6.272 -4.192 -3.488 1.00 0.00 N ATOM 626 CA GLY A 44 7.258 -5.212 -3.795 1.00 0.00 C ATOM 627 C GLY A 44 8.012 -4.921 -5.078 1.00 0.00 C ATOM 628 O GLY A 44 8.109 -5.778 -5.958 1.00 0.00 O ATOM 0 H GLY A 44 6.286 -3.859 -2.524 1.00 0.00 H new ATOM 0 HA2 GLY A 44 7.966 -5.288 -2.970 1.00 0.00 H new ATOM 0 HA3 GLY A 44 6.762 -6.179 -3.880 1.00 0.00 H new ATOM 632 N LEU A 45 8.546 -3.710 -5.187 1.00 0.00 N ATOM 633 CA LEU A 45 9.294 -3.307 -6.373 1.00 0.00 C ATOM 634 C LEU A 45 8.420 -3.386 -7.621 1.00 0.00 C ATOM 635 O LEU A 45 8.899 -3.715 -8.707 1.00 0.00 O ATOM 636 CB LEU A 45 10.530 -4.192 -6.545 1.00 0.00 C ATOM 637 CG LEU A 45 11.750 -3.811 -5.706 1.00 0.00 C ATOM 638 CD1 LEU A 45 12.618 -5.032 -5.441 1.00 0.00 C ATOM 639 CD2 LEU A 45 12.556 -2.723 -6.400 1.00 0.00 C ATOM 0 H LEU A 45 8.475 -2.990 -4.468 1.00 0.00 H new ATOM 0 HA LEU A 45 9.611 -2.273 -6.239 1.00 0.00 H new ATOM 0 HB2 LEU A 45 10.254 -5.218 -6.303 1.00 0.00 H new ATOM 0 HB3 LEU A 45 10.818 -4.179 -7.596 1.00 0.00 H new ATOM 0 HG LEU A 45 11.402 -3.423 -4.749 1.00 0.00 H new ATOM 0 HD11 LEU A 45 13.482 -4.742 -4.843 1.00 0.00 H new ATOM 0 HD12 LEU A 45 12.038 -5.781 -4.902 1.00 0.00 H new ATOM 0 HD13 LEU A 45 12.957 -5.450 -6.389 1.00 0.00 H new ATOM 0 HD21 LEU A 45 13.420 -2.464 -5.788 1.00 0.00 H new ATOM 0 HD22 LEU A 45 12.894 -3.084 -7.371 1.00 0.00 H new ATOM 0 HD23 LEU A 45 11.932 -1.840 -6.538 1.00 0.00 H new ATOM 651 N LEU A 46 7.138 -3.082 -7.458 1.00 0.00 N ATOM 652 CA LEU A 46 6.196 -3.116 -8.572 1.00 0.00 C ATOM 653 C LEU A 46 5.327 -1.863 -8.589 1.00 0.00 C ATOM 654 O LEU A 46 4.813 -1.439 -7.555 1.00 0.00 O ATOM 655 CB LEU A 46 5.313 -4.362 -8.482 1.00 0.00 C ATOM 656 CG LEU A 46 4.819 -4.933 -9.811 1.00 0.00 C ATOM 657 CD1 LEU A 46 5.865 -5.857 -10.417 1.00 0.00 C ATOM 658 CD2 LEU A 46 3.502 -5.670 -9.619 1.00 0.00 C ATOM 0 H LEU A 46 6.726 -2.809 -6.566 1.00 0.00 H new ATOM 0 HA LEU A 46 6.769 -3.151 -9.499 1.00 0.00 H new ATOM 0 HB2 LEU A 46 5.870 -5.140 -7.960 1.00 0.00 H new ATOM 0 HB3 LEU A 46 4.445 -4.124 -7.867 1.00 0.00 H new ATOM 0 HG LEU A 46 4.652 -4.105 -10.500 1.00 0.00 H new ATOM 0 HD11 LEU A 46 5.496 -6.254 -11.363 1.00 0.00 H new ATOM 0 HD12 LEU A 46 6.785 -5.300 -10.592 1.00 0.00 H new ATOM 0 HD13 LEU A 46 6.064 -6.680 -9.731 1.00 0.00 H new ATOM 0 HD21 LEU A 46 3.166 -6.070 -10.576 1.00 0.00 H new ATOM 0 HD22 LEU A 46 3.643 -6.489 -8.913 1.00 0.00 H new ATOM 0 HD23 LEU A 46 2.753 -4.981 -9.230 1.00 0.00 H new ATOM 670 N GLU A 47 5.167 -1.276 -9.771 1.00 0.00 N ATOM 671 CA GLU A 47 4.358 -0.072 -9.922 1.00 0.00 C ATOM 672 C GLU A 47 2.874 -0.419 -10.000 1.00 0.00 C ATOM 673 O GLU A 47 2.461 -1.250 -10.810 1.00 0.00 O ATOM 674 CB GLU A 47 4.779 0.698 -11.176 1.00 0.00 C ATOM 675 CG GLU A 47 4.225 2.112 -11.236 1.00 0.00 C ATOM 676 CD GLU A 47 4.215 2.675 -12.644 1.00 0.00 C ATOM 677 OE1 GLU A 47 3.256 2.387 -13.391 1.00 0.00 O ATOM 678 OE2 GLU A 47 5.166 3.402 -13.000 1.00 0.00 O ATOM 0 H GLU A 47 5.586 -1.614 -10.637 1.00 0.00 H new ATOM 0 HA GLU A 47 4.521 0.556 -9.046 1.00 0.00 H new ATOM 0 HB2 GLU A 47 5.867 0.741 -11.218 1.00 0.00 H new ATOM 0 HB3 GLU A 47 4.448 0.149 -12.058 1.00 0.00 H new ATOM 0 HG2 GLU A 47 3.210 2.118 -10.839 1.00 0.00 H new ATOM 0 HG3 GLU A 47 4.822 2.760 -10.594 1.00 0.00 H new ATOM 685 N LEU A 48 2.078 0.222 -9.151 1.00 0.00 N ATOM 686 CA LEU A 48 0.639 -0.019 -9.122 1.00 0.00 C ATOM 687 C LEU A 48 -0.092 0.941 -10.055 1.00 0.00 C ATOM 688 O LEU A 48 0.375 2.051 -10.310 1.00 0.00 O ATOM 689 CB LEU A 48 0.106 0.132 -7.697 1.00 0.00 C ATOM 690 CG LEU A 48 0.778 -0.738 -6.633 1.00 0.00 C ATOM 691 CD1 LEU A 48 0.287 -0.358 -5.245 1.00 0.00 C ATOM 692 CD2 LEU A 48 0.518 -2.212 -6.908 1.00 0.00 C ATOM 0 H LEU A 48 2.404 0.912 -8.474 1.00 0.00 H new ATOM 0 HA LEU A 48 0.459 -1.038 -9.465 1.00 0.00 H new ATOM 0 HB2 LEU A 48 0.208 1.176 -7.401 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -0.960 -0.095 -7.703 1.00 0.00 H new ATOM 0 HG LEU A 48 1.853 -0.565 -6.675 1.00 0.00 H new ATOM 0 HD11 LEU A 48 0.776 -0.987 -4.501 1.00 0.00 H new ATOM 0 HD12 LEU A 48 0.525 0.687 -5.049 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -0.792 -0.501 -5.189 1.00 0.00 H new ATOM 0 HD21 LEU A 48 1.003 -2.816 -6.142 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -0.555 -2.401 -6.893 1.00 0.00 H new ATOM 0 HD23 LEU A 48 0.920 -2.476 -7.886 1.00 0.00 H new ATOM 704 N ARG A 49 -1.243 0.507 -10.559 1.00 0.00 N ATOM 705 CA ARG A 49 -2.039 1.328 -11.463 1.00 0.00 C ATOM 706 C ARG A 49 -3.481 1.433 -10.973 1.00 0.00 C ATOM 707 O ARG A 49 -4.045 0.467 -10.460 1.00 0.00 O ATOM 708 CB ARG A 49 -2.011 0.743 -12.876 1.00 0.00 C ATOM 709 CG ARG A 49 -2.732 -0.589 -12.999 1.00 0.00 C ATOM 710 CD ARG A 49 -2.118 -1.456 -14.087 1.00 0.00 C ATOM 711 NE ARG A 49 -0.979 -2.226 -13.596 1.00 0.00 N ATOM 712 CZ ARG A 49 -0.330 -3.126 -14.327 1.00 0.00 C ATOM 713 NH1 ARG A 49 -0.707 -3.368 -15.575 1.00 0.00 N ATOM 714 NH2 ARG A 49 0.698 -3.786 -13.809 1.00 0.00 N ATOM 0 H ARG A 49 -1.645 -0.408 -10.356 1.00 0.00 H new ATOM 0 HA ARG A 49 -1.605 2.328 -11.483 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -2.464 1.456 -13.564 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -0.974 0.615 -13.186 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -2.691 -1.116 -12.046 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -3.785 -0.415 -13.222 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -2.874 -2.137 -14.478 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -1.798 -0.825 -14.916 1.00 0.00 H new ATOM 0 HE ARG A 49 -0.664 -2.064 -12.639 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -1.497 -2.863 -15.976 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -0.207 -4.059 -16.134 1.00 0.00 H new ATOM 0 HH21 ARG A 49 0.990 -3.603 -12.849 1.00 0.00 H new ATOM 0 HH22 ARG A 49 1.196 -4.477 -14.371 1.00 0.00 H new ATOM 728 N ALA A 50 -4.070 2.613 -11.135 1.00 0.00 N ATOM 729 CA ALA A 50 -5.446 2.844 -10.711 1.00 0.00 C ATOM 730 C ALA A 50 -6.397 1.850 -11.368 1.00 0.00 C ATOM 731 O ALA A 50 -6.755 1.998 -12.536 1.00 0.00 O ATOM 732 CB ALA A 50 -5.865 4.271 -11.034 1.00 0.00 C ATOM 0 H ALA A 50 -3.616 3.424 -11.556 1.00 0.00 H new ATOM 0 HA ALA A 50 -5.497 2.697 -9.632 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -6.894 4.430 -10.712 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -5.210 4.969 -10.513 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -5.791 4.437 -12.109 1.00 0.00 H new ATOM 738 N SER A 51 -6.802 0.836 -10.610 1.00 0.00 N ATOM 739 CA SER A 51 -7.709 -0.185 -11.120 1.00 0.00 C ATOM 740 C SER A 51 -8.536 -0.791 -9.991 1.00 0.00 C ATOM 741 O SER A 51 -8.420 -0.386 -8.835 1.00 0.00 O ATOM 742 CB SER A 51 -6.922 -1.284 -11.837 1.00 0.00 C ATOM 743 OG SER A 51 -6.082 -0.737 -12.839 1.00 0.00 O ATOM 0 H SER A 51 -6.516 0.700 -9.640 1.00 0.00 H new ATOM 0 HA SER A 51 -8.387 0.289 -11.829 1.00 0.00 H new ATOM 0 HB2 SER A 51 -6.320 -1.836 -11.115 1.00 0.00 H new ATOM 0 HB3 SER A 51 -7.613 -1.997 -12.286 1.00 0.00 H new ATOM 0 HG SER A 51 -5.711 -1.461 -13.386 1.00 0.00 H new ATOM 749 N GLY A 52 -9.372 -1.766 -10.335 1.00 0.00 N ATOM 750 CA GLY A 52 -10.207 -2.413 -9.340 1.00 0.00 C ATOM 751 C GLY A 52 -9.420 -2.857 -8.122 1.00 0.00 C ATOM 752 O GLY A 52 -9.905 -2.771 -6.994 1.00 0.00 O ATOM 0 H GLY A 52 -9.486 -2.119 -11.285 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -10.995 -1.727 -9.029 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -10.696 -3.278 -9.788 1.00 0.00 H new ATOM 756 N LYS A 53 -8.201 -3.335 -8.350 1.00 0.00 N ATOM 757 CA LYS A 53 -7.344 -3.795 -7.264 1.00 0.00 C ATOM 758 C LYS A 53 -6.825 -2.617 -6.445 1.00 0.00 C ATOM 759 O LYS A 53 -7.083 -2.521 -5.244 1.00 0.00 O ATOM 760 CB LYS A 53 -6.168 -4.600 -7.821 1.00 0.00 C ATOM 761 CG LYS A 53 -5.440 -5.419 -6.769 1.00 0.00 C ATOM 762 CD LYS A 53 -6.276 -6.599 -6.303 1.00 0.00 C ATOM 763 CE LYS A 53 -5.637 -7.300 -5.114 1.00 0.00 C ATOM 764 NZ LYS A 53 -4.333 -7.924 -5.473 1.00 0.00 N ATOM 0 H LYS A 53 -7.785 -3.414 -9.278 1.00 0.00 H new ATOM 0 HA LYS A 53 -7.938 -4.435 -6.612 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -6.533 -5.268 -8.601 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -5.461 -3.917 -8.291 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -4.496 -5.780 -7.177 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -5.198 -4.785 -5.916 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -7.274 -6.254 -6.030 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -6.396 -7.307 -7.123 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -5.486 -6.583 -4.307 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -6.315 -8.066 -4.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -3.906 -8.348 -4.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -4.487 -8.663 -6.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -3.695 -7.198 -5.857 1.00 0.00 H new ATOM 778 N HIS A 54 -6.093 -1.723 -7.101 1.00 0.00 N ATOM 779 CA HIS A 54 -5.539 -0.550 -6.434 1.00 0.00 C ATOM 780 C HIS A 54 -6.148 0.732 -6.993 1.00 0.00 C ATOM 781 O HIS A 54 -5.710 1.239 -8.025 1.00 0.00 O ATOM 782 CB HIS A 54 -4.019 -0.517 -6.592 1.00 0.00 C ATOM 783 CG HIS A 54 -3.363 -1.844 -6.357 1.00 0.00 C ATOM 784 ND1 HIS A 54 -2.998 -2.694 -7.379 1.00 0.00 N ATOM 785 CD2 HIS A 54 -3.006 -2.463 -5.208 1.00 0.00 C ATOM 786 CE1 HIS A 54 -2.447 -3.781 -6.869 1.00 0.00 C ATOM 787 NE2 HIS A 54 -2.439 -3.665 -5.553 1.00 0.00 N ATOM 0 H HIS A 54 -5.869 -1.788 -8.094 1.00 0.00 H new ATOM 0 HA HIS A 54 -5.785 -0.616 -5.374 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -3.774 -0.173 -7.597 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -3.605 0.212 -5.895 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -3.142 -2.083 -4.206 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -2.068 -4.621 -7.432 1.00 0.00 H new ATOM 0 HE2 HIS A 54 -2.071 -4.356 -4.899 1.00 0.00 H new ATOM 796 N GLN A 55 -7.160 1.250 -6.305 1.00 0.00 N ATOM 797 CA GLN A 55 -7.830 2.472 -6.735 1.00 0.00 C ATOM 798 C GLN A 55 -7.506 3.629 -5.796 1.00 0.00 C ATOM 799 O GLN A 55 -8.216 3.891 -4.825 1.00 0.00 O ATOM 800 CB GLN A 55 -9.343 2.256 -6.793 1.00 0.00 C ATOM 801 CG GLN A 55 -10.037 3.098 -7.851 1.00 0.00 C ATOM 802 CD GLN A 55 -10.065 4.572 -7.498 1.00 0.00 C ATOM 803 OE1 GLN A 55 -10.842 5.003 -6.645 1.00 0.00 O ATOM 804 NE2 GLN A 55 -9.216 5.354 -8.154 1.00 0.00 N ATOM 0 H GLN A 55 -7.534 0.843 -5.448 1.00 0.00 H new ATOM 0 HA GLN A 55 -7.468 2.724 -7.732 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -9.544 1.203 -6.989 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -9.772 2.486 -5.818 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -9.528 2.967 -8.806 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -11.058 2.740 -7.982 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -8.590 4.954 -8.853 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -9.190 6.355 -7.959 1.00 0.00 H new ATOM 813 N PRO A 56 -6.407 4.341 -6.091 1.00 0.00 N ATOM 814 CA PRO A 56 -5.964 5.482 -5.285 1.00 0.00 C ATOM 815 C PRO A 56 -6.895 6.682 -5.418 1.00 0.00 C ATOM 816 O PRO A 56 -7.857 6.652 -6.186 1.00 0.00 O ATOM 817 CB PRO A 56 -4.585 5.810 -5.863 1.00 0.00 C ATOM 818 CG PRO A 56 -4.630 5.302 -7.262 1.00 0.00 C ATOM 819 CD PRO A 56 -5.514 4.086 -7.233 1.00 0.00 C ATOM 0 HA PRO A 56 -5.951 5.248 -4.220 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -4.390 6.882 -5.837 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -3.792 5.328 -5.292 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -5.028 6.058 -7.939 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -3.631 5.050 -7.618 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -6.072 3.973 -8.162 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -4.936 3.172 -7.095 1.00 0.00 H new ATOM 827 N SER A 57 -6.604 7.738 -4.665 1.00 0.00 N ATOM 828 CA SER A 57 -7.418 8.947 -4.696 1.00 0.00 C ATOM 829 C SER A 57 -6.614 10.156 -4.225 1.00 0.00 C ATOM 830 O SER A 57 -5.415 10.054 -3.968 1.00 0.00 O ATOM 831 CB SER A 57 -8.660 8.774 -3.820 1.00 0.00 C ATOM 832 OG SER A 57 -9.742 9.547 -4.311 1.00 0.00 O ATOM 0 H SER A 57 -5.810 7.781 -4.026 1.00 0.00 H new ATOM 0 HA SER A 57 -7.730 9.119 -5.726 1.00 0.00 H new ATOM 0 HB2 SER A 57 -8.944 7.722 -3.790 1.00 0.00 H new ATOM 0 HB3 SER A 57 -8.431 9.071 -2.797 1.00 0.00 H new ATOM 0 HG SER A 57 -10.524 9.418 -3.735 1.00 0.00 H new ATOM 838 N GLN A 58 -7.285 11.298 -4.115 1.00 0.00 N ATOM 839 CA GLN A 58 -6.633 12.526 -3.675 1.00 0.00 C ATOM 840 C GLN A 58 -7.624 13.445 -2.968 1.00 0.00 C ATOM 841 O GLN A 58 -8.669 13.787 -3.520 1.00 0.00 O ATOM 842 CB GLN A 58 -6.009 13.252 -4.868 1.00 0.00 C ATOM 843 CG GLN A 58 -5.777 14.735 -4.625 1.00 0.00 C ATOM 844 CD GLN A 58 -4.676 14.996 -3.617 1.00 0.00 C ATOM 845 OE1 GLN A 58 -4.942 15.267 -2.446 1.00 0.00 O ATOM 846 NE2 GLN A 58 -3.429 14.915 -4.068 1.00 0.00 N ATOM 0 H GLN A 58 -8.278 11.399 -4.324 1.00 0.00 H new ATOM 0 HA GLN A 58 -5.847 12.258 -2.969 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -5.058 12.779 -5.113 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -6.658 13.132 -5.736 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -5.523 15.218 -5.568 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -6.702 15.191 -4.273 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -3.254 14.687 -5.047 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -2.646 15.080 -3.435 1.00 0.00 H new ATOM 855 N GLU A 59 -7.288 13.840 -1.744 1.00 0.00 N ATOM 856 CA GLU A 59 -8.150 14.718 -0.961 1.00 0.00 C ATOM 857 C GLU A 59 -7.344 15.851 -0.332 1.00 0.00 C ATOM 858 O GLU A 59 -6.119 15.893 -0.443 1.00 0.00 O ATOM 859 CB GLU A 59 -8.869 13.923 0.130 1.00 0.00 C ATOM 860 CG GLU A 59 -10.170 13.289 -0.336 1.00 0.00 C ATOM 861 CD GLU A 59 -11.054 14.261 -1.093 1.00 0.00 C ATOM 862 OE1 GLU A 59 -11.420 15.305 -0.512 1.00 0.00 O ATOM 863 OE2 GLU A 59 -11.379 13.979 -2.265 1.00 0.00 O ATOM 0 H GLU A 59 -6.426 13.566 -1.273 1.00 0.00 H new ATOM 0 HA GLU A 59 -8.891 15.151 -1.633 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -8.204 13.141 0.496 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -9.077 14.584 0.972 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -9.945 12.435 -0.975 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -10.713 12.907 0.528 1.00 0.00 H new ATOM 870 N GLY A 60 -8.042 16.770 0.328 1.00 0.00 N ATOM 871 CA GLY A 60 -7.377 17.892 0.964 1.00 0.00 C ATOM 872 C GLY A 60 -6.134 17.474 1.723 1.00 0.00 C ATOM 873 O GLY A 60 -6.212 17.075 2.886 1.00 0.00 O ATOM 0 H GLY A 60 -9.056 16.757 0.434 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -7.106 18.627 0.206 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -8.070 18.381 1.649 1.00 0.00 H new ATOM 877 N LEU A 61 -4.983 17.562 1.066 1.00 0.00 N ATOM 878 CA LEU A 61 -3.716 17.188 1.686 1.00 0.00 C ATOM 879 C LEU A 61 -3.809 15.804 2.320 1.00 0.00 C ATOM 880 O LEU A 61 -3.098 15.499 3.279 1.00 0.00 O ATOM 881 CB LEU A 61 -3.318 18.220 2.742 1.00 0.00 C ATOM 882 CG LEU A 61 -3.068 19.640 2.232 1.00 0.00 C ATOM 883 CD1 LEU A 61 -2.907 20.605 3.396 1.00 0.00 C ATOM 884 CD2 LEU A 61 -1.839 19.675 1.334 1.00 0.00 C ATOM 0 H LEU A 61 -4.901 17.889 0.103 1.00 0.00 H new ATOM 0 HA LEU A 61 -2.953 17.161 0.908 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -4.103 18.259 3.497 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -2.414 17.870 3.241 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.932 19.952 1.645 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.730 21.610 3.013 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.814 20.601 4.000 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -2.061 20.296 4.010 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -1.676 20.693 0.980 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -0.967 19.343 1.897 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -1.993 19.014 0.481 1.00 0.00 H new ATOM 896 N THR A 62 -4.688 14.967 1.778 1.00 0.00 N ATOM 897 CA THR A 62 -4.873 13.615 2.290 1.00 0.00 C ATOM 898 C THR A 62 -5.069 12.619 1.153 1.00 0.00 C ATOM 899 O THR A 62 -6.002 12.743 0.358 1.00 0.00 O ATOM 900 CB THR A 62 -6.082 13.535 3.241 1.00 0.00 C ATOM 901 OG1 THR A 62 -6.019 14.594 4.203 1.00 0.00 O ATOM 902 CG2 THR A 62 -6.119 12.194 3.958 1.00 0.00 C ATOM 0 H THR A 62 -5.283 15.202 0.984 1.00 0.00 H new ATOM 0 HA THR A 62 -3.968 13.359 2.842 1.00 0.00 H new ATOM 0 HB THR A 62 -6.991 13.637 2.647 1.00 0.00 H new ATOM 0 HG1 THR A 62 -6.149 15.454 3.752 1.00 0.00 H new ATOM 0 HG21 THR A 62 -6.981 12.161 4.624 1.00 0.00 H new ATOM 0 HG22 THR A 62 -6.196 11.391 3.225 1.00 0.00 H new ATOM 0 HG23 THR A 62 -5.206 12.067 4.540 1.00 0.00 H new ATOM 910 N LEU A 63 -4.184 11.630 1.081 1.00 0.00 N ATOM 911 CA LEU A 63 -4.260 10.610 0.040 1.00 0.00 C ATOM 912 C LEU A 63 -4.568 9.242 0.640 1.00 0.00 C ATOM 913 O LEU A 63 -4.338 9.008 1.827 1.00 0.00 O ATOM 914 CB LEU A 63 -2.947 10.553 -0.742 1.00 0.00 C ATOM 915 CG LEU A 63 -2.439 11.883 -1.299 1.00 0.00 C ATOM 916 CD1 LEU A 63 -0.989 11.759 -1.739 1.00 0.00 C ATOM 917 CD2 LEU A 63 -3.312 12.344 -2.457 1.00 0.00 C ATOM 0 H LEU A 63 -3.406 11.513 1.730 1.00 0.00 H new ATOM 0 HA LEU A 63 -5.069 10.879 -0.639 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -2.178 10.137 -0.091 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -3.072 9.858 -1.573 1.00 0.00 H new ATOM 0 HG LEU A 63 -2.494 12.631 -0.508 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -0.645 12.716 -2.133 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -0.373 11.475 -0.886 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -0.908 10.997 -2.515 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -2.936 13.292 -2.841 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -3.289 11.596 -3.250 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -4.337 12.474 -2.110 1.00 0.00 H new ATOM 929 N ARG A 64 -5.088 8.342 -0.188 1.00 0.00 N ATOM 930 CA ARG A 64 -5.426 6.997 0.260 1.00 0.00 C ATOM 931 C ARG A 64 -5.487 6.030 -0.918 1.00 0.00 C ATOM 932 O ARG A 64 -5.751 6.432 -2.052 1.00 0.00 O ATOM 933 CB ARG A 64 -6.767 7.004 0.997 1.00 0.00 C ATOM 934 CG ARG A 64 -7.945 7.385 0.116 1.00 0.00 C ATOM 935 CD ARG A 64 -9.106 7.921 0.938 1.00 0.00 C ATOM 936 NE ARG A 64 -10.284 8.182 0.116 1.00 0.00 N ATOM 937 CZ ARG A 64 -11.070 7.227 -0.367 1.00 0.00 C ATOM 938 NH1 ARG A 64 -10.805 5.953 -0.111 1.00 0.00 N ATOM 939 NH2 ARG A 64 -12.125 7.544 -1.107 1.00 0.00 N ATOM 0 H ARG A 64 -5.284 8.520 -1.173 1.00 0.00 H new ATOM 0 HA ARG A 64 -4.645 6.662 0.943 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -6.945 6.015 1.419 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -6.709 7.701 1.833 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -7.631 8.138 -0.607 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -8.272 6.514 -0.453 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -9.360 7.203 1.718 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -8.802 8.841 1.438 1.00 0.00 H new ATOM 0 HE ARG A 64 -10.516 9.152 -0.099 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -9.996 5.705 0.458 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -11.410 5.221 -0.483 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -12.333 8.523 -1.306 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -12.728 6.809 -1.477 1.00 0.00 H new ATOM 953 N LEU A 65 -5.241 4.754 -0.643 1.00 0.00 N ATOM 954 CA LEU A 65 -5.267 3.729 -1.681 1.00 0.00 C ATOM 955 C LEU A 65 -6.074 2.516 -1.228 1.00 0.00 C ATOM 956 O LEU A 65 -5.577 1.665 -0.491 1.00 0.00 O ATOM 957 CB LEU A 65 -3.843 3.302 -2.040 1.00 0.00 C ATOM 958 CG LEU A 65 -3.718 2.171 -3.061 1.00 0.00 C ATOM 959 CD1 LEU A 65 -3.998 2.686 -4.465 1.00 0.00 C ATOM 960 CD2 LEU A 65 -2.336 1.537 -2.989 1.00 0.00 C ATOM 0 H LEU A 65 -5.021 4.404 0.290 1.00 0.00 H new ATOM 0 HA LEU A 65 -5.746 4.153 -2.563 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -3.310 4.172 -2.424 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -3.335 2.996 -1.125 1.00 0.00 H new ATOM 0 HG LEU A 65 -4.458 1.408 -2.822 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -3.904 1.867 -5.178 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -5.009 3.092 -4.509 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -3.282 3.469 -4.715 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -2.265 0.734 -3.723 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -1.578 2.291 -3.202 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -2.173 1.131 -1.990 1.00 0.00 H new ATOM 972 N THR A 66 -7.324 2.442 -1.677 1.00 0.00 N ATOM 973 CA THR A 66 -8.200 1.334 -1.319 1.00 0.00 C ATOM 974 C THR A 66 -7.816 0.065 -2.072 1.00 0.00 C ATOM 975 O THR A 66 -7.699 0.070 -3.297 1.00 0.00 O ATOM 976 CB THR A 66 -9.675 1.666 -1.615 1.00 0.00 C ATOM 977 OG1 THR A 66 -10.047 2.879 -0.950 1.00 0.00 O ATOM 978 CG2 THR A 66 -10.585 0.534 -1.162 1.00 0.00 C ATOM 0 H THR A 66 -7.752 3.137 -2.289 1.00 0.00 H new ATOM 0 HA THR A 66 -8.080 1.169 -0.248 1.00 0.00 H new ATOM 0 HB THR A 66 -9.787 1.793 -2.692 1.00 0.00 H new ATOM 0 HG1 THR A 66 -10.985 3.084 -1.144 1.00 0.00 H new ATOM 0 HG21 THR A 66 -11.621 0.791 -1.381 1.00 0.00 H new ATOM 0 HG22 THR A 66 -10.318 -0.381 -1.691 1.00 0.00 H new ATOM 0 HG23 THR A 66 -10.468 0.380 -0.089 1.00 0.00 H new ATOM 986 N ILE A 67 -7.622 -1.021 -1.330 1.00 0.00 N ATOM 987 CA ILE A 67 -7.253 -2.298 -1.929 1.00 0.00 C ATOM 988 C ILE A 67 -8.220 -3.400 -1.512 1.00 0.00 C ATOM 989 O ILE A 67 -8.347 -3.715 -0.329 1.00 0.00 O ATOM 990 CB ILE A 67 -5.822 -2.711 -1.536 1.00 0.00 C ATOM 991 CG1 ILE A 67 -4.868 -1.523 -1.679 1.00 0.00 C ATOM 992 CG2 ILE A 67 -5.354 -3.879 -2.392 1.00 0.00 C ATOM 993 CD1 ILE A 67 -3.581 -1.685 -0.900 1.00 0.00 C ATOM 0 H ILE A 67 -7.714 -1.042 -0.314 1.00 0.00 H new ATOM 0 HA ILE A 67 -7.301 -2.165 -3.010 1.00 0.00 H new ATOM 0 HB ILE A 67 -5.824 -3.028 -0.493 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -4.630 -1.383 -2.733 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -5.375 -0.618 -1.344 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -4.341 -4.159 -2.103 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -6.022 -4.728 -2.245 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -5.364 -3.587 -3.442 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -2.953 -0.806 -1.048 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -3.809 -1.794 0.160 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -3.052 -2.571 -1.251 1.00 0.00 H new ATOM 1005 N SER A 68 -8.901 -3.984 -2.493 1.00 0.00 N ATOM 1006 CA SER A 68 -9.859 -5.051 -2.229 1.00 0.00 C ATOM 1007 C SER A 68 -9.352 -6.384 -2.771 1.00 0.00 C ATOM 1008 O SER A 68 -8.299 -6.448 -3.404 1.00 0.00 O ATOM 1009 CB SER A 68 -11.214 -4.715 -2.855 1.00 0.00 C ATOM 1010 OG SER A 68 -11.737 -3.510 -2.322 1.00 0.00 O ATOM 0 H SER A 68 -8.807 -3.736 -3.478 1.00 0.00 H new ATOM 0 HA SER A 68 -9.977 -5.140 -1.149 1.00 0.00 H new ATOM 0 HB2 SER A 68 -11.106 -4.622 -3.936 1.00 0.00 H new ATOM 0 HB3 SER A 68 -11.914 -5.531 -2.674 1.00 0.00 H new ATOM 0 HG SER A 68 -12.602 -3.316 -2.739 1.00 0.00 H new ATOM 1016 N ALA A 69 -10.110 -7.446 -2.517 1.00 0.00 N ATOM 1017 CA ALA A 69 -9.740 -8.777 -2.981 1.00 0.00 C ATOM 1018 C ALA A 69 -8.327 -9.140 -2.537 1.00 0.00 C ATOM 1019 O ALA A 69 -7.563 -9.743 -3.292 1.00 0.00 O ATOM 1020 CB ALA A 69 -9.856 -8.860 -4.496 1.00 0.00 C ATOM 0 H ALA A 69 -10.984 -7.410 -1.992 1.00 0.00 H new ATOM 0 HA ALA A 69 -10.429 -9.494 -2.535 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -9.576 -9.860 -4.828 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -10.884 -8.653 -4.794 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -9.191 -8.127 -4.953 1.00 0.00 H new ATOM 1026 N LEU A 70 -7.984 -8.768 -1.308 1.00 0.00 N ATOM 1027 CA LEU A 70 -6.662 -9.054 -0.763 1.00 0.00 C ATOM 1028 C LEU A 70 -6.353 -10.546 -0.836 1.00 0.00 C ATOM 1029 O LEU A 70 -7.227 -11.355 -1.149 1.00 0.00 O ATOM 1030 CB LEU A 70 -6.571 -8.573 0.686 1.00 0.00 C ATOM 1031 CG LEU A 70 -6.731 -7.069 0.906 1.00 0.00 C ATOM 1032 CD1 LEU A 70 -7.321 -6.790 2.279 1.00 0.00 C ATOM 1033 CD2 LEU A 70 -5.394 -6.361 0.743 1.00 0.00 C ATOM 0 H LEU A 70 -8.603 -8.268 -0.671 1.00 0.00 H new ATOM 0 HA LEU A 70 -5.926 -8.520 -1.364 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -7.336 -9.088 1.267 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -5.605 -8.878 1.089 1.00 0.00 H new ATOM 0 HG LEU A 70 -7.418 -6.682 0.153 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -7.427 -5.714 2.417 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -8.299 -7.265 2.358 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -6.660 -7.191 3.047 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -5.527 -5.291 0.903 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -4.684 -6.752 1.472 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.012 -6.533 -0.263 1.00 0.00 H new ATOM 1045 N GLU A 71 -5.107 -10.903 -0.543 1.00 0.00 N ATOM 1046 CA GLU A 71 -4.685 -12.298 -0.575 1.00 0.00 C ATOM 1047 C GLU A 71 -3.355 -12.481 0.151 1.00 0.00 C ATOM 1048 O GLU A 71 -2.665 -11.510 0.461 1.00 0.00 O ATOM 1049 CB GLU A 71 -4.561 -12.784 -2.020 1.00 0.00 C ATOM 1050 CG GLU A 71 -3.604 -11.956 -2.861 1.00 0.00 C ATOM 1051 CD GLU A 71 -3.582 -12.386 -4.315 1.00 0.00 C ATOM 1052 OE1 GLU A 71 -2.805 -13.305 -4.649 1.00 0.00 O ATOM 1053 OE2 GLU A 71 -4.341 -11.804 -5.118 1.00 0.00 O ATOM 0 H GLU A 71 -4.372 -10.246 -0.281 1.00 0.00 H new ATOM 0 HA GLU A 71 -5.443 -12.892 -0.064 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -4.225 -13.821 -2.018 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -5.547 -12.769 -2.485 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -3.889 -10.906 -2.801 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -2.599 -12.037 -2.447 1.00 0.00 H new ATOM 1060 N LYS A 72 -3.001 -13.733 0.419 1.00 0.00 N ATOM 1061 CA LYS A 72 -1.754 -14.046 1.107 1.00 0.00 C ATOM 1062 C LYS A 72 -0.577 -13.331 0.452 1.00 0.00 C ATOM 1063 O LYS A 72 0.427 -13.045 1.103 1.00 0.00 O ATOM 1064 CB LYS A 72 -1.512 -15.557 1.105 1.00 0.00 C ATOM 1065 CG LYS A 72 -2.578 -16.345 1.847 1.00 0.00 C ATOM 1066 CD LYS A 72 -2.426 -16.206 3.353 1.00 0.00 C ATOM 1067 CE LYS A 72 -3.519 -16.961 4.095 1.00 0.00 C ATOM 1068 NZ LYS A 72 -3.243 -18.424 4.150 1.00 0.00 N ATOM 0 H LYS A 72 -3.561 -14.549 0.170 1.00 0.00 H new ATOM 0 HA LYS A 72 -1.839 -13.699 2.137 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -1.465 -15.908 0.074 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -0.541 -15.762 1.556 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -3.566 -15.996 1.546 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -2.514 -17.397 1.569 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -1.450 -16.584 3.658 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -2.460 -15.152 3.628 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -3.607 -16.570 5.108 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -4.477 -16.790 3.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -4.010 -18.903 4.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -3.184 -18.803 3.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -2.342 -18.589 4.642 1.00 0.00 H new ATOM 1082 N ALA A 73 -0.709 -13.044 -0.839 1.00 0.00 N ATOM 1083 CA ALA A 73 0.343 -12.359 -1.580 1.00 0.00 C ATOM 1084 C ALA A 73 0.378 -10.874 -1.237 1.00 0.00 C ATOM 1085 O ALA A 73 1.441 -10.316 -0.961 1.00 0.00 O ATOM 1086 CB ALA A 73 0.145 -12.552 -3.077 1.00 0.00 C ATOM 0 H ALA A 73 -1.534 -13.275 -1.393 1.00 0.00 H new ATOM 0 HA ALA A 73 1.300 -12.795 -1.291 1.00 0.00 H new ATOM 0 HB1 ALA A 73 0.937 -12.035 -3.618 1.00 0.00 H new ATOM 0 HB2 ALA A 73 0.177 -13.615 -3.314 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -0.822 -12.144 -3.372 1.00 0.00 H new ATOM 1092 N ASP A 74 -0.788 -10.239 -1.257 1.00 0.00 N ATOM 1093 CA ASP A 74 -0.890 -8.817 -0.947 1.00 0.00 C ATOM 1094 C ASP A 74 0.043 -8.443 0.200 1.00 0.00 C ATOM 1095 O ASP A 74 0.611 -7.351 0.221 1.00 0.00 O ATOM 1096 CB ASP A 74 -2.332 -8.454 -0.588 1.00 0.00 C ATOM 1097 CG ASP A 74 -3.153 -8.075 -1.805 1.00 0.00 C ATOM 1098 OD1 ASP A 74 -2.829 -8.553 -2.912 1.00 0.00 O ATOM 1099 OD2 ASP A 74 -4.120 -7.300 -1.650 1.00 0.00 O ATOM 0 H ASP A 74 -1.676 -10.686 -1.485 1.00 0.00 H new ATOM 0 HA ASP A 74 -0.592 -8.255 -1.832 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -2.802 -9.299 -0.085 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -2.330 -7.624 0.118 1.00 0.00 H new ATOM 1104 N SER A 75 0.195 -9.356 1.155 1.00 0.00 N ATOM 1105 CA SER A 75 1.054 -9.120 2.308 1.00 0.00 C ATOM 1106 C SER A 75 2.468 -8.752 1.866 1.00 0.00 C ATOM 1107 O SER A 75 3.288 -9.625 1.582 1.00 0.00 O ATOM 1108 CB SER A 75 1.094 -10.360 3.204 1.00 0.00 C ATOM 1109 OG SER A 75 -0.133 -10.533 3.890 1.00 0.00 O ATOM 0 H SER A 75 -0.266 -10.266 1.152 1.00 0.00 H new ATOM 0 HA SER A 75 0.640 -8.285 2.874 1.00 0.00 H new ATOM 0 HB2 SER A 75 1.304 -11.243 2.600 1.00 0.00 H new ATOM 0 HB3 SER A 75 1.907 -10.266 3.924 1.00 0.00 H new ATOM 0 HG SER A 75 -0.219 -11.466 4.177 1.00 0.00 H new ATOM 1115 N ASP A 76 2.744 -7.454 1.812 1.00 0.00 N ATOM 1116 CA ASP A 76 4.058 -6.968 1.405 1.00 0.00 C ATOM 1117 C ASP A 76 4.254 -5.515 1.826 1.00 0.00 C ATOM 1118 O ASP A 76 3.367 -4.904 2.422 1.00 0.00 O ATOM 1119 CB ASP A 76 4.229 -7.102 -0.109 1.00 0.00 C ATOM 1120 CG ASP A 76 5.686 -7.178 -0.522 1.00 0.00 C ATOM 1121 OD1 ASP A 76 6.487 -7.764 0.236 1.00 0.00 O ATOM 1122 OD2 ASP A 76 6.024 -6.652 -1.603 1.00 0.00 O ATOM 0 H ASP A 76 2.076 -6.719 2.045 1.00 0.00 H new ATOM 0 HA ASP A 76 4.813 -7.576 1.902 1.00 0.00 H new ATOM 0 HB2 ASP A 76 3.710 -7.997 -0.453 1.00 0.00 H new ATOM 0 HB3 ASP A 76 3.758 -6.251 -0.602 1.00 0.00 H new ATOM 1127 N THR A 77 5.424 -4.966 1.512 1.00 0.00 N ATOM 1128 CA THR A 77 5.738 -3.586 1.859 1.00 0.00 C ATOM 1129 C THR A 77 5.323 -2.631 0.745 1.00 0.00 C ATOM 1130 O THR A 77 5.822 -2.716 -0.377 1.00 0.00 O ATOM 1131 CB THR A 77 7.242 -3.406 2.140 1.00 0.00 C ATOM 1132 OG1 THR A 77 7.654 -4.290 3.188 1.00 0.00 O ATOM 1133 CG2 THR A 77 7.551 -1.969 2.532 1.00 0.00 C ATOM 0 H THR A 77 6.169 -5.457 1.018 1.00 0.00 H new ATOM 0 HA THR A 77 5.176 -3.352 2.763 1.00 0.00 H new ATOM 0 HB THR A 77 7.790 -3.644 1.228 1.00 0.00 H new ATOM 0 HG1 THR A 77 8.611 -4.170 3.359 1.00 0.00 H new ATOM 0 HG21 THR A 77 8.619 -1.866 2.726 1.00 0.00 H new ATOM 0 HG22 THR A 77 7.263 -1.301 1.720 1.00 0.00 H new ATOM 0 HG23 THR A 77 6.993 -1.709 3.431 1.00 0.00 H new ATOM 1141 N TYR A 78 4.408 -1.723 1.062 1.00 0.00 N ATOM 1142 CA TYR A 78 3.924 -0.752 0.088 1.00 0.00 C ATOM 1143 C TYR A 78 4.688 0.563 0.204 1.00 0.00 C ATOM 1144 O TYR A 78 5.190 0.912 1.273 1.00 0.00 O ATOM 1145 CB TYR A 78 2.427 -0.505 0.282 1.00 0.00 C ATOM 1146 CG TYR A 78 1.581 -1.746 0.111 1.00 0.00 C ATOM 1147 CD1 TYR A 78 1.678 -2.806 1.004 1.00 0.00 C ATOM 1148 CD2 TYR A 78 0.685 -1.860 -0.945 1.00 0.00 C ATOM 1149 CE1 TYR A 78 0.908 -3.942 0.852 1.00 0.00 C ATOM 1150 CE2 TYR A 78 -0.090 -2.992 -1.105 1.00 0.00 C ATOM 1151 CZ TYR A 78 0.025 -4.031 -0.204 1.00 0.00 C ATOM 1152 OH TYR A 78 -0.745 -5.161 -0.361 1.00 0.00 O ATOM 0 H TYR A 78 3.986 -1.639 1.987 1.00 0.00 H new ATOM 0 HA TYR A 78 4.091 -1.161 -0.908 1.00 0.00 H new ATOM 0 HB2 TYR A 78 2.261 -0.097 1.279 1.00 0.00 H new ATOM 0 HB3 TYR A 78 2.097 0.251 -0.431 1.00 0.00 H new ATOM 0 HD1 TYR A 78 2.368 -2.740 1.832 1.00 0.00 H new ATOM 0 HD2 TYR A 78 0.593 -1.049 -1.653 1.00 0.00 H new ATOM 0 HE1 TYR A 78 0.997 -4.756 1.556 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -0.782 -3.064 -1.931 1.00 0.00 H new ATOM 0 HH TYR A 78 -0.165 -5.950 -0.391 1.00 0.00 H new ATOM 1162 N THR A 79 4.770 1.292 -0.905 1.00 0.00 N ATOM 1163 CA THR A 79 5.472 2.569 -0.930 1.00 0.00 C ATOM 1164 C THR A 79 4.710 3.599 -1.755 1.00 0.00 C ATOM 1165 O THR A 79 4.575 3.459 -2.971 1.00 0.00 O ATOM 1166 CB THR A 79 6.893 2.418 -1.505 1.00 0.00 C ATOM 1167 OG1 THR A 79 7.686 1.594 -0.643 1.00 0.00 O ATOM 1168 CG2 THR A 79 7.558 3.776 -1.669 1.00 0.00 C ATOM 0 H THR A 79 4.359 1.019 -1.798 1.00 0.00 H new ATOM 0 HA THR A 79 5.540 2.912 0.102 1.00 0.00 H new ATOM 0 HB THR A 79 6.816 1.948 -2.486 1.00 0.00 H new ATOM 0 HG1 THR A 79 8.587 1.502 -1.017 1.00 0.00 H new ATOM 0 HG21 THR A 79 8.560 3.643 -2.076 1.00 0.00 H new ATOM 0 HG22 THR A 79 6.968 4.390 -2.349 1.00 0.00 H new ATOM 0 HG23 THR A 79 7.623 4.269 -0.699 1.00 0.00 H new ATOM 1176 N CYS A 80 4.213 4.634 -1.087 1.00 0.00 N ATOM 1177 CA CYS A 80 3.463 5.690 -1.759 1.00 0.00 C ATOM 1178 C CYS A 80 4.372 6.862 -2.113 1.00 0.00 C ATOM 1179 O CYS A 80 4.802 7.614 -1.237 1.00 0.00 O ATOM 1180 CB CYS A 80 2.312 6.170 -0.873 1.00 0.00 C ATOM 1181 SG CYS A 80 1.347 7.522 -1.586 1.00 0.00 S ATOM 0 H CYS A 80 4.316 4.765 -0.081 1.00 0.00 H new ATOM 0 HA CYS A 80 3.054 5.280 -2.682 1.00 0.00 H new ATOM 0 HB2 CYS A 80 1.647 5.330 -0.672 1.00 0.00 H new ATOM 0 HB3 CYS A 80 2.716 6.493 0.086 1.00 0.00 H new ATOM 0 HG CYS A 80 0.127 7.123 -1.792 1.00 0.00 H new ATOM 1187 N ASP A 81 4.662 7.011 -3.401 1.00 0.00 N ATOM 1188 CA ASP A 81 5.521 8.092 -3.871 1.00 0.00 C ATOM 1189 C ASP A 81 4.693 9.216 -4.484 1.00 0.00 C ATOM 1190 O ASP A 81 3.701 8.967 -5.170 1.00 0.00 O ATOM 1191 CB ASP A 81 6.526 7.564 -4.896 1.00 0.00 C ATOM 1192 CG ASP A 81 7.084 8.663 -5.779 1.00 0.00 C ATOM 1193 OD1 ASP A 81 8.091 9.288 -5.384 1.00 0.00 O ATOM 1194 OD2 ASP A 81 6.513 8.898 -6.865 1.00 0.00 O ATOM 0 H ASP A 81 4.315 6.397 -4.138 1.00 0.00 H new ATOM 0 HA ASP A 81 6.064 8.491 -3.014 1.00 0.00 H new ATOM 0 HB2 ASP A 81 7.346 7.069 -4.375 1.00 0.00 H new ATOM 0 HB3 ASP A 81 6.043 6.811 -5.519 1.00 0.00 H new ATOM 1199 N ILE A 82 5.106 10.454 -4.231 1.00 0.00 N ATOM 1200 CA ILE A 82 4.402 11.616 -4.759 1.00 0.00 C ATOM 1201 C ILE A 82 5.264 12.371 -5.764 1.00 0.00 C ATOM 1202 O ILE A 82 4.752 13.100 -6.613 1.00 0.00 O ATOM 1203 CB ILE A 82 3.984 12.580 -3.632 1.00 0.00 C ATOM 1204 CG1 ILE A 82 5.182 12.906 -2.739 1.00 0.00 C ATOM 1205 CG2 ILE A 82 2.853 11.977 -2.812 1.00 0.00 C ATOM 1206 CD1 ILE A 82 4.998 14.162 -1.916 1.00 0.00 C ATOM 0 H ILE A 82 5.924 10.678 -3.664 1.00 0.00 H new ATOM 0 HA ILE A 82 3.508 11.243 -5.259 1.00 0.00 H new ATOM 0 HB ILE A 82 3.627 13.507 -4.081 1.00 0.00 H new ATOM 0 HG12 ILE A 82 5.365 12.066 -2.069 1.00 0.00 H new ATOM 0 HG13 ILE A 82 6.070 13.016 -3.362 1.00 0.00 H new ATOM 0 HG21 ILE A 82 2.569 12.670 -2.020 1.00 0.00 H new ATOM 0 HG22 ILE A 82 1.994 11.792 -3.457 1.00 0.00 H new ATOM 0 HG23 ILE A 82 3.185 11.037 -2.371 1.00 0.00 H new ATOM 0 HD11 ILE A 82 5.886 14.331 -1.307 1.00 0.00 H new ATOM 0 HD12 ILE A 82 4.845 15.013 -2.580 1.00 0.00 H new ATOM 0 HD13 ILE A 82 4.130 14.048 -1.267 1.00 0.00 H new ATOM 1218 N GLY A 83 6.578 12.190 -5.664 1.00 0.00 N ATOM 1219 CA GLY A 83 7.490 12.859 -6.572 1.00 0.00 C ATOM 1220 C GLY A 83 8.741 13.357 -5.875 1.00 0.00 C ATOM 1221 O GLY A 83 9.810 13.427 -6.480 1.00 0.00 O ATOM 0 H GLY A 83 7.026 11.592 -4.970 1.00 0.00 H new ATOM 0 HA2 GLY A 83 7.772 12.172 -7.370 1.00 0.00 H new ATOM 0 HA3 GLY A 83 6.979 13.700 -7.040 1.00 0.00 H new ATOM 1225 N GLN A 84 8.606 13.706 -4.599 1.00 0.00 N ATOM 1226 CA GLN A 84 9.734 14.203 -3.820 1.00 0.00 C ATOM 1227 C GLN A 84 10.036 13.276 -2.647 1.00 0.00 C ATOM 1228 O GLN A 84 11.193 13.088 -2.275 1.00 0.00 O ATOM 1229 CB GLN A 84 9.444 15.615 -3.308 1.00 0.00 C ATOM 1230 CG GLN A 84 9.907 16.712 -4.253 1.00 0.00 C ATOM 1231 CD GLN A 84 9.255 16.619 -5.618 1.00 0.00 C ATOM 1232 OE1 GLN A 84 8.172 16.051 -5.765 1.00 0.00 O ATOM 1233 NE2 GLN A 84 9.912 17.179 -6.628 1.00 0.00 N ATOM 0 H GLN A 84 7.727 13.654 -4.083 1.00 0.00 H new ATOM 0 HA GLN A 84 10.608 14.232 -4.471 1.00 0.00 H new ATOM 0 HB2 GLN A 84 8.372 15.719 -3.142 1.00 0.00 H new ATOM 0 HB3 GLN A 84 9.931 15.749 -2.342 1.00 0.00 H new ATOM 0 HG2 GLN A 84 9.683 17.684 -3.813 1.00 0.00 H new ATOM 0 HG3 GLN A 84 10.990 16.655 -4.367 1.00 0.00 H new ATOM 0 HE21 GLN A 84 10.807 17.639 -6.462 1.00 0.00 H new ATOM 0 HE22 GLN A 84 9.522 17.148 -7.570 1.00 0.00 H new ATOM 1242 N ALA A 85 8.987 12.700 -2.070 1.00 0.00 N ATOM 1243 CA ALA A 85 9.140 11.791 -0.940 1.00 0.00 C ATOM 1244 C ALA A 85 8.293 10.537 -1.126 1.00 0.00 C ATOM 1245 O ALA A 85 7.466 10.465 -2.034 1.00 0.00 O ATOM 1246 CB ALA A 85 8.769 12.494 0.357 1.00 0.00 C ATOM 0 H ALA A 85 8.022 12.846 -2.366 1.00 0.00 H new ATOM 0 HA ALA A 85 10.185 11.487 -0.889 1.00 0.00 H new ATOM 0 HB1 ALA A 85 8.888 11.804 1.192 1.00 0.00 H new ATOM 0 HB2 ALA A 85 9.420 13.356 0.503 1.00 0.00 H new ATOM 0 HB3 ALA A 85 7.732 12.827 0.307 1.00 0.00 H new ATOM 1252 N GLN A 86 8.505 9.551 -0.260 1.00 0.00 N ATOM 1253 CA GLN A 86 7.761 8.299 -0.330 1.00 0.00 C ATOM 1254 C GLN A 86 7.605 7.680 1.055 1.00 0.00 C ATOM 1255 O GLN A 86 8.527 7.718 1.870 1.00 0.00 O ATOM 1256 CB GLN A 86 8.464 7.315 -1.266 1.00 0.00 C ATOM 1257 CG GLN A 86 8.924 7.941 -2.573 1.00 0.00 C ATOM 1258 CD GLN A 86 10.072 8.913 -2.382 1.00 0.00 C ATOM 1259 OE1 GLN A 86 10.904 8.741 -1.491 1.00 0.00 O ATOM 1260 NE2 GLN A 86 10.123 9.941 -3.221 1.00 0.00 N ATOM 0 H GLN A 86 9.186 9.595 0.498 1.00 0.00 H new ATOM 0 HA GLN A 86 6.768 8.517 -0.724 1.00 0.00 H new ATOM 0 HB2 GLN A 86 9.327 6.891 -0.752 1.00 0.00 H new ATOM 0 HB3 GLN A 86 7.787 6.490 -1.487 1.00 0.00 H new ATOM 0 HG2 GLN A 86 9.231 7.153 -3.261 1.00 0.00 H new ATOM 0 HG3 GLN A 86 8.086 8.461 -3.037 1.00 0.00 H new ATOM 0 HE21 GLN A 86 9.412 10.044 -3.945 1.00 0.00 H new ATOM 0 HE22 GLN A 86 10.873 10.627 -3.142 1.00 0.00 H new ATOM 1269 N SER A 87 6.433 7.110 1.315 1.00 0.00 N ATOM 1270 CA SER A 87 6.155 6.486 2.603 1.00 0.00 C ATOM 1271 C SER A 87 6.248 4.967 2.502 1.00 0.00 C ATOM 1272 O SER A 87 6.481 4.419 1.425 1.00 0.00 O ATOM 1273 CB SER A 87 4.766 6.892 3.101 1.00 0.00 C ATOM 1274 OG SER A 87 4.517 6.373 4.396 1.00 0.00 O ATOM 0 H SER A 87 5.660 7.067 0.650 1.00 0.00 H new ATOM 0 HA SER A 87 6.904 6.832 3.316 1.00 0.00 H new ATOM 0 HB2 SER A 87 4.686 7.979 3.120 1.00 0.00 H new ATOM 0 HB3 SER A 87 4.007 6.529 2.408 1.00 0.00 H new ATOM 0 HG SER A 87 4.669 7.074 5.064 1.00 0.00 H new ATOM 1280 N ARG A 88 6.064 4.292 3.632 1.00 0.00 N ATOM 1281 CA ARG A 88 6.128 2.837 3.673 1.00 0.00 C ATOM 1282 C ARG A 88 5.253 2.285 4.794 1.00 0.00 C ATOM 1283 O ARG A 88 5.194 2.851 5.885 1.00 0.00 O ATOM 1284 CB ARG A 88 7.573 2.374 3.864 1.00 0.00 C ATOM 1285 CG ARG A 88 8.399 2.412 2.588 1.00 0.00 C ATOM 1286 CD ARG A 88 9.721 1.680 2.758 1.00 0.00 C ATOM 1287 NE ARG A 88 10.740 2.168 1.832 1.00 0.00 N ATOM 1288 CZ ARG A 88 11.891 1.544 1.611 1.00 0.00 C ATOM 1289 NH1 ARG A 88 12.169 0.414 2.247 1.00 0.00 N ATOM 1290 NH2 ARG A 88 12.768 2.050 0.753 1.00 0.00 N ATOM 0 H ARG A 88 5.869 4.731 4.532 1.00 0.00 H new ATOM 0 HA ARG A 88 5.754 2.455 2.723 1.00 0.00 H new ATOM 0 HB2 ARG A 88 8.051 3.003 4.615 1.00 0.00 H new ATOM 0 HB3 ARG A 88 7.571 1.357 4.255 1.00 0.00 H new ATOM 0 HG2 ARG A 88 7.833 1.959 1.774 1.00 0.00 H new ATOM 0 HG3 ARG A 88 8.589 3.448 2.307 1.00 0.00 H new ATOM 0 HD2 ARG A 88 10.074 1.802 3.782 1.00 0.00 H new ATOM 0 HD3 ARG A 88 9.568 0.613 2.599 1.00 0.00 H new ATOM 0 HE ARG A 88 10.557 3.036 1.328 1.00 0.00 H new ATOM 0 HH11 ARG A 88 11.498 0.022 2.908 1.00 0.00 H new ATOM 0 HH12 ARG A 88 13.054 -0.063 2.075 1.00 0.00 H new ATOM 0 HH21 ARG A 88 12.558 2.919 0.262 1.00 0.00 H new ATOM 0 HH22 ARG A 88 13.652 1.570 0.584 1.00 0.00 H new ATOM 1304 N ALA A 89 4.575 1.176 4.517 1.00 0.00 N ATOM 1305 CA ALA A 89 3.704 0.547 5.503 1.00 0.00 C ATOM 1306 C ALA A 89 3.627 -0.961 5.284 1.00 0.00 C ATOM 1307 O ALA A 89 3.723 -1.438 4.154 1.00 0.00 O ATOM 1308 CB ALA A 89 2.314 1.162 5.448 1.00 0.00 C ATOM 0 H ALA A 89 4.612 0.695 3.618 1.00 0.00 H new ATOM 0 HA ALA A 89 4.128 0.723 6.492 1.00 0.00 H new ATOM 0 HB1 ALA A 89 1.675 0.683 6.189 1.00 0.00 H new ATOM 0 HB2 ALA A 89 2.380 2.229 5.661 1.00 0.00 H new ATOM 0 HB3 ALA A 89 1.890 1.015 4.454 1.00 0.00 H new ATOM 1314 N GLN A 90 3.454 -1.703 6.373 1.00 0.00 N ATOM 1315 CA GLN A 90 3.366 -3.157 6.299 1.00 0.00 C ATOM 1316 C GLN A 90 1.916 -3.620 6.401 1.00 0.00 C ATOM 1317 O GLN A 90 1.140 -3.094 7.199 1.00 0.00 O ATOM 1318 CB GLN A 90 4.197 -3.797 7.412 1.00 0.00 C ATOM 1319 CG GLN A 90 5.660 -3.987 7.045 1.00 0.00 C ATOM 1320 CD GLN A 90 5.930 -5.330 6.397 1.00 0.00 C ATOM 1321 OE1 GLN A 90 6.519 -6.222 7.009 1.00 0.00 O ATOM 1322 NE2 GLN A 90 5.498 -5.483 5.150 1.00 0.00 N ATOM 0 H GLN A 90 3.372 -1.322 7.316 1.00 0.00 H new ATOM 0 HA GLN A 90 3.762 -3.471 5.333 1.00 0.00 H new ATOM 0 HB2 GLN A 90 4.133 -3.176 8.305 1.00 0.00 H new ATOM 0 HB3 GLN A 90 3.766 -4.765 7.665 1.00 0.00 H new ATOM 0 HG2 GLN A 90 5.966 -3.192 6.365 1.00 0.00 H new ATOM 0 HG3 GLN A 90 6.271 -3.892 7.943 1.00 0.00 H new ATOM 0 HE21 GLN A 90 5.014 -4.718 4.680 1.00 0.00 H new ATOM 0 HE22 GLN A 90 5.650 -6.366 4.662 1.00 0.00 H new ATOM 1331 N LEU A 91 1.557 -4.607 5.587 1.00 0.00 N ATOM 1332 CA LEU A 91 0.200 -5.142 5.585 1.00 0.00 C ATOM 1333 C LEU A 91 0.205 -6.642 5.865 1.00 0.00 C ATOM 1334 O LEU A 91 1.113 -7.359 5.443 1.00 0.00 O ATOM 1335 CB LEU A 91 -0.477 -4.864 4.242 1.00 0.00 C ATOM 1336 CG LEU A 91 -1.645 -5.781 3.877 1.00 0.00 C ATOM 1337 CD1 LEU A 91 -2.851 -5.483 4.753 1.00 0.00 C ATOM 1338 CD2 LEU A 91 -2.002 -5.628 2.405 1.00 0.00 C ATOM 0 H LEU A 91 2.187 -5.053 4.920 1.00 0.00 H new ATOM 0 HA LEU A 91 -0.361 -4.646 6.377 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -0.836 -3.835 4.245 1.00 0.00 H new ATOM 0 HB3 LEU A 91 0.275 -4.937 3.457 1.00 0.00 H new ATOM 0 HG LEU A 91 -1.341 -6.813 4.052 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -3.672 -6.145 4.479 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -2.589 -5.643 5.799 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -3.157 -4.447 4.610 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -2.835 -6.288 2.162 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -2.287 -4.595 2.205 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -1.140 -5.892 1.792 1.00 0.00 H new ATOM 1350 N LEU A 92 -0.815 -7.109 6.575 1.00 0.00 N ATOM 1351 CA LEU A 92 -0.931 -8.525 6.909 1.00 0.00 C ATOM 1352 C LEU A 92 -2.249 -9.099 6.400 1.00 0.00 C ATOM 1353 O LEU A 92 -3.320 -8.554 6.668 1.00 0.00 O ATOM 1354 CB LEU A 92 -0.826 -8.722 8.422 1.00 0.00 C ATOM 1355 CG LEU A 92 -0.966 -10.160 8.922 1.00 0.00 C ATOM 1356 CD1 LEU A 92 0.056 -11.062 8.248 1.00 0.00 C ATOM 1357 CD2 LEU A 92 -0.813 -10.216 10.435 1.00 0.00 C ATOM 0 H LEU A 92 -1.574 -6.528 6.931 1.00 0.00 H new ATOM 0 HA LEU A 92 -0.113 -9.056 6.422 1.00 0.00 H new ATOM 0 HB2 LEU A 92 0.138 -8.336 8.753 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.594 -8.115 8.902 1.00 0.00 H new ATOM 0 HG LEU A 92 -1.963 -10.518 8.664 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -0.059 -12.081 8.617 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -0.100 -11.046 7.169 1.00 0.00 H new ATOM 0 HD13 LEU A 92 1.061 -10.706 8.474 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -0.916 -11.247 10.773 1.00 0.00 H new ATOM 0 HD22 LEU A 92 0.170 -9.838 10.716 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -1.584 -9.603 10.902 1.00 0.00 H new ATOM 1369 N VAL A 93 -2.163 -10.203 5.664 1.00 0.00 N ATOM 1370 CA VAL A 93 -3.349 -10.853 5.120 1.00 0.00 C ATOM 1371 C VAL A 93 -3.665 -12.140 5.875 1.00 0.00 C ATOM 1372 O VAL A 93 -3.241 -13.224 5.476 1.00 0.00 O ATOM 1373 CB VAL A 93 -3.175 -11.177 3.625 1.00 0.00 C ATOM 1374 CG1 VAL A 93 -4.253 -12.143 3.159 1.00 0.00 C ATOM 1375 CG2 VAL A 93 -3.198 -9.901 2.797 1.00 0.00 C ATOM 0 H VAL A 93 -1.284 -10.666 5.431 1.00 0.00 H new ATOM 0 HA VAL A 93 -4.176 -10.153 5.238 1.00 0.00 H new ATOM 0 HB VAL A 93 -2.206 -11.656 3.486 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -4.114 -12.360 2.100 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -4.185 -13.068 3.731 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -5.234 -11.694 3.311 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -3.074 -10.149 1.743 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -4.151 -9.392 2.940 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -2.386 -9.247 3.114 1.00 0.00 H new ATOM 1385 N GLN A 94 -4.413 -12.011 6.966 1.00 0.00 N ATOM 1386 CA GLN A 94 -4.785 -13.165 7.776 1.00 0.00 C ATOM 1387 C GLN A 94 -5.557 -14.186 6.947 1.00 0.00 C ATOM 1388 O GLN A 94 -6.167 -13.845 5.935 1.00 0.00 O ATOM 1389 CB GLN A 94 -5.627 -12.722 8.975 1.00 0.00 C ATOM 1390 CG GLN A 94 -4.844 -11.928 10.008 1.00 0.00 C ATOM 1391 CD GLN A 94 -3.825 -12.774 10.744 1.00 0.00 C ATOM 1392 OE1 GLN A 94 -2.764 -13.095 10.208 1.00 0.00 O ATOM 1393 NE2 GLN A 94 -4.141 -13.140 11.981 1.00 0.00 N ATOM 0 H GLN A 94 -4.773 -11.120 7.309 1.00 0.00 H new ATOM 0 HA GLN A 94 -3.870 -13.635 8.137 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -6.461 -12.117 8.619 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -6.054 -13.603 9.454 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -4.335 -11.100 9.515 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -5.537 -11.493 10.728 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -5.031 -12.852 12.386 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -3.493 -13.709 12.526 1.00 0.00 H new ATOM 1402 N GLY A 95 -5.525 -15.441 7.384 1.00 0.00 N ATOM 1403 CA GLY A 95 -6.225 -16.493 6.670 1.00 0.00 C ATOM 1404 C GLY A 95 -7.683 -16.597 7.074 1.00 0.00 C ATOM 1405 O GLY A 95 -7.996 -16.982 8.200 1.00 0.00 O ATOM 0 H GLY A 95 -5.027 -15.748 8.220 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -6.161 -16.305 5.598 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -5.730 -17.446 6.857 1.00 0.00 H new ATOM 1409 N ARG A 96 -8.576 -16.252 6.153 1.00 0.00 N ATOM 1410 CA ARG A 96 -10.008 -16.305 6.419 1.00 0.00 C ATOM 1411 C ARG A 96 -10.389 -17.625 7.084 1.00 0.00 C ATOM 1412 O ARG A 96 -9.710 -18.637 6.909 1.00 0.00 O ATOM 1413 CB ARG A 96 -10.798 -16.130 5.121 1.00 0.00 C ATOM 1414 CG ARG A 96 -12.305 -16.121 5.320 1.00 0.00 C ATOM 1415 CD ARG A 96 -13.041 -16.349 4.010 1.00 0.00 C ATOM 1416 NE ARG A 96 -14.484 -16.177 4.156 1.00 0.00 N ATOM 1417 CZ ARG A 96 -15.363 -16.514 3.219 1.00 0.00 C ATOM 1418 NH1 ARG A 96 -14.948 -17.039 2.074 1.00 0.00 N ATOM 1419 NH2 ARG A 96 -16.661 -16.327 3.426 1.00 0.00 N ATOM 0 H ARG A 96 -8.333 -15.933 5.215 1.00 0.00 H new ATOM 0 HA ARG A 96 -10.255 -15.490 7.099 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -10.497 -15.196 4.646 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -10.536 -16.935 4.435 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -12.583 -16.896 6.035 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -12.611 -15.167 5.749 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -12.667 -15.654 3.258 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -12.831 -17.355 3.646 1.00 0.00 H new ATOM 0 HE ARG A 96 -14.836 -15.776 5.025 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -13.952 -17.185 1.911 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -15.625 -17.297 1.356 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -16.984 -15.924 4.305 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -17.335 -16.586 2.706 1.00 0.00 H new ATOM 1433 N ARG A 97 -11.477 -17.606 7.846 1.00 0.00 N ATOM 1434 CA ARG A 97 -11.946 -18.801 8.538 1.00 0.00 C ATOM 1435 C ARG A 97 -11.676 -20.052 7.707 1.00 0.00 C ATOM 1436 O ARG A 97 -11.880 -20.059 6.493 1.00 0.00 O ATOM 1437 CB ARG A 97 -13.442 -18.688 8.838 1.00 0.00 C ATOM 1438 CG ARG A 97 -13.942 -19.715 9.840 1.00 0.00 C ATOM 1439 CD ARG A 97 -13.687 -19.267 11.271 1.00 0.00 C ATOM 1440 NE ARG A 97 -14.599 -18.203 11.682 1.00 0.00 N ATOM 1441 CZ ARG A 97 -14.705 -17.768 12.932 1.00 0.00 C ATOM 1442 NH1 ARG A 97 -13.960 -18.304 13.890 1.00 0.00 N ATOM 1443 NH2 ARG A 97 -15.558 -16.795 13.228 1.00 0.00 N ATOM 0 H ARG A 97 -12.051 -16.777 8.000 1.00 0.00 H new ATOM 0 HA ARG A 97 -11.399 -18.885 9.477 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -13.653 -17.689 9.219 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -14.000 -18.799 7.908 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -15.010 -19.878 9.693 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -13.446 -20.669 9.663 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -13.797 -20.118 11.943 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -12.658 -18.919 11.364 1.00 0.00 H new ATOM 0 HE ARG A 97 -15.187 -17.770 10.970 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -13.304 -19.052 13.667 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -14.044 -17.968 14.849 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -16.133 -16.380 12.495 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -15.638 -16.462 14.189 1.00 0.00 H new ATOM 1457 N SER A 98 -11.216 -21.108 8.369 1.00 0.00 N ATOM 1458 CA SER A 98 -10.914 -22.363 7.692 1.00 0.00 C ATOM 1459 C SER A 98 -9.654 -22.231 6.840 1.00 0.00 C ATOM 1460 O SER A 98 -9.641 -22.609 5.670 1.00 0.00 O ATOM 1461 CB SER A 98 -12.093 -22.791 6.816 1.00 0.00 C ATOM 1462 OG SER A 98 -11.995 -24.160 6.463 1.00 0.00 O ATOM 0 H SER A 98 -11.044 -21.119 9.374 1.00 0.00 H new ATOM 0 HA SER A 98 -10.740 -23.125 8.452 1.00 0.00 H new ATOM 0 HB2 SER A 98 -13.028 -22.615 7.348 1.00 0.00 H new ATOM 0 HB3 SER A 98 -12.120 -22.180 5.913 1.00 0.00 H new ATOM 0 HG SER A 98 -11.147 -24.318 5.998 1.00 0.00 H new ATOM 1468 N GLY A 99 -8.597 -21.691 7.438 1.00 0.00 N ATOM 1469 CA GLY A 99 -7.347 -21.518 6.721 1.00 0.00 C ATOM 1470 C GLY A 99 -6.157 -22.056 7.492 1.00 0.00 C ATOM 1471 O GLY A 99 -5.659 -23.149 7.222 1.00 0.00 O ATOM 0 H GLY A 99 -8.584 -21.370 8.406 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -7.411 -22.024 5.758 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -7.194 -20.459 6.515 1.00 0.00 H new ATOM 1475 N PRO A 100 -5.683 -21.277 8.475 1.00 0.00 N ATOM 1476 CA PRO A 100 -4.538 -21.660 9.306 1.00 0.00 C ATOM 1477 C PRO A 100 -4.865 -22.816 10.246 1.00 0.00 C ATOM 1478 O PRO A 100 -5.918 -22.831 10.884 1.00 0.00 O ATOM 1479 CB PRO A 100 -4.238 -20.390 10.105 1.00 0.00 C ATOM 1480 CG PRO A 100 -5.534 -19.656 10.150 1.00 0.00 C ATOM 1481 CD PRO A 100 -6.228 -19.962 8.852 1.00 0.00 C ATOM 0 HA PRO A 100 -3.698 -22.010 8.706 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -3.883 -20.628 11.108 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -3.462 -19.794 9.625 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -6.136 -19.978 11.000 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -5.372 -18.584 10.263 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -7.311 -19.996 8.974 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -6.016 -19.207 8.095 1.00 0.00 H new ATOM 1489 N SER A 101 -3.955 -23.782 10.327 1.00 0.00 N ATOM 1490 CA SER A 101 -4.149 -24.943 11.187 1.00 0.00 C ATOM 1491 C SER A 101 -3.962 -24.570 12.655 1.00 0.00 C ATOM 1492 O SER A 101 -2.839 -24.534 13.159 1.00 0.00 O ATOM 1493 CB SER A 101 -3.172 -26.057 10.804 1.00 0.00 C ATOM 1494 OG SER A 101 -3.683 -26.839 9.738 1.00 0.00 O ATOM 0 H SER A 101 -3.077 -23.783 9.808 1.00 0.00 H new ATOM 0 HA SER A 101 -5.169 -25.300 11.048 1.00 0.00 H new ATOM 0 HB2 SER A 101 -2.215 -25.622 10.514 1.00 0.00 H new ATOM 0 HB3 SER A 101 -2.984 -26.694 11.669 1.00 0.00 H new ATOM 0 HG SER A 101 -3.040 -27.543 9.511 1.00 0.00 H new ATOM 1500 N SER A 102 -5.070 -24.293 13.334 1.00 0.00 N ATOM 1501 CA SER A 102 -5.029 -23.918 14.743 1.00 0.00 C ATOM 1502 C SER A 102 -6.339 -24.277 15.439 1.00 0.00 C ATOM 1503 O SER A 102 -7.298 -24.706 14.798 1.00 0.00 O ATOM 1504 CB SER A 102 -4.755 -22.420 14.886 1.00 0.00 C ATOM 1505 OG SER A 102 -5.659 -21.659 14.104 1.00 0.00 O ATOM 0 H SER A 102 -6.007 -24.321 12.932 1.00 0.00 H new ATOM 0 HA SER A 102 -4.221 -24.474 15.219 1.00 0.00 H new ATOM 0 HB2 SER A 102 -4.842 -22.130 15.933 1.00 0.00 H new ATOM 0 HB3 SER A 102 -3.732 -22.203 14.579 1.00 0.00 H new ATOM 0 HG SER A 102 -5.464 -20.705 14.214 1.00 0.00 H new ATOM 1511 N GLY A 103 -6.371 -24.097 16.756 1.00 0.00 N ATOM 1512 CA GLY A 103 -7.567 -24.405 17.518 1.00 0.00 C ATOM 1513 C GLY A 103 -7.251 -25.009 18.872 1.00 0.00 C ATOM 1514 O GLY A 103 -8.133 -25.139 19.721 1.00 0.00 O ATOM 0 H GLY A 103 -5.590 -23.743 17.309 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -8.150 -23.495 17.657 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -8.188 -25.098 16.950 1.00 0.00 H new TER 1518 GLY A 103