USER MOD reduce.3.24.130724 H: found=0, std=0, add=817, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 808 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 93 GLN : amide:sc= 0.488 K(o=0.83,f=0.32) USER MOD Set 1.2: A 94 SER OG : rot 87:sc= 0.341 USER MOD Set 2.1: A 77 ASN : amide:sc= -0.0758 K(o=-0.076,f=-2.1!) USER MOD Set 2.2: A 82 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 21 ASN : amide:sc= -0.848 K(o=1.8,f=-1.2) USER MOD Set 3.2: A 26 LYS NZ :NH3+ -176:sc= 1.43 (180deg=1.21) USER MOD Set 3.3: A 71 THR OG1 : rot 168:sc= 1.19 USER MOD Set 4.1: A 40 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 53 SER OG : rot -111:sc= 0.528 USER MOD Single : A 1 GLY N :NH3+ -134:sc= 0.101 (180deg=0) USER MOD Single : A 2 SER OG : rot 170:sc= 0 USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 5 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 GLN : amide:sc= 0.614 K(o=0.61,f=0) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 86:sc= 0.0714 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot -36:sc= 0.352 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 31 GLN : amide:sc= -0.002 K(o=-0.002,f=-1.3) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 54 TYR OH : rot -60:sc= -0.334 USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 56 THR OG1 : rot 180:sc=0.000904 USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 84:sc= 0.759 USER MOD Single : A 63 ASN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 66 SER OG : rot -107:sc= 0.71 USER MOD Single : A 68 CYS SG : rot 180:sc= 0.096 USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 THR OG1 : rot -130:sc= -0.0871 USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 GLN : amide:sc= -0.0149 X(o=-0.015,f=-0.015) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot -83:sc= 0.184 USER MOD Single : A 95 SER OG : rot 174:sc= 1.24 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.051 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 GLN : amide:sc= -0.239 X(o=-0.24,f=-0.28) USER MOD Single : A 115 GLN : amide:sc= -0.075 K(o=-0.075,f=-1.5!) USER MOD Single : A 116 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 9.039 -10.130 -2.527 1.00 0.00 N ATOM 2 CA GLY A 1 10.109 -9.236 -3.036 1.00 0.00 C ATOM 3 C GLY A 1 10.022 -7.865 -2.388 1.00 0.00 C ATOM 4 O GLY A 1 9.487 -7.757 -1.288 1.00 0.00 O ATOM 0 H1 GLY A 1 9.445 -11.058 -2.291 1.00 0.00 H new ATOM 0 H2 GLY A 1 8.613 -9.712 -1.676 1.00 0.00 H new ATOM 0 H3 GLY A 1 8.308 -10.248 -3.258 1.00 0.00 H new ATOM 0 HA2 GLY A 1 11.085 -9.678 -2.833 1.00 0.00 H new ATOM 0 HA3 GLY A 1 10.022 -9.138 -4.118 1.00 0.00 H new ATOM 7 N SER A 2 10.495 -6.806 -3.055 1.00 0.00 N ATOM 8 CA SER A 2 10.493 -5.422 -2.527 1.00 0.00 C ATOM 9 C SER A 2 9.104 -4.911 -2.116 1.00 0.00 C ATOM 10 O SER A 2 8.992 -4.097 -1.196 1.00 0.00 O ATOM 11 CB SER A 2 11.107 -4.455 -3.546 1.00 0.00 C ATOM 12 OG SER A 2 12.394 -4.912 -3.934 1.00 0.00 O ATOM 0 H SER A 2 10.897 -6.879 -3.990 1.00 0.00 H new ATOM 0 HA SER A 2 11.097 -5.457 -1.621 1.00 0.00 H new ATOM 0 HB2 SER A 2 10.461 -4.376 -4.420 1.00 0.00 H new ATOM 0 HB3 SER A 2 11.181 -3.457 -3.114 1.00 0.00 H new ATOM 0 HG SER A 2 12.712 -4.386 -4.697 1.00 0.00 H new ATOM 18 N GLU A 3 8.033 -5.454 -2.710 1.00 0.00 N ATOM 19 CA GLU A 3 6.654 -5.189 -2.280 1.00 0.00 C ATOM 20 C GLU A 3 6.394 -5.488 -0.789 1.00 0.00 C ATOM 21 O GLU A 3 5.489 -4.888 -0.210 1.00 0.00 O ATOM 22 CB GLU A 3 5.621 -5.880 -3.192 1.00 0.00 C ATOM 23 CG GLU A 3 5.513 -5.183 -4.563 1.00 0.00 C ATOM 24 CD GLU A 3 4.410 -5.747 -5.486 1.00 0.00 C ATOM 25 OE1 GLU A 3 3.560 -6.544 -5.029 1.00 0.00 O ATOM 26 OE2 GLU A 3 4.375 -5.376 -6.684 1.00 0.00 O ATOM 0 H GLU A 3 8.099 -6.091 -3.504 1.00 0.00 H new ATOM 0 HA GLU A 3 6.523 -4.112 -2.387 1.00 0.00 H new ATOM 0 HB2 GLU A 3 5.903 -6.923 -3.335 1.00 0.00 H new ATOM 0 HB3 GLU A 3 4.646 -5.877 -2.705 1.00 0.00 H new ATOM 0 HG2 GLU A 3 5.326 -4.121 -4.402 1.00 0.00 H new ATOM 0 HG3 GLU A 3 6.473 -5.264 -5.074 1.00 0.00 H new ATOM 33 N GLN A 4 7.215 -6.325 -0.131 1.00 0.00 N ATOM 34 CA GLN A 4 7.148 -6.594 1.315 1.00 0.00 C ATOM 35 C GLN A 4 7.335 -5.348 2.203 1.00 0.00 C ATOM 36 O GLN A 4 6.846 -5.324 3.332 1.00 0.00 O ATOM 37 CB GLN A 4 8.148 -7.696 1.713 1.00 0.00 C ATOM 38 CG GLN A 4 9.601 -7.211 1.895 1.00 0.00 C ATOM 39 CD GLN A 4 10.585 -8.344 2.193 1.00 0.00 C ATOM 40 OE1 GLN A 4 10.251 -9.392 2.730 1.00 0.00 O ATOM 41 NE2 GLN A 4 11.853 -8.170 1.874 1.00 0.00 N ATOM 0 H GLN A 4 7.958 -6.843 -0.599 1.00 0.00 H new ATOM 0 HA GLN A 4 6.130 -6.938 1.499 1.00 0.00 H new ATOM 0 HB2 GLN A 4 7.813 -8.154 2.644 1.00 0.00 H new ATOM 0 HB3 GLN A 4 8.132 -8.475 0.951 1.00 0.00 H new ATOM 0 HG2 GLN A 4 9.919 -6.691 0.991 1.00 0.00 H new ATOM 0 HG3 GLN A 4 9.635 -6.486 2.708 1.00 0.00 H new ATOM 0 HE21 GLN A 4 12.152 -7.304 1.426 1.00 0.00 H new ATOM 0 HE22 GLN A 4 12.535 -8.902 2.075 1.00 0.00 H new ATOM 50 N GLN A 5 8.041 -4.323 1.705 1.00 0.00 N ATOM 51 CA GLN A 5 8.145 -3.013 2.361 1.00 0.00 C ATOM 52 C GLN A 5 7.175 -2.005 1.733 1.00 0.00 C ATOM 53 O GLN A 5 6.591 -1.188 2.448 1.00 0.00 O ATOM 54 CB GLN A 5 9.584 -2.480 2.300 1.00 0.00 C ATOM 55 CG GLN A 5 10.562 -3.349 3.107 1.00 0.00 C ATOM 56 CD GLN A 5 11.843 -2.593 3.454 1.00 0.00 C ATOM 57 OE1 GLN A 5 11.974 -1.988 4.512 1.00 0.00 O ATOM 58 NE2 GLN A 5 12.837 -2.585 2.591 1.00 0.00 N ATOM 0 H GLN A 5 8.560 -4.381 0.829 1.00 0.00 H new ATOM 0 HA GLN A 5 7.872 -3.144 3.408 1.00 0.00 H new ATOM 0 HB2 GLN A 5 9.910 -2.439 1.261 1.00 0.00 H new ATOM 0 HB3 GLN A 5 9.608 -1.459 2.682 1.00 0.00 H new ATOM 0 HG2 GLN A 5 10.078 -3.684 4.025 1.00 0.00 H new ATOM 0 HG3 GLN A 5 10.811 -4.242 2.534 1.00 0.00 H new ATOM 0 HE21 GLN A 5 12.747 -3.083 1.705 1.00 0.00 H new ATOM 0 HE22 GLN A 5 13.697 -2.081 2.808 1.00 0.00 H new ATOM 67 N ASP A 6 6.933 -2.111 0.421 1.00 0.00 N ATOM 68 CA ASP A 6 5.989 -1.233 -0.273 1.00 0.00 C ATOM 69 C ASP A 6 4.588 -1.308 0.338 1.00 0.00 C ATOM 70 O ASP A 6 3.975 -0.268 0.520 1.00 0.00 O ATOM 71 CB ASP A 6 5.858 -1.540 -1.767 1.00 0.00 C ATOM 72 CG ASP A 6 7.163 -1.454 -2.579 1.00 0.00 C ATOM 73 OD1 ASP A 6 8.145 -0.823 -2.126 1.00 0.00 O ATOM 74 OD2 ASP A 6 7.201 -2.027 -3.690 1.00 0.00 O ATOM 0 H ASP A 6 7.381 -2.800 -0.182 1.00 0.00 H new ATOM 0 HA ASP A 6 6.408 -0.234 -0.152 1.00 0.00 H new ATOM 0 HB2 ASP A 6 5.446 -2.543 -1.879 1.00 0.00 H new ATOM 0 HB3 ASP A 6 5.135 -0.849 -2.200 1.00 0.00 H new ATOM 79 N LEU A 7 4.084 -2.493 0.712 1.00 0.00 N ATOM 80 CA LEU A 7 2.778 -2.662 1.374 1.00 0.00 C ATOM 81 C LEU A 7 2.610 -1.828 2.659 1.00 0.00 C ATOM 82 O LEU A 7 1.498 -1.411 2.981 1.00 0.00 O ATOM 83 CB LEU A 7 2.517 -4.162 1.621 1.00 0.00 C ATOM 84 CG LEU A 7 3.521 -4.868 2.562 1.00 0.00 C ATOM 85 CD1 LEU A 7 3.141 -4.812 4.047 1.00 0.00 C ATOM 86 CD2 LEU A 7 3.623 -6.338 2.163 1.00 0.00 C ATOM 0 H LEU A 7 4.577 -3.373 0.562 1.00 0.00 H new ATOM 0 HA LEU A 7 2.021 -2.268 0.696 1.00 0.00 H new ATOM 0 HB2 LEU A 7 1.516 -4.275 2.037 1.00 0.00 H new ATOM 0 HB3 LEU A 7 2.523 -4.677 0.660 1.00 0.00 H new ATOM 0 HG LEU A 7 4.465 -4.334 2.450 1.00 0.00 H new ATOM 0 HD11 LEU A 7 3.898 -5.330 4.636 1.00 0.00 H new ATOM 0 HD12 LEU A 7 3.081 -3.772 4.368 1.00 0.00 H new ATOM 0 HD13 LEU A 7 2.174 -5.294 4.194 1.00 0.00 H new ATOM 0 HD21 LEU A 7 4.329 -6.845 2.821 1.00 0.00 H new ATOM 0 HD22 LEU A 7 2.643 -6.808 2.251 1.00 0.00 H new ATOM 0 HD23 LEU A 7 3.970 -6.412 1.132 1.00 0.00 H new ATOM 98 N ASP A 8 3.701 -1.559 3.382 1.00 0.00 N ATOM 99 CA ASP A 8 3.677 -0.820 4.649 1.00 0.00 C ATOM 100 C ASP A 8 3.691 0.698 4.406 1.00 0.00 C ATOM 101 O ASP A 8 3.026 1.450 5.120 1.00 0.00 O ATOM 102 CB ASP A 8 4.866 -1.257 5.522 1.00 0.00 C ATOM 103 CG ASP A 8 4.427 -1.506 6.974 1.00 0.00 C ATOM 104 OD1 ASP A 8 3.953 -2.625 7.279 1.00 0.00 O ATOM 105 OD2 ASP A 8 4.562 -0.588 7.820 1.00 0.00 O ATOM 0 H ASP A 8 4.637 -1.851 3.101 1.00 0.00 H new ATOM 0 HA ASP A 8 2.751 -1.051 5.176 1.00 0.00 H new ATOM 0 HB2 ASP A 8 5.307 -2.165 5.112 1.00 0.00 H new ATOM 0 HB3 ASP A 8 5.639 -0.489 5.500 1.00 0.00 H new ATOM 110 N ASP A 9 4.383 1.134 3.347 1.00 0.00 N ATOM 111 CA ASP A 9 4.284 2.490 2.791 1.00 0.00 C ATOM 112 C ASP A 9 2.912 2.726 2.141 1.00 0.00 C ATOM 113 O ASP A 9 2.320 3.796 2.304 1.00 0.00 O ATOM 114 CB ASP A 9 5.386 2.728 1.745 1.00 0.00 C ATOM 115 CG ASP A 9 6.817 2.655 2.315 1.00 0.00 C ATOM 116 OD1 ASP A 9 7.051 3.097 3.466 1.00 0.00 O ATOM 117 OD2 ASP A 9 7.729 2.193 1.592 1.00 0.00 O ATOM 0 H ASP A 9 5.042 0.542 2.841 1.00 0.00 H new ATOM 0 HA ASP A 9 4.408 3.191 3.617 1.00 0.00 H new ATOM 0 HB2 ASP A 9 5.284 1.989 0.950 1.00 0.00 H new ATOM 0 HB3 ASP A 9 5.236 3.707 1.291 1.00 0.00 H new ATOM 122 N LEU A 10 2.362 1.713 1.460 1.00 0.00 N ATOM 123 CA LEU A 10 1.004 1.736 0.936 1.00 0.00 C ATOM 124 C LEU A 10 -0.012 1.892 2.073 1.00 0.00 C ATOM 125 O LEU A 10 -0.881 2.744 1.970 1.00 0.00 O ATOM 126 CB LEU A 10 0.697 0.565 -0.019 1.00 0.00 C ATOM 127 CG LEU A 10 0.909 0.940 -1.507 1.00 0.00 C ATOM 128 CD1 LEU A 10 2.123 0.240 -2.112 1.00 0.00 C ATOM 129 CD2 LEU A 10 -0.313 0.596 -2.357 1.00 0.00 C ATOM 0 H LEU A 10 2.860 0.846 1.258 1.00 0.00 H new ATOM 0 HA LEU A 10 0.911 2.619 0.304 1.00 0.00 H new ATOM 0 HB2 LEU A 10 1.335 -0.282 0.233 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -0.334 0.242 0.127 1.00 0.00 H new ATOM 0 HG LEU A 10 1.074 2.017 -1.516 1.00 0.00 H new ATOM 0 HD11 LEU A 10 2.230 0.535 -3.156 1.00 0.00 H new ATOM 0 HD12 LEU A 10 3.019 0.525 -1.561 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.988 -0.840 -2.052 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -0.125 0.874 -3.394 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -0.507 -0.475 -2.298 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -1.180 1.143 -1.986 1.00 0.00 H new ATOM 141 N ALA A 11 0.161 1.221 3.211 1.00 0.00 N ATOM 142 CA ALA A 11 -0.626 1.485 4.420 1.00 0.00 C ATOM 143 C ALA A 11 -0.450 2.907 5.024 1.00 0.00 C ATOM 144 O ALA A 11 -1.084 3.204 6.034 1.00 0.00 O ATOM 145 CB ALA A 11 -0.354 0.373 5.440 1.00 0.00 C ATOM 0 H ALA A 11 0.851 0.478 3.323 1.00 0.00 H new ATOM 0 HA ALA A 11 -1.676 1.473 4.129 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -0.934 0.559 6.344 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -0.642 -0.589 5.015 1.00 0.00 H new ATOM 0 HB3 ALA A 11 0.708 0.358 5.687 1.00 0.00 H new ATOM 151 N GLN A 12 0.348 3.808 4.425 1.00 0.00 N ATOM 152 CA GLN A 12 0.399 5.241 4.771 1.00 0.00 C ATOM 153 C GLN A 12 -0.236 6.119 3.680 1.00 0.00 C ATOM 154 O GLN A 12 -1.065 6.976 3.984 1.00 0.00 O ATOM 155 CB GLN A 12 1.842 5.719 5.033 1.00 0.00 C ATOM 156 CG GLN A 12 2.704 4.802 5.911 1.00 0.00 C ATOM 157 CD GLN A 12 2.007 4.322 7.182 1.00 0.00 C ATOM 158 OE1 GLN A 12 1.545 5.095 8.010 1.00 0.00 O ATOM 159 NE2 GLN A 12 1.911 3.024 7.382 1.00 0.00 N ATOM 0 H GLN A 12 0.988 3.557 3.672 1.00 0.00 H new ATOM 0 HA GLN A 12 -0.179 5.348 5.689 1.00 0.00 H new ATOM 0 HB2 GLN A 12 2.342 5.845 4.073 1.00 0.00 H new ATOM 0 HB3 GLN A 12 1.799 6.702 5.501 1.00 0.00 H new ATOM 0 HG2 GLN A 12 3.006 3.934 5.325 1.00 0.00 H new ATOM 0 HG3 GLN A 12 3.615 5.333 6.187 1.00 0.00 H new ATOM 0 HE21 GLN A 12 2.294 2.373 6.697 1.00 0.00 H new ATOM 0 HE22 GLN A 12 1.454 2.670 8.222 1.00 0.00 H new ATOM 168 N VAL A 13 0.097 5.895 2.402 1.00 0.00 N ATOM 169 CA VAL A 13 -0.505 6.633 1.266 1.00 0.00 C ATOM 170 C VAL A 13 -1.983 6.278 1.071 1.00 0.00 C ATOM 171 O VAL A 13 -2.789 7.165 0.799 1.00 0.00 O ATOM 172 CB VAL A 13 0.258 6.403 -0.056 1.00 0.00 C ATOM 173 CG1 VAL A 13 1.757 6.683 0.080 1.00 0.00 C ATOM 174 CG2 VAL A 13 0.065 4.972 -0.543 1.00 0.00 C ATOM 0 H VAL A 13 0.789 5.201 2.119 1.00 0.00 H new ATOM 0 HA VAL A 13 -0.428 7.688 1.527 1.00 0.00 H new ATOM 0 HB VAL A 13 -0.156 7.105 -0.780 1.00 0.00 H new ATOM 0 HG11 VAL A 13 2.248 6.507 -0.877 1.00 0.00 H new ATOM 0 HG12 VAL A 13 1.908 7.720 0.380 1.00 0.00 H new ATOM 0 HG13 VAL A 13 2.184 6.022 0.834 1.00 0.00 H new ATOM 0 HG21 VAL A 13 0.610 4.829 -1.476 1.00 0.00 H new ATOM 0 HG22 VAL A 13 0.442 4.278 0.208 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -0.996 4.784 -0.710 1.00 0.00 H new ATOM 184 N ILE A 14 -2.353 5.004 1.264 1.00 0.00 N ATOM 185 CA ILE A 14 -3.741 4.541 1.276 1.00 0.00 C ATOM 186 C ILE A 14 -4.442 5.187 2.459 1.00 0.00 C ATOM 187 O ILE A 14 -5.490 5.762 2.237 1.00 0.00 O ATOM 188 CB ILE A 14 -3.861 3.005 1.346 1.00 0.00 C ATOM 189 CG1 ILE A 14 -3.295 2.309 0.084 1.00 0.00 C ATOM 190 CG2 ILE A 14 -5.327 2.580 1.517 1.00 0.00 C ATOM 191 CD1 ILE A 14 -3.110 0.793 0.277 1.00 0.00 C ATOM 0 H ILE A 14 -1.679 4.254 1.419 1.00 0.00 H new ATOM 0 HA ILE A 14 -4.212 4.834 0.338 1.00 0.00 H new ATOM 0 HB ILE A 14 -3.272 2.694 2.209 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -3.967 2.485 -0.756 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -2.336 2.758 -0.175 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -5.388 1.493 1.564 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -5.724 3.006 2.439 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -5.911 2.940 0.670 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -2.711 0.356 -0.638 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -2.416 0.613 1.098 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -4.072 0.336 0.508 1.00 0.00 H new ATOM 202 N LEU A 15 -3.876 5.181 3.675 1.00 0.00 N ATOM 203 CA LEU A 15 -4.447 5.879 4.840 1.00 0.00 C ATOM 204 C LEU A 15 -4.724 7.356 4.529 1.00 0.00 C ATOM 205 O LEU A 15 -5.833 7.831 4.754 1.00 0.00 O ATOM 206 CB LEU A 15 -3.523 5.706 6.060 1.00 0.00 C ATOM 207 CG LEU A 15 -3.857 4.513 6.975 1.00 0.00 C ATOM 208 CD1 LEU A 15 -4.977 4.854 7.953 1.00 0.00 C ATOM 209 CD2 LEU A 15 -4.267 3.238 6.237 1.00 0.00 C ATOM 0 H LEU A 15 -3.006 4.690 3.880 1.00 0.00 H new ATOM 0 HA LEU A 15 -5.411 5.430 5.080 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -2.498 5.595 5.706 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -3.558 6.619 6.654 1.00 0.00 H new ATOM 0 HG LEU A 15 -2.919 4.317 7.495 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -5.186 3.989 8.583 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -4.671 5.693 8.578 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -5.875 5.124 7.398 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -4.483 2.452 6.961 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -5.156 3.434 5.638 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -3.454 2.917 5.585 1.00 0.00 H new ATOM 221 N SER A 16 -3.761 8.061 3.929 1.00 0.00 N ATOM 222 CA SER A 16 -3.946 9.425 3.427 1.00 0.00 C ATOM 223 C SER A 16 -5.095 9.531 2.408 1.00 0.00 C ATOM 224 O SER A 16 -5.893 10.459 2.503 1.00 0.00 O ATOM 225 CB SER A 16 -2.615 9.929 2.855 1.00 0.00 C ATOM 226 OG SER A 16 -2.763 11.152 2.156 1.00 0.00 O ATOM 0 H SER A 16 -2.821 7.697 3.777 1.00 0.00 H new ATOM 0 HA SER A 16 -4.243 10.065 4.258 1.00 0.00 H new ATOM 0 HB2 SER A 16 -1.899 10.060 3.666 1.00 0.00 H new ATOM 0 HB3 SER A 16 -2.201 9.176 2.184 1.00 0.00 H new ATOM 0 HG SER A 16 -1.892 11.438 1.810 1.00 0.00 H new ATOM 232 N ALA A 17 -5.249 8.571 1.487 1.00 0.00 N ATOM 233 CA ALA A 17 -6.321 8.530 0.488 1.00 0.00 C ATOM 234 C ALA A 17 -7.713 8.183 1.075 1.00 0.00 C ATOM 235 O ALA A 17 -8.672 8.936 0.899 1.00 0.00 O ATOM 236 CB ALA A 17 -5.899 7.530 -0.602 1.00 0.00 C ATOM 0 H ALA A 17 -4.611 7.778 1.416 1.00 0.00 H new ATOM 0 HA ALA A 17 -6.448 9.530 0.073 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -6.676 7.474 -1.365 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.966 7.861 -1.058 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -5.756 6.545 -0.157 1.00 0.00 H new ATOM 242 N VAL A 18 -7.831 7.076 1.814 1.00 0.00 N ATOM 243 CA VAL A 18 -9.078 6.574 2.415 1.00 0.00 C ATOM 244 C VAL A 18 -9.581 7.458 3.565 1.00 0.00 C ATOM 245 O VAL A 18 -10.786 7.514 3.795 1.00 0.00 O ATOM 246 CB VAL A 18 -8.976 5.095 2.854 1.00 0.00 C ATOM 247 CG1 VAL A 18 -8.567 4.173 1.704 1.00 0.00 C ATOM 248 CG2 VAL A 18 -8.090 4.818 4.078 1.00 0.00 C ATOM 0 H VAL A 18 -7.030 6.479 2.020 1.00 0.00 H new ATOM 0 HA VAL A 18 -9.822 6.625 1.620 1.00 0.00 H new ATOM 0 HB VAL A 18 -9.995 4.868 3.167 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -8.510 3.146 2.064 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -9.307 4.237 0.906 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -7.593 4.478 1.322 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -8.093 3.750 4.295 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -7.071 5.144 3.871 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -8.477 5.364 4.938 1.00 0.00 H new ATOM 258 N THR A 19 -8.698 8.212 4.226 1.00 0.00 N ATOM 259 CA THR A 19 -9.045 9.190 5.278 1.00 0.00 C ATOM 260 C THR A 19 -9.069 10.635 4.737 1.00 0.00 C ATOM 261 O THR A 19 -9.541 11.539 5.424 1.00 0.00 O ATOM 262 CB THR A 19 -8.108 9.031 6.497 1.00 0.00 C ATOM 263 OG1 THR A 19 -8.027 7.667 6.864 1.00 0.00 O ATOM 264 CG2 THR A 19 -8.571 9.758 7.764 1.00 0.00 C ATOM 0 H THR A 19 -7.695 8.163 4.045 1.00 0.00 H new ATOM 0 HA THR A 19 -10.060 8.979 5.615 1.00 0.00 H new ATOM 0 HB THR A 19 -7.162 9.461 6.166 1.00 0.00 H new ATOM 0 HG1 THR A 19 -7.333 7.226 6.331 1.00 0.00 H new ATOM 0 HG21 THR A 19 -7.851 9.588 8.564 1.00 0.00 H new ATOM 0 HG22 THR A 19 -8.646 10.827 7.563 1.00 0.00 H new ATOM 0 HG23 THR A 19 -9.546 9.377 8.067 1.00 0.00 H new ATOM 272 N SER A 20 -8.677 10.872 3.474 1.00 0.00 N ATOM 273 CA SER A 20 -8.811 12.171 2.769 1.00 0.00 C ATOM 274 C SER A 20 -10.258 12.683 2.712 1.00 0.00 C ATOM 275 O SER A 20 -10.517 13.885 2.644 1.00 0.00 O ATOM 276 CB SER A 20 -8.299 12.062 1.322 1.00 0.00 C ATOM 277 OG SER A 20 -7.450 13.146 1.012 1.00 0.00 O ATOM 0 H SER A 20 -8.246 10.151 2.895 1.00 0.00 H new ATOM 0 HA SER A 20 -8.214 12.876 3.347 1.00 0.00 H new ATOM 0 HB2 SER A 20 -7.761 11.123 1.191 1.00 0.00 H new ATOM 0 HB3 SER A 20 -9.143 12.045 0.632 1.00 0.00 H new ATOM 0 HG SER A 20 -7.133 13.059 0.089 1.00 0.00 H new ATOM 283 N ASN A 21 -11.204 11.745 2.776 1.00 0.00 N ATOM 284 CA ASN A 21 -12.653 11.945 2.805 1.00 0.00 C ATOM 285 C ASN A 21 -13.227 11.967 4.246 1.00 0.00 C ATOM 286 O ASN A 21 -14.424 11.772 4.439 1.00 0.00 O ATOM 287 CB ASN A 21 -13.310 10.904 1.875 1.00 0.00 C ATOM 288 CG ASN A 21 -12.846 9.470 2.072 1.00 0.00 C ATOM 289 OD1 ASN A 21 -13.488 8.649 2.705 1.00 0.00 O ATOM 290 ND2 ASN A 21 -11.711 9.115 1.513 1.00 0.00 N ATOM 0 H ASN A 21 -10.960 10.755 2.811 1.00 0.00 H new ATOM 0 HA ASN A 21 -12.895 12.937 2.424 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -14.390 10.942 2.020 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -13.117 11.192 0.842 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -11.372 8.158 1.610 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -11.169 9.797 0.982 1.00 0.00 H new ATOM 297 N THR A 22 -12.361 12.217 5.238 1.00 0.00 N ATOM 298 CA THR A 22 -12.636 12.428 6.680 1.00 0.00 C ATOM 299 C THR A 22 -13.177 11.209 7.450 1.00 0.00 C ATOM 300 O THR A 22 -13.540 11.315 8.625 1.00 0.00 O ATOM 301 CB THR A 22 -13.426 13.728 6.974 1.00 0.00 C ATOM 302 OG1 THR A 22 -14.818 13.586 6.780 1.00 0.00 O ATOM 303 CG2 THR A 22 -12.975 14.916 6.114 1.00 0.00 C ATOM 0 H THR A 22 -11.362 12.284 5.043 1.00 0.00 H new ATOM 0 HA THR A 22 -11.639 12.568 7.097 1.00 0.00 H new ATOM 0 HB THR A 22 -13.211 13.924 8.025 1.00 0.00 H new ATOM 0 HG1 THR A 22 -14.983 12.997 6.015 1.00 0.00 H new ATOM 0 HG21 THR A 22 -13.567 15.795 6.369 1.00 0.00 H new ATOM 0 HG22 THR A 22 -11.921 15.122 6.302 1.00 0.00 H new ATOM 0 HG23 THR A 22 -13.116 14.676 5.060 1.00 0.00 H new ATOM 311 N ASP A 23 -13.186 10.027 6.826 1.00 0.00 N ATOM 312 CA ASP A 23 -13.713 8.781 7.393 1.00 0.00 C ATOM 313 C ASP A 23 -12.723 8.120 8.375 1.00 0.00 C ATOM 314 O ASP A 23 -11.856 7.342 7.980 1.00 0.00 O ATOM 315 CB ASP A 23 -14.100 7.808 6.259 1.00 0.00 C ATOM 316 CG ASP A 23 -15.452 8.103 5.584 1.00 0.00 C ATOM 317 OD1 ASP A 23 -16.131 9.100 5.922 1.00 0.00 O ATOM 318 OD2 ASP A 23 -15.859 7.278 4.734 1.00 0.00 O ATOM 0 H ASP A 23 -12.815 9.907 5.883 1.00 0.00 H new ATOM 0 HA ASP A 23 -14.604 9.030 7.969 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -13.319 7.830 5.499 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -14.125 6.795 6.662 1.00 0.00 H new ATOM 323 N THR A 24 -12.878 8.370 9.680 1.00 0.00 N ATOM 324 CA THR A 24 -12.129 7.653 10.738 1.00 0.00 C ATOM 325 C THR A 24 -12.334 6.127 10.683 1.00 0.00 C ATOM 326 O THR A 24 -11.411 5.351 10.935 1.00 0.00 O ATOM 327 CB THR A 24 -12.472 8.219 12.130 1.00 0.00 C ATOM 328 OG1 THR A 24 -11.574 7.720 13.096 1.00 0.00 O ATOM 329 CG2 THR A 24 -13.895 7.903 12.606 1.00 0.00 C ATOM 0 H THR A 24 -13.524 9.073 10.040 1.00 0.00 H new ATOM 0 HA THR A 24 -11.069 7.824 10.549 1.00 0.00 H new ATOM 0 HB THR A 24 -12.392 9.301 12.022 1.00 0.00 H new ATOM 0 HG1 THR A 24 -11.802 8.088 13.975 1.00 0.00 H new ATOM 0 HG21 THR A 24 -14.053 8.337 13.593 1.00 0.00 H new ATOM 0 HG22 THR A 24 -14.615 8.324 11.904 1.00 0.00 H new ATOM 0 HG23 THR A 24 -14.029 6.823 12.659 1.00 0.00 H new ATOM 337 N SER A 25 -13.519 5.672 10.258 1.00 0.00 N ATOM 338 CA SER A 25 -13.845 4.247 10.087 1.00 0.00 C ATOM 339 C SER A 25 -13.094 3.584 8.916 1.00 0.00 C ATOM 340 O SER A 25 -12.907 2.369 8.904 1.00 0.00 O ATOM 341 CB SER A 25 -15.365 4.107 9.939 1.00 0.00 C ATOM 342 OG SER A 25 -15.784 2.765 10.109 1.00 0.00 O ATOM 0 H SER A 25 -14.292 6.292 10.019 1.00 0.00 H new ATOM 0 HA SER A 25 -13.507 3.712 10.974 1.00 0.00 H new ATOM 0 HB2 SER A 25 -15.862 4.740 10.674 1.00 0.00 H new ATOM 0 HB3 SER A 25 -15.669 4.462 8.954 1.00 0.00 H new ATOM 0 HG SER A 25 -16.758 2.711 10.010 1.00 0.00 H new ATOM 348 N LYS A 26 -12.574 4.348 7.942 1.00 0.00 N ATOM 349 CA LYS A 26 -11.703 3.814 6.872 1.00 0.00 C ATOM 350 C LYS A 26 -10.352 3.294 7.399 1.00 0.00 C ATOM 351 O LYS A 26 -9.794 2.371 6.808 1.00 0.00 O ATOM 352 CB LYS A 26 -11.534 4.859 5.755 1.00 0.00 C ATOM 353 CG LYS A 26 -12.177 4.474 4.414 1.00 0.00 C ATOM 354 CD LYS A 26 -13.697 4.303 4.440 1.00 0.00 C ATOM 355 CE LYS A 26 -14.266 4.506 3.029 1.00 0.00 C ATOM 356 NZ LYS A 26 -14.538 5.942 2.746 1.00 0.00 N ATOM 0 H LYS A 26 -12.742 5.351 7.870 1.00 0.00 H new ATOM 0 HA LYS A 26 -12.198 2.940 6.449 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -11.964 5.803 6.091 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -10.470 5.032 5.596 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -11.927 5.238 3.678 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -11.729 3.542 4.070 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -13.954 3.309 4.807 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -14.142 5.022 5.128 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -13.562 4.117 2.293 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -15.187 3.933 2.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -14.984 6.033 1.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -15.176 6.324 3.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -13.644 6.473 2.756 1.00 0.00 H new ATOM 370 N SER A 27 -9.883 3.771 8.558 1.00 0.00 N ATOM 371 CA SER A 27 -8.754 3.162 9.293 1.00 0.00 C ATOM 372 C SER A 27 -9.038 1.716 9.731 1.00 0.00 C ATOM 373 O SER A 27 -8.121 0.894 9.752 1.00 0.00 O ATOM 374 CB SER A 27 -8.388 3.994 10.533 1.00 0.00 C ATOM 375 OG SER A 27 -7.070 4.497 10.428 1.00 0.00 O ATOM 0 H SER A 27 -10.273 4.593 9.019 1.00 0.00 H new ATOM 0 HA SER A 27 -7.918 3.147 8.594 1.00 0.00 H new ATOM 0 HB2 SER A 27 -9.090 4.821 10.642 1.00 0.00 H new ATOM 0 HB3 SER A 27 -8.477 3.379 11.429 1.00 0.00 H new ATOM 0 HG SER A 27 -6.857 5.025 11.226 1.00 0.00 H new ATOM 381 N ALA A 28 -10.298 1.365 10.028 1.00 0.00 N ATOM 382 CA ALA A 28 -10.682 -0.015 10.332 1.00 0.00 C ATOM 383 C ALA A 28 -10.546 -0.935 9.107 1.00 0.00 C ATOM 384 O ALA A 28 -10.215 -2.108 9.258 1.00 0.00 O ATOM 385 CB ALA A 28 -12.114 -0.057 10.879 1.00 0.00 C ATOM 0 H ALA A 28 -11.073 2.028 10.063 1.00 0.00 H new ATOM 0 HA ALA A 28 -9.996 -0.388 11.093 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -12.388 -1.088 11.101 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -12.173 0.539 11.790 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -12.800 0.349 10.135 1.00 0.00 H new ATOM 391 N ARG A 29 -10.743 -0.414 7.886 1.00 0.00 N ATOM 392 CA ARG A 29 -10.528 -1.189 6.654 1.00 0.00 C ATOM 393 C ARG A 29 -9.062 -1.470 6.377 1.00 0.00 C ATOM 394 O ARG A 29 -8.774 -2.527 5.839 1.00 0.00 O ATOM 395 CB ARG A 29 -11.174 -0.542 5.427 1.00 0.00 C ATOM 396 CG ARG A 29 -12.691 -0.739 5.416 1.00 0.00 C ATOM 397 CD ARG A 29 -13.445 0.384 6.129 1.00 0.00 C ATOM 398 NE ARG A 29 -14.700 -0.101 6.728 1.00 0.00 N ATOM 399 CZ ARG A 29 -15.660 0.636 7.250 1.00 0.00 C ATOM 400 NH1 ARG A 29 -15.629 1.934 7.205 1.00 0.00 N ATOM 401 NH2 ARG A 29 -16.677 0.077 7.835 1.00 0.00 N ATOM 0 H ARG A 29 -11.052 0.545 7.725 1.00 0.00 H new ATOM 0 HA ARG A 29 -11.024 -2.142 6.837 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -10.945 0.524 5.415 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -10.745 -0.970 4.521 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -13.036 -0.802 4.384 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -12.932 -1.690 5.892 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -12.812 0.812 6.906 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -13.664 1.183 5.421 1.00 0.00 H new ATOM 0 HE ARG A 29 -14.841 -1.111 6.740 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -14.846 2.410 6.756 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -16.387 2.477 7.618 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -16.737 -0.940 7.893 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -17.416 0.655 8.236 1.00 0.00 H new ATOM 415 N ALA A 30 -8.131 -0.610 6.781 1.00 0.00 N ATOM 416 CA ALA A 30 -6.697 -0.864 6.600 1.00 0.00 C ATOM 417 C ALA A 30 -6.225 -2.225 7.169 1.00 0.00 C ATOM 418 O ALA A 30 -5.289 -2.818 6.633 1.00 0.00 O ATOM 419 CB ALA A 30 -5.915 0.303 7.196 1.00 0.00 C ATOM 0 H ALA A 30 -8.342 0.276 7.240 1.00 0.00 H new ATOM 0 HA ALA A 30 -6.503 -0.936 5.530 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -4.847 0.128 7.069 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -6.195 1.226 6.688 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -6.144 0.390 8.258 1.00 0.00 H new ATOM 425 N GLN A 31 -6.908 -2.775 8.186 1.00 0.00 N ATOM 426 CA GLN A 31 -6.671 -4.143 8.678 1.00 0.00 C ATOM 427 C GLN A 31 -6.987 -5.238 7.634 1.00 0.00 C ATOM 428 O GLN A 31 -6.349 -6.288 7.629 1.00 0.00 O ATOM 429 CB GLN A 31 -7.418 -4.363 10.011 1.00 0.00 C ATOM 430 CG GLN A 31 -8.899 -4.784 9.915 1.00 0.00 C ATOM 431 CD GLN A 31 -9.117 -6.294 10.037 1.00 0.00 C ATOM 432 OE1 GLN A 31 -9.019 -7.050 9.080 1.00 0.00 O ATOM 433 NE2 GLN A 31 -9.439 -6.795 11.211 1.00 0.00 N ATOM 0 H GLN A 31 -7.643 -2.282 8.692 1.00 0.00 H new ATOM 0 HA GLN A 31 -5.601 -4.241 8.862 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -6.884 -5.125 10.578 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -7.364 -3.440 10.588 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -9.463 -4.280 10.700 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -9.304 -4.443 8.962 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -9.526 -6.181 12.021 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -9.602 -7.797 11.311 1.00 0.00 H new ATOM 442 N ALA A 32 -7.926 -4.993 6.713 1.00 0.00 N ATOM 443 CA ALA A 32 -8.243 -5.889 5.601 1.00 0.00 C ATOM 444 C ALA A 32 -7.101 -5.952 4.573 1.00 0.00 C ATOM 445 O ALA A 32 -6.884 -7.001 3.973 1.00 0.00 O ATOM 446 CB ALA A 32 -9.557 -5.451 4.939 1.00 0.00 C ATOM 0 H ALA A 32 -8.497 -4.148 6.722 1.00 0.00 H new ATOM 0 HA ALA A 32 -8.364 -6.896 6.000 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -9.789 -6.121 4.111 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -10.363 -5.487 5.672 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -9.453 -4.433 4.563 1.00 0.00 H new ATOM 452 N LEU A 33 -6.302 -4.890 4.414 1.00 0.00 N ATOM 453 CA LEU A 33 -5.050 -4.951 3.641 1.00 0.00 C ATOM 454 C LEU A 33 -4.081 -5.988 4.260 1.00 0.00 C ATOM 455 O LEU A 33 -3.451 -6.753 3.535 1.00 0.00 O ATOM 456 CB LEU A 33 -4.452 -3.528 3.524 1.00 0.00 C ATOM 457 CG LEU A 33 -3.628 -3.195 2.261 1.00 0.00 C ATOM 458 CD1 LEU A 33 -2.385 -4.063 2.089 1.00 0.00 C ATOM 459 CD2 LEU A 33 -4.459 -3.274 0.979 1.00 0.00 C ATOM 0 H LEU A 33 -6.500 -3.972 4.812 1.00 0.00 H new ATOM 0 HA LEU A 33 -5.244 -5.299 2.626 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -5.273 -2.814 3.586 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -3.816 -3.359 4.393 1.00 0.00 H new ATOM 0 HG LEU A 33 -3.306 -2.167 2.424 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -1.859 -3.769 1.180 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -1.727 -3.931 2.948 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -2.680 -5.110 2.016 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -3.830 -3.031 0.122 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.855 -4.283 0.864 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -5.285 -2.565 1.036 1.00 0.00 H new ATOM 471 N SER A 34 -4.054 -6.140 5.591 1.00 0.00 N ATOM 472 CA SER A 34 -3.338 -7.238 6.274 1.00 0.00 C ATOM 473 C SER A 34 -3.920 -8.644 6.005 1.00 0.00 C ATOM 474 O SER A 34 -3.248 -9.638 6.275 1.00 0.00 O ATOM 475 CB SER A 34 -3.254 -7.011 7.790 1.00 0.00 C ATOM 476 OG SER A 34 -2.887 -5.674 8.102 1.00 0.00 O ATOM 0 H SER A 34 -4.529 -5.504 6.232 1.00 0.00 H new ATOM 0 HA SER A 34 -2.339 -7.214 5.839 1.00 0.00 H new ATOM 0 HB2 SER A 34 -4.217 -7.240 8.246 1.00 0.00 H new ATOM 0 HB3 SER A 34 -2.526 -7.698 8.221 1.00 0.00 H new ATOM 0 HG SER A 34 -2.845 -5.565 9.075 1.00 0.00 H new ATOM 482 N THR A 35 -5.129 -8.772 5.441 1.00 0.00 N ATOM 483 CA THR A 35 -5.644 -10.064 4.935 1.00 0.00 C ATOM 484 C THR A 35 -4.938 -10.496 3.643 1.00 0.00 C ATOM 485 O THR A 35 -4.748 -11.690 3.414 1.00 0.00 O ATOM 486 CB THR A 35 -7.182 -10.053 4.773 1.00 0.00 C ATOM 487 OG1 THR A 35 -7.704 -11.240 5.332 1.00 0.00 O ATOM 488 CG2 THR A 35 -7.724 -9.982 3.338 1.00 0.00 C ATOM 0 H THR A 35 -5.777 -7.994 5.321 1.00 0.00 H new ATOM 0 HA THR A 35 -5.411 -10.813 5.692 1.00 0.00 H new ATOM 0 HB THR A 35 -7.494 -9.134 5.270 1.00 0.00 H new ATOM 0 HG1 THR A 35 -8.679 -11.245 5.237 1.00 0.00 H new ATOM 0 HG21 THR A 35 -8.814 -9.981 3.360 1.00 0.00 H new ATOM 0 HG22 THR A 35 -7.370 -9.069 2.860 1.00 0.00 H new ATOM 0 HG23 THR A 35 -7.374 -10.846 2.774 1.00 0.00 H new ATOM 496 N ALA A 36 -4.470 -9.540 2.827 1.00 0.00 N ATOM 497 CA ALA A 36 -3.616 -9.828 1.676 1.00 0.00 C ATOM 498 C ALA A 36 -2.288 -10.461 2.140 1.00 0.00 C ATOM 499 O ALA A 36 -1.860 -11.486 1.610 1.00 0.00 O ATOM 500 CB ALA A 36 -3.388 -8.533 0.883 1.00 0.00 C ATOM 0 H ALA A 36 -4.675 -8.548 2.950 1.00 0.00 H new ATOM 0 HA ALA A 36 -4.103 -10.550 1.021 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -2.752 -8.740 0.023 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -4.346 -8.143 0.540 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -2.904 -7.795 1.523 1.00 0.00 H new ATOM 506 N LEU A 37 -1.688 -9.912 3.204 1.00 0.00 N ATOM 507 CA LEU A 37 -0.436 -10.389 3.809 1.00 0.00 C ATOM 508 C LEU A 37 -0.507 -11.866 4.246 1.00 0.00 C ATOM 509 O LEU A 37 0.495 -12.574 4.155 1.00 0.00 O ATOM 510 CB LEU A 37 -0.062 -9.478 4.999 1.00 0.00 C ATOM 511 CG LEU A 37 0.732 -8.197 4.675 1.00 0.00 C ATOM 512 CD1 LEU A 37 2.218 -8.521 4.546 1.00 0.00 C ATOM 513 CD2 LEU A 37 0.235 -7.481 3.418 1.00 0.00 C ATOM 0 H LEU A 37 -2.072 -9.098 3.683 1.00 0.00 H new ATOM 0 HA LEU A 37 0.342 -10.337 3.047 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -0.982 -9.187 5.506 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.520 -10.067 5.708 1.00 0.00 H new ATOM 0 HG LEU A 37 0.573 -7.510 5.506 1.00 0.00 H new ATOM 0 HD11 LEU A 37 2.771 -7.610 4.317 1.00 0.00 H new ATOM 0 HD12 LEU A 37 2.582 -8.940 5.484 1.00 0.00 H new ATOM 0 HD13 LEU A 37 2.364 -9.245 3.744 1.00 0.00 H new ATOM 0 HD21 LEU A 37 0.836 -6.588 3.246 1.00 0.00 H new ATOM 0 HD22 LEU A 37 0.323 -8.148 2.560 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -0.809 -7.196 3.550 1.00 0.00 H new ATOM 525 N ALA A 38 -1.681 -12.358 4.658 1.00 0.00 N ATOM 526 CA ALA A 38 -1.898 -13.779 4.948 1.00 0.00 C ATOM 527 C ALA A 38 -1.751 -14.673 3.696 1.00 0.00 C ATOM 528 O ALA A 38 -1.212 -15.777 3.785 1.00 0.00 O ATOM 529 CB ALA A 38 -3.279 -13.942 5.589 1.00 0.00 C ATOM 0 H ALA A 38 -2.509 -11.780 4.800 1.00 0.00 H new ATOM 0 HA ALA A 38 -1.125 -14.113 5.640 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -3.455 -14.995 5.811 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -3.322 -13.364 6.512 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -4.044 -13.583 4.901 1.00 0.00 H new ATOM 535 N SER A 39 -2.175 -14.191 2.522 1.00 0.00 N ATOM 536 CA SER A 39 -1.901 -14.843 1.234 1.00 0.00 C ATOM 537 C SER A 39 -0.425 -14.690 0.832 1.00 0.00 C ATOM 538 O SER A 39 0.200 -15.670 0.430 1.00 0.00 O ATOM 539 CB SER A 39 -2.819 -14.278 0.142 1.00 0.00 C ATOM 540 OG SER A 39 -2.817 -15.138 -0.985 1.00 0.00 O ATOM 0 H SER A 39 -2.721 -13.333 2.437 1.00 0.00 H new ATOM 0 HA SER A 39 -2.106 -15.908 1.347 1.00 0.00 H new ATOM 0 HB2 SER A 39 -3.833 -14.172 0.527 1.00 0.00 H new ATOM 0 HB3 SER A 39 -2.482 -13.283 -0.149 1.00 0.00 H new ATOM 0 HG SER A 39 -3.406 -14.772 -1.677 1.00 0.00 H new ATOM 546 N SER A 40 0.176 -13.507 1.031 1.00 0.00 N ATOM 547 CA SER A 40 1.609 -13.263 0.778 1.00 0.00 C ATOM 548 C SER A 40 2.530 -14.196 1.575 1.00 0.00 C ATOM 549 O SER A 40 3.525 -14.675 1.039 1.00 0.00 O ATOM 550 CB SER A 40 1.973 -11.805 1.056 1.00 0.00 C ATOM 551 OG SER A 40 3.318 -11.542 0.698 1.00 0.00 O ATOM 0 H SER A 40 -0.320 -12.685 1.375 1.00 0.00 H new ATOM 0 HA SER A 40 1.770 -13.481 -0.278 1.00 0.00 H new ATOM 0 HB2 SER A 40 1.308 -11.147 0.496 1.00 0.00 H new ATOM 0 HB3 SER A 40 1.824 -11.584 2.113 1.00 0.00 H new ATOM 0 HG SER A 40 3.528 -10.603 0.883 1.00 0.00 H new ATOM 557 N LEU A 41 2.172 -14.543 2.817 1.00 0.00 N ATOM 558 CA LEU A 41 2.847 -15.564 3.638 1.00 0.00 C ATOM 559 C LEU A 41 3.044 -16.894 2.871 1.00 0.00 C ATOM 560 O LEU A 41 4.140 -17.460 2.887 1.00 0.00 O ATOM 561 CB LEU A 41 2.085 -15.685 4.988 1.00 0.00 C ATOM 562 CG LEU A 41 1.706 -17.092 5.504 1.00 0.00 C ATOM 563 CD1 LEU A 41 2.899 -17.854 6.083 1.00 0.00 C ATOM 564 CD2 LEU A 41 0.661 -16.974 6.615 1.00 0.00 C ATOM 0 H LEU A 41 1.382 -14.110 3.296 1.00 0.00 H new ATOM 0 HA LEU A 41 3.868 -15.260 3.867 1.00 0.00 H new ATOM 0 HB2 LEU A 41 2.693 -15.205 5.755 1.00 0.00 H new ATOM 0 HB3 LEU A 41 1.165 -15.106 4.901 1.00 0.00 H new ATOM 0 HG LEU A 41 1.324 -17.639 4.642 1.00 0.00 H new ATOM 0 HD11 LEU A 41 2.571 -18.834 6.429 1.00 0.00 H new ATOM 0 HD12 LEU A 41 3.661 -17.977 5.313 1.00 0.00 H new ATOM 0 HD13 LEU A 41 3.316 -17.295 6.920 1.00 0.00 H new ATOM 0 HD21 LEU A 41 0.398 -17.969 6.974 1.00 0.00 H new ATOM 0 HD22 LEU A 41 1.069 -16.387 7.438 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -0.230 -16.482 6.226 1.00 0.00 H new ATOM 576 N ALA A 42 2.020 -17.358 2.150 1.00 0.00 N ATOM 577 CA ALA A 42 2.098 -18.550 1.303 1.00 0.00 C ATOM 578 C ALA A 42 2.719 -18.253 -0.078 1.00 0.00 C ATOM 579 O ALA A 42 3.452 -19.080 -0.619 1.00 0.00 O ATOM 580 CB ALA A 42 0.686 -19.134 1.170 1.00 0.00 C ATOM 0 H ALA A 42 1.103 -16.911 2.138 1.00 0.00 H new ATOM 0 HA ALA A 42 2.762 -19.277 1.771 1.00 0.00 H new ATOM 0 HB1 ALA A 42 0.718 -20.025 0.542 1.00 0.00 H new ATOM 0 HB2 ALA A 42 0.308 -19.399 2.157 1.00 0.00 H new ATOM 0 HB3 ALA A 42 0.027 -18.394 0.716 1.00 0.00 H new ATOM 586 N ASP A 43 2.484 -17.064 -0.640 1.00 0.00 N ATOM 587 CA ASP A 43 3.085 -16.619 -1.903 1.00 0.00 C ATOM 588 C ASP A 43 4.624 -16.493 -1.828 1.00 0.00 C ATOM 589 O ASP A 43 5.301 -16.686 -2.832 1.00 0.00 O ATOM 590 CB ASP A 43 2.440 -15.297 -2.354 1.00 0.00 C ATOM 591 CG ASP A 43 2.240 -15.266 -3.880 1.00 0.00 C ATOM 592 OD1 ASP A 43 3.173 -14.873 -4.615 1.00 0.00 O ATOM 593 OD2 ASP A 43 1.138 -15.652 -4.344 1.00 0.00 O ATOM 0 H ASP A 43 1.861 -16.372 -0.224 1.00 0.00 H new ATOM 0 HA ASP A 43 2.883 -17.389 -2.647 1.00 0.00 H new ATOM 0 HB2 ASP A 43 1.479 -15.170 -1.856 1.00 0.00 H new ATOM 0 HB3 ASP A 43 3.069 -14.460 -2.050 1.00 0.00 H new ATOM 598 N LEU A 44 5.181 -16.228 -0.639 1.00 0.00 N ATOM 599 CA LEU A 44 6.621 -16.143 -0.349 1.00 0.00 C ATOM 600 C LEU A 44 7.340 -17.506 -0.466 1.00 0.00 C ATOM 601 O LEU A 44 8.506 -17.553 -0.866 1.00 0.00 O ATOM 602 CB LEU A 44 6.776 -15.504 1.051 1.00 0.00 C ATOM 603 CG LEU A 44 8.149 -14.876 1.372 1.00 0.00 C ATOM 604 CD1 LEU A 44 7.971 -13.745 2.392 1.00 0.00 C ATOM 605 CD2 LEU A 44 9.148 -15.858 1.987 1.00 0.00 C ATOM 0 H LEU A 44 4.611 -16.058 0.190 1.00 0.00 H new ATOM 0 HA LEU A 44 7.110 -15.520 -1.098 1.00 0.00 H new ATOM 0 HB2 LEU A 44 6.014 -14.733 1.160 1.00 0.00 H new ATOM 0 HB3 LEU A 44 6.566 -16.268 1.800 1.00 0.00 H new ATOM 0 HG LEU A 44 8.541 -14.530 0.416 1.00 0.00 H new ATOM 0 HD11 LEU A 44 8.941 -13.303 2.618 1.00 0.00 H new ATOM 0 HD12 LEU A 44 7.312 -12.982 1.978 1.00 0.00 H new ATOM 0 HD13 LEU A 44 7.533 -14.145 3.306 1.00 0.00 H new ATOM 0 HD21 LEU A 44 10.089 -15.344 2.185 1.00 0.00 H new ATOM 0 HD22 LEU A 44 8.745 -16.250 2.921 1.00 0.00 H new ATOM 0 HD23 LEU A 44 9.323 -16.681 1.294 1.00 0.00 H new ATOM 617 N LEU A 45 6.652 -18.616 -0.163 1.00 0.00 N ATOM 618 CA LEU A 45 7.140 -19.984 -0.421 1.00 0.00 C ATOM 619 C LEU A 45 7.270 -20.256 -1.935 1.00 0.00 C ATOM 620 O LEU A 45 8.241 -20.864 -2.391 1.00 0.00 O ATOM 621 CB LEU A 45 6.152 -20.983 0.220 1.00 0.00 C ATOM 622 CG LEU A 45 6.524 -22.469 0.049 1.00 0.00 C ATOM 623 CD1 LEU A 45 7.713 -22.862 0.926 1.00 0.00 C ATOM 624 CD2 LEU A 45 5.332 -23.349 0.421 1.00 0.00 C ATOM 0 H LEU A 45 5.730 -18.592 0.273 1.00 0.00 H new ATOM 0 HA LEU A 45 8.132 -20.101 0.016 1.00 0.00 H new ATOM 0 HB2 LEU A 45 6.077 -20.763 1.285 1.00 0.00 H new ATOM 0 HB3 LEU A 45 5.164 -20.820 -0.210 1.00 0.00 H new ATOM 0 HG LEU A 45 6.799 -22.616 -0.996 1.00 0.00 H new ATOM 0 HD11 LEU A 45 7.943 -23.917 0.776 1.00 0.00 H new ATOM 0 HD12 LEU A 45 8.580 -22.259 0.655 1.00 0.00 H new ATOM 0 HD13 LEU A 45 7.465 -22.690 1.973 1.00 0.00 H new ATOM 0 HD21 LEU A 45 5.602 -24.398 0.298 1.00 0.00 H new ATOM 0 HD22 LEU A 45 5.054 -23.165 1.459 1.00 0.00 H new ATOM 0 HD23 LEU A 45 4.489 -23.113 -0.228 1.00 0.00 H new ATOM 636 N ILE A 46 6.270 -19.808 -2.696 1.00 0.00 N ATOM 637 CA ILE A 46 6.189 -19.881 -4.163 1.00 0.00 C ATOM 638 C ILE A 46 7.119 -18.802 -4.778 1.00 0.00 C ATOM 639 O ILE A 46 7.637 -17.929 -4.078 1.00 0.00 O ATOM 640 CB ILE A 46 4.693 -19.743 -4.582 1.00 0.00 C ATOM 641 CG1 ILE A 46 3.788 -20.784 -3.864 1.00 0.00 C ATOM 642 CG2 ILE A 46 4.493 -19.909 -6.103 1.00 0.00 C ATOM 643 CD1 ILE A 46 2.298 -20.409 -3.840 1.00 0.00 C ATOM 0 H ILE A 46 5.450 -19.360 -2.288 1.00 0.00 H new ATOM 0 HA ILE A 46 6.539 -20.840 -4.545 1.00 0.00 H new ATOM 0 HB ILE A 46 4.405 -18.735 -4.285 1.00 0.00 H new ATOM 0 HG12 ILE A 46 3.901 -21.749 -4.358 1.00 0.00 H new ATOM 0 HG13 ILE A 46 4.137 -20.907 -2.839 1.00 0.00 H new ATOM 0 HG21 ILE A 46 3.435 -19.805 -6.344 1.00 0.00 H new ATOM 0 HG22 ILE A 46 5.063 -19.144 -6.631 1.00 0.00 H new ATOM 0 HG23 ILE A 46 4.839 -20.896 -6.410 1.00 0.00 H new ATOM 0 HD11 ILE A 46 1.736 -21.186 -3.322 1.00 0.00 H new ATOM 0 HD12 ILE A 46 2.170 -19.460 -3.319 1.00 0.00 H new ATOM 0 HD13 ILE A 46 1.930 -20.315 -4.862 1.00 0.00 H new ATOM 654 N SER A 47 7.369 -18.842 -6.087 1.00 0.00 N ATOM 655 CA SER A 47 8.006 -17.732 -6.815 1.00 0.00 C ATOM 656 C SER A 47 7.117 -16.476 -6.796 1.00 0.00 C ATOM 657 O SER A 47 6.030 -16.483 -7.377 1.00 0.00 O ATOM 658 CB SER A 47 8.273 -18.133 -8.272 1.00 0.00 C ATOM 659 OG SER A 47 9.115 -19.276 -8.338 1.00 0.00 O ATOM 0 H SER A 47 7.138 -19.642 -6.677 1.00 0.00 H new ATOM 0 HA SER A 47 8.949 -17.508 -6.316 1.00 0.00 H new ATOM 0 HB2 SER A 47 7.329 -18.343 -8.774 1.00 0.00 H new ATOM 0 HB3 SER A 47 8.739 -17.302 -8.802 1.00 0.00 H new ATOM 0 HG SER A 47 9.270 -19.514 -9.276 1.00 0.00 H new ATOM 665 N GLU A 48 7.579 -15.373 -6.194 1.00 0.00 N ATOM 666 CA GLU A 48 6.879 -14.070 -6.209 1.00 0.00 C ATOM 667 C GLU A 48 6.875 -13.369 -7.591 1.00 0.00 C ATOM 668 O GLU A 48 6.513 -12.197 -7.685 1.00 0.00 O ATOM 669 CB GLU A 48 7.462 -13.104 -5.158 1.00 0.00 C ATOM 670 CG GLU A 48 7.490 -13.642 -3.722 1.00 0.00 C ATOM 671 CD GLU A 48 8.907 -14.084 -3.317 1.00 0.00 C ATOM 672 OE1 GLU A 48 9.493 -14.965 -3.990 1.00 0.00 O ATOM 673 OE2 GLU A 48 9.457 -13.483 -2.363 1.00 0.00 O ATOM 0 H GLU A 48 8.457 -15.354 -5.676 1.00 0.00 H new ATOM 0 HA GLU A 48 5.844 -14.311 -5.965 1.00 0.00 H new ATOM 0 HB2 GLU A 48 8.479 -12.844 -5.451 1.00 0.00 H new ATOM 0 HB3 GLU A 48 6.880 -12.182 -5.173 1.00 0.00 H new ATOM 0 HG2 GLU A 48 7.137 -12.872 -3.036 1.00 0.00 H new ATOM 0 HG3 GLU A 48 6.805 -14.485 -3.634 1.00 0.00 H new ATOM 680 N SER A 49 7.308 -14.035 -8.668 1.00 0.00 N ATOM 681 CA SER A 49 7.309 -13.508 -10.043 1.00 0.00 C ATOM 682 C SER A 49 8.119 -12.201 -10.185 1.00 0.00 C ATOM 683 O SER A 49 7.618 -11.164 -10.620 1.00 0.00 O ATOM 684 CB SER A 49 5.864 -13.414 -10.556 1.00 0.00 C ATOM 685 OG SER A 49 5.830 -13.450 -11.975 1.00 0.00 O ATOM 0 H SER A 49 7.679 -14.983 -8.608 1.00 0.00 H new ATOM 0 HA SER A 49 7.839 -14.207 -10.689 1.00 0.00 H new ATOM 0 HB2 SER A 49 5.276 -14.238 -10.153 1.00 0.00 H new ATOM 0 HB3 SER A 49 5.406 -12.491 -10.200 1.00 0.00 H new ATOM 0 HG SER A 49 4.901 -13.391 -12.282 1.00 0.00 H new ATOM 691 N SER A 50 9.389 -12.249 -9.757 1.00 0.00 N ATOM 692 CA SER A 50 10.339 -11.115 -9.733 1.00 0.00 C ATOM 693 C SER A 50 9.961 -9.994 -8.739 1.00 0.00 C ATOM 694 O SER A 50 10.287 -8.820 -8.932 1.00 0.00 O ATOM 695 CB SER A 50 10.598 -10.598 -11.160 1.00 0.00 C ATOM 696 OG SER A 50 11.894 -10.025 -11.267 1.00 0.00 O ATOM 0 H SER A 50 9.804 -13.111 -9.403 1.00 0.00 H new ATOM 0 HA SER A 50 11.280 -11.501 -9.341 1.00 0.00 H new ATOM 0 HB2 SER A 50 10.499 -11.418 -11.871 1.00 0.00 H new ATOM 0 HB3 SER A 50 9.845 -9.855 -11.424 1.00 0.00 H new ATOM 0 HG SER A 50 12.036 -9.705 -12.182 1.00 0.00 H new ATOM 702 N GLY A 51 9.258 -10.350 -7.657 1.00 0.00 N ATOM 703 CA GLY A 51 8.877 -9.423 -6.580 1.00 0.00 C ATOM 704 C GLY A 51 7.524 -8.731 -6.783 1.00 0.00 C ATOM 705 O GLY A 51 7.315 -7.627 -6.279 1.00 0.00 O ATOM 0 H GLY A 51 8.932 -11.304 -7.501 1.00 0.00 H new ATOM 0 HA2 GLY A 51 8.852 -9.971 -5.638 1.00 0.00 H new ATOM 0 HA3 GLY A 51 9.650 -8.660 -6.485 1.00 0.00 H new ATOM 709 N SER A 52 6.611 -9.390 -7.491 1.00 0.00 N ATOM 710 CA SER A 52 5.242 -8.962 -7.785 1.00 0.00 C ATOM 711 C SER A 52 4.275 -9.760 -6.909 1.00 0.00 C ATOM 712 O SER A 52 3.670 -10.734 -7.364 1.00 0.00 O ATOM 713 CB SER A 52 4.933 -9.175 -9.272 1.00 0.00 C ATOM 714 OG SER A 52 5.633 -8.233 -10.069 1.00 0.00 O ATOM 0 H SER A 52 6.820 -10.299 -7.904 1.00 0.00 H new ATOM 0 HA SER A 52 5.129 -7.900 -7.567 1.00 0.00 H new ATOM 0 HB2 SER A 52 5.213 -10.187 -9.566 1.00 0.00 H new ATOM 0 HB3 SER A 52 3.861 -9.079 -9.443 1.00 0.00 H new ATOM 0 HG SER A 52 5.425 -8.386 -11.014 1.00 0.00 H new ATOM 720 N SER A 53 4.172 -9.373 -5.632 1.00 0.00 N ATOM 721 CA SER A 53 3.346 -10.053 -4.622 1.00 0.00 C ATOM 722 C SER A 53 1.937 -10.349 -5.149 1.00 0.00 C ATOM 723 O SER A 53 1.510 -11.506 -5.097 1.00 0.00 O ATOM 724 CB SER A 53 3.261 -9.213 -3.341 1.00 0.00 C ATOM 725 OG SER A 53 2.783 -9.998 -2.264 1.00 0.00 O ATOM 0 H SER A 53 4.669 -8.563 -5.263 1.00 0.00 H new ATOM 0 HA SER A 53 3.827 -11.004 -4.395 1.00 0.00 H new ATOM 0 HB2 SER A 53 4.244 -8.811 -3.097 1.00 0.00 H new ATOM 0 HB3 SER A 53 2.599 -8.362 -3.500 1.00 0.00 H new ATOM 0 HG SER A 53 1.888 -9.691 -2.008 1.00 0.00 H new ATOM 731 N TYR A 54 1.278 -9.325 -5.726 1.00 0.00 N ATOM 732 CA TYR A 54 -0.121 -9.331 -6.199 1.00 0.00 C ATOM 733 C TYR A 54 -0.687 -7.915 -6.480 1.00 0.00 C ATOM 734 O TYR A 54 -1.572 -7.450 -5.761 1.00 0.00 O ATOM 735 CB TYR A 54 -1.033 -10.120 -5.227 1.00 0.00 C ATOM 736 CG TYR A 54 -0.828 -9.869 -3.729 1.00 0.00 C ATOM 737 CD1 TYR A 54 -0.365 -8.624 -3.234 1.00 0.00 C ATOM 738 CD2 TYR A 54 -1.085 -10.910 -2.814 1.00 0.00 C ATOM 739 CE1 TYR A 54 -0.162 -8.421 -1.865 1.00 0.00 C ATOM 740 CE2 TYR A 54 -0.867 -10.714 -1.438 1.00 0.00 C ATOM 741 CZ TYR A 54 -0.401 -9.470 -0.961 1.00 0.00 C ATOM 742 OH TYR A 54 -0.181 -9.254 0.358 1.00 0.00 O ATOM 0 H TYR A 54 1.730 -8.424 -5.883 1.00 0.00 H new ATOM 0 HA TYR A 54 -0.113 -9.843 -7.161 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -2.070 -9.889 -5.471 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -0.890 -11.184 -5.416 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -0.166 -7.819 -3.925 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -1.451 -11.862 -3.171 1.00 0.00 H new ATOM 0 HE1 TYR A 54 0.177 -7.461 -1.504 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -1.057 -11.519 -0.744 1.00 0.00 H new ATOM 0 HH TYR A 54 0.759 -9.016 0.498 1.00 0.00 H new ATOM 752 N GLN A 55 -0.224 -7.196 -7.513 1.00 0.00 N ATOM 753 CA GLN A 55 -0.789 -5.871 -7.863 1.00 0.00 C ATOM 754 C GLN A 55 -2.329 -5.860 -7.951 1.00 0.00 C ATOM 755 O GLN A 55 -2.963 -4.905 -7.497 1.00 0.00 O ATOM 756 CB GLN A 55 -0.188 -5.347 -9.177 1.00 0.00 C ATOM 757 CG GLN A 55 1.105 -4.549 -8.946 1.00 0.00 C ATOM 758 CD GLN A 55 1.728 -4.019 -10.241 1.00 0.00 C ATOM 759 OE1 GLN A 55 1.413 -4.427 -11.353 1.00 0.00 O ATOM 760 NE2 GLN A 55 2.639 -3.071 -10.154 1.00 0.00 N ATOM 0 H GLN A 55 0.535 -7.502 -8.121 1.00 0.00 H new ATOM 0 HA GLN A 55 -0.514 -5.208 -7.042 1.00 0.00 H new ATOM 0 HB2 GLN A 55 0.019 -6.187 -9.840 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -0.918 -4.714 -9.682 1.00 0.00 H new ATOM 0 HG2 GLN A 55 0.893 -3.710 -8.283 1.00 0.00 H new ATOM 0 HG3 GLN A 55 1.829 -5.184 -8.435 1.00 0.00 H new ATOM 0 HE21 GLN A 55 2.918 -2.714 -9.240 1.00 0.00 H new ATOM 0 HE22 GLN A 55 3.065 -2.694 -11.001 1.00 0.00 H new ATOM 769 N THR A 56 -2.940 -6.939 -8.457 1.00 0.00 N ATOM 770 CA THR A 56 -4.402 -7.110 -8.487 1.00 0.00 C ATOM 771 C THR A 56 -5.011 -7.190 -7.084 1.00 0.00 C ATOM 772 O THR A 56 -6.017 -6.533 -6.845 1.00 0.00 O ATOM 773 CB THR A 56 -4.818 -8.356 -9.288 1.00 0.00 C ATOM 774 OG1 THR A 56 -4.034 -8.479 -10.458 1.00 0.00 O ATOM 775 CG2 THR A 56 -6.283 -8.280 -9.731 1.00 0.00 C ATOM 0 H THR A 56 -2.431 -7.725 -8.861 1.00 0.00 H new ATOM 0 HA THR A 56 -4.790 -6.220 -8.983 1.00 0.00 H new ATOM 0 HB THR A 56 -4.673 -9.211 -8.628 1.00 0.00 H new ATOM 0 HG1 THR A 56 -4.310 -9.277 -10.955 1.00 0.00 H new ATOM 0 HG21 THR A 56 -6.540 -9.177 -10.294 1.00 0.00 H new ATOM 0 HG22 THR A 56 -6.925 -8.206 -8.853 1.00 0.00 H new ATOM 0 HG23 THR A 56 -6.427 -7.403 -10.361 1.00 0.00 H new ATOM 783 N GLN A 57 -4.411 -7.921 -6.136 1.00 0.00 N ATOM 784 CA GLN A 57 -4.869 -7.969 -4.737 1.00 0.00 C ATOM 785 C GLN A 57 -4.641 -6.629 -4.027 1.00 0.00 C ATOM 786 O GLN A 57 -5.540 -6.187 -3.325 1.00 0.00 O ATOM 787 CB GLN A 57 -4.131 -9.082 -3.976 1.00 0.00 C ATOM 788 CG GLN A 57 -4.531 -9.332 -2.509 1.00 0.00 C ATOM 789 CD GLN A 57 -5.437 -10.540 -2.286 1.00 0.00 C ATOM 790 OE1 GLN A 57 -5.124 -11.447 -1.525 1.00 0.00 O ATOM 791 NE2 GLN A 57 -6.589 -10.619 -2.914 1.00 0.00 N ATOM 0 H GLN A 57 -3.590 -8.499 -6.316 1.00 0.00 H new ATOM 0 HA GLN A 57 -5.939 -8.177 -4.746 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -4.270 -10.013 -4.525 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -3.065 -8.855 -3.999 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -3.625 -9.462 -1.918 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -5.035 -8.443 -2.129 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -6.873 -9.877 -3.553 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -7.199 -11.422 -2.762 1.00 0.00 H new ATOM 800 N ILE A 58 -3.495 -5.958 -4.204 1.00 0.00 N ATOM 801 CA ILE A 58 -3.255 -4.625 -3.624 1.00 0.00 C ATOM 802 C ILE A 58 -4.307 -3.628 -4.119 1.00 0.00 C ATOM 803 O ILE A 58 -4.946 -2.967 -3.304 1.00 0.00 O ATOM 804 CB ILE A 58 -1.807 -4.149 -3.900 1.00 0.00 C ATOM 805 CG1 ILE A 58 -0.809 -4.811 -2.922 1.00 0.00 C ATOM 806 CG2 ILE A 58 -1.639 -2.619 -3.863 1.00 0.00 C ATOM 807 CD1 ILE A 58 -0.849 -4.315 -1.465 1.00 0.00 C ATOM 0 H ILE A 58 -2.712 -6.319 -4.749 1.00 0.00 H new ATOM 0 HA ILE A 58 -3.358 -4.690 -2.541 1.00 0.00 H new ATOM 0 HB ILE A 58 -1.587 -4.465 -4.920 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -0.992 -5.886 -2.922 1.00 0.00 H new ATOM 0 HG13 ILE A 58 0.199 -4.659 -3.307 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -0.599 -2.362 -4.065 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -2.279 -2.164 -4.619 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -1.920 -2.246 -2.878 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -0.105 -4.853 -0.877 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -0.630 -3.247 -1.438 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -1.840 -4.493 -1.047 1.00 0.00 H new ATOM 818 N SER A 59 -4.542 -3.551 -5.431 1.00 0.00 N ATOM 819 CA SER A 59 -5.555 -2.654 -6.000 1.00 0.00 C ATOM 820 C SER A 59 -6.985 -3.060 -5.610 1.00 0.00 C ATOM 821 O SER A 59 -7.781 -2.201 -5.228 1.00 0.00 O ATOM 822 CB SER A 59 -5.397 -2.597 -7.521 1.00 0.00 C ATOM 823 OG SER A 59 -6.186 -1.547 -8.058 1.00 0.00 O ATOM 0 H SER A 59 -4.040 -4.104 -6.126 1.00 0.00 H new ATOM 0 HA SER A 59 -5.392 -1.661 -5.582 1.00 0.00 H new ATOM 0 HB2 SER A 59 -4.349 -2.443 -7.779 1.00 0.00 H new ATOM 0 HB3 SER A 59 -5.697 -3.548 -7.961 1.00 0.00 H new ATOM 0 HG SER A 59 -6.075 -1.520 -9.031 1.00 0.00 H new ATOM 829 N ALA A 60 -7.308 -4.361 -5.616 1.00 0.00 N ATOM 830 CA ALA A 60 -8.612 -4.876 -5.202 1.00 0.00 C ATOM 831 C ALA A 60 -8.887 -4.612 -3.719 1.00 0.00 C ATOM 832 O ALA A 60 -9.906 -4.013 -3.408 1.00 0.00 O ATOM 833 CB ALA A 60 -8.726 -6.374 -5.508 1.00 0.00 C ATOM 0 H ALA A 60 -6.660 -5.091 -5.913 1.00 0.00 H new ATOM 0 HA ALA A 60 -9.367 -4.340 -5.777 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -9.704 -6.737 -5.192 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -8.608 -6.537 -6.579 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -7.947 -6.915 -4.971 1.00 0.00 H new ATOM 839 N LEU A 61 -7.989 -4.997 -2.804 1.00 0.00 N ATOM 840 CA LEU A 61 -8.153 -4.739 -1.372 1.00 0.00 C ATOM 841 C LEU A 61 -8.195 -3.231 -1.099 1.00 0.00 C ATOM 842 O LEU A 61 -9.105 -2.810 -0.395 1.00 0.00 O ATOM 843 CB LEU A 61 -7.107 -5.480 -0.515 1.00 0.00 C ATOM 844 CG LEU A 61 -7.454 -6.945 -0.154 1.00 0.00 C ATOM 845 CD1 LEU A 61 -8.556 -7.020 0.906 1.00 0.00 C ATOM 846 CD2 LEU A 61 -7.911 -7.807 -1.332 1.00 0.00 C ATOM 0 H LEU A 61 -7.130 -5.495 -3.037 1.00 0.00 H new ATOM 0 HA LEU A 61 -9.114 -5.151 -1.064 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -6.156 -5.471 -1.047 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -6.960 -4.922 0.410 1.00 0.00 H new ATOM 0 HG LEU A 61 -6.509 -7.342 0.216 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -8.772 -8.064 1.133 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -8.225 -6.513 1.812 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -9.457 -6.537 0.529 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -8.131 -8.815 -0.981 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -8.808 -7.373 -1.774 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -7.120 -7.848 -2.081 1.00 0.00 H new ATOM 858 N THR A 62 -7.331 -2.413 -1.724 1.00 0.00 N ATOM 859 CA THR A 62 -7.403 -0.934 -1.672 1.00 0.00 C ATOM 860 C THR A 62 -8.777 -0.397 -2.093 1.00 0.00 C ATOM 861 O THR A 62 -9.349 0.431 -1.384 1.00 0.00 O ATOM 862 CB THR A 62 -6.301 -0.260 -2.510 1.00 0.00 C ATOM 863 OG1 THR A 62 -5.037 -0.511 -1.944 1.00 0.00 O ATOM 864 CG2 THR A 62 -6.434 1.264 -2.560 1.00 0.00 C ATOM 0 H THR A 62 -6.553 -2.759 -2.286 1.00 0.00 H new ATOM 0 HA THR A 62 -7.242 -0.676 -0.625 1.00 0.00 H new ATOM 0 HB THR A 62 -6.406 -0.676 -3.512 1.00 0.00 H new ATOM 0 HG1 THR A 62 -4.706 -1.379 -2.255 1.00 0.00 H new ATOM 0 HG21 THR A 62 -5.629 1.680 -3.165 1.00 0.00 H new ATOM 0 HG22 THR A 62 -7.394 1.531 -3.001 1.00 0.00 H new ATOM 0 HG23 THR A 62 -6.374 1.668 -1.549 1.00 0.00 H new ATOM 872 N ASN A 63 -9.345 -0.883 -3.202 1.00 0.00 N ATOM 873 CA ASN A 63 -10.706 -0.534 -3.622 1.00 0.00 C ATOM 874 C ASN A 63 -11.770 -1.051 -2.634 1.00 0.00 C ATOM 875 O ASN A 63 -12.741 -0.356 -2.355 1.00 0.00 O ATOM 876 CB ASN A 63 -10.959 -1.093 -5.032 1.00 0.00 C ATOM 877 CG ASN A 63 -12.346 -0.722 -5.537 1.00 0.00 C ATOM 878 OD1 ASN A 63 -12.727 0.437 -5.594 1.00 0.00 O ATOM 879 ND2 ASN A 63 -13.155 -1.697 -5.889 1.00 0.00 N ATOM 0 H ASN A 63 -8.873 -1.530 -3.834 1.00 0.00 H new ATOM 0 HA ASN A 63 -10.791 0.553 -3.634 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -10.205 -0.707 -5.718 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -10.853 -2.178 -5.019 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -14.100 -1.485 -6.209 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -12.838 -2.665 -5.842 1.00 0.00 H new ATOM 886 N ILE A 64 -11.586 -2.253 -2.081 1.00 0.00 N ATOM 887 CA ILE A 64 -12.449 -2.853 -1.056 1.00 0.00 C ATOM 888 C ILE A 64 -12.473 -2.024 0.237 1.00 0.00 C ATOM 889 O ILE A 64 -13.507 -1.998 0.895 1.00 0.00 O ATOM 890 CB ILE A 64 -12.094 -4.348 -0.844 1.00 0.00 C ATOM 891 CG1 ILE A 64 -12.990 -5.307 -1.661 1.00 0.00 C ATOM 892 CG2 ILE A 64 -12.137 -4.823 0.622 1.00 0.00 C ATOM 893 CD1 ILE A 64 -13.164 -4.986 -3.151 1.00 0.00 C ATOM 0 H ILE A 64 -10.806 -2.857 -2.342 1.00 0.00 H new ATOM 0 HA ILE A 64 -13.478 -2.833 -1.416 1.00 0.00 H new ATOM 0 HB ILE A 64 -11.063 -4.392 -1.196 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -12.579 -6.313 -1.575 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -13.977 -5.326 -1.200 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -11.875 -5.880 0.670 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -11.426 -4.245 1.213 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -13.141 -4.680 1.022 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -13.813 -5.731 -3.610 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -13.611 -3.998 -3.261 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -12.191 -5.000 -3.642 1.00 0.00 H new ATOM 904 N LEU A 65 -11.409 -1.290 0.591 1.00 0.00 N ATOM 905 CA LEU A 65 -11.431 -0.388 1.757 1.00 0.00 C ATOM 906 C LEU A 65 -12.508 0.696 1.599 1.00 0.00 C ATOM 907 O LEU A 65 -13.235 1.034 2.535 1.00 0.00 O ATOM 908 CB LEU A 65 -10.065 0.285 1.996 1.00 0.00 C ATOM 909 CG LEU A 65 -8.823 -0.596 1.818 1.00 0.00 C ATOM 910 CD1 LEU A 65 -7.578 0.183 2.197 1.00 0.00 C ATOM 911 CD2 LEU A 65 -8.808 -1.907 2.593 1.00 0.00 C ATOM 0 H LEU A 65 -10.521 -1.301 0.089 1.00 0.00 H new ATOM 0 HA LEU A 65 -11.665 -1.009 2.622 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -9.980 1.134 1.317 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -10.056 0.686 3.010 1.00 0.00 H new ATOM 0 HG LEU A 65 -8.848 -0.870 0.763 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -6.700 -0.449 2.068 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -7.490 1.061 1.558 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -7.649 0.498 3.238 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -7.881 -2.441 2.386 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -8.877 -1.699 3.661 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -9.656 -2.520 2.287 1.00 0.00 H new ATOM 923 N SER A 66 -12.625 1.201 0.377 1.00 0.00 N ATOM 924 CA SER A 66 -13.639 2.145 -0.083 1.00 0.00 C ATOM 925 C SER A 66 -15.012 1.466 -0.230 1.00 0.00 C ATOM 926 O SER A 66 -16.015 1.965 0.281 1.00 0.00 O ATOM 927 CB SER A 66 -13.172 2.757 -1.416 1.00 0.00 C ATOM 928 OG SER A 66 -11.776 2.605 -1.629 1.00 0.00 O ATOM 0 H SER A 66 -11.974 0.947 -0.366 1.00 0.00 H new ATOM 0 HA SER A 66 -13.760 2.936 0.657 1.00 0.00 H new ATOM 0 HB2 SER A 66 -13.714 2.287 -2.237 1.00 0.00 H new ATOM 0 HB3 SER A 66 -13.425 3.817 -1.433 1.00 0.00 H new ATOM 0 HG SER A 66 -11.331 3.470 -1.508 1.00 0.00 H new ATOM 934 N ASP A 67 -15.048 0.291 -0.862 1.00 0.00 N ATOM 935 CA ASP A 67 -16.245 -0.538 -1.089 1.00 0.00 C ATOM 936 C ASP A 67 -16.876 -1.113 0.198 1.00 0.00 C ATOM 937 O ASP A 67 -18.012 -1.585 0.179 1.00 0.00 O ATOM 938 CB ASP A 67 -15.895 -1.692 -2.043 1.00 0.00 C ATOM 939 CG ASP A 67 -17.120 -2.232 -2.795 1.00 0.00 C ATOM 940 OD1 ASP A 67 -17.689 -1.476 -3.612 1.00 0.00 O ATOM 941 OD2 ASP A 67 -17.482 -3.420 -2.617 1.00 0.00 O ATOM 0 H ASP A 67 -14.205 -0.133 -1.250 1.00 0.00 H new ATOM 0 HA ASP A 67 -16.993 0.126 -1.524 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -15.153 -1.349 -2.764 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -15.437 -2.501 -1.475 1.00 0.00 H new ATOM 946 N CYS A 68 -16.156 -1.080 1.321 1.00 0.00 N ATOM 947 CA CYS A 68 -16.654 -1.505 2.631 1.00 0.00 C ATOM 948 C CYS A 68 -17.636 -0.490 3.251 1.00 0.00 C ATOM 949 O CYS A 68 -18.538 -0.889 3.991 1.00 0.00 O ATOM 950 CB CYS A 68 -15.446 -1.719 3.550 1.00 0.00 C ATOM 951 SG CYS A 68 -15.893 -2.763 4.969 1.00 0.00 S ATOM 0 H CYS A 68 -15.191 -0.750 1.346 1.00 0.00 H new ATOM 0 HA CYS A 68 -17.216 -2.431 2.509 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -14.635 -2.186 2.990 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -15.077 -0.756 3.903 1.00 0.00 H new ATOM 0 HG CYS A 68 -14.852 -2.930 5.730 1.00 0.00 H new ATOM 957 N PHE A 69 -17.493 0.807 2.930 1.00 0.00 N ATOM 958 CA PHE A 69 -18.335 1.879 3.491 1.00 0.00 C ATOM 959 C PHE A 69 -19.230 2.554 2.433 1.00 0.00 C ATOM 960 O PHE A 69 -20.387 2.848 2.728 1.00 0.00 O ATOM 961 CB PHE A 69 -17.457 2.906 4.233 1.00 0.00 C ATOM 962 CG PHE A 69 -18.058 3.661 5.421 1.00 0.00 C ATOM 963 CD1 PHE A 69 -19.384 3.470 5.868 1.00 0.00 C ATOM 964 CD2 PHE A 69 -17.245 4.589 6.103 1.00 0.00 C ATOM 965 CE1 PHE A 69 -19.877 4.190 6.973 1.00 0.00 C ATOM 966 CE2 PHE A 69 -17.735 5.307 7.207 1.00 0.00 C ATOM 967 CZ PHE A 69 -19.053 5.106 7.646 1.00 0.00 C ATOM 0 H PHE A 69 -16.789 1.143 2.273 1.00 0.00 H new ATOM 0 HA PHE A 69 -19.018 1.419 4.205 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -16.567 2.386 4.587 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -17.125 3.646 3.504 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -20.025 2.766 5.358 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -16.230 4.751 5.772 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -20.893 4.037 7.304 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -17.098 6.014 7.718 1.00 0.00 H new ATOM 0 HZ PHE A 69 -19.431 5.653 8.497 1.00 0.00 H new ATOM 977 N VAL A 70 -18.741 2.730 1.194 1.00 0.00 N ATOM 978 CA VAL A 70 -19.503 3.282 0.048 1.00 0.00 C ATOM 979 C VAL A 70 -20.139 4.651 0.379 1.00 0.00 C ATOM 980 O VAL A 70 -21.353 4.850 0.304 1.00 0.00 O ATOM 981 CB VAL A 70 -20.491 2.236 -0.531 1.00 0.00 C ATOM 982 CG1 VAL A 70 -21.111 2.666 -1.870 1.00 0.00 C ATOM 983 CG2 VAL A 70 -19.771 0.907 -0.802 1.00 0.00 C ATOM 0 H VAL A 70 -17.781 2.488 0.950 1.00 0.00 H new ATOM 0 HA VAL A 70 -18.801 3.493 -0.758 1.00 0.00 H new ATOM 0 HB VAL A 70 -21.274 2.137 0.221 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -21.792 1.891 -2.221 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -21.660 3.598 -1.734 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -20.321 2.815 -2.606 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -20.480 0.185 -1.208 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -18.967 1.069 -1.520 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -19.355 0.522 0.129 1.00 0.00 H new ATOM 993 N THR A 71 -19.297 5.601 0.800 1.00 0.00 N ATOM 994 CA THR A 71 -19.700 6.907 1.367 1.00 0.00 C ATOM 995 C THR A 71 -19.335 8.080 0.442 1.00 0.00 C ATOM 996 O THR A 71 -20.154 8.519 -0.366 1.00 0.00 O ATOM 997 CB THR A 71 -19.064 7.092 2.760 1.00 0.00 C ATOM 998 OG1 THR A 71 -17.695 6.728 2.712 1.00 0.00 O ATOM 999 CG2 THR A 71 -19.753 6.219 3.800 1.00 0.00 C ATOM 0 H THR A 71 -18.284 5.486 0.757 1.00 0.00 H new ATOM 0 HA THR A 71 -20.786 6.907 1.463 1.00 0.00 H new ATOM 0 HB THR A 71 -19.175 8.140 3.040 1.00 0.00 H new ATOM 0 HG1 THR A 71 -17.248 7.027 3.531 1.00 0.00 H new ATOM 0 HG21 THR A 71 -19.283 6.371 4.772 1.00 0.00 H new ATOM 0 HG22 THR A 71 -20.807 6.489 3.861 1.00 0.00 H new ATOM 0 HG23 THR A 71 -19.663 5.171 3.513 1.00 0.00 H new ATOM 1007 N THR A 72 -18.085 8.545 0.508 1.00 0.00 N ATOM 1008 CA THR A 72 -17.514 9.683 -0.252 1.00 0.00 C ATOM 1009 C THR A 72 -16.555 9.156 -1.344 1.00 0.00 C ATOM 1010 O THR A 72 -15.641 9.832 -1.809 1.00 0.00 O ATOM 1011 CB THR A 72 -16.859 10.655 0.751 1.00 0.00 C ATOM 1012 OG1 THR A 72 -17.819 11.040 1.718 1.00 0.00 O ATOM 1013 CG2 THR A 72 -16.298 11.968 0.190 1.00 0.00 C ATOM 0 H THR A 72 -17.396 8.119 1.127 1.00 0.00 H new ATOM 0 HA THR A 72 -18.284 10.241 -0.785 1.00 0.00 H new ATOM 0 HB THR A 72 -16.013 10.084 1.133 1.00 0.00 H new ATOM 0 HG1 THR A 72 -17.408 11.657 2.359 1.00 0.00 H new ATOM 0 HG21 THR A 72 -15.867 12.556 1.001 1.00 0.00 H new ATOM 0 HG22 THR A 72 -15.527 11.748 -0.548 1.00 0.00 H new ATOM 0 HG23 THR A 72 -17.101 12.534 -0.282 1.00 0.00 H new ATOM 1021 N THR A 73 -16.769 7.905 -1.755 1.00 0.00 N ATOM 1022 CA THR A 73 -15.946 7.111 -2.684 1.00 0.00 C ATOM 1023 C THR A 73 -16.790 6.641 -3.879 1.00 0.00 C ATOM 1024 O THR A 73 -18.009 6.478 -3.772 1.00 0.00 O ATOM 1025 CB THR A 73 -15.276 5.923 -1.953 1.00 0.00 C ATOM 1026 OG1 THR A 73 -15.033 4.859 -2.845 1.00 0.00 O ATOM 1027 CG2 THR A 73 -16.092 5.307 -0.812 1.00 0.00 C ATOM 0 H THR A 73 -17.578 7.378 -1.427 1.00 0.00 H new ATOM 0 HA THR A 73 -15.147 7.744 -3.069 1.00 0.00 H new ATOM 0 HB THR A 73 -14.370 6.368 -1.541 1.00 0.00 H new ATOM 0 HG1 THR A 73 -15.377 4.025 -2.461 1.00 0.00 H new ATOM 0 HG21 THR A 73 -15.533 4.484 -0.368 1.00 0.00 H new ATOM 0 HG22 THR A 73 -16.286 6.065 -0.053 1.00 0.00 H new ATOM 0 HG23 THR A 73 -17.039 4.933 -1.202 1.00 0.00 H new ATOM 1035 N GLY A 74 -16.127 6.392 -5.014 1.00 0.00 N ATOM 1036 CA GLY A 74 -16.729 5.888 -6.254 1.00 0.00 C ATOM 1037 C GLY A 74 -17.003 4.374 -6.286 1.00 0.00 C ATOM 1038 O GLY A 74 -17.533 3.899 -7.289 1.00 0.00 O ATOM 0 H GLY A 74 -15.121 6.541 -5.097 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -17.669 6.414 -6.422 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -16.071 6.139 -7.086 1.00 0.00 H new ATOM 1042 N SER A 75 -16.642 3.629 -5.227 1.00 0.00 N ATOM 1043 CA SER A 75 -16.920 2.187 -5.005 1.00 0.00 C ATOM 1044 C SER A 75 -16.641 1.241 -6.200 1.00 0.00 C ATOM 1045 O SER A 75 -17.307 0.222 -6.404 1.00 0.00 O ATOM 1046 CB SER A 75 -18.320 1.997 -4.397 1.00 0.00 C ATOM 1047 OG SER A 75 -19.369 2.371 -5.277 1.00 0.00 O ATOM 0 H SER A 75 -16.117 4.035 -4.453 1.00 0.00 H new ATOM 0 HA SER A 75 -16.173 1.861 -4.282 1.00 0.00 H new ATOM 0 HB2 SER A 75 -18.447 0.952 -4.114 1.00 0.00 H new ATOM 0 HB3 SER A 75 -18.395 2.586 -3.483 1.00 0.00 H new ATOM 0 HG SER A 75 -20.233 2.227 -4.837 1.00 0.00 H new ATOM 1053 N ASN A 76 -15.634 1.584 -7.007 1.00 0.00 N ATOM 1054 CA ASN A 76 -15.154 0.796 -8.150 1.00 0.00 C ATOM 1055 C ASN A 76 -13.747 1.250 -8.579 1.00 0.00 C ATOM 1056 O ASN A 76 -12.847 0.436 -8.794 1.00 0.00 O ATOM 1057 CB ASN A 76 -16.141 0.970 -9.323 1.00 0.00 C ATOM 1058 CG ASN A 76 -15.856 -0.015 -10.443 1.00 0.00 C ATOM 1059 OD1 ASN A 76 -15.116 0.260 -11.378 1.00 0.00 O ATOM 1060 ND2 ASN A 76 -16.426 -1.197 -10.372 1.00 0.00 N ATOM 0 H ASN A 76 -15.110 2.450 -6.879 1.00 0.00 H new ATOM 0 HA ASN A 76 -15.096 -0.253 -7.860 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -17.161 0.830 -8.965 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -16.075 1.988 -9.707 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -16.253 -1.891 -11.099 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -17.042 -1.420 -9.590 1.00 0.00 H new ATOM 1067 N ASN A 77 -13.580 2.571 -8.674 1.00 0.00 N ATOM 1068 CA ASN A 77 -12.334 3.265 -8.984 1.00 0.00 C ATOM 1069 C ASN A 77 -12.395 4.688 -8.374 1.00 0.00 C ATOM 1070 O ASN A 77 -12.658 5.661 -9.089 1.00 0.00 O ATOM 1071 CB ASN A 77 -12.122 3.241 -10.512 1.00 0.00 C ATOM 1072 CG ASN A 77 -10.741 3.721 -10.941 1.00 0.00 C ATOM 1073 OD1 ASN A 77 -10.117 4.576 -10.333 1.00 0.00 O ATOM 1074 ND2 ASN A 77 -10.198 3.157 -12.000 1.00 0.00 N ATOM 0 H ASN A 77 -14.355 3.218 -8.528 1.00 0.00 H new ATOM 0 HA ASN A 77 -11.466 2.774 -8.543 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -12.274 2.225 -10.876 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -12.879 3.866 -10.986 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -9.265 3.436 -12.304 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -10.710 2.441 -12.516 1.00 0.00 H new ATOM 1081 N PRO A 78 -12.266 4.823 -7.036 1.00 0.00 N ATOM 1082 CA PRO A 78 -12.171 6.129 -6.388 1.00 0.00 C ATOM 1083 C PRO A 78 -10.851 6.823 -6.750 1.00 0.00 C ATOM 1084 O PRO A 78 -9.966 6.231 -7.379 1.00 0.00 O ATOM 1085 CB PRO A 78 -12.282 5.851 -4.884 1.00 0.00 C ATOM 1086 CG PRO A 78 -11.781 4.420 -4.722 1.00 0.00 C ATOM 1087 CD PRO A 78 -12.072 3.753 -6.066 1.00 0.00 C ATOM 0 HA PRO A 78 -12.958 6.808 -6.716 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -11.679 6.551 -4.306 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -13.310 5.953 -4.536 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -10.716 4.397 -4.491 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -12.295 3.910 -3.907 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -11.246 3.107 -6.364 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -12.960 3.125 -6.001 1.00 0.00 H new ATOM 1095 N ALA A 79 -10.669 8.053 -6.257 1.00 0.00 N ATOM 1096 CA ALA A 79 -9.387 8.751 -6.317 1.00 0.00 C ATOM 1097 C ALA A 79 -8.214 7.891 -5.811 1.00 0.00 C ATOM 1098 O ALA A 79 -7.096 8.086 -6.265 1.00 0.00 O ATOM 1099 CB ALA A 79 -9.490 10.060 -5.523 1.00 0.00 C ATOM 0 H ALA A 79 -11.409 8.590 -5.805 1.00 0.00 H new ATOM 0 HA ALA A 79 -9.171 8.967 -7.363 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -8.536 10.586 -5.564 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -10.269 10.687 -5.955 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -9.738 9.837 -4.485 1.00 0.00 H new ATOM 1105 N PHE A 80 -8.452 6.921 -4.920 1.00 0.00 N ATOM 1106 CA PHE A 80 -7.413 6.080 -4.324 1.00 0.00 C ATOM 1107 C PHE A 80 -6.899 5.021 -5.314 1.00 0.00 C ATOM 1108 O PHE A 80 -5.695 4.807 -5.371 1.00 0.00 O ATOM 1109 CB PHE A 80 -7.907 5.416 -3.018 1.00 0.00 C ATOM 1110 CG PHE A 80 -9.023 6.106 -2.235 1.00 0.00 C ATOM 1111 CD1 PHE A 80 -9.180 7.510 -2.205 1.00 0.00 C ATOM 1112 CD2 PHE A 80 -9.965 5.305 -1.572 1.00 0.00 C ATOM 1113 CE1 PHE A 80 -10.330 8.084 -1.642 1.00 0.00 C ATOM 1114 CE2 PHE A 80 -11.100 5.879 -0.973 1.00 0.00 C ATOM 1115 CZ PHE A 80 -11.304 7.265 -1.048 1.00 0.00 C ATOM 0 H PHE A 80 -9.390 6.696 -4.589 1.00 0.00 H new ATOM 0 HA PHE A 80 -6.577 6.734 -4.076 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -8.246 4.409 -3.264 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -7.050 5.311 -2.353 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -8.410 8.145 -2.618 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -9.817 4.236 -1.521 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -10.466 9.155 -1.665 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -11.813 5.254 -0.456 1.00 0.00 H new ATOM 0 HZ PHE A 80 -12.208 7.701 -0.650 1.00 0.00 H new ATOM 1125 N VAL A 81 -7.762 4.408 -6.140 1.00 0.00 N ATOM 1126 CA VAL A 81 -7.331 3.502 -7.227 1.00 0.00 C ATOM 1127 C VAL A 81 -6.634 4.283 -8.342 1.00 0.00 C ATOM 1128 O VAL A 81 -5.535 3.904 -8.746 1.00 0.00 O ATOM 1129 CB VAL A 81 -8.513 2.681 -7.787 1.00 0.00 C ATOM 1130 CG1 VAL A 81 -8.238 2.018 -9.148 1.00 0.00 C ATOM 1131 CG2 VAL A 81 -8.866 1.546 -6.819 1.00 0.00 C ATOM 0 H VAL A 81 -8.774 4.523 -6.077 1.00 0.00 H new ATOM 0 HA VAL A 81 -6.616 2.798 -6.802 1.00 0.00 H new ATOM 0 HB VAL A 81 -9.320 3.404 -7.911 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -9.120 1.462 -9.467 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -8.006 2.786 -9.886 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -7.393 1.336 -9.056 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -9.701 0.971 -7.221 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -8.002 0.893 -6.694 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -9.146 1.966 -5.853 1.00 0.00 H new ATOM 1141 N SER A 82 -7.211 5.400 -8.797 1.00 0.00 N ATOM 1142 CA SER A 82 -6.570 6.253 -9.811 1.00 0.00 C ATOM 1143 C SER A 82 -5.228 6.823 -9.330 1.00 0.00 C ATOM 1144 O SER A 82 -4.248 6.812 -10.080 1.00 0.00 O ATOM 1145 CB SER A 82 -7.509 7.385 -10.253 1.00 0.00 C ATOM 1146 OG SER A 82 -8.060 7.083 -11.526 1.00 0.00 O ATOM 0 H SER A 82 -8.120 5.737 -8.481 1.00 0.00 H new ATOM 0 HA SER A 82 -6.362 5.616 -10.671 1.00 0.00 H new ATOM 0 HB2 SER A 82 -8.307 7.514 -9.522 1.00 0.00 H new ATOM 0 HB3 SER A 82 -6.962 8.327 -10.297 1.00 0.00 H new ATOM 0 HG SER A 82 -8.660 7.807 -11.803 1.00 0.00 H new ATOM 1152 N ARG A 83 -5.145 7.240 -8.057 1.00 0.00 N ATOM 1153 CA ARG A 83 -3.883 7.572 -7.382 1.00 0.00 C ATOM 1154 C ARG A 83 -2.965 6.362 -7.328 1.00 0.00 C ATOM 1155 O ARG A 83 -1.809 6.541 -7.658 1.00 0.00 O ATOM 1156 CB ARG A 83 -4.134 8.172 -5.984 1.00 0.00 C ATOM 1157 CG ARG A 83 -2.851 8.511 -5.205 1.00 0.00 C ATOM 1158 CD ARG A 83 -3.178 9.177 -3.863 1.00 0.00 C ATOM 1159 NE ARG A 83 -1.971 9.335 -3.023 1.00 0.00 N ATOM 1160 CZ ARG A 83 -1.934 9.678 -1.745 1.00 0.00 C ATOM 1161 NH1 ARG A 83 -3.010 9.959 -1.069 1.00 0.00 N ATOM 1162 NH2 ARG A 83 -0.797 9.768 -1.119 1.00 0.00 N ATOM 0 H ARG A 83 -5.964 7.357 -7.461 1.00 0.00 H new ATOM 0 HA ARG A 83 -3.377 8.339 -7.967 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -4.731 9.078 -6.091 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -4.726 7.468 -5.399 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -2.276 7.601 -5.032 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -2.225 9.175 -5.801 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -3.628 10.154 -4.041 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -3.917 8.578 -3.330 1.00 0.00 H new ATOM 0 HE ARG A 83 -1.074 9.162 -3.476 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -3.923 9.919 -1.523 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -2.941 10.219 -0.085 1.00 0.00 H new ATOM 0 HH21 ARG A 83 0.074 9.574 -1.613 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -0.777 10.033 -0.134 1.00 0.00 H new ATOM 1176 N VAL A 84 -3.427 5.153 -6.989 1.00 0.00 N ATOM 1177 CA VAL A 84 -2.584 3.942 -6.949 1.00 0.00 C ATOM 1178 C VAL A 84 -1.789 3.716 -8.234 1.00 0.00 C ATOM 1179 O VAL A 84 -0.634 3.341 -8.121 1.00 0.00 O ATOM 1180 CB VAL A 84 -3.343 2.682 -6.460 1.00 0.00 C ATOM 1181 CG1 VAL A 84 -2.746 1.333 -6.887 1.00 0.00 C ATOM 1182 CG2 VAL A 84 -3.354 2.636 -4.927 1.00 0.00 C ATOM 0 H VAL A 84 -4.399 4.981 -6.733 1.00 0.00 H new ATOM 0 HA VAL A 84 -1.834 4.137 -6.182 1.00 0.00 H new ATOM 0 HB VAL A 84 -4.326 2.790 -6.918 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -3.357 0.523 -6.490 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -2.726 1.272 -7.975 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -1.731 1.245 -6.500 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -3.890 1.747 -4.593 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -2.329 2.603 -4.557 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -3.851 3.526 -4.540 1.00 0.00 H new ATOM 1192 N GLN A 85 -2.288 4.020 -9.438 1.00 0.00 N ATOM 1193 CA GLN A 85 -1.452 3.919 -10.649 1.00 0.00 C ATOM 1194 C GLN A 85 -0.251 4.893 -10.637 1.00 0.00 C ATOM 1195 O GLN A 85 0.880 4.479 -10.904 1.00 0.00 O ATOM 1196 CB GLN A 85 -2.297 4.105 -11.923 1.00 0.00 C ATOM 1197 CG GLN A 85 -3.061 2.839 -12.348 1.00 0.00 C ATOM 1198 CD GLN A 85 -4.279 2.532 -11.477 1.00 0.00 C ATOM 1199 OE1 GLN A 85 -5.380 3.018 -11.705 1.00 0.00 O ATOM 1200 NE2 GLN A 85 -4.143 1.706 -10.460 1.00 0.00 N ATOM 0 H GLN A 85 -3.245 4.332 -9.603 1.00 0.00 H new ATOM 0 HA GLN A 85 -1.035 2.912 -10.651 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -3.011 4.912 -11.760 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -1.645 4.416 -12.739 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -3.385 2.952 -13.383 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -2.381 1.988 -12.318 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -3.233 1.293 -10.257 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -4.948 1.480 -9.876 1.00 0.00 H new ATOM 1209 N THR A 86 -0.460 6.164 -10.279 1.00 0.00 N ATOM 1210 CA THR A 86 0.612 7.178 -10.181 1.00 0.00 C ATOM 1211 C THR A 86 1.490 6.965 -8.948 1.00 0.00 C ATOM 1212 O THR A 86 2.715 7.004 -9.040 1.00 0.00 O ATOM 1213 CB THR A 86 0.020 8.598 -10.149 1.00 0.00 C ATOM 1214 OG1 THR A 86 -0.714 8.820 -11.337 1.00 0.00 O ATOM 1215 CG2 THR A 86 1.085 9.696 -10.064 1.00 0.00 C ATOM 0 H THR A 86 -1.384 6.528 -10.046 1.00 0.00 H new ATOM 0 HA THR A 86 1.236 7.064 -11.068 1.00 0.00 H new ATOM 0 HB THR A 86 -0.602 8.652 -9.256 1.00 0.00 H new ATOM 0 HG1 THR A 86 -1.095 9.723 -11.322 1.00 0.00 H new ATOM 0 HG21 THR A 86 0.600 10.672 -10.045 1.00 0.00 H new ATOM 0 HG22 THR A 86 1.672 9.564 -9.155 1.00 0.00 H new ATOM 0 HG23 THR A 86 1.742 9.634 -10.932 1.00 0.00 H new ATOM 1223 N LEU A 87 0.887 6.700 -7.788 1.00 0.00 N ATOM 1224 CA LEU A 87 1.583 6.404 -6.544 1.00 0.00 C ATOM 1225 C LEU A 87 2.441 5.160 -6.711 1.00 0.00 C ATOM 1226 O LEU A 87 3.600 5.252 -6.360 1.00 0.00 O ATOM 1227 CB LEU A 87 0.621 6.378 -5.334 1.00 0.00 C ATOM 1228 CG LEU A 87 0.311 5.012 -4.676 1.00 0.00 C ATOM 1229 CD1 LEU A 87 1.456 4.487 -3.796 1.00 0.00 C ATOM 1230 CD2 LEU A 87 -0.928 5.171 -3.795 1.00 0.00 C ATOM 0 H LEU A 87 -0.128 6.686 -7.690 1.00 0.00 H new ATOM 0 HA LEU A 87 2.272 7.216 -6.311 1.00 0.00 H new ATOM 0 HB2 LEU A 87 1.034 7.032 -4.566 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -0.325 6.817 -5.651 1.00 0.00 H new ATOM 0 HG LEU A 87 0.161 4.294 -5.482 1.00 0.00 H new ATOM 0 HD11 LEU A 87 1.173 3.526 -3.366 1.00 0.00 H new ATOM 0 HD12 LEU A 87 2.353 4.363 -4.402 1.00 0.00 H new ATOM 0 HD13 LEU A 87 1.655 5.199 -2.995 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -1.163 4.218 -3.322 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -0.734 5.919 -3.027 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -1.771 5.490 -4.407 1.00 0.00 H new ATOM 1242 N ILE A 88 1.954 4.055 -7.293 1.00 0.00 N ATOM 1243 CA ILE A 88 2.773 2.860 -7.558 1.00 0.00 C ATOM 1244 C ILE A 88 3.946 3.212 -8.472 1.00 0.00 C ATOM 1245 O ILE A 88 5.043 2.745 -8.201 1.00 0.00 O ATOM 1246 CB ILE A 88 1.946 1.672 -8.112 1.00 0.00 C ATOM 1247 CG1 ILE A 88 1.059 1.050 -7.005 1.00 0.00 C ATOM 1248 CG2 ILE A 88 2.802 0.573 -8.767 1.00 0.00 C ATOM 1249 CD1 ILE A 88 1.777 0.179 -5.962 1.00 0.00 C ATOM 0 H ILE A 88 0.984 3.963 -7.593 1.00 0.00 H new ATOM 0 HA ILE A 88 3.170 2.521 -6.601 1.00 0.00 H new ATOM 0 HB ILE A 88 1.319 2.095 -8.896 1.00 0.00 H new ATOM 0 HG12 ILE A 88 0.549 1.859 -6.482 1.00 0.00 H new ATOM 0 HG13 ILE A 88 0.289 0.445 -7.484 1.00 0.00 H new ATOM 0 HG21 ILE A 88 2.154 -0.225 -9.131 1.00 0.00 H new ATOM 0 HG22 ILE A 88 3.361 0.996 -9.602 1.00 0.00 H new ATOM 0 HG23 ILE A 88 3.498 0.168 -8.033 1.00 0.00 H new ATOM 0 HD11 ILE A 88 1.051 -0.199 -5.242 1.00 0.00 H new ATOM 0 HD12 ILE A 88 2.263 -0.659 -6.461 1.00 0.00 H new ATOM 0 HD13 ILE A 88 2.526 0.776 -5.443 1.00 0.00 H new ATOM 1260 N ALA A 89 3.771 4.072 -9.484 1.00 0.00 N ATOM 1261 CA ALA A 89 4.892 4.547 -10.297 1.00 0.00 C ATOM 1262 C ALA A 89 5.940 5.337 -9.481 1.00 0.00 C ATOM 1263 O ALA A 89 7.136 5.161 -9.714 1.00 0.00 O ATOM 1264 CB ALA A 89 4.356 5.363 -11.481 1.00 0.00 C ATOM 0 H ALA A 89 2.864 4.451 -9.757 1.00 0.00 H new ATOM 0 HA ALA A 89 5.423 3.674 -10.676 1.00 0.00 H new ATOM 0 HB1 ALA A 89 5.190 5.717 -12.086 1.00 0.00 H new ATOM 0 HB2 ALA A 89 3.706 4.736 -12.091 1.00 0.00 H new ATOM 0 HB3 ALA A 89 3.791 6.217 -11.108 1.00 0.00 H new ATOM 1270 N VAL A 90 5.526 6.165 -8.508 1.00 0.00 N ATOM 1271 CA VAL A 90 6.431 6.910 -7.604 1.00 0.00 C ATOM 1272 C VAL A 90 7.016 6.018 -6.492 1.00 0.00 C ATOM 1273 O VAL A 90 8.184 6.146 -6.161 1.00 0.00 O ATOM 1274 CB VAL A 90 5.735 8.147 -6.993 1.00 0.00 C ATOM 1275 CG1 VAL A 90 6.657 8.930 -6.046 1.00 0.00 C ATOM 1276 CG2 VAL A 90 5.316 9.130 -8.095 1.00 0.00 C ATOM 0 H VAL A 90 4.539 6.341 -8.321 1.00 0.00 H new ATOM 0 HA VAL A 90 7.262 7.253 -8.221 1.00 0.00 H new ATOM 0 HB VAL A 90 4.876 7.761 -6.444 1.00 0.00 H new ATOM 0 HG11 VAL A 90 6.120 9.789 -5.644 1.00 0.00 H new ATOM 0 HG12 VAL A 90 6.972 8.283 -5.227 1.00 0.00 H new ATOM 0 HG13 VAL A 90 7.534 9.274 -6.594 1.00 0.00 H new ATOM 0 HG21 VAL A 90 4.828 9.994 -7.645 1.00 0.00 H new ATOM 0 HG22 VAL A 90 6.198 9.457 -8.645 1.00 0.00 H new ATOM 0 HG23 VAL A 90 4.624 8.637 -8.778 1.00 0.00 H new ATOM 1286 N LEU A 91 6.240 5.087 -5.941 1.00 0.00 N ATOM 1287 CA LEU A 91 6.593 4.115 -4.902 1.00 0.00 C ATOM 1288 C LEU A 91 7.572 3.062 -5.434 1.00 0.00 C ATOM 1289 O LEU A 91 8.581 2.803 -4.783 1.00 0.00 O ATOM 1290 CB LEU A 91 5.261 3.533 -4.383 1.00 0.00 C ATOM 1291 CG LEU A 91 5.191 2.244 -3.558 1.00 0.00 C ATOM 1292 CD1 LEU A 91 5.435 1.006 -4.422 1.00 0.00 C ATOM 1293 CD2 LEU A 91 6.095 2.273 -2.335 1.00 0.00 C ATOM 0 H LEU A 91 5.268 4.982 -6.232 1.00 0.00 H new ATOM 0 HA LEU A 91 7.129 4.577 -4.073 1.00 0.00 H new ATOM 0 HB2 LEU A 91 4.793 4.313 -3.783 1.00 0.00 H new ATOM 0 HB3 LEU A 91 4.627 3.379 -5.256 1.00 0.00 H new ATOM 0 HG LEU A 91 4.172 2.179 -3.176 1.00 0.00 H new ATOM 0 HD11 LEU A 91 5.377 0.112 -3.801 1.00 0.00 H new ATOM 0 HD12 LEU A 91 4.678 0.954 -5.205 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.424 1.069 -4.877 1.00 0.00 H new ATOM 0 HD21 LEU A 91 6.002 1.333 -1.791 1.00 0.00 H new ATOM 0 HD22 LEU A 91 7.130 2.409 -2.650 1.00 0.00 H new ATOM 0 HD23 LEU A 91 5.802 3.098 -1.686 1.00 0.00 H new ATOM 1305 N SER A 92 7.336 2.506 -6.627 1.00 0.00 N ATOM 1306 CA SER A 92 8.242 1.541 -7.257 1.00 0.00 C ATOM 1307 C SER A 92 9.589 2.193 -7.568 1.00 0.00 C ATOM 1308 O SER A 92 10.623 1.651 -7.178 1.00 0.00 O ATOM 1309 CB SER A 92 7.621 0.908 -8.514 1.00 0.00 C ATOM 1310 OG SER A 92 7.536 1.814 -9.603 1.00 0.00 O ATOM 0 H SER A 92 6.508 2.714 -7.185 1.00 0.00 H new ATOM 0 HA SER A 92 8.411 0.732 -6.547 1.00 0.00 H new ATOM 0 HB2 SER A 92 8.216 0.044 -8.812 1.00 0.00 H new ATOM 0 HB3 SER A 92 6.623 0.541 -8.275 1.00 0.00 H new ATOM 0 HG SER A 92 6.731 2.364 -9.509 1.00 0.00 H new ATOM 1316 N GLN A 93 9.602 3.394 -8.166 1.00 0.00 N ATOM 1317 CA GLN A 93 10.843 4.147 -8.367 1.00 0.00 C ATOM 1318 C GLN A 93 11.446 4.662 -7.053 1.00 0.00 C ATOM 1319 O GLN A 93 12.661 4.765 -6.992 1.00 0.00 O ATOM 1320 CB GLN A 93 10.703 5.244 -9.440 1.00 0.00 C ATOM 1321 CG GLN A 93 9.841 6.456 -9.061 1.00 0.00 C ATOM 1322 CD GLN A 93 10.605 7.605 -8.396 1.00 0.00 C ATOM 1323 OE1 GLN A 93 11.352 8.337 -9.024 1.00 0.00 O ATOM 1324 NE2 GLN A 93 10.429 7.840 -7.112 1.00 0.00 N ATOM 0 H GLN A 93 8.766 3.862 -8.517 1.00 0.00 H new ATOM 0 HA GLN A 93 11.569 3.436 -8.763 1.00 0.00 H new ATOM 0 HB2 GLN A 93 11.700 5.600 -9.698 1.00 0.00 H new ATOM 0 HB3 GLN A 93 10.283 4.793 -10.339 1.00 0.00 H new ATOM 0 HG2 GLN A 93 9.355 6.834 -9.961 1.00 0.00 H new ATOM 0 HG3 GLN A 93 9.051 6.126 -8.387 1.00 0.00 H new ATOM 0 HE21 GLN A 93 9.810 7.243 -6.564 1.00 0.00 H new ATOM 0 HE22 GLN A 93 10.912 8.619 -6.665 1.00 0.00 H new ATOM 1333 N SER A 94 10.678 4.926 -5.989 1.00 0.00 N ATOM 1334 CA SER A 94 11.231 5.311 -4.675 1.00 0.00 C ATOM 1335 C SER A 94 11.963 4.143 -4.021 1.00 0.00 C ATOM 1336 O SER A 94 13.109 4.305 -3.606 1.00 0.00 O ATOM 1337 CB SER A 94 10.153 5.827 -3.714 1.00 0.00 C ATOM 1338 OG SER A 94 9.860 7.185 -3.997 1.00 0.00 O ATOM 0 H SER A 94 9.659 4.880 -6.009 1.00 0.00 H new ATOM 0 HA SER A 94 11.933 6.122 -4.869 1.00 0.00 H new ATOM 0 HB2 SER A 94 9.250 5.224 -3.810 1.00 0.00 H new ATOM 0 HB3 SER A 94 10.495 5.727 -2.684 1.00 0.00 H new ATOM 0 HG SER A 94 9.165 7.233 -4.687 1.00 0.00 H new ATOM 1344 N SER A 95 11.355 2.956 -3.989 1.00 0.00 N ATOM 1345 CA SER A 95 12.003 1.740 -3.486 1.00 0.00 C ATOM 1346 C SER A 95 13.193 1.324 -4.359 1.00 0.00 C ATOM 1347 O SER A 95 14.251 1.024 -3.817 1.00 0.00 O ATOM 1348 CB SER A 95 10.987 0.602 -3.337 1.00 0.00 C ATOM 1349 OG SER A 95 10.081 0.952 -2.308 1.00 0.00 O ATOM 0 H SER A 95 10.398 2.809 -4.311 1.00 0.00 H new ATOM 0 HA SER A 95 12.402 1.964 -2.497 1.00 0.00 H new ATOM 0 HB2 SER A 95 10.455 0.442 -4.275 1.00 0.00 H new ATOM 0 HB3 SER A 95 11.495 -0.332 -3.096 1.00 0.00 H new ATOM 0 HG SER A 95 9.368 0.281 -2.258 1.00 0.00 H new ATOM 1355 N SER A 96 13.103 1.399 -5.691 1.00 0.00 N ATOM 1356 CA SER A 96 14.246 1.126 -6.588 1.00 0.00 C ATOM 1357 C SER A 96 15.355 2.195 -6.543 1.00 0.00 C ATOM 1358 O SER A 96 16.535 1.857 -6.634 1.00 0.00 O ATOM 1359 CB SER A 96 13.764 0.910 -8.025 1.00 0.00 C ATOM 1360 OG SER A 96 13.057 -0.320 -8.110 1.00 0.00 O ATOM 0 H SER A 96 12.244 1.649 -6.182 1.00 0.00 H new ATOM 0 HA SER A 96 14.703 0.211 -6.212 1.00 0.00 H new ATOM 0 HB2 SER A 96 13.119 1.734 -8.331 1.00 0.00 H new ATOM 0 HB3 SER A 96 14.614 0.901 -8.707 1.00 0.00 H new ATOM 0 HG SER A 96 12.747 -0.456 -9.030 1.00 0.00 H new ATOM 1366 N ASN A 97 15.020 3.468 -6.317 1.00 0.00 N ATOM 1367 CA ASN A 97 15.978 4.545 -6.008 1.00 0.00 C ATOM 1368 C ASN A 97 16.598 4.395 -4.602 1.00 0.00 C ATOM 1369 O ASN A 97 17.668 4.936 -4.340 1.00 0.00 O ATOM 1370 CB ASN A 97 15.255 5.896 -6.165 1.00 0.00 C ATOM 1371 CG ASN A 97 16.137 7.111 -5.929 1.00 0.00 C ATOM 1372 OD1 ASN A 97 17.191 7.276 -6.525 1.00 0.00 O ATOM 1373 ND2 ASN A 97 15.716 8.018 -5.073 1.00 0.00 N ATOM 0 H ASN A 97 14.053 3.791 -6.343 1.00 0.00 H new ATOM 0 HA ASN A 97 16.814 4.488 -6.706 1.00 0.00 H new ATOM 0 HB2 ASN A 97 14.836 5.956 -7.170 1.00 0.00 H new ATOM 0 HB3 ASN A 97 14.417 5.929 -5.468 1.00 0.00 H new ATOM 0 HD21 ASN A 97 16.270 8.859 -4.907 1.00 0.00 H new ATOM 0 HD22 ASN A 97 14.836 7.880 -4.576 1.00 0.00 H new ATOM 1380 N ALA A 98 15.961 3.637 -3.706 1.00 0.00 N ATOM 1381 CA ALA A 98 16.472 3.312 -2.376 1.00 0.00 C ATOM 1382 C ALA A 98 17.286 1.996 -2.344 1.00 0.00 C ATOM 1383 O ALA A 98 18.175 1.859 -1.503 1.00 0.00 O ATOM 1384 CB ALA A 98 15.283 3.295 -1.411 1.00 0.00 C ATOM 0 H ALA A 98 15.049 3.221 -3.893 1.00 0.00 H new ATOM 0 HA ALA A 98 17.188 4.074 -2.067 1.00 0.00 H new ATOM 0 HB1 ALA A 98 15.633 3.055 -0.407 1.00 0.00 H new ATOM 0 HB2 ALA A 98 14.806 4.275 -1.404 1.00 0.00 H new ATOM 0 HB3 ALA A 98 14.563 2.543 -1.734 1.00 0.00 H new ATOM 1390 N ILE A 99 17.054 1.060 -3.278 1.00 0.00 N ATOM 1391 CA ILE A 99 17.875 -0.158 -3.472 1.00 0.00 C ATOM 1392 C ILE A 99 19.365 0.192 -3.653 1.00 0.00 C ATOM 1393 O ILE A 99 20.220 -0.472 -3.064 1.00 0.00 O ATOM 1394 CB ILE A 99 17.318 -1.015 -4.646 1.00 0.00 C ATOM 1395 CG1 ILE A 99 16.104 -1.841 -4.161 1.00 0.00 C ATOM 1396 CG2 ILE A 99 18.365 -1.957 -5.279 1.00 0.00 C ATOM 1397 CD1 ILE A 99 15.356 -2.603 -5.266 1.00 0.00 C ATOM 0 H ILE A 99 16.277 1.125 -3.935 1.00 0.00 H new ATOM 0 HA ILE A 99 17.808 -0.766 -2.569 1.00 0.00 H new ATOM 0 HB ILE A 99 17.021 -0.312 -5.425 1.00 0.00 H new ATOM 0 HG12 ILE A 99 16.446 -2.557 -3.414 1.00 0.00 H new ATOM 0 HG13 ILE A 99 15.403 -1.171 -3.663 1.00 0.00 H new ATOM 0 HG21 ILE A 99 17.904 -2.521 -6.089 1.00 0.00 H new ATOM 0 HG22 ILE A 99 19.194 -1.368 -5.672 1.00 0.00 H new ATOM 0 HG23 ILE A 99 18.738 -2.647 -4.522 1.00 0.00 H new ATOM 0 HD11 ILE A 99 14.522 -3.152 -4.829 1.00 0.00 H new ATOM 0 HD12 ILE A 99 14.978 -1.895 -6.004 1.00 0.00 H new ATOM 0 HD13 ILE A 99 16.037 -3.303 -5.750 1.00 0.00 H new ATOM 1408 N SER A 100 19.681 1.238 -4.431 1.00 0.00 N ATOM 1409 CA SER A 100 21.064 1.690 -4.670 1.00 0.00 C ATOM 1410 C SER A 100 21.138 3.164 -5.121 1.00 0.00 C ATOM 1411 O SER A 100 21.606 3.489 -6.216 1.00 0.00 O ATOM 1412 CB SER A 100 21.780 0.737 -5.642 1.00 0.00 C ATOM 1413 OG SER A 100 23.187 0.841 -5.480 1.00 0.00 O ATOM 0 H SER A 100 18.981 1.799 -4.916 1.00 0.00 H new ATOM 0 HA SER A 100 21.594 1.654 -3.718 1.00 0.00 H new ATOM 0 HB2 SER A 100 21.460 -0.289 -5.460 1.00 0.00 H new ATOM 0 HB3 SER A 100 21.506 0.979 -6.669 1.00 0.00 H new ATOM 0 HG SER A 100 23.634 0.230 -6.102 1.00 0.00 H new ATOM 1419 N GLY A 101 20.642 4.071 -4.274 1.00 0.00 N ATOM 1420 CA GLY A 101 20.728 5.527 -4.477 1.00 0.00 C ATOM 1421 C GLY A 101 20.679 6.303 -3.155 1.00 0.00 C ATOM 1422 O GLY A 101 21.725 6.744 -2.673 1.00 0.00 O ATOM 0 H GLY A 101 20.161 3.813 -3.412 1.00 0.00 H new ATOM 0 HA2 GLY A 101 21.654 5.764 -5.001 1.00 0.00 H new ATOM 0 HA3 GLY A 101 19.907 5.851 -5.117 1.00 0.00 H new ATOM 1426 N ALA A 102 19.499 6.416 -2.537 1.00 0.00 N ATOM 1427 CA ALA A 102 19.319 6.991 -1.195 1.00 0.00 C ATOM 1428 C ALA A 102 18.005 6.527 -0.523 1.00 0.00 C ATOM 1429 O ALA A 102 16.907 6.754 -1.034 1.00 0.00 O ATOM 1430 CB ALA A 102 19.370 8.526 -1.291 1.00 0.00 C ATOM 0 H ALA A 102 18.625 6.106 -2.961 1.00 0.00 H new ATOM 0 HA ALA A 102 20.131 6.632 -0.563 1.00 0.00 H new ATOM 0 HB1 ALA A 102 19.237 8.957 -0.299 1.00 0.00 H new ATOM 0 HB2 ALA A 102 20.335 8.833 -1.694 1.00 0.00 H new ATOM 0 HB3 ALA A 102 18.574 8.876 -1.948 1.00 0.00 H new ATOM 1436 N THR A 103 18.117 5.899 0.650 1.00 0.00 N ATOM 1437 CA THR A 103 17.010 5.502 1.548 1.00 0.00 C ATOM 1438 C THR A 103 16.446 6.702 2.339 1.00 0.00 C ATOM 1439 O THR A 103 16.782 6.920 3.507 1.00 0.00 O ATOM 1440 CB THR A 103 17.455 4.370 2.500 1.00 0.00 C ATOM 1441 OG1 THR A 103 18.782 4.570 2.957 1.00 0.00 O ATOM 1442 CG2 THR A 103 17.437 3.008 1.807 1.00 0.00 C ATOM 0 H THR A 103 19.028 5.636 1.026 1.00 0.00 H new ATOM 0 HA THR A 103 16.202 5.126 0.920 1.00 0.00 H new ATOM 0 HB THR A 103 16.749 4.389 3.330 1.00 0.00 H new ATOM 0 HG1 THR A 103 19.034 3.839 3.559 1.00 0.00 H new ATOM 0 HG21 THR A 103 17.756 2.238 2.509 1.00 0.00 H new ATOM 0 HG22 THR A 103 16.426 2.788 1.462 1.00 0.00 H new ATOM 0 HG23 THR A 103 18.115 3.025 0.954 1.00 0.00 H new ATOM 1450 N GLY A 104 15.590 7.507 1.700 1.00 0.00 N ATOM 1451 CA GLY A 104 15.025 8.753 2.253 1.00 0.00 C ATOM 1452 C GLY A 104 13.522 8.661 2.550 1.00 0.00 C ATOM 1453 O GLY A 104 12.700 8.954 1.680 1.00 0.00 O ATOM 0 H GLY A 104 15.259 7.308 0.756 1.00 0.00 H new ATOM 0 HA2 GLY A 104 15.554 9.007 3.171 1.00 0.00 H new ATOM 0 HA3 GLY A 104 15.200 9.566 1.549 1.00 0.00 H new ATOM 1457 N GLY A 105 13.159 8.246 3.770 1.00 0.00 N ATOM 1458 CA GLY A 105 11.760 8.049 4.194 1.00 0.00 C ATOM 1459 C GLY A 105 10.941 9.341 4.359 1.00 0.00 C ATOM 1460 O GLY A 105 9.767 9.376 3.986 1.00 0.00 O ATOM 0 H GLY A 105 13.835 8.034 4.503 1.00 0.00 H new ATOM 0 HA2 GLY A 105 11.261 7.412 3.464 1.00 0.00 H new ATOM 0 HA3 GLY A 105 11.756 7.511 5.142 1.00 0.00 H new ATOM 1464 N SER A 106 11.567 10.412 4.862 1.00 0.00 N ATOM 1465 CA SER A 106 10.918 11.698 5.193 1.00 0.00 C ATOM 1466 C SER A 106 11.741 12.887 4.676 1.00 0.00 C ATOM 1467 O SER A 106 12.350 13.632 5.448 1.00 0.00 O ATOM 1468 CB SER A 106 10.644 11.817 6.703 1.00 0.00 C ATOM 1469 OG SER A 106 9.785 10.780 7.153 1.00 0.00 O ATOM 0 H SER A 106 12.568 10.413 5.058 1.00 0.00 H new ATOM 0 HA SER A 106 9.954 11.720 4.685 1.00 0.00 H new ATOM 0 HB2 SER A 106 11.586 11.776 7.250 1.00 0.00 H new ATOM 0 HB3 SER A 106 10.193 12.786 6.918 1.00 0.00 H new ATOM 0 HG SER A 106 9.629 10.879 8.115 1.00 0.00 H new ATOM 1475 N ALA A 107 11.783 13.043 3.348 1.00 0.00 N ATOM 1476 CA ALA A 107 12.636 14.007 2.633 1.00 0.00 C ATOM 1477 C ALA A 107 11.879 14.851 1.575 1.00 0.00 C ATOM 1478 O ALA A 107 12.489 15.440 0.680 1.00 0.00 O ATOM 1479 CB ALA A 107 13.820 13.223 2.049 1.00 0.00 C ATOM 0 H ALA A 107 11.206 12.485 2.718 1.00 0.00 H new ATOM 0 HA ALA A 107 12.996 14.761 3.333 1.00 0.00 H new ATOM 0 HB1 ALA A 107 14.477 13.905 1.510 1.00 0.00 H new ATOM 0 HB2 ALA A 107 14.375 12.747 2.857 1.00 0.00 H new ATOM 0 HB3 ALA A 107 13.449 12.460 1.365 1.00 0.00 H new ATOM 1485 N PHE A 108 10.544 14.922 1.672 1.00 0.00 N ATOM 1486 CA PHE A 108 9.677 15.691 0.760 1.00 0.00 C ATOM 1487 C PHE A 108 9.639 17.208 1.042 1.00 0.00 C ATOM 1488 O PHE A 108 9.148 17.966 0.204 1.00 0.00 O ATOM 1489 CB PHE A 108 8.256 15.106 0.810 1.00 0.00 C ATOM 1490 CG PHE A 108 8.090 13.847 -0.019 1.00 0.00 C ATOM 1491 CD1 PHE A 108 8.463 12.592 0.494 1.00 0.00 C ATOM 1492 CD2 PHE A 108 7.566 13.940 -1.325 1.00 0.00 C ATOM 1493 CE1 PHE A 108 8.325 11.436 -0.299 1.00 0.00 C ATOM 1494 CE2 PHE A 108 7.426 12.786 -2.114 1.00 0.00 C ATOM 1495 CZ PHE A 108 7.813 11.534 -1.604 1.00 0.00 C ATOM 0 H PHE A 108 10.023 14.437 2.402 1.00 0.00 H new ATOM 0 HA PHE A 108 10.108 15.594 -0.236 1.00 0.00 H new ATOM 0 HB2 PHE A 108 7.999 14.886 1.846 1.00 0.00 H new ATOM 0 HB3 PHE A 108 7.550 15.858 0.459 1.00 0.00 H new ATOM 0 HD1 PHE A 108 8.856 12.514 1.497 1.00 0.00 H new ATOM 0 HD2 PHE A 108 7.271 14.901 -1.720 1.00 0.00 H new ATOM 0 HE1 PHE A 108 8.613 10.473 0.096 1.00 0.00 H new ATOM 0 HE2 PHE A 108 7.021 12.860 -3.112 1.00 0.00 H new ATOM 0 HZ PHE A 108 7.717 10.648 -2.215 1.00 0.00 H new ATOM 1505 N ALA A 109 10.136 17.657 2.203 1.00 0.00 N ATOM 1506 CA ALA A 109 10.085 19.051 2.677 1.00 0.00 C ATOM 1507 C ALA A 109 8.678 19.702 2.602 1.00 0.00 C ATOM 1508 O ALA A 109 8.552 20.904 2.347 1.00 0.00 O ATOM 1509 CB ALA A 109 11.193 19.852 1.971 1.00 0.00 C ATOM 0 H ALA A 109 10.603 17.037 2.865 1.00 0.00 H new ATOM 0 HA ALA A 109 10.281 19.059 3.749 1.00 0.00 H new ATOM 0 HB1 ALA A 109 11.168 20.887 2.312 1.00 0.00 H new ATOM 0 HB2 ALA A 109 12.164 19.416 2.207 1.00 0.00 H new ATOM 0 HB3 ALA A 109 11.034 19.821 0.893 1.00 0.00 H new ATOM 1515 N GLN A 110 7.616 18.906 2.805 1.00 0.00 N ATOM 1516 CA GLN A 110 6.220 19.361 2.699 1.00 0.00 C ATOM 1517 C GLN A 110 5.291 18.624 3.687 1.00 0.00 C ATOM 1518 O GLN A 110 4.806 19.251 4.630 1.00 0.00 O ATOM 1519 CB GLN A 110 5.774 19.242 1.224 1.00 0.00 C ATOM 1520 CG GLN A 110 4.659 20.231 0.825 1.00 0.00 C ATOM 1521 CD GLN A 110 4.992 21.008 -0.457 1.00 0.00 C ATOM 1522 OE1 GLN A 110 5.408 20.461 -1.471 1.00 0.00 O ATOM 1523 NE2 GLN A 110 4.831 22.317 -0.468 1.00 0.00 N ATOM 0 H GLN A 110 7.703 17.920 3.050 1.00 0.00 H new ATOM 0 HA GLN A 110 6.150 20.408 2.993 1.00 0.00 H new ATOM 0 HB2 GLN A 110 6.638 19.405 0.579 1.00 0.00 H new ATOM 0 HB3 GLN A 110 5.427 18.225 1.041 1.00 0.00 H new ATOM 0 HG2 GLN A 110 3.727 19.684 0.683 1.00 0.00 H new ATOM 0 HG3 GLN A 110 4.494 20.935 1.640 1.00 0.00 H new ATOM 0 HE21 GLN A 110 4.486 22.795 0.364 1.00 0.00 H new ATOM 0 HE22 GLN A 110 5.052 22.851 -1.309 1.00 0.00 H new ATOM 1532 N SER A 111 5.088 17.304 3.526 1.00 0.00 N ATOM 1533 CA SER A 111 4.317 16.451 4.467 1.00 0.00 C ATOM 1534 C SER A 111 4.465 14.937 4.181 1.00 0.00 C ATOM 1535 O SER A 111 3.483 14.194 4.161 1.00 0.00 O ATOM 1536 CB SER A 111 2.832 16.872 4.505 1.00 0.00 C ATOM 1537 OG SER A 111 2.320 16.743 5.823 1.00 0.00 O ATOM 0 H SER A 111 5.458 16.786 2.729 1.00 0.00 H new ATOM 0 HA SER A 111 4.749 16.614 5.454 1.00 0.00 H new ATOM 0 HB2 SER A 111 2.730 17.903 4.167 1.00 0.00 H new ATOM 0 HB3 SER A 111 2.253 16.253 3.820 1.00 0.00 H new ATOM 0 HG SER A 111 1.378 17.014 5.836 1.00 0.00 H new ATOM 1543 N GLN A 112 5.693 14.473 3.898 1.00 0.00 N ATOM 1544 CA GLN A 112 6.004 13.083 3.490 1.00 0.00 C ATOM 1545 C GLN A 112 5.083 12.561 2.356 1.00 0.00 C ATOM 1546 O GLN A 112 4.334 11.597 2.533 1.00 0.00 O ATOM 1547 CB GLN A 112 6.058 12.127 4.703 1.00 0.00 C ATOM 1548 CG GLN A 112 7.054 12.531 5.807 1.00 0.00 C ATOM 1549 CD GLN A 112 6.531 13.614 6.753 1.00 0.00 C ATOM 1550 OE1 GLN A 112 5.442 13.537 7.306 1.00 0.00 O ATOM 1551 NE2 GLN A 112 7.283 14.671 6.986 1.00 0.00 N ATOM 0 H GLN A 112 6.522 15.065 3.946 1.00 0.00 H new ATOM 0 HA GLN A 112 7.006 13.105 3.061 1.00 0.00 H new ATOM 0 HB2 GLN A 112 5.061 12.062 5.140 1.00 0.00 H new ATOM 0 HB3 GLN A 112 6.317 11.129 4.349 1.00 0.00 H new ATOM 0 HG2 GLN A 112 7.312 11.647 6.391 1.00 0.00 H new ATOM 0 HG3 GLN A 112 7.974 12.884 5.341 1.00 0.00 H new ATOM 0 HE21 GLN A 112 8.195 14.757 6.537 1.00 0.00 H new ATOM 0 HE22 GLN A 112 6.953 15.403 7.616 1.00 0.00 H new ATOM 1560 N ALA A 113 5.127 13.245 1.204 1.00 0.00 N ATOM 1561 CA ALA A 113 4.252 13.072 0.034 1.00 0.00 C ATOM 1562 C ALA A 113 2.829 13.624 0.272 1.00 0.00 C ATOM 1563 O ALA A 113 1.837 12.889 0.238 1.00 0.00 O ATOM 1564 CB ALA A 113 4.299 11.633 -0.510 1.00 0.00 C ATOM 0 H ALA A 113 5.818 13.980 1.054 1.00 0.00 H new ATOM 0 HA ALA A 113 4.651 13.692 -0.769 1.00 0.00 H new ATOM 0 HB1 ALA A 113 3.639 11.549 -1.373 1.00 0.00 H new ATOM 0 HB2 ALA A 113 5.319 11.390 -0.808 1.00 0.00 H new ATOM 0 HB3 ALA A 113 3.973 10.940 0.265 1.00 0.00 H new ATOM 1570 N PHE A 114 2.730 14.934 0.538 1.00 0.00 N ATOM 1571 CA PHE A 114 1.447 15.639 0.668 1.00 0.00 C ATOM 1572 C PHE A 114 0.571 15.455 -0.586 1.00 0.00 C ATOM 1573 O PHE A 114 1.006 15.754 -1.702 1.00 0.00 O ATOM 1574 CB PHE A 114 1.681 17.135 0.928 1.00 0.00 C ATOM 1575 CG PHE A 114 0.386 17.891 1.168 1.00 0.00 C ATOM 1576 CD1 PHE A 114 -0.323 17.708 2.371 1.00 0.00 C ATOM 1577 CD2 PHE A 114 -0.152 18.720 0.164 1.00 0.00 C ATOM 1578 CE1 PHE A 114 -1.560 18.347 2.569 1.00 0.00 C ATOM 1579 CE2 PHE A 114 -1.390 19.360 0.362 1.00 0.00 C ATOM 1580 CZ PHE A 114 -2.094 19.173 1.564 1.00 0.00 C ATOM 0 H PHE A 114 3.542 15.537 0.670 1.00 0.00 H new ATOM 0 HA PHE A 114 0.918 15.205 1.517 1.00 0.00 H new ATOM 0 HB2 PHE A 114 2.333 17.253 1.794 1.00 0.00 H new ATOM 0 HB3 PHE A 114 2.201 17.572 0.076 1.00 0.00 H new ATOM 0 HD1 PHE A 114 0.085 17.074 3.145 1.00 0.00 H new ATOM 0 HD2 PHE A 114 0.387 18.865 -0.761 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -2.100 18.203 3.493 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -1.799 19.995 -0.410 1.00 0.00 H new ATOM 0 HZ PHE A 114 -3.044 19.663 1.716 1.00 0.00 H new ATOM 1590 N GLN A 115 -0.664 14.976 -0.402 1.00 0.00 N ATOM 1591 CA GLN A 115 -1.604 14.701 -1.494 1.00 0.00 C ATOM 1592 C GLN A 115 -3.062 14.855 -1.014 1.00 0.00 C ATOM 1593 O GLN A 115 -3.611 13.970 -0.355 1.00 0.00 O ATOM 1594 CB GLN A 115 -1.324 13.294 -2.063 1.00 0.00 C ATOM 1595 CG GLN A 115 -1.803 13.127 -3.523 1.00 0.00 C ATOM 1596 CD GLN A 115 -0.687 12.998 -4.572 1.00 0.00 C ATOM 1597 OE1 GLN A 115 0.500 12.878 -4.300 1.00 0.00 O ATOM 1598 NE2 GLN A 115 -1.032 12.996 -5.843 1.00 0.00 N ATOM 0 H GLN A 115 -1.044 14.766 0.521 1.00 0.00 H new ATOM 0 HA GLN A 115 -1.461 15.428 -2.294 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -0.254 13.094 -2.012 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -1.817 12.550 -1.437 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -2.437 12.242 -3.581 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -2.426 13.983 -3.783 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -2.013 13.094 -6.105 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -0.318 12.896 -6.565 1.00 0.00 H new ATOM 1607 N GLN A 116 -3.681 15.997 -1.322 1.00 0.00 N ATOM 1608 CA GLN A 116 -5.070 16.322 -0.967 1.00 0.00 C ATOM 1609 C GLN A 116 -5.634 17.366 -1.948 1.00 0.00 C ATOM 1610 O GLN A 116 -5.101 18.471 -2.038 1.00 0.00 O ATOM 1611 CB GLN A 116 -5.135 16.850 0.486 1.00 0.00 C ATOM 1612 CG GLN A 116 -5.942 15.910 1.388 1.00 0.00 C ATOM 1613 CD GLN A 116 -6.061 16.421 2.825 1.00 0.00 C ATOM 1614 OE1 GLN A 116 -5.085 16.737 3.495 1.00 0.00 O ATOM 1615 NE2 GLN A 116 -7.261 16.526 3.362 1.00 0.00 N ATOM 0 H GLN A 116 -3.219 16.744 -1.840 1.00 0.00 H new ATOM 0 HA GLN A 116 -5.677 15.419 -1.035 1.00 0.00 H new ATOM 0 HB2 GLN A 116 -4.125 16.957 0.881 1.00 0.00 H new ATOM 0 HB3 GLN A 116 -5.587 17.842 0.494 1.00 0.00 H new ATOM 0 HG2 GLN A 116 -6.940 15.781 0.970 1.00 0.00 H new ATOM 0 HG3 GLN A 116 -5.470 14.927 1.395 1.00 0.00 H new ATOM 0 HE21 GLN A 116 -8.086 16.268 2.821 1.00 0.00 H new ATOM 0 HE22 GLN A 116 -7.364 16.865 4.318 1.00 0.00 H new ATOM 1624 N SER A 117 -6.712 17.013 -2.659 1.00 0.00 N ATOM 1625 CA SER A 117 -7.416 17.780 -3.714 1.00 0.00 C ATOM 1626 C SER A 117 -6.553 18.320 -4.875 1.00 0.00 C ATOM 1627 O SER A 117 -6.720 17.866 -6.011 1.00 0.00 O ATOM 1628 CB SER A 117 -8.253 18.910 -3.096 1.00 0.00 C ATOM 1629 OG SER A 117 -9.245 18.380 -2.225 1.00 0.00 O ATOM 0 H SER A 117 -7.158 16.109 -2.504 1.00 0.00 H new ATOM 0 HA SER A 117 -8.056 17.036 -4.188 1.00 0.00 H new ATOM 0 HB2 SER A 117 -7.604 19.591 -2.545 1.00 0.00 H new ATOM 0 HB3 SER A 117 -8.728 19.492 -3.886 1.00 0.00 H new ATOM 0 HG SER A 117 -9.767 19.114 -1.839 1.00 0.00 H new ATOM 1635 N ALA A 118 -5.647 19.270 -4.618 1.00 0.00 N ATOM 1636 CA ALA A 118 -4.754 19.923 -5.587 1.00 0.00 C ATOM 1637 C ALA A 118 -3.453 20.417 -4.916 1.00 0.00 C ATOM 1638 O ALA A 118 -2.360 19.993 -5.356 1.00 0.00 O ATOM 1639 CB ALA A 118 -5.512 21.076 -6.270 1.00 0.00 C ATOM 0 H ALA A 118 -5.508 19.626 -3.672 1.00 0.00 H new ATOM 0 HA ALA A 118 -4.455 19.197 -6.342 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -4.857 21.566 -6.990 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -6.387 20.681 -6.786 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -5.829 21.799 -5.518 1.00 0.00 H new TER 1645 ALA A 118