USER MOD reduce.3.24.130724 H: found=0, std=0, add=1210, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1203 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 134 ASN : amide:sc= 0.428 K(o=0.86,f=-3.4!) USER MOD Set 1.2: A 138 ASN : amide:sc= 0.435 K(o=0.86,f=-0.012) USER MOD Set 2.1: A 20 GLN : amide:sc= -0.736 K(o=1.4,f=-7.7!) USER MOD Set 2.2: A 64 ASN : amide:sc= 1.61 K(o=1.4,f=-5.2!) USER MOD Set 2.3: A 111 GLN : amide:sc= 0.493 K(o=1.4,f=-5.2) USER MOD Set 3.1: A 11 SER OG : rot 58:sc= 2.22 USER MOD Set 3.2: A 75 TYR OH : rot 25:sc= 1.08 USER MOD Set 4.1: A 61 HIS : no HE2:sc= 0.323 K(o=0.29,f=-2.6) USER MOD Set 4.2: A 62 SER OG : rot 180:sc= -0.0346 USER MOD Set 5.1: A 44 HIS : no HE2:sc= -0.524! C(o=-0.062!,f=-5.3!) USER MOD Set 5.2: A 48 LYS NZ :NH3+ -114:sc= 0.462! (180deg=-0.265) USER MOD Set 6.1: A 3 HIS : no HE2:sc= 0.625 K(o=1.6,f=-5.8!) USER MOD Set 6.2: A 38 LYS NZ :NH3+ 175:sc= 0.94 (180deg=0.112) USER MOD Single : A 1 GLY N :NH3+ -118:sc= 0.248 (180deg=-1.67!) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 7 GLN : amide:sc= 0.941 K(o=0.94,f=-0.24) USER MOD Single : A 8 GLN : amide:sc= 1 K(o=1,f=0) USER MOD Single : A 13 TYR OH : rot 180:sc= 1.26 USER MOD Single : A 19 HIS : no HE2:sc= 0.448 K(o=0.45,f=-2.3!) USER MOD Single : A 35 SER OG : rot 38:sc= 0.0894 USER MOD Single : A 39 MET CE :methyl 159:sc= -2.36 (180deg=-4.38!) USER MOD Single : A 43 THR OG1 : rot -49:sc= 0.886 USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 GLN : amide:sc= -0.224 X(o=-0.22,f=-0.11) USER MOD Single : A 53 MET CE :methyl 175:sc= -1.44 (180deg=-1.6) USER MOD Single : A 59 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 66 THR OG1 : rot 127:sc= 1.19 USER MOD Single : A 68 GLN : amide:sc= 0.471 K(o=0.47,f=-1.8!) USER MOD Single : A 72 GLN : amide:sc= 0.859 K(o=0.86,f=0) USER MOD Single : A 77 TYR OH : rot -6:sc= 0.171 USER MOD Single : A 81 SER OG : rot -127:sc= 1.04 USER MOD Single : A 84 SER OG : rot 84:sc= 1.23 USER MOD Single : A 87 LYS NZ :NH3+ -103:sc= 0.549 (180deg=-3.54!) USER MOD Single : A 90 MET CE :methyl -178:sc= -0.686 (180deg=-0.751) USER MOD Single : A 94 THR OG1 : rot -35:sc= 0.166 USER MOD Single : A 96 ASN : amide:sc= -0.191 X(o=-0.19,f=-0.19) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 HIS : no HD1:sc= -8.36! C(o=-8.4!,f=-15!) USER MOD Single : A 106 LYS NZ :NH3+ 175:sc= 1.01 (180deg=0.851) USER MOD Single : A 108 SER OG : rot 51:sc= 1.23 USER MOD Single : A 119 LYS NZ :NH3+ 176:sc= 2.46 (180deg=2.26) USER MOD Single : A 120 GLN :FLIP amide:sc= 0.103 F(o=-0.61,f=0.1) USER MOD Single : A 133 MET CE :methyl -179:sc= -0.992 (180deg=-1) USER MOD Single : A 135 SER OG : rot -32:sc= 0.21 USER MOD Single : A 139 THR OG1 : rot 180:sc= 0.00295 USER MOD Single : A 142 GLN : amide:sc= -0.0549 K(o=-0.055,f=-2) USER MOD Single : A 143 THR OG1 : rot 72:sc= 1.22 USER MOD Single : A 145 GLN : amide:sc= 1.23 K(o=1.2,f=-0.38) USER MOD Single : A 146 ASN : amide:sc= 0.645 K(o=0.65,f=-1.9!) USER MOD Single : A 151 LYS NZ :NH3+ 161:sc= 2.3 (180deg=1.59) USER MOD Single : A 152 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 GLN : amide:sc= 0.969 K(o=0.97,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 8.171 6.228 2.330 1.00 0.00 N ATOM 2 CA GLY A 1 7.696 7.291 1.429 1.00 0.00 C ATOM 3 C GLY A 1 8.785 8.338 1.308 1.00 0.00 C ATOM 4 O GLY A 1 9.945 7.979 1.132 1.00 0.00 O ATOM 0 H1 GLY A 1 8.218 5.328 1.811 1.00 0.00 H new ATOM 0 H2 GLY A 1 9.117 6.472 2.686 1.00 0.00 H new ATOM 0 H3 GLY A 1 7.514 6.132 3.130 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.456 6.878 0.449 1.00 0.00 H new ATOM 0 HA3 GLY A 1 6.782 7.738 1.819 1.00 0.00 H new ATOM 8 N SER A 2 8.451 9.616 1.444 1.00 0.00 N ATOM 9 CA SER A 2 9.382 10.723 1.654 1.00 0.00 C ATOM 10 C SER A 2 8.697 11.699 2.618 1.00 0.00 C ATOM 11 O SER A 2 7.573 11.417 3.034 1.00 0.00 O ATOM 12 CB SER A 2 9.762 11.343 0.305 1.00 0.00 C ATOM 13 OG SER A 2 10.518 10.403 -0.439 1.00 0.00 O ATOM 0 H SER A 2 7.480 9.925 1.410 1.00 0.00 H new ATOM 0 HA SER A 2 10.324 10.403 2.099 1.00 0.00 H new ATOM 0 HB2 SER A 2 8.865 11.625 -0.246 1.00 0.00 H new ATOM 0 HB3 SER A 2 10.341 12.254 0.459 1.00 0.00 H new ATOM 0 HG SER A 2 10.763 10.792 -1.304 1.00 0.00 H new ATOM 19 N HIS A 3 9.373 12.769 3.040 1.00 0.00 N ATOM 20 CA HIS A 3 8.850 13.713 4.020 1.00 0.00 C ATOM 21 C HIS A 3 8.788 15.088 3.368 1.00 0.00 C ATOM 22 O HIS A 3 9.686 15.447 2.603 1.00 0.00 O ATOM 23 CB HIS A 3 9.738 13.716 5.278 1.00 0.00 C ATOM 24 CG HIS A 3 9.010 14.168 6.521 1.00 0.00 C ATOM 25 ND1 HIS A 3 8.701 15.462 6.882 1.00 0.00 N ATOM 26 CD2 HIS A 3 8.526 13.346 7.501 1.00 0.00 C ATOM 27 CE1 HIS A 3 8.032 15.413 8.048 1.00 0.00 C ATOM 28 NE2 HIS A 3 7.844 14.133 8.426 1.00 0.00 N ATOM 0 H HIS A 3 10.308 13.004 2.706 1.00 0.00 H new ATOM 0 HA HIS A 3 7.848 13.425 4.337 1.00 0.00 H new ATOM 0 HB2 HIS A 3 10.130 12.712 5.440 1.00 0.00 H new ATOM 0 HB3 HIS A 3 10.594 14.369 5.109 1.00 0.00 H new ATOM 0 HD1 HIS A 3 8.937 16.305 6.359 1.00 0.00 H new ATOM 0 HD2 HIS A 3 8.651 12.274 7.549 1.00 0.00 H new ATOM 0 HE1 HIS A 3 7.694 16.276 8.602 1.00 0.00 H new ATOM 36 N MET A 4 7.713 15.814 3.654 1.00 0.00 N ATOM 37 CA MET A 4 7.484 17.192 3.259 1.00 0.00 C ATOM 38 C MET A 4 8.322 18.099 4.170 1.00 0.00 C ATOM 39 O MET A 4 8.994 17.618 5.089 1.00 0.00 O ATOM 40 CB MET A 4 5.989 17.538 3.439 1.00 0.00 C ATOM 41 CG MET A 4 4.973 16.598 2.766 1.00 0.00 C ATOM 42 SD MET A 4 4.813 14.924 3.472 1.00 0.00 S ATOM 43 CE MET A 4 3.132 14.521 2.922 1.00 0.00 C ATOM 0 H MET A 4 6.938 15.433 4.197 1.00 0.00 H new ATOM 0 HA MET A 4 7.764 17.335 2.215 1.00 0.00 H new ATOM 0 HB2 MET A 4 5.772 17.564 4.507 1.00 0.00 H new ATOM 0 HB3 MET A 4 5.825 18.545 3.056 1.00 0.00 H new ATOM 0 HG2 MET A 4 3.994 17.076 2.798 1.00 0.00 H new ATOM 0 HG3 MET A 4 5.245 16.499 1.715 1.00 0.00 H new ATOM 0 HE1 MET A 4 2.866 13.522 3.268 1.00 0.00 H new ATOM 0 HE2 MET A 4 2.431 15.247 3.334 1.00 0.00 H new ATOM 0 HE3 MET A 4 3.088 14.551 1.833 1.00 0.00 H new ATOM 53 N LEU A 5 8.321 19.408 3.908 1.00 0.00 N ATOM 54 CA LEU A 5 8.962 20.368 4.801 1.00 0.00 C ATOM 55 C LEU A 5 7.984 20.416 5.970 1.00 0.00 C ATOM 56 O LEU A 5 6.818 20.722 5.733 1.00 0.00 O ATOM 57 CB LEU A 5 9.131 21.724 4.091 1.00 0.00 C ATOM 58 CG LEU A 5 9.875 22.823 4.877 1.00 0.00 C ATOM 59 CD1 LEU A 5 9.063 23.449 6.017 1.00 0.00 C ATOM 60 CD2 LEU A 5 11.241 22.354 5.398 1.00 0.00 C ATOM 0 H LEU A 5 7.884 19.824 3.086 1.00 0.00 H new ATOM 0 HA LEU A 5 9.971 20.104 5.119 1.00 0.00 H new ATOM 0 HB2 LEU A 5 9.662 21.555 3.154 1.00 0.00 H new ATOM 0 HB3 LEU A 5 8.141 22.100 3.833 1.00 0.00 H new ATOM 0 HG LEU A 5 10.033 23.609 4.138 1.00 0.00 H new ATOM 0 HD11 LEU A 5 9.663 24.211 6.515 1.00 0.00 H new ATOM 0 HD12 LEU A 5 8.160 23.905 5.612 1.00 0.00 H new ATOM 0 HD13 LEU A 5 8.789 22.676 6.735 1.00 0.00 H new ATOM 0 HD21 LEU A 5 11.721 23.167 5.943 1.00 0.00 H new ATOM 0 HD22 LEU A 5 11.104 21.502 6.063 1.00 0.00 H new ATOM 0 HD23 LEU A 5 11.870 22.060 4.557 1.00 0.00 H new ATOM 72 N ASP A 6 8.429 20.095 7.186 1.00 0.00 N ATOM 73 CA ASP A 6 7.580 19.959 8.371 1.00 0.00 C ATOM 74 C ASP A 6 6.561 21.092 8.483 1.00 0.00 C ATOM 75 O ASP A 6 6.908 22.250 8.733 1.00 0.00 O ATOM 76 CB ASP A 6 8.451 19.880 9.633 1.00 0.00 C ATOM 77 CG ASP A 6 9.393 18.679 9.592 1.00 0.00 C ATOM 78 OD1 ASP A 6 10.424 18.793 8.889 1.00 0.00 O ATOM 79 OD2 ASP A 6 9.054 17.653 10.219 1.00 0.00 O ATOM 0 H ASP A 6 9.415 19.918 7.379 1.00 0.00 H new ATOM 0 HA ASP A 6 7.013 19.034 8.270 1.00 0.00 H new ATOM 0 HB2 ASP A 6 9.033 20.796 9.732 1.00 0.00 H new ATOM 0 HB3 ASP A 6 7.812 19.812 10.513 1.00 0.00 H new ATOM 84 N GLN A 7 5.290 20.721 8.335 1.00 0.00 N ATOM 85 CA GLN A 7 4.052 21.447 8.260 1.00 0.00 C ATOM 86 C GLN A 7 2.999 20.348 8.486 1.00 0.00 C ATOM 87 O GLN A 7 3.304 19.167 8.670 1.00 0.00 O ATOM 88 CB GLN A 7 3.853 22.100 6.870 1.00 0.00 C ATOM 89 CG GLN A 7 4.735 23.321 6.565 1.00 0.00 C ATOM 90 CD GLN A 7 4.533 24.462 7.561 1.00 0.00 C ATOM 91 OE1 GLN A 7 3.631 25.282 7.434 1.00 0.00 O ATOM 92 NE2 GLN A 7 5.358 24.545 8.590 1.00 0.00 N ATOM 0 H GLN A 7 5.091 19.724 8.252 1.00 0.00 H new ATOM 0 HA GLN A 7 4.002 22.266 8.977 1.00 0.00 H new ATOM 0 HB2 GLN A 7 4.037 21.344 6.106 1.00 0.00 H new ATOM 0 HB3 GLN A 7 2.809 22.399 6.778 1.00 0.00 H new ATOM 0 HG2 GLN A 7 5.782 23.018 6.574 1.00 0.00 H new ATOM 0 HG3 GLN A 7 4.516 23.680 5.559 1.00 0.00 H new ATOM 0 HE21 GLN A 7 6.109 23.864 8.698 1.00 0.00 H new ATOM 0 HE22 GLN A 7 5.243 25.290 9.277 1.00 0.00 H new ATOM 101 N GLN A 8 1.751 20.771 8.537 1.00 0.00 N ATOM 102 CA GLN A 8 0.577 19.915 8.610 1.00 0.00 C ATOM 103 C GLN A 8 0.075 19.696 7.181 1.00 0.00 C ATOM 104 O GLN A 8 -0.389 20.643 6.543 1.00 0.00 O ATOM 105 CB GLN A 8 -0.483 20.526 9.550 1.00 0.00 C ATOM 106 CG GLN A 8 -0.881 21.999 9.298 1.00 0.00 C ATOM 107 CD GLN A 8 -2.347 22.157 8.893 1.00 0.00 C ATOM 108 OE1 GLN A 8 -3.170 22.635 9.666 1.00 0.00 O ATOM 109 NE2 GLN A 8 -2.701 21.774 7.679 1.00 0.00 N ATOM 0 H GLN A 8 1.515 21.763 8.528 1.00 0.00 H new ATOM 0 HA GLN A 8 0.817 18.944 9.043 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -1.384 19.916 9.486 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -0.115 20.445 10.573 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -0.694 22.580 10.201 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -0.246 22.413 8.515 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -2.006 21.378 7.046 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -3.669 21.874 7.375 1.00 0.00 H new ATOM 118 N GLU A 9 0.154 18.463 6.692 1.00 0.00 N ATOM 119 CA GLU A 9 -0.305 18.010 5.385 1.00 0.00 C ATOM 120 C GLU A 9 -0.910 16.618 5.586 1.00 0.00 C ATOM 121 O GLU A 9 -0.742 16.014 6.647 1.00 0.00 O ATOM 122 CB GLU A 9 0.869 17.975 4.381 1.00 0.00 C ATOM 123 CG GLU A 9 1.378 19.377 4.001 1.00 0.00 C ATOM 124 CD GLU A 9 2.455 19.337 2.909 1.00 0.00 C ATOM 125 OE1 GLU A 9 2.145 18.852 1.797 1.00 0.00 O ATOM 126 OE2 GLU A 9 3.584 19.806 3.180 1.00 0.00 O ATOM 0 H GLU A 9 0.568 17.704 7.234 1.00 0.00 H new ATOM 0 HA GLU A 9 -1.049 18.690 4.971 1.00 0.00 H new ATOM 0 HB2 GLU A 9 1.690 17.401 4.810 1.00 0.00 H new ATOM 0 HB3 GLU A 9 0.552 17.453 3.478 1.00 0.00 H new ATOM 0 HG2 GLU A 9 0.540 19.983 3.658 1.00 0.00 H new ATOM 0 HG3 GLU A 9 1.782 19.865 4.888 1.00 0.00 H new ATOM 133 N GLU A 10 -1.621 16.114 4.580 1.00 0.00 N ATOM 134 CA GLU A 10 -2.156 14.757 4.554 1.00 0.00 C ATOM 135 C GLU A 10 -2.053 14.204 3.127 1.00 0.00 C ATOM 136 O GLU A 10 -1.760 14.939 2.182 1.00 0.00 O ATOM 137 CB GLU A 10 -3.625 14.688 4.979 1.00 0.00 C ATOM 138 CG GLU A 10 -4.018 15.089 6.402 1.00 0.00 C ATOM 139 CD GLU A 10 -5.417 14.519 6.677 1.00 0.00 C ATOM 140 OE1 GLU A 10 -5.483 13.317 7.033 1.00 0.00 O ATOM 141 OE2 GLU A 10 -6.414 15.232 6.428 1.00 0.00 O ATOM 0 H GLU A 10 -1.846 16.651 3.742 1.00 0.00 H new ATOM 0 HA GLU A 10 -1.569 14.172 5.262 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -4.193 15.317 4.294 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -3.962 13.663 4.824 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -3.298 14.700 7.122 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -4.019 16.174 6.507 1.00 0.00 H new ATOM 148 N SER A 11 -2.302 12.901 2.967 1.00 0.00 N ATOM 149 CA SER A 11 -2.195 12.089 1.757 1.00 0.00 C ATOM 150 C SER A 11 -2.678 10.661 2.056 1.00 0.00 C ATOM 151 O SER A 11 -3.083 10.371 3.177 1.00 0.00 O ATOM 152 CB SER A 11 -0.799 12.179 1.120 1.00 0.00 C ATOM 153 OG SER A 11 -0.734 13.363 0.355 1.00 0.00 O ATOM 0 H SER A 11 -2.613 12.337 3.758 1.00 0.00 H new ATOM 0 HA SER A 11 -2.855 12.488 0.986 1.00 0.00 H new ATOM 0 HB2 SER A 11 -0.029 12.184 1.892 1.00 0.00 H new ATOM 0 HB3 SER A 11 -0.613 11.309 0.490 1.00 0.00 H new ATOM 0 HG SER A 11 -0.920 14.135 0.930 1.00 0.00 H new ATOM 159 N LEU A 12 -2.700 9.798 1.039 1.00 0.00 N ATOM 160 CA LEU A 12 -3.183 8.415 1.044 1.00 0.00 C ATOM 161 C LEU A 12 -2.739 7.628 2.289 1.00 0.00 C ATOM 162 O LEU A 12 -1.549 7.604 2.616 1.00 0.00 O ATOM 163 CB LEU A 12 -2.572 7.795 -0.230 1.00 0.00 C ATOM 164 CG LEU A 12 -2.970 6.373 -0.666 1.00 0.00 C ATOM 165 CD1 LEU A 12 -2.188 6.073 -1.937 1.00 0.00 C ATOM 166 CD2 LEU A 12 -2.575 5.269 0.300 1.00 0.00 C ATOM 0 H LEU A 12 -2.354 10.068 0.119 1.00 0.00 H new ATOM 0 HA LEU A 12 -4.272 8.382 1.065 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -2.804 8.464 -1.059 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -1.489 7.804 -0.107 1.00 0.00 H new ATOM 0 HG LEU A 12 -4.056 6.373 -0.754 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -2.436 5.071 -2.289 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -2.448 6.802 -2.705 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -1.120 6.131 -1.729 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -2.899 4.306 -0.096 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -1.492 5.265 0.424 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -3.050 5.443 1.265 1.00 0.00 H new ATOM 178 N TYR A 13 -3.698 6.956 2.933 1.00 0.00 N ATOM 179 CA TYR A 13 -3.543 6.037 4.053 1.00 0.00 C ATOM 180 C TYR A 13 -3.983 4.636 3.591 1.00 0.00 C ATOM 181 O TYR A 13 -4.962 4.491 2.856 1.00 0.00 O ATOM 182 CB TYR A 13 -4.415 6.463 5.243 1.00 0.00 C ATOM 183 CG TYR A 13 -4.151 7.831 5.847 1.00 0.00 C ATOM 184 CD1 TYR A 13 -3.258 7.978 6.928 1.00 0.00 C ATOM 185 CD2 TYR A 13 -4.886 8.944 5.397 1.00 0.00 C ATOM 186 CE1 TYR A 13 -3.065 9.242 7.518 1.00 0.00 C ATOM 187 CE2 TYR A 13 -4.724 10.202 6.005 1.00 0.00 C ATOM 188 CZ TYR A 13 -3.807 10.358 7.065 1.00 0.00 C ATOM 189 OH TYR A 13 -3.654 11.563 7.676 1.00 0.00 O ATOM 0 H TYR A 13 -4.676 7.051 2.660 1.00 0.00 H new ATOM 0 HA TYR A 13 -2.501 6.039 4.372 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -5.457 6.430 4.926 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -4.298 5.719 6.030 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -2.721 7.120 7.304 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -5.580 8.831 4.578 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -2.349 9.360 8.318 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -5.301 11.047 5.661 1.00 0.00 H new ATOM 0 HH TYR A 13 -4.234 12.225 7.244 1.00 0.00 H new ATOM 199 N LEU A 14 -3.283 3.584 4.011 1.00 0.00 N ATOM 200 CA LEU A 14 -3.542 2.188 3.671 1.00 0.00 C ATOM 201 C LEU A 14 -3.081 1.385 4.882 1.00 0.00 C ATOM 202 O LEU A 14 -1.903 1.452 5.242 1.00 0.00 O ATOM 203 CB LEU A 14 -2.744 1.801 2.407 1.00 0.00 C ATOM 204 CG LEU A 14 -3.101 0.496 1.681 1.00 0.00 C ATOM 205 CD1 LEU A 14 -1.910 -0.007 0.862 1.00 0.00 C ATOM 206 CD2 LEU A 14 -3.623 -0.669 2.521 1.00 0.00 C ATOM 0 H LEU A 14 -2.479 3.689 4.629 1.00 0.00 H new ATOM 0 HA LEU A 14 -4.593 1.999 3.451 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -2.844 2.616 1.690 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -1.691 1.748 2.684 1.00 0.00 H new ATOM 0 HG LEU A 14 -3.947 0.801 1.065 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -2.182 -0.933 0.355 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -1.634 0.744 0.122 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -1.065 -0.192 1.525 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -3.832 -1.520 1.873 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -2.872 -0.951 3.259 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -4.538 -0.368 3.031 1.00 0.00 H new ATOM 218 N TRP A 15 -3.976 0.662 5.543 1.00 0.00 N ATOM 219 CA TRP A 15 -3.632 -0.184 6.669 1.00 0.00 C ATOM 220 C TRP A 15 -4.359 -1.517 6.537 1.00 0.00 C ATOM 221 O TRP A 15 -5.094 -1.762 5.581 1.00 0.00 O ATOM 222 CB TRP A 15 -3.925 0.575 7.974 1.00 0.00 C ATOM 223 CG TRP A 15 -5.357 0.900 8.278 1.00 0.00 C ATOM 224 CD1 TRP A 15 -6.125 0.275 9.201 1.00 0.00 C ATOM 225 CD2 TRP A 15 -6.170 1.987 7.728 1.00 0.00 C ATOM 226 NE1 TRP A 15 -7.371 0.892 9.224 1.00 0.00 N ATOM 227 CE2 TRP A 15 -7.447 1.975 8.359 1.00 0.00 C ATOM 228 CE3 TRP A 15 -5.943 3.006 6.779 1.00 0.00 C ATOM 229 CZ2 TRP A 15 -8.438 2.944 8.067 1.00 0.00 C ATOM 230 CZ3 TRP A 15 -6.922 3.971 6.481 1.00 0.00 C ATOM 231 CH2 TRP A 15 -8.163 3.977 7.140 1.00 0.00 C ATOM 0 H TRP A 15 -4.968 0.649 5.307 1.00 0.00 H new ATOM 0 HA TRP A 15 -2.568 -0.422 6.686 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -3.531 -0.014 8.802 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -3.365 1.510 7.953 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -5.822 -0.560 9.815 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -8.145 0.583 9.812 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -4.992 3.046 6.268 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -9.402 2.894 8.551 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -6.716 4.721 5.732 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -8.890 4.752 6.944 1.00 0.00 H new ATOM 242 N ILE A 16 -4.090 -2.435 7.447 1.00 0.00 N ATOM 243 CA ILE A 16 -4.786 -3.700 7.554 1.00 0.00 C ATOM 244 C ILE A 16 -5.458 -3.505 8.898 1.00 0.00 C ATOM 245 O ILE A 16 -4.757 -3.324 9.892 1.00 0.00 O ATOM 246 CB ILE A 16 -3.821 -4.902 7.498 1.00 0.00 C ATOM 247 CG1 ILE A 16 -2.738 -4.765 6.419 1.00 0.00 C ATOM 248 CG2 ILE A 16 -4.616 -6.154 7.171 1.00 0.00 C ATOM 249 CD1 ILE A 16 -1.693 -5.881 6.394 1.00 0.00 C ATOM 0 H ILE A 16 -3.361 -2.316 8.150 1.00 0.00 H new ATOM 0 HA ILE A 16 -5.477 -3.933 6.744 1.00 0.00 H new ATOM 0 HB ILE A 16 -3.332 -4.951 8.471 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -3.224 -4.723 5.444 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -2.226 -3.814 6.561 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -3.944 -7.011 7.129 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -5.367 -6.320 7.943 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -5.108 -6.031 6.206 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -0.975 -5.689 5.597 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -1.172 -5.913 7.351 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -2.186 -6.837 6.217 1.00 0.00 H new ATOM 261 N ASP A 17 -6.784 -3.419 8.939 1.00 0.00 N ATOM 262 CA ASP A 17 -7.458 -3.095 10.185 1.00 0.00 C ATOM 263 C ASP A 17 -7.541 -4.316 11.095 1.00 0.00 C ATOM 264 O ASP A 17 -7.706 -5.462 10.661 1.00 0.00 O ATOM 265 CB ASP A 17 -8.821 -2.445 9.936 1.00 0.00 C ATOM 266 CG ASP A 17 -9.824 -3.410 9.323 1.00 0.00 C ATOM 267 OD1 ASP A 17 -9.821 -3.498 8.075 1.00 0.00 O ATOM 268 OD2 ASP A 17 -10.606 -3.992 10.111 1.00 0.00 O ATOM 0 H ASP A 17 -7.400 -3.566 8.140 1.00 0.00 H new ATOM 0 HA ASP A 17 -6.860 -2.351 10.711 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -9.216 -2.065 10.878 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -8.696 -1.588 9.274 1.00 0.00 H new ATOM 273 N ALA A 18 -7.430 -4.038 12.393 1.00 0.00 N ATOM 274 CA ALA A 18 -7.349 -5.047 13.431 1.00 0.00 C ATOM 275 C ALA A 18 -8.602 -5.916 13.514 1.00 0.00 C ATOM 276 O ALA A 18 -8.515 -7.087 13.896 1.00 0.00 O ATOM 277 CB ALA A 18 -7.122 -4.317 14.761 1.00 0.00 C ATOM 0 H ALA A 18 -7.394 -3.084 12.753 1.00 0.00 H new ATOM 0 HA ALA A 18 -6.528 -5.726 13.200 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -7.055 -5.045 15.569 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -6.195 -3.747 14.709 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -7.954 -3.639 14.951 1.00 0.00 H new ATOM 283 N HIS A 19 -9.757 -5.391 13.096 1.00 0.00 N ATOM 284 CA HIS A 19 -11.021 -6.081 13.234 1.00 0.00 C ATOM 285 C HIS A 19 -10.991 -7.305 12.323 1.00 0.00 C ATOM 286 O HIS A 19 -11.492 -8.367 12.699 1.00 0.00 O ATOM 287 CB HIS A 19 -12.160 -5.150 12.817 1.00 0.00 C ATOM 288 CG HIS A 19 -11.997 -3.711 13.232 1.00 0.00 C ATOM 289 ND1 HIS A 19 -11.684 -2.711 12.345 1.00 0.00 N ATOM 290 CD2 HIS A 19 -12.019 -3.170 14.489 1.00 0.00 C ATOM 291 CE1 HIS A 19 -11.562 -1.571 13.043 1.00 0.00 C ATOM 292 NE2 HIS A 19 -11.775 -1.800 14.350 1.00 0.00 N ATOM 0 H HIS A 19 -9.831 -4.475 12.654 1.00 0.00 H new ATOM 0 HA HIS A 19 -11.180 -6.385 14.269 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -12.261 -5.189 11.732 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -13.091 -5.530 13.238 1.00 0.00 H new ATOM 0 HD1 HIS A 19 -11.566 -2.815 11.337 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -12.192 -3.701 15.414 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -11.326 -0.608 12.615 1.00 0.00 H new ATOM 300 N GLN A 20 -10.407 -7.162 11.126 1.00 0.00 N ATOM 301 CA GLN A 20 -10.198 -8.277 10.229 1.00 0.00 C ATOM 302 C GLN A 20 -9.272 -9.277 10.909 1.00 0.00 C ATOM 303 O GLN A 20 -9.667 -10.435 11.021 1.00 0.00 O ATOM 304 CB GLN A 20 -9.669 -7.810 8.862 1.00 0.00 C ATOM 305 CG GLN A 20 -9.063 -8.937 8.004 1.00 0.00 C ATOM 306 CD GLN A 20 -10.039 -10.026 7.540 1.00 0.00 C ATOM 307 OE1 GLN A 20 -10.112 -10.333 6.361 1.00 0.00 O ATOM 308 NE2 GLN A 20 -10.772 -10.697 8.413 1.00 0.00 N ATOM 0 H GLN A 20 -10.072 -6.269 10.765 1.00 0.00 H new ATOM 0 HA GLN A 20 -11.148 -8.769 10.019 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -10.485 -7.345 8.308 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -8.912 -7.042 9.020 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -8.603 -8.489 7.123 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -8.264 -9.411 8.574 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -10.729 -10.460 9.404 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -11.380 -11.452 8.095 1.00 0.00 H new ATOM 317 N ALA A 21 -8.062 -8.883 11.318 1.00 0.00 N ATOM 318 CA ALA A 21 -7.113 -9.800 11.947 1.00 0.00 C ATOM 319 C ALA A 21 -7.757 -10.587 13.087 1.00 0.00 C ATOM 320 O ALA A 21 -7.583 -11.803 13.126 1.00 0.00 O ATOM 321 CB ALA A 21 -5.820 -9.109 12.359 1.00 0.00 C ATOM 0 H ALA A 21 -7.717 -7.928 11.223 1.00 0.00 H new ATOM 0 HA ALA A 21 -6.827 -10.530 11.190 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -5.151 -9.835 12.821 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -5.340 -8.681 11.479 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -6.043 -8.316 13.073 1.00 0.00 H new ATOM 327 N ARG A 22 -8.586 -9.964 13.929 1.00 0.00 N ATOM 328 CA ARG A 22 -9.340 -10.669 14.952 1.00 0.00 C ATOM 329 C ARG A 22 -10.076 -11.825 14.284 1.00 0.00 C ATOM 330 O ARG A 22 -9.724 -12.980 14.500 1.00 0.00 O ATOM 331 CB ARG A 22 -10.287 -9.687 15.656 1.00 0.00 C ATOM 332 CG ARG A 22 -10.973 -10.277 16.901 1.00 0.00 C ATOM 333 CD ARG A 22 -12.424 -9.788 17.034 1.00 0.00 C ATOM 334 NE ARG A 22 -12.514 -8.320 16.983 1.00 0.00 N ATOM 335 CZ ARG A 22 -13.248 -7.547 16.178 1.00 0.00 C ATOM 336 NH1 ARG A 22 -14.133 -8.080 15.335 1.00 0.00 N ATOM 337 NH2 ARG A 22 -13.099 -6.232 16.213 1.00 0.00 N ATOM 0 H ARG A 22 -8.749 -8.957 13.915 1.00 0.00 H new ATOM 0 HA ARG A 22 -8.687 -11.081 15.721 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -9.725 -8.799 15.947 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -11.051 -9.363 14.950 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -10.959 -11.365 16.843 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -10.412 -9.998 17.793 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -13.027 -10.217 16.233 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -12.843 -10.145 17.975 1.00 0.00 H new ATOM 0 HE ARG A 22 -11.934 -7.822 17.658 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -14.257 -9.092 15.298 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -14.686 -7.476 14.727 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -12.425 -5.812 16.853 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -13.658 -5.639 15.600 1.00 0.00 H new ATOM 351 N VAL A 23 -11.022 -11.529 13.394 1.00 0.00 N ATOM 352 CA VAL A 23 -11.819 -12.507 12.660 1.00 0.00 C ATOM 353 C VAL A 23 -10.934 -13.574 11.991 1.00 0.00 C ATOM 354 O VAL A 23 -11.405 -14.684 11.750 1.00 0.00 O ATOM 355 CB VAL A 23 -12.734 -11.760 11.659 1.00 0.00 C ATOM 356 CG1 VAL A 23 -13.585 -12.685 10.776 1.00 0.00 C ATOM 357 CG2 VAL A 23 -13.706 -10.820 12.394 1.00 0.00 C ATOM 0 H VAL A 23 -11.262 -10.566 13.157 1.00 0.00 H new ATOM 0 HA VAL A 23 -12.455 -13.058 13.353 1.00 0.00 H new ATOM 0 HB VAL A 23 -12.043 -11.209 11.021 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -14.197 -12.084 10.103 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -12.931 -13.332 10.191 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -14.231 -13.296 11.406 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -14.337 -10.308 11.667 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -14.331 -11.401 13.072 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -13.139 -10.084 12.964 1.00 0.00 H new ATOM 367 N LEU A 24 -9.663 -13.274 11.712 1.00 0.00 N ATOM 368 CA LEU A 24 -8.746 -14.190 11.085 1.00 0.00 C ATOM 369 C LEU A 24 -8.064 -15.150 12.057 1.00 0.00 C ATOM 370 O LEU A 24 -7.822 -16.299 11.689 1.00 0.00 O ATOM 371 CB LEU A 24 -7.639 -13.409 10.371 1.00 0.00 C ATOM 372 CG LEU A 24 -8.082 -12.707 9.079 1.00 0.00 C ATOM 373 CD1 LEU A 24 -6.956 -11.828 8.519 1.00 0.00 C ATOM 374 CD2 LEU A 24 -8.634 -13.580 7.952 1.00 0.00 C ATOM 0 H LEU A 24 -9.248 -12.367 11.925 1.00 0.00 H new ATOM 0 HA LEU A 24 -9.352 -14.779 10.396 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -7.240 -12.661 11.057 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -6.824 -14.093 10.136 1.00 0.00 H new ATOM 0 HG LEU A 24 -8.936 -12.119 9.416 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -7.295 -11.342 7.604 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -6.686 -11.070 9.254 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -6.086 -12.447 8.300 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -8.906 -12.951 7.104 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -7.874 -14.298 7.642 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -9.516 -14.115 8.305 1.00 0.00 H new ATOM 386 N ILE A 25 -7.702 -14.677 13.255 1.00 0.00 N ATOM 387 CA ILE A 25 -6.903 -15.463 14.224 1.00 0.00 C ATOM 388 C ILE A 25 -7.208 -15.260 15.718 1.00 0.00 C ATOM 389 O ILE A 25 -6.457 -15.691 16.589 1.00 0.00 O ATOM 390 CB ILE A 25 -5.391 -15.302 13.927 1.00 0.00 C ATOM 391 CG1 ILE A 25 -4.982 -13.820 13.827 1.00 0.00 C ATOM 392 CG2 ILE A 25 -4.938 -16.066 12.668 1.00 0.00 C ATOM 393 CD1 ILE A 25 -3.487 -13.652 14.095 1.00 0.00 C ATOM 0 H ILE A 25 -7.949 -13.745 13.586 1.00 0.00 H new ATOM 0 HA ILE A 25 -7.223 -16.491 14.056 1.00 0.00 H new ATOM 0 HB ILE A 25 -4.877 -15.749 14.778 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -5.224 -13.437 12.836 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -5.553 -13.231 14.544 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -3.870 -15.913 12.514 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -5.138 -17.130 12.796 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -5.486 -15.696 11.801 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -3.220 -12.598 14.019 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -3.254 -14.014 15.096 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -2.919 -14.224 13.361 1.00 0.00 H new ATOM 405 N GLY A 26 -8.330 -14.632 16.010 1.00 0.00 N ATOM 406 CA GLY A 26 -8.824 -14.193 17.319 1.00 0.00 C ATOM 407 C GLY A 26 -7.938 -13.165 18.032 1.00 0.00 C ATOM 408 O GLY A 26 -8.232 -12.776 19.157 1.00 0.00 O ATOM 0 H GLY A 26 -8.989 -14.388 15.271 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -9.819 -13.767 17.191 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -8.931 -15.066 17.962 1.00 0.00 H new ATOM 412 N PHE A 27 -6.838 -12.783 17.398 1.00 0.00 N ATOM 413 CA PHE A 27 -5.810 -11.847 17.819 1.00 0.00 C ATOM 414 C PHE A 27 -6.081 -10.544 17.072 1.00 0.00 C ATOM 415 O PHE A 27 -6.301 -10.609 15.862 1.00 0.00 O ATOM 416 CB PHE A 27 -4.479 -12.526 17.491 1.00 0.00 C ATOM 417 CG PHE A 27 -3.223 -11.708 17.637 1.00 0.00 C ATOM 418 CD1 PHE A 27 -2.878 -10.782 16.635 1.00 0.00 C ATOM 419 CD2 PHE A 27 -2.355 -11.941 18.720 1.00 0.00 C ATOM 420 CE1 PHE A 27 -1.661 -10.094 16.716 1.00 0.00 C ATOM 421 CE2 PHE A 27 -1.134 -11.253 18.796 1.00 0.00 C ATOM 422 CZ PHE A 27 -0.789 -10.337 17.790 1.00 0.00 C ATOM 0 H PHE A 27 -6.623 -13.164 16.477 1.00 0.00 H new ATOM 0 HA PHE A 27 -5.794 -11.597 18.880 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -4.384 -13.404 18.130 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -4.529 -12.884 16.463 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -3.549 -10.603 15.808 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -2.628 -12.647 19.490 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -1.393 -9.377 15.954 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -0.463 -11.428 19.624 1.00 0.00 H new ATOM 0 HZ PHE A 27 0.155 -9.815 17.842 1.00 0.00 H new ATOM 432 N GLU A 28 -6.040 -9.388 17.733 1.00 0.00 N ATOM 433 CA GLU A 28 -6.422 -8.113 17.137 1.00 0.00 C ATOM 434 C GLU A 28 -5.275 -7.102 17.248 1.00 0.00 C ATOM 435 O GLU A 28 -4.942 -6.683 18.353 1.00 0.00 O ATOM 436 CB GLU A 28 -7.711 -7.688 17.875 1.00 0.00 C ATOM 437 CG GLU A 28 -8.385 -6.423 17.324 1.00 0.00 C ATOM 438 CD GLU A 28 -9.903 -6.350 17.557 1.00 0.00 C ATOM 439 OE1 GLU A 28 -10.470 -7.129 18.357 1.00 0.00 O ATOM 440 OE2 GLU A 28 -10.584 -5.583 16.840 1.00 0.00 O ATOM 0 H GLU A 28 -5.738 -9.312 18.704 1.00 0.00 H new ATOM 0 HA GLU A 28 -6.618 -8.180 16.067 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -8.425 -8.511 17.832 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -7.474 -7.527 18.927 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -7.919 -5.551 17.782 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -8.192 -6.362 16.253 1.00 0.00 H new ATOM 447 N GLU A 29 -4.700 -6.713 16.103 1.00 0.00 N ATOM 448 CA GLU A 29 -3.679 -5.681 15.904 1.00 0.00 C ATOM 449 C GLU A 29 -3.866 -5.171 14.465 1.00 0.00 C ATOM 450 O GLU A 29 -4.174 -5.981 13.582 1.00 0.00 O ATOM 451 CB GLU A 29 -2.249 -6.250 16.023 1.00 0.00 C ATOM 452 CG GLU A 29 -1.787 -6.593 17.451 1.00 0.00 C ATOM 453 CD GLU A 29 -0.317 -7.051 17.534 1.00 0.00 C ATOM 454 OE1 GLU A 29 0.278 -7.407 16.487 1.00 0.00 O ATOM 455 OE2 GLU A 29 0.210 -7.123 18.667 1.00 0.00 O ATOM 0 H GLU A 29 -4.960 -7.150 15.219 1.00 0.00 H new ATOM 0 HA GLU A 29 -3.792 -4.905 16.661 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -2.184 -7.151 15.413 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -1.553 -5.527 15.599 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -1.922 -5.718 18.087 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -2.427 -7.380 17.851 1.00 0.00 H new ATOM 462 N ASP A 30 -3.758 -3.858 14.229 1.00 0.00 N ATOM 463 CA ASP A 30 -3.774 -3.256 12.887 1.00 0.00 C ATOM 464 C ASP A 30 -2.329 -3.277 12.373 1.00 0.00 C ATOM 465 O ASP A 30 -1.391 -3.534 13.133 1.00 0.00 O ATOM 466 CB ASP A 30 -4.296 -1.806 12.891 1.00 0.00 C ATOM 467 CG ASP A 30 -3.243 -0.771 13.301 1.00 0.00 C ATOM 468 OD1 ASP A 30 -3.128 -0.537 14.522 1.00 0.00 O ATOM 469 OD2 ASP A 30 -2.605 -0.210 12.379 1.00 0.00 O ATOM 0 H ASP A 30 -3.655 -3.171 14.976 1.00 0.00 H new ATOM 0 HA ASP A 30 -4.450 -3.826 12.249 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -4.665 -1.560 11.895 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -5.144 -1.737 13.572 1.00 0.00 H new ATOM 474 N ILE A 31 -2.136 -3.044 11.076 1.00 0.00 N ATOM 475 CA ILE A 31 -0.808 -2.896 10.505 1.00 0.00 C ATOM 476 C ILE A 31 -0.920 -1.683 9.594 1.00 0.00 C ATOM 477 O ILE A 31 -1.577 -1.745 8.551 1.00 0.00 O ATOM 478 CB ILE A 31 -0.317 -4.164 9.762 1.00 0.00 C ATOM 479 CG1 ILE A 31 -0.272 -5.447 10.630 1.00 0.00 C ATOM 480 CG2 ILE A 31 1.107 -3.896 9.230 1.00 0.00 C ATOM 481 CD1 ILE A 31 -1.575 -6.259 10.643 1.00 0.00 C ATOM 0 H ILE A 31 -2.894 -2.954 10.399 1.00 0.00 H new ATOM 0 HA ILE A 31 -0.052 -2.758 11.278 1.00 0.00 H new ATOM 0 HB ILE A 31 -1.041 -4.351 8.969 1.00 0.00 H new ATOM 0 HG12 ILE A 31 0.534 -6.085 10.269 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -0.024 -5.168 11.654 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.471 -4.778 8.703 1.00 0.00 H new ATOM 0 HG22 ILE A 31 1.086 -3.048 8.546 1.00 0.00 H new ATOM 0 HG23 ILE A 31 1.771 -3.673 10.065 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -1.450 -7.138 11.276 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -2.384 -5.642 11.035 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -1.818 -6.574 9.628 1.00 0.00 H new ATOM 493 N LEU A 32 -0.230 -0.602 9.946 1.00 0.00 N ATOM 494 CA LEU A 32 -0.283 0.646 9.205 1.00 0.00 C ATOM 495 C LEU A 32 0.790 0.551 8.112 1.00 0.00 C ATOM 496 O LEU A 32 1.980 0.467 8.420 1.00 0.00 O ATOM 497 CB LEU A 32 -0.060 1.819 10.181 1.00 0.00 C ATOM 498 CG LEU A 32 -0.579 3.195 9.709 1.00 0.00 C ATOM 499 CD1 LEU A 32 -0.509 3.416 8.198 1.00 0.00 C ATOM 500 CD2 LEU A 32 -2.029 3.426 10.151 1.00 0.00 C ATOM 0 H LEU A 32 0.385 -0.571 10.759 1.00 0.00 H new ATOM 0 HA LEU A 32 -1.249 0.822 8.732 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -0.542 1.576 11.128 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.008 1.904 10.380 1.00 0.00 H new ATOM 0 HG LEU A 32 0.096 3.908 10.182 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -0.893 4.407 7.957 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.526 3.338 7.866 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -1.110 2.661 7.692 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -2.364 4.403 9.803 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -2.667 2.651 9.726 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -2.088 3.388 11.239 1.00 0.00 H new ATOM 512 N ILE A 33 0.392 0.519 6.836 1.00 0.00 N ATOM 513 CA ILE A 33 1.314 0.355 5.712 1.00 0.00 C ATOM 514 C ILE A 33 1.715 1.744 5.203 1.00 0.00 C ATOM 515 O ILE A 33 2.901 2.071 5.084 1.00 0.00 O ATOM 516 CB ILE A 33 0.673 -0.513 4.601 1.00 0.00 C ATOM 517 CG1 ILE A 33 0.171 -1.855 5.182 1.00 0.00 C ATOM 518 CG2 ILE A 33 1.683 -0.762 3.468 1.00 0.00 C ATOM 519 CD1 ILE A 33 -0.325 -2.829 4.113 1.00 0.00 C ATOM 0 H ILE A 33 -0.584 0.607 6.555 1.00 0.00 H new ATOM 0 HA ILE A 33 2.213 -0.171 6.035 1.00 0.00 H new ATOM 0 HB ILE A 33 -0.182 0.025 4.192 1.00 0.00 H new ATOM 0 HG12 ILE A 33 0.978 -2.324 5.745 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -0.637 -1.658 5.887 1.00 0.00 H new ATOM 0 HG21 ILE A 33 1.218 -1.373 2.694 1.00 0.00 H new ATOM 0 HG22 ILE A 33 1.992 0.192 3.040 1.00 0.00 H new ATOM 0 HG23 ILE A 33 2.555 -1.281 3.866 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -0.663 -3.750 4.588 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -1.153 -2.378 3.566 1.00 0.00 H new ATOM 0 HD13 ILE A 33 0.487 -3.054 3.421 1.00 0.00 H new ATOM 531 N VAL A 34 0.714 2.544 4.844 1.00 0.00 N ATOM 532 CA VAL A 34 0.848 3.848 4.224 1.00 0.00 C ATOM 533 C VAL A 34 0.053 4.822 5.076 1.00 0.00 C ATOM 534 O VAL A 34 -1.086 4.545 5.438 1.00 0.00 O ATOM 535 CB VAL A 34 0.328 3.813 2.765 1.00 0.00 C ATOM 536 CG1 VAL A 34 0.747 5.049 1.958 1.00 0.00 C ATOM 537 CG2 VAL A 34 0.829 2.585 1.999 1.00 0.00 C ATOM 0 H VAL A 34 -0.261 2.281 4.988 1.00 0.00 H new ATOM 0 HA VAL A 34 1.892 4.156 4.173 1.00 0.00 H new ATOM 0 HB VAL A 34 -0.757 3.782 2.863 1.00 0.00 H new ATOM 0 HG11 VAL A 34 0.355 4.971 0.944 1.00 0.00 H new ATOM 0 HG12 VAL A 34 0.349 5.946 2.433 1.00 0.00 H new ATOM 0 HG13 VAL A 34 1.835 5.109 1.923 1.00 0.00 H new ATOM 0 HG21 VAL A 34 0.437 2.606 0.982 1.00 0.00 H new ATOM 0 HG22 VAL A 34 1.919 2.595 1.969 1.00 0.00 H new ATOM 0 HG23 VAL A 34 0.488 1.679 2.500 1.00 0.00 H new ATOM 547 N SER A 35 0.645 5.962 5.377 1.00 0.00 N ATOM 548 CA SER A 35 0.041 7.087 6.059 1.00 0.00 C ATOM 549 C SER A 35 0.617 8.264 5.304 1.00 0.00 C ATOM 550 O SER A 35 1.836 8.271 5.132 1.00 0.00 O ATOM 551 CB SER A 35 0.441 7.113 7.544 1.00 0.00 C ATOM 552 OG SER A 35 1.813 6.794 7.724 1.00 0.00 O ATOM 0 H SER A 35 1.621 6.136 5.136 1.00 0.00 H new ATOM 0 HA SER A 35 -1.049 7.068 6.064 1.00 0.00 H new ATOM 0 HB2 SER A 35 0.240 8.101 7.958 1.00 0.00 H new ATOM 0 HB3 SER A 35 -0.173 6.404 8.099 1.00 0.00 H new ATOM 0 HG SER A 35 2.340 7.196 7.002 1.00 0.00 H new ATOM 558 N GLU A 36 -0.205 9.182 4.798 1.00 0.00 N ATOM 559 CA GLU A 36 0.210 10.340 4.005 1.00 0.00 C ATOM 560 C GLU A 36 1.234 9.995 2.898 1.00 0.00 C ATOM 561 O GLU A 36 2.119 10.780 2.579 1.00 0.00 O ATOM 562 CB GLU A 36 0.561 11.551 4.909 1.00 0.00 C ATOM 563 CG GLU A 36 1.581 11.221 6.009 1.00 0.00 C ATOM 564 CD GLU A 36 2.294 12.410 6.648 1.00 0.00 C ATOM 565 OE1 GLU A 36 2.919 13.195 5.902 1.00 0.00 O ATOM 566 OE2 GLU A 36 2.501 12.392 7.883 1.00 0.00 O ATOM 0 H GLU A 36 -1.215 9.139 4.933 1.00 0.00 H new ATOM 0 HA GLU A 36 -0.650 10.672 3.423 1.00 0.00 H new ATOM 0 HB2 GLU A 36 0.956 12.355 4.288 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -0.352 11.925 5.372 1.00 0.00 H new ATOM 0 HG2 GLU A 36 1.069 10.666 6.795 1.00 0.00 H new ATOM 0 HG3 GLU A 36 2.335 10.556 5.588 1.00 0.00 H new ATOM 573 N GLY A 37 1.139 8.799 2.293 1.00 0.00 N ATOM 574 CA GLY A 37 2.114 8.289 1.307 1.00 0.00 C ATOM 575 C GLY A 37 3.528 8.053 1.880 1.00 0.00 C ATOM 576 O GLY A 37 4.430 7.508 1.237 1.00 0.00 O ATOM 0 H GLY A 37 0.374 8.149 2.475 1.00 0.00 H new ATOM 0 HA2 GLY A 37 1.740 7.352 0.894 1.00 0.00 H new ATOM 0 HA3 GLY A 37 2.182 8.997 0.481 1.00 0.00 H new ATOM 580 N LYS A 38 3.729 8.394 3.143 1.00 0.00 N ATOM 581 CA LYS A 38 4.942 8.416 3.945 1.00 0.00 C ATOM 582 C LYS A 38 5.304 7.020 4.448 1.00 0.00 C ATOM 583 O LYS A 38 5.822 6.904 5.551 1.00 0.00 O ATOM 584 CB LYS A 38 4.792 9.497 5.034 1.00 0.00 C ATOM 585 CG LYS A 38 6.131 9.986 5.613 1.00 0.00 C ATOM 586 CD LYS A 38 6.100 11.489 5.940 1.00 0.00 C ATOM 587 CE LYS A 38 5.426 11.772 7.289 1.00 0.00 C ATOM 588 NZ LYS A 38 5.085 13.199 7.473 1.00 0.00 N ATOM 0 H LYS A 38 2.936 8.704 3.705 1.00 0.00 H new ATOM 0 HA LYS A 38 5.805 8.699 3.343 1.00 0.00 H new ATOM 0 HB2 LYS A 38 4.255 10.349 4.616 1.00 0.00 H new ATOM 0 HB3 LYS A 38 4.180 9.101 5.844 1.00 0.00 H new ATOM 0 HG2 LYS A 38 6.363 9.423 6.517 1.00 0.00 H new ATOM 0 HG3 LYS A 38 6.930 9.786 4.899 1.00 0.00 H new ATOM 0 HD2 LYS A 38 7.118 11.877 5.955 1.00 0.00 H new ATOM 0 HD3 LYS A 38 5.568 12.020 5.151 1.00 0.00 H new ATOM 0 HE2 LYS A 38 4.519 11.173 7.369 1.00 0.00 H new ATOM 0 HE3 LYS A 38 6.089 11.455 8.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 4.558 13.318 8.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 5.958 13.763 7.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 4.499 13.521 6.677 1.00 0.00 H new ATOM 602 N MET A 39 5.088 5.971 3.633 1.00 0.00 N ATOM 603 CA MET A 39 5.246 4.558 4.002 1.00 0.00 C ATOM 604 C MET A 39 6.436 4.317 4.922 1.00 0.00 C ATOM 605 O MET A 39 7.577 4.660 4.578 1.00 0.00 O ATOM 606 CB MET A 39 5.581 3.698 2.771 1.00 0.00 C ATOM 607 CG MET A 39 4.398 3.302 1.926 1.00 0.00 C ATOM 608 SD MET A 39 4.919 2.488 0.401 1.00 0.00 S ATOM 609 CE MET A 39 3.334 1.830 -0.171 1.00 0.00 C ATOM 0 H MET A 39 4.788 6.092 2.666 1.00 0.00 H new ATOM 0 HA MET A 39 4.300 4.298 4.477 1.00 0.00 H new ATOM 0 HB2 MET A 39 6.287 4.245 2.146 1.00 0.00 H new ATOM 0 HB3 MET A 39 6.087 2.793 3.106 1.00 0.00 H new ATOM 0 HG2 MET A 39 3.751 2.634 2.494 1.00 0.00 H new ATOM 0 HG3 MET A 39 3.809 4.187 1.685 1.00 0.00 H new ATOM 0 HE1 MET A 39 3.387 1.632 -1.242 1.00 0.00 H new ATOM 0 HE2 MET A 39 3.112 0.903 0.358 1.00 0.00 H new ATOM 0 HE3 MET A 39 2.546 2.557 0.025 1.00 0.00 H new ATOM 619 N ALA A 40 6.113 3.732 6.072 1.00 0.00 N ATOM 620 CA ALA A 40 7.034 3.255 7.084 1.00 0.00 C ATOM 621 C ALA A 40 7.865 2.118 6.473 1.00 0.00 C ATOM 622 O ALA A 40 7.510 1.572 5.427 1.00 0.00 O ATOM 623 CB ALA A 40 6.164 2.759 8.254 1.00 0.00 C ATOM 0 H ALA A 40 5.140 3.571 6.332 1.00 0.00 H new ATOM 0 HA ALA A 40 7.723 4.022 7.436 1.00 0.00 H new ATOM 0 HB1 ALA A 40 6.806 2.385 9.052 1.00 0.00 H new ATOM 0 HB2 ALA A 40 5.558 3.583 8.631 1.00 0.00 H new ATOM 0 HB3 ALA A 40 5.511 1.957 7.908 1.00 0.00 H new ATOM 629 N PRO A 41 8.945 1.688 7.134 1.00 0.00 N ATOM 630 CA PRO A 41 9.747 0.533 6.726 1.00 0.00 C ATOM 631 C PRO A 41 9.011 -0.808 6.962 1.00 0.00 C ATOM 632 O PRO A 41 9.655 -1.836 7.174 1.00 0.00 O ATOM 633 CB PRO A 41 11.062 0.689 7.507 1.00 0.00 C ATOM 634 CG PRO A 41 10.670 1.494 8.746 1.00 0.00 C ATOM 635 CD PRO A 41 9.535 2.373 8.269 1.00 0.00 C ATOM 0 HA PRO A 41 9.939 0.506 5.653 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.481 -0.280 7.778 1.00 0.00 H new ATOM 0 HB3 PRO A 41 11.816 1.209 6.917 1.00 0.00 H new ATOM 0 HG2 PRO A 41 10.355 0.843 9.561 1.00 0.00 H new ATOM 0 HG3 PRO A 41 11.506 2.088 9.117 1.00 0.00 H new ATOM 0 HD2 PRO A 41 8.799 2.523 9.059 1.00 0.00 H new ATOM 0 HD3 PRO A 41 9.900 3.359 7.982 1.00 0.00 H new ATOM 643 N PHE A 42 7.671 -0.818 6.904 1.00 0.00 N ATOM 644 CA PHE A 42 6.790 -1.941 7.217 1.00 0.00 C ATOM 645 C PHE A 42 7.140 -3.210 6.440 1.00 0.00 C ATOM 646 O PHE A 42 6.926 -4.321 6.917 1.00 0.00 O ATOM 647 CB PHE A 42 5.340 -1.541 6.828 1.00 0.00 C ATOM 648 CG PHE A 42 5.024 -1.674 5.332 1.00 0.00 C ATOM 649 CD1 PHE A 42 5.249 -0.618 4.429 1.00 0.00 C ATOM 650 CD2 PHE A 42 4.600 -2.917 4.821 1.00 0.00 C ATOM 651 CE1 PHE A 42 5.111 -0.823 3.043 1.00 0.00 C ATOM 652 CE2 PHE A 42 4.478 -3.133 3.436 1.00 0.00 C ATOM 653 CZ PHE A 42 4.749 -2.085 2.540 1.00 0.00 C ATOM 0 H PHE A 42 7.147 0.010 6.620 1.00 0.00 H new ATOM 0 HA PHE A 42 6.901 -2.155 8.280 1.00 0.00 H new ATOM 0 HB2 PHE A 42 4.642 -2.161 7.391 1.00 0.00 H new ATOM 0 HB3 PHE A 42 5.167 -0.509 7.133 1.00 0.00 H new ATOM 0 HD1 PHE A 42 5.529 0.356 4.802 1.00 0.00 H new ATOM 0 HD2 PHE A 42 4.364 -3.719 5.505 1.00 0.00 H new ATOM 0 HE1 PHE A 42 5.285 -0.004 2.361 1.00 0.00 H new ATOM 0 HE2 PHE A 42 4.177 -4.101 3.063 1.00 0.00 H new ATOM 0 HZ PHE A 42 4.680 -2.247 1.475 1.00 0.00 H new ATOM 663 N THR A 43 7.747 -3.045 5.269 1.00 0.00 N ATOM 664 CA THR A 43 8.035 -4.101 4.321 1.00 0.00 C ATOM 665 C THR A 43 8.986 -5.146 4.917 1.00 0.00 C ATOM 666 O THR A 43 8.900 -6.321 4.565 1.00 0.00 O ATOM 667 CB THR A 43 8.624 -3.435 3.070 1.00 0.00 C ATOM 668 OG1 THR A 43 7.965 -2.208 2.805 1.00 0.00 O ATOM 669 CG2 THR A 43 8.421 -4.325 1.843 1.00 0.00 C ATOM 0 H THR A 43 8.063 -2.130 4.947 1.00 0.00 H new ATOM 0 HA THR A 43 7.126 -4.645 4.063 1.00 0.00 H new ATOM 0 HB THR A 43 9.685 -3.272 3.258 1.00 0.00 H new ATOM 0 HG1 THR A 43 6.995 -2.344 2.836 1.00 0.00 H new ATOM 0 HG21 THR A 43 8.845 -3.837 0.965 1.00 0.00 H new ATOM 0 HG22 THR A 43 8.918 -5.282 2.001 1.00 0.00 H new ATOM 0 HG23 THR A 43 7.355 -4.491 1.686 1.00 0.00 H new ATOM 677 N HIS A 44 9.862 -4.728 5.836 1.00 0.00 N ATOM 678 CA HIS A 44 10.778 -5.587 6.570 1.00 0.00 C ATOM 679 C HIS A 44 9.985 -6.690 7.274 1.00 0.00 C ATOM 680 O HIS A 44 10.129 -7.871 6.938 1.00 0.00 O ATOM 681 CB HIS A 44 11.576 -4.689 7.533 1.00 0.00 C ATOM 682 CG HIS A 44 12.332 -5.366 8.650 1.00 0.00 C ATOM 683 ND1 HIS A 44 12.112 -5.135 9.986 1.00 0.00 N ATOM 684 CD2 HIS A 44 13.412 -6.203 8.554 1.00 0.00 C ATOM 685 CE1 HIS A 44 13.056 -5.770 10.681 1.00 0.00 C ATOM 686 NE2 HIS A 44 13.844 -6.492 9.860 1.00 0.00 N ATOM 0 H HIS A 44 9.951 -3.745 6.094 1.00 0.00 H new ATOM 0 HA HIS A 44 11.486 -6.096 5.917 1.00 0.00 H new ATOM 0 HB2 HIS A 44 12.290 -4.114 6.943 1.00 0.00 H new ATOM 0 HB3 HIS A 44 10.884 -3.975 7.979 1.00 0.00 H new ATOM 0 HD1 HIS A 44 11.356 -4.574 10.379 1.00 0.00 H new ATOM 0 HD2 HIS A 44 13.852 -6.574 7.640 1.00 0.00 H new ATOM 0 HE1 HIS A 44 13.173 -5.714 11.753 1.00 0.00 H new ATOM 694 N ASP A 45 9.152 -6.315 8.244 1.00 0.00 N ATOM 695 CA ASP A 45 8.413 -7.285 9.044 1.00 0.00 C ATOM 696 C ASP A 45 7.221 -7.869 8.266 1.00 0.00 C ATOM 697 O ASP A 45 6.786 -8.991 8.520 1.00 0.00 O ATOM 698 CB ASP A 45 8.117 -6.764 10.457 1.00 0.00 C ATOM 699 CG ASP A 45 9.432 -6.556 11.230 1.00 0.00 C ATOM 700 OD1 ASP A 45 10.142 -7.546 11.547 1.00 0.00 O ATOM 701 OD2 ASP A 45 9.825 -5.380 11.397 1.00 0.00 O ATOM 0 H ASP A 45 8.973 -5.342 8.494 1.00 0.00 H new ATOM 0 HA ASP A 45 9.051 -8.150 9.229 1.00 0.00 H new ATOM 0 HB2 ASP A 45 7.568 -5.824 10.399 1.00 0.00 H new ATOM 0 HB3 ASP A 45 7.482 -7.472 10.989 1.00 0.00 H new ATOM 706 N PHE A 46 6.702 -7.161 7.257 1.00 0.00 N ATOM 707 CA PHE A 46 5.663 -7.697 6.374 1.00 0.00 C ATOM 708 C PHE A 46 6.218 -8.942 5.678 1.00 0.00 C ATOM 709 O PHE A 46 5.548 -9.969 5.596 1.00 0.00 O ATOM 710 CB PHE A 46 5.248 -6.628 5.355 1.00 0.00 C ATOM 711 CG PHE A 46 4.066 -6.919 4.439 1.00 0.00 C ATOM 712 CD1 PHE A 46 4.135 -7.911 3.436 1.00 0.00 C ATOM 713 CD2 PHE A 46 2.913 -6.111 4.521 1.00 0.00 C ATOM 714 CE1 PHE A 46 3.074 -8.079 2.528 1.00 0.00 C ATOM 715 CE2 PHE A 46 1.868 -6.259 3.597 1.00 0.00 C ATOM 716 CZ PHE A 46 1.949 -7.241 2.599 1.00 0.00 C ATOM 0 H PHE A 46 6.988 -6.208 7.031 1.00 0.00 H new ATOM 0 HA PHE A 46 4.777 -7.973 6.945 1.00 0.00 H new ATOM 0 HB2 PHE A 46 5.024 -5.714 5.905 1.00 0.00 H new ATOM 0 HB3 PHE A 46 6.112 -6.417 4.725 1.00 0.00 H new ATOM 0 HD1 PHE A 46 5.007 -8.544 3.366 1.00 0.00 H new ATOM 0 HD2 PHE A 46 2.834 -5.371 5.303 1.00 0.00 H new ATOM 0 HE1 PHE A 46 3.124 -8.853 1.776 1.00 0.00 H new ATOM 0 HE2 PHE A 46 1.001 -5.617 3.654 1.00 0.00 H new ATOM 0 HZ PHE A 46 1.146 -7.353 1.885 1.00 0.00 H new ATOM 726 N ARG A 47 7.460 -8.872 5.182 1.00 0.00 N ATOM 727 CA ARG A 47 8.142 -10.007 4.570 1.00 0.00 C ATOM 728 C ARG A 47 8.491 -11.033 5.655 1.00 0.00 C ATOM 729 O ARG A 47 8.415 -12.240 5.397 1.00 0.00 O ATOM 730 CB ARG A 47 9.356 -9.459 3.784 1.00 0.00 C ATOM 731 CG ARG A 47 9.950 -10.344 2.669 1.00 0.00 C ATOM 732 CD ARG A 47 11.092 -11.278 3.091 1.00 0.00 C ATOM 733 NE ARG A 47 10.563 -12.496 3.715 1.00 0.00 N ATOM 734 CZ ARG A 47 10.183 -13.614 3.094 1.00 0.00 C ATOM 735 NH1 ARG A 47 10.682 -13.943 1.904 1.00 0.00 N ATOM 736 NH2 ARG A 47 9.276 -14.381 3.686 1.00 0.00 N ATOM 0 H ARG A 47 8.019 -8.019 5.197 1.00 0.00 H new ATOM 0 HA ARG A 47 7.514 -10.541 3.857 1.00 0.00 H new ATOM 0 HB2 ARG A 47 9.064 -8.508 3.337 1.00 0.00 H new ATOM 0 HB3 ARG A 47 10.149 -9.245 4.500 1.00 0.00 H new ATOM 0 HG2 ARG A 47 9.148 -10.950 2.247 1.00 0.00 H new ATOM 0 HG3 ARG A 47 10.313 -9.695 1.872 1.00 0.00 H new ATOM 0 HD2 ARG A 47 11.693 -11.541 2.221 1.00 0.00 H new ATOM 0 HD3 ARG A 47 11.751 -10.762 3.790 1.00 0.00 H new ATOM 0 HE ARG A 47 10.477 -12.487 4.731 1.00 0.00 H new ATOM 0 HH11 ARG A 47 11.366 -13.336 1.453 1.00 0.00 H new ATOM 0 HH12 ARG A 47 10.380 -14.802 1.444 1.00 0.00 H new ATOM 0 HH21 ARG A 47 8.890 -14.109 4.590 1.00 0.00 H new ATOM 0 HH22 ARG A 47 8.965 -15.242 3.237 1.00 0.00 H new ATOM 750 N LYS A 48 8.934 -10.619 6.847 1.00 0.00 N ATOM 751 CA LYS A 48 9.373 -11.523 7.913 1.00 0.00 C ATOM 752 C LYS A 48 8.612 -11.233 9.210 1.00 0.00 C ATOM 753 O LYS A 48 8.881 -10.250 9.872 1.00 0.00 O ATOM 754 CB LYS A 48 10.903 -11.256 7.995 1.00 0.00 C ATOM 755 CG LYS A 48 11.713 -11.597 9.269 1.00 0.00 C ATOM 756 CD LYS A 48 11.602 -10.456 10.308 1.00 0.00 C ATOM 757 CE LYS A 48 12.859 -9.980 11.025 1.00 0.00 C ATOM 758 NZ LYS A 48 12.613 -8.619 11.553 1.00 0.00 N ATOM 0 H LYS A 48 8.998 -9.633 7.101 1.00 0.00 H new ATOM 0 HA LYS A 48 9.171 -12.578 7.728 1.00 0.00 H new ATOM 0 HB2 LYS A 48 11.365 -11.799 7.170 1.00 0.00 H new ATOM 0 HB3 LYS A 48 11.051 -10.194 7.800 1.00 0.00 H new ATOM 0 HG2 LYS A 48 11.345 -12.527 9.702 1.00 0.00 H new ATOM 0 HG3 LYS A 48 12.759 -11.758 9.009 1.00 0.00 H new ATOM 0 HD2 LYS A 48 11.166 -9.594 9.804 1.00 0.00 H new ATOM 0 HD3 LYS A 48 10.890 -10.774 11.070 1.00 0.00 H new ATOM 0 HE2 LYS A 48 13.112 -10.661 11.837 1.00 0.00 H new ATOM 0 HE3 LYS A 48 13.706 -9.973 10.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 13.228 -7.940 11.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 11.618 -8.361 11.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 12.820 -8.599 12.572 1.00 0.00 H new ATOM 772 N ALA A 49 7.760 -12.148 9.670 1.00 0.00 N ATOM 773 CA ALA A 49 7.077 -12.066 10.959 1.00 0.00 C ATOM 774 C ALA A 49 6.265 -13.339 11.120 1.00 0.00 C ATOM 775 O ALA A 49 5.365 -13.535 10.299 1.00 0.00 O ATOM 776 CB ALA A 49 6.120 -10.862 11.043 1.00 0.00 C ATOM 0 H ALA A 49 7.520 -12.988 9.143 1.00 0.00 H new ATOM 0 HA ALA A 49 7.825 -11.944 11.743 1.00 0.00 H new ATOM 0 HB1 ALA A 49 5.638 -10.848 12.021 1.00 0.00 H new ATOM 0 HB2 ALA A 49 6.683 -9.939 10.902 1.00 0.00 H new ATOM 0 HB3 ALA A 49 5.361 -10.946 10.266 1.00 0.00 H new ATOM 782 N GLN A 50 6.548 -14.246 12.063 1.00 0.00 N ATOM 783 CA GLN A 50 5.584 -15.332 12.195 1.00 0.00 C ATOM 784 C GLN A 50 4.592 -14.708 13.174 1.00 0.00 C ATOM 785 O GLN A 50 4.934 -14.566 14.343 1.00 0.00 O ATOM 786 CB GLN A 50 6.272 -16.586 12.760 1.00 0.00 C ATOM 787 CG GLN A 50 5.272 -17.729 12.979 1.00 0.00 C ATOM 788 CD GLN A 50 5.968 -18.969 13.530 1.00 0.00 C ATOM 789 OE1 GLN A 50 6.366 -19.851 12.783 1.00 0.00 O ATOM 790 NE2 GLN A 50 6.138 -19.061 14.839 1.00 0.00 N ATOM 0 H GLN A 50 7.354 -14.255 12.688 1.00 0.00 H new ATOM 0 HA GLN A 50 5.121 -15.673 11.269 1.00 0.00 H new ATOM 0 HB2 GLN A 50 7.054 -16.913 12.075 1.00 0.00 H new ATOM 0 HB3 GLN A 50 6.758 -16.341 13.704 1.00 0.00 H new ATOM 0 HG2 GLN A 50 4.493 -17.408 13.671 1.00 0.00 H new ATOM 0 HG3 GLN A 50 4.781 -17.972 12.037 1.00 0.00 H new ATOM 0 HE21 GLN A 50 5.801 -18.318 15.451 1.00 0.00 H new ATOM 0 HE22 GLN A 50 6.606 -19.875 15.236 1.00 0.00 H new ATOM 799 N GLN A 51 3.370 -14.426 12.719 1.00 0.00 N ATOM 800 CA GLN A 51 2.249 -13.945 13.523 1.00 0.00 C ATOM 801 C GLN A 51 1.041 -13.841 12.593 1.00 0.00 C ATOM 802 O GLN A 51 0.142 -14.681 12.657 1.00 0.00 O ATOM 803 CB GLN A 51 2.582 -12.575 14.156 1.00 0.00 C ATOM 804 CG GLN A 51 1.450 -12.000 15.016 1.00 0.00 C ATOM 805 CD GLN A 51 1.939 -10.757 15.757 1.00 0.00 C ATOM 806 OE1 GLN A 51 2.799 -10.865 16.621 1.00 0.00 O ATOM 807 NE2 GLN A 51 1.434 -9.592 15.394 1.00 0.00 N ATOM 0 H GLN A 51 3.125 -14.532 11.734 1.00 0.00 H new ATOM 0 HA GLN A 51 2.038 -14.630 14.344 1.00 0.00 H new ATOM 0 HB2 GLN A 51 3.477 -12.677 14.770 1.00 0.00 H new ATOM 0 HB3 GLN A 51 2.819 -11.866 13.362 1.00 0.00 H new ATOM 0 HG2 GLN A 51 0.597 -11.747 14.387 1.00 0.00 H new ATOM 0 HG3 GLN A 51 1.108 -12.749 15.730 1.00 0.00 H new ATOM 0 HE21 GLN A 51 0.718 -9.550 14.669 1.00 0.00 H new ATOM 0 HE22 GLN A 51 1.760 -8.734 15.839 1.00 0.00 H new ATOM 816 N ARG A 52 1.085 -12.911 11.619 1.00 0.00 N ATOM 817 CA ARG A 52 -0.015 -12.764 10.665 1.00 0.00 C ATOM 818 C ARG A 52 0.318 -12.139 9.312 1.00 0.00 C ATOM 819 O ARG A 52 -0.468 -12.369 8.396 1.00 0.00 O ATOM 820 CB ARG A 52 -1.179 -12.012 11.362 1.00 0.00 C ATOM 821 CG ARG A 52 -2.487 -11.710 10.589 1.00 0.00 C ATOM 822 CD ARG A 52 -3.206 -12.835 9.812 1.00 0.00 C ATOM 823 NE ARG A 52 -2.994 -14.189 10.364 1.00 0.00 N ATOM 824 CZ ARG A 52 -2.183 -15.127 9.850 1.00 0.00 C ATOM 825 NH1 ARG A 52 -1.572 -14.951 8.679 1.00 0.00 N ATOM 826 NH2 ARG A 52 -1.906 -16.219 10.555 1.00 0.00 N ATOM 0 H ARG A 52 1.860 -12.263 11.479 1.00 0.00 H new ATOM 0 HA ARG A 52 -0.296 -13.780 10.389 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -1.452 -12.588 12.246 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -0.784 -11.059 11.712 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -3.201 -11.305 11.307 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -2.266 -10.915 9.877 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -4.275 -12.625 9.798 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -2.865 -12.820 8.777 1.00 0.00 H new ATOM 0 HE ARG A 52 -3.509 -14.432 11.210 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -1.716 -14.089 8.153 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -0.960 -15.678 8.309 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -2.309 -16.342 11.484 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -1.290 -16.934 10.167 1.00 0.00 H new ATOM 840 N MET A 53 1.451 -11.455 9.126 1.00 0.00 N ATOM 841 CA MET A 53 1.677 -10.767 7.854 1.00 0.00 C ATOM 842 C MET A 53 2.111 -11.693 6.709 1.00 0.00 C ATOM 843 O MET A 53 1.305 -11.886 5.802 1.00 0.00 O ATOM 844 CB MET A 53 2.610 -9.559 8.039 1.00 0.00 C ATOM 845 CG MET A 53 1.856 -8.334 8.558 1.00 0.00 C ATOM 846 SD MET A 53 1.380 -7.177 7.245 1.00 0.00 S ATOM 847 CE MET A 53 0.571 -8.234 6.006 1.00 0.00 C ATOM 0 H MET A 53 2.200 -11.364 9.812 1.00 0.00 H new ATOM 0 HA MET A 53 0.707 -10.388 7.533 1.00 0.00 H new ATOM 0 HB2 MET A 53 3.406 -9.818 8.737 1.00 0.00 H new ATOM 0 HB3 MET A 53 3.085 -9.318 7.088 1.00 0.00 H new ATOM 0 HG2 MET A 53 0.961 -8.663 9.085 1.00 0.00 H new ATOM 0 HG3 MET A 53 2.480 -7.813 9.284 1.00 0.00 H new ATOM 0 HE1 MET A 53 0.166 -7.613 5.207 1.00 0.00 H new ATOM 0 HE2 MET A 53 1.299 -8.930 5.591 1.00 0.00 H new ATOM 0 HE3 MET A 53 -0.238 -8.793 6.477 1.00 0.00 H new ATOM 857 N PRO A 54 3.302 -12.322 6.727 1.00 0.00 N ATOM 858 CA PRO A 54 3.732 -13.144 5.608 1.00 0.00 C ATOM 859 C PRO A 54 3.056 -14.509 5.653 1.00 0.00 C ATOM 860 O PRO A 54 2.326 -14.865 4.737 1.00 0.00 O ATOM 861 CB PRO A 54 5.254 -13.256 5.721 1.00 0.00 C ATOM 862 CG PRO A 54 5.540 -13.017 7.200 1.00 0.00 C ATOM 863 CD PRO A 54 4.396 -12.114 7.659 1.00 0.00 C ATOM 0 HA PRO A 54 3.453 -12.702 4.652 1.00 0.00 H new ATOM 0 HB2 PRO A 54 5.606 -14.237 5.401 1.00 0.00 H new ATOM 0 HB3 PRO A 54 5.755 -12.518 5.095 1.00 0.00 H new ATOM 0 HG2 PRO A 54 5.558 -13.953 7.759 1.00 0.00 H new ATOM 0 HG3 PRO A 54 6.509 -12.539 7.347 1.00 0.00 H new ATOM 0 HD2 PRO A 54 4.091 -12.362 8.676 1.00 0.00 H new ATOM 0 HD3 PRO A 54 4.706 -11.069 7.665 1.00 0.00 H new ATOM 871 N ALA A 55 3.354 -15.290 6.694 1.00 0.00 N ATOM 872 CA ALA A 55 2.915 -16.667 6.849 1.00 0.00 C ATOM 873 C ALA A 55 1.415 -16.730 7.150 1.00 0.00 C ATOM 874 O ALA A 55 0.935 -16.246 8.183 1.00 0.00 O ATOM 875 CB ALA A 55 3.735 -17.342 7.952 1.00 0.00 C ATOM 0 H ALA A 55 3.926 -14.965 7.474 1.00 0.00 H new ATOM 0 HA ALA A 55 3.079 -17.204 5.915 1.00 0.00 H new ATOM 0 HB1 ALA A 55 3.407 -18.375 8.069 1.00 0.00 H new ATOM 0 HB2 ALA A 55 4.791 -17.325 7.682 1.00 0.00 H new ATOM 0 HB3 ALA A 55 3.592 -16.807 8.891 1.00 0.00 H new ATOM 881 N ILE A 56 0.670 -17.364 6.256 1.00 0.00 N ATOM 882 CA ILE A 56 -0.775 -17.459 6.249 1.00 0.00 C ATOM 883 C ILE A 56 -1.116 -18.953 6.173 1.00 0.00 C ATOM 884 O ILE A 56 -0.748 -19.602 5.200 1.00 0.00 O ATOM 885 CB ILE A 56 -1.314 -16.639 5.060 1.00 0.00 C ATOM 886 CG1 ILE A 56 -1.017 -15.124 5.201 1.00 0.00 C ATOM 887 CG2 ILE A 56 -2.825 -16.837 4.951 1.00 0.00 C ATOM 888 CD1 ILE A 56 -0.857 -14.445 3.840 1.00 0.00 C ATOM 0 H ILE A 56 1.090 -17.856 5.467 1.00 0.00 H new ATOM 0 HA ILE A 56 -1.242 -17.047 7.143 1.00 0.00 H new ATOM 0 HB ILE A 56 -0.807 -16.997 4.164 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -1.826 -14.645 5.753 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -0.107 -14.985 5.785 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -3.208 -16.258 4.111 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -3.043 -17.893 4.793 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -3.303 -16.501 5.871 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -0.650 -13.385 3.984 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -0.031 -14.906 3.299 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -1.776 -14.560 3.266 1.00 0.00 H new ATOM 900 N PRO A 57 -1.767 -19.549 7.182 1.00 0.00 N ATOM 901 CA PRO A 57 -2.109 -20.962 7.151 1.00 0.00 C ATOM 902 C PRO A 57 -3.243 -21.214 6.152 1.00 0.00 C ATOM 903 O PRO A 57 -4.074 -20.335 5.921 1.00 0.00 O ATOM 904 CB PRO A 57 -2.530 -21.297 8.583 1.00 0.00 C ATOM 905 CG PRO A 57 -3.109 -19.980 9.102 1.00 0.00 C ATOM 906 CD PRO A 57 -2.285 -18.914 8.375 1.00 0.00 C ATOM 0 HA PRO A 57 -1.278 -21.588 6.826 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -3.269 -22.098 8.607 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -1.683 -21.627 9.184 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -4.171 -19.891 8.873 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -3.008 -19.896 10.184 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -2.901 -18.052 8.121 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -1.474 -18.551 9.006 1.00 0.00 H new ATOM 914 N VAL A 58 -3.324 -22.449 5.653 1.00 0.00 N ATOM 915 CA VAL A 58 -4.298 -22.963 4.691 1.00 0.00 C ATOM 916 C VAL A 58 -5.723 -22.445 4.949 1.00 0.00 C ATOM 917 O VAL A 58 -6.394 -22.012 4.009 1.00 0.00 O ATOM 918 CB VAL A 58 -4.153 -24.509 4.634 1.00 0.00 C ATOM 919 CG1 VAL A 58 -4.592 -25.246 5.909 1.00 0.00 C ATOM 920 CG2 VAL A 58 -4.824 -25.106 3.394 1.00 0.00 C ATOM 0 H VAL A 58 -2.659 -23.170 5.933 1.00 0.00 H new ATOM 0 HA VAL A 58 -4.087 -22.576 3.694 1.00 0.00 H new ATOM 0 HB VAL A 58 -3.078 -24.674 4.560 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -4.454 -26.319 5.775 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.990 -24.906 6.752 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -5.643 -25.037 6.106 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -4.697 -26.189 3.397 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -5.887 -24.866 3.404 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -4.366 -24.689 2.497 1.00 0.00 H new ATOM 930 N ASN A 59 -6.131 -22.439 6.225 1.00 0.00 N ATOM 931 CA ASN A 59 -7.447 -22.050 6.724 1.00 0.00 C ATOM 932 C ASN A 59 -7.836 -20.607 6.399 1.00 0.00 C ATOM 933 O ASN A 59 -9.019 -20.334 6.218 1.00 0.00 O ATOM 934 CB ASN A 59 -7.492 -22.245 8.247 1.00 0.00 C ATOM 935 CG ASN A 59 -8.901 -22.011 8.785 1.00 0.00 C ATOM 936 OD1 ASN A 59 -9.748 -22.883 8.678 1.00 0.00 O ATOM 937 ND2 ASN A 59 -9.179 -20.868 9.394 1.00 0.00 N ATOM 0 H ASN A 59 -5.508 -22.725 6.980 1.00 0.00 H new ATOM 0 HA ASN A 59 -8.167 -22.691 6.215 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -7.166 -23.254 8.498 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -6.796 -21.556 8.726 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -10.110 -20.709 9.780 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -8.462 -20.147 9.477 1.00 0.00 H new ATOM 944 N ILE A 60 -6.887 -19.662 6.364 1.00 0.00 N ATOM 945 CA ILE A 60 -7.223 -18.299 5.962 1.00 0.00 C ATOM 946 C ILE A 60 -7.557 -18.421 4.473 1.00 0.00 C ATOM 947 O ILE A 60 -6.680 -18.656 3.634 1.00 0.00 O ATOM 948 CB ILE A 60 -6.028 -17.355 6.234 1.00 0.00 C ATOM 949 CG1 ILE A 60 -5.657 -17.193 7.732 1.00 0.00 C ATOM 950 CG2 ILE A 60 -6.190 -15.983 5.558 1.00 0.00 C ATOM 951 CD1 ILE A 60 -6.340 -16.081 8.537 1.00 0.00 C ATOM 0 H ILE A 60 -5.907 -19.814 6.603 1.00 0.00 H new ATOM 0 HA ILE A 60 -8.058 -17.870 6.517 1.00 0.00 H new ATOM 0 HB ILE A 60 -5.184 -17.866 5.771 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -5.866 -18.140 8.230 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -4.581 -17.033 7.792 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -5.323 -15.362 5.783 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.271 -16.116 4.479 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -7.091 -15.497 5.932 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -5.975 -16.099 9.564 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -6.113 -15.114 8.088 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -7.419 -16.239 8.533 1.00 0.00 H new ATOM 963 N HIS A 61 -8.824 -18.196 4.139 1.00 0.00 N ATOM 964 CA HIS A 61 -9.281 -18.162 2.762 1.00 0.00 C ATOM 965 C HIS A 61 -8.993 -16.799 2.162 1.00 0.00 C ATOM 966 O HIS A 61 -8.749 -16.688 0.964 1.00 0.00 O ATOM 967 CB HIS A 61 -10.776 -18.464 2.703 1.00 0.00 C ATOM 968 CG HIS A 61 -11.303 -18.565 1.292 1.00 0.00 C ATOM 969 ND1 HIS A 61 -11.825 -17.532 0.542 1.00 0.00 N ATOM 970 CD2 HIS A 61 -11.277 -19.682 0.501 1.00 0.00 C ATOM 971 CE1 HIS A 61 -12.101 -18.021 -0.680 1.00 0.00 C ATOM 972 NE2 HIS A 61 -11.780 -19.322 -0.750 1.00 0.00 N ATOM 0 H HIS A 61 -9.563 -18.032 4.823 1.00 0.00 H new ATOM 0 HA HIS A 61 -8.750 -18.920 2.186 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -10.973 -19.400 3.226 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -11.320 -17.682 3.233 1.00 0.00 H new ATOM 0 HD1 HIS A 61 -11.974 -16.573 0.856 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -10.931 -20.663 0.792 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -12.522 -17.447 -1.492 1.00 0.00 H new ATOM 980 N SER A 62 -9.064 -15.749 2.971 1.00 0.00 N ATOM 981 CA SER A 62 -8.928 -14.380 2.513 1.00 0.00 C ATOM 982 C SER A 62 -8.527 -13.497 3.682 1.00 0.00 C ATOM 983 O SER A 62 -8.723 -13.878 4.835 1.00 0.00 O ATOM 984 CB SER A 62 -10.282 -13.892 1.957 1.00 0.00 C ATOM 985 OG SER A 62 -10.843 -14.824 1.042 1.00 0.00 O ATOM 0 H SER A 62 -9.220 -15.830 3.976 1.00 0.00 H new ATOM 0 HA SER A 62 -8.168 -14.330 1.734 1.00 0.00 H new ATOM 0 HB2 SER A 62 -10.976 -13.729 2.781 1.00 0.00 H new ATOM 0 HB3 SER A 62 -10.146 -12.931 1.460 1.00 0.00 H new ATOM 0 HG SER A 62 -11.700 -14.483 0.712 1.00 0.00 H new ATOM 991 N MET A 63 -7.933 -12.353 3.374 1.00 0.00 N ATOM 992 CA MET A 63 -7.588 -11.286 4.300 1.00 0.00 C ATOM 993 C MET A 63 -8.224 -10.028 3.708 1.00 0.00 C ATOM 994 O MET A 63 -8.632 -10.032 2.546 1.00 0.00 O ATOM 995 CB MET A 63 -6.067 -11.165 4.504 1.00 0.00 C ATOM 996 CG MET A 63 -5.502 -12.421 5.181 1.00 0.00 C ATOM 997 SD MET A 63 -3.907 -12.273 6.053 1.00 0.00 S ATOM 998 CE MET A 63 -2.819 -11.484 4.828 1.00 0.00 C ATOM 0 H MET A 63 -7.664 -12.133 2.415 1.00 0.00 H new ATOM 0 HA MET A 63 -7.965 -11.475 5.305 1.00 0.00 H new ATOM 0 HB2 MET A 63 -5.578 -11.015 3.541 1.00 0.00 H new ATOM 0 HB3 MET A 63 -5.847 -10.289 5.113 1.00 0.00 H new ATOM 0 HG2 MET A 63 -6.243 -12.778 5.896 1.00 0.00 H new ATOM 0 HG3 MET A 63 -5.397 -13.193 4.419 1.00 0.00 H new ATOM 0 HE1 MET A 63 -1.826 -11.349 5.257 1.00 0.00 H new ATOM 0 HE2 MET A 63 -2.749 -12.116 3.943 1.00 0.00 H new ATOM 0 HE3 MET A 63 -3.229 -10.513 4.549 1.00 0.00 H new ATOM 1008 N ASN A 64 -8.304 -8.945 4.468 1.00 0.00 N ATOM 1009 CA ASN A 64 -8.894 -7.687 4.038 1.00 0.00 C ATOM 1010 C ASN A 64 -7.944 -6.594 4.472 1.00 0.00 C ATOM 1011 O ASN A 64 -7.461 -6.626 5.603 1.00 0.00 O ATOM 1012 CB ASN A 64 -10.286 -7.448 4.649 1.00 0.00 C ATOM 1013 CG ASN A 64 -11.407 -8.182 3.924 1.00 0.00 C ATOM 1014 OD1 ASN A 64 -12.062 -7.622 3.058 1.00 0.00 O ATOM 1015 ND2 ASN A 64 -11.656 -9.441 4.243 1.00 0.00 N ATOM 0 H ASN A 64 -7.951 -8.917 5.425 1.00 0.00 H new ATOM 0 HA ASN A 64 -9.037 -7.702 2.957 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -10.274 -7.762 5.693 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -10.498 -6.379 4.640 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -12.399 -9.951 3.765 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -11.105 -9.902 4.967 1.00 0.00 H new ATOM 1022 N PHE A 65 -7.618 -5.700 3.549 1.00 0.00 N ATOM 1023 CA PHE A 65 -6.833 -4.501 3.797 1.00 0.00 C ATOM 1024 C PHE A 65 -7.840 -3.350 3.699 1.00 0.00 C ATOM 1025 O PHE A 65 -8.905 -3.516 3.098 1.00 0.00 O ATOM 1026 CB PHE A 65 -5.714 -4.349 2.749 1.00 0.00 C ATOM 1027 CG PHE A 65 -4.458 -5.206 2.878 1.00 0.00 C ATOM 1028 CD1 PHE A 65 -4.475 -6.510 3.417 1.00 0.00 C ATOM 1029 CD2 PHE A 65 -3.234 -4.680 2.417 1.00 0.00 C ATOM 1030 CE1 PHE A 65 -3.286 -7.252 3.526 1.00 0.00 C ATOM 1031 CE2 PHE A 65 -2.046 -5.423 2.519 1.00 0.00 C ATOM 1032 CZ PHE A 65 -2.070 -6.704 3.088 1.00 0.00 C ATOM 0 H PHE A 65 -7.903 -5.794 2.574 1.00 0.00 H new ATOM 0 HA PHE A 65 -6.335 -4.528 4.766 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -6.150 -4.550 1.770 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -5.401 -3.305 2.751 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -5.408 -6.941 3.748 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -3.209 -3.693 1.980 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -3.308 -8.246 3.948 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -1.116 -5.008 2.160 1.00 0.00 H new ATOM 0 HZ PHE A 65 -1.155 -7.268 3.189 1.00 0.00 H new ATOM 1042 N THR A 66 -7.505 -2.179 4.223 1.00 0.00 N ATOM 1043 CA THR A 66 -8.390 -1.032 4.282 1.00 0.00 C ATOM 1044 C THR A 66 -7.581 0.187 3.867 1.00 0.00 C ATOM 1045 O THR A 66 -6.473 0.390 4.352 1.00 0.00 O ATOM 1046 CB THR A 66 -8.983 -0.907 5.695 1.00 0.00 C ATOM 1047 OG1 THR A 66 -9.991 -1.890 5.869 1.00 0.00 O ATOM 1048 CG2 THR A 66 -9.597 0.484 5.874 1.00 0.00 C ATOM 0 H THR A 66 -6.586 -2.000 4.628 1.00 0.00 H new ATOM 0 HA THR A 66 -9.237 -1.135 3.604 1.00 0.00 H new ATOM 0 HB THR A 66 -8.194 -1.053 6.433 1.00 0.00 H new ATOM 0 HG1 THR A 66 -9.807 -2.407 6.681 1.00 0.00 H new ATOM 0 HG21 THR A 66 -10.017 0.570 6.876 1.00 0.00 H new ATOM 0 HG22 THR A 66 -8.826 1.242 5.737 1.00 0.00 H new ATOM 0 HG23 THR A 66 -10.386 0.631 5.136 1.00 0.00 H new ATOM 1056 N TRP A 67 -8.115 1.028 2.988 1.00 0.00 N ATOM 1057 CA TRP A 67 -7.407 2.220 2.557 1.00 0.00 C ATOM 1058 C TRP A 67 -8.360 3.371 2.323 1.00 0.00 C ATOM 1059 O TRP A 67 -9.581 3.184 2.246 1.00 0.00 O ATOM 1060 CB TRP A 67 -6.570 1.878 1.316 1.00 0.00 C ATOM 1061 CG TRP A 67 -7.253 1.476 0.035 1.00 0.00 C ATOM 1062 CD1 TRP A 67 -8.582 1.337 -0.189 1.00 0.00 C ATOM 1063 CD2 TRP A 67 -6.602 1.090 -1.213 1.00 0.00 C ATOM 1064 NE1 TRP A 67 -8.792 0.933 -1.495 1.00 0.00 N ATOM 1065 CE2 TRP A 67 -7.602 0.679 -2.146 1.00 0.00 C ATOM 1066 CE3 TRP A 67 -5.254 1.019 -1.628 1.00 0.00 C ATOM 1067 CZ2 TRP A 67 -7.278 0.148 -3.408 1.00 0.00 C ATOM 1068 CZ3 TRP A 67 -4.917 0.468 -2.881 1.00 0.00 C ATOM 1069 CH2 TRP A 67 -5.923 0.026 -3.760 1.00 0.00 C ATOM 0 H TRP A 67 -9.034 0.904 2.563 1.00 0.00 H new ATOM 0 HA TRP A 67 -6.731 2.554 3.344 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -5.949 2.746 1.094 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -5.896 1.067 1.593 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -9.358 1.514 0.540 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -9.712 0.835 -1.924 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -4.474 1.390 -0.980 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -8.055 -0.160 -4.092 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -3.879 0.385 -3.168 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -5.652 -0.409 -4.711 1.00 0.00 H new ATOM 1080 N GLN A 68 -7.786 4.566 2.221 1.00 0.00 N ATOM 1081 CA GLN A 68 -8.492 5.780 1.892 1.00 0.00 C ATOM 1082 C GLN A 68 -7.520 6.929 1.666 1.00 0.00 C ATOM 1083 O GLN A 68 -6.379 6.903 2.114 1.00 0.00 O ATOM 1084 CB GLN A 68 -9.543 6.158 2.958 1.00 0.00 C ATOM 1085 CG GLN A 68 -9.130 5.941 4.423 1.00 0.00 C ATOM 1086 CD GLN A 68 -8.780 7.209 5.177 1.00 0.00 C ATOM 1087 OE1 GLN A 68 -7.699 7.345 5.719 1.00 0.00 O ATOM 1088 NE2 GLN A 68 -9.705 8.139 5.292 1.00 0.00 N ATOM 0 H GLN A 68 -6.788 4.711 2.371 1.00 0.00 H new ATOM 0 HA GLN A 68 -9.031 5.589 0.964 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -9.802 7.209 2.827 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -10.448 5.580 2.768 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -9.944 5.437 4.945 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -8.271 5.270 4.449 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -10.609 8.019 4.835 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -9.518 8.980 5.838 1.00 0.00 H new ATOM 1097 N ALA A 69 -7.973 7.948 0.945 1.00 0.00 N ATOM 1098 CA ALA A 69 -7.217 9.175 0.748 1.00 0.00 C ATOM 1099 C ALA A 69 -7.622 10.201 1.814 1.00 0.00 C ATOM 1100 O ALA A 69 -8.584 10.001 2.552 1.00 0.00 O ATOM 1101 CB ALA A 69 -7.410 9.647 -0.694 1.00 0.00 C ATOM 0 H ALA A 69 -8.880 7.944 0.479 1.00 0.00 H new ATOM 0 HA ALA A 69 -6.147 9.017 0.880 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -6.848 10.567 -0.854 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -7.052 8.879 -1.379 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -8.468 9.832 -0.878 1.00 0.00 H new ATOM 1107 N ALA A 70 -6.998 11.376 1.831 1.00 0.00 N ATOM 1108 CA ALA A 70 -7.214 12.409 2.821 1.00 0.00 C ATOM 1109 C ALA A 70 -8.147 13.471 2.237 1.00 0.00 C ATOM 1110 O ALA A 70 -7.789 14.263 1.365 1.00 0.00 O ATOM 1111 CB ALA A 70 -5.876 13.015 3.216 1.00 0.00 C ATOM 0 H ALA A 70 -6.306 11.637 1.129 1.00 0.00 H new ATOM 0 HA ALA A 70 -7.678 11.990 3.714 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -6.035 13.794 3.962 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -5.234 12.239 3.633 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -5.398 13.447 2.337 1.00 0.00 H new ATOM 1117 N GLY A 71 -9.389 13.354 2.675 1.00 0.00 N ATOM 1118 CA GLY A 71 -10.595 14.164 2.479 1.00 0.00 C ATOM 1119 C GLY A 71 -10.960 14.691 1.078 1.00 0.00 C ATOM 1120 O GLY A 71 -12.128 14.550 0.714 1.00 0.00 O ATOM 0 H GLY A 71 -9.615 12.560 3.274 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -11.441 13.574 2.832 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -10.513 15.029 3.137 1.00 0.00 H new ATOM 1124 N GLN A 72 -10.090 15.400 0.345 1.00 0.00 N ATOM 1125 CA GLN A 72 -10.329 15.838 -1.042 1.00 0.00 C ATOM 1126 C GLN A 72 -9.366 15.257 -2.093 1.00 0.00 C ATOM 1127 O GLN A 72 -9.647 15.281 -3.287 1.00 0.00 O ATOM 1128 CB GLN A 72 -10.354 17.374 -1.088 1.00 0.00 C ATOM 1129 CG GLN A 72 -11.468 18.036 -0.254 1.00 0.00 C ATOM 1130 CD GLN A 72 -12.873 17.829 -0.826 1.00 0.00 C ATOM 1131 OE1 GLN A 72 -13.455 18.730 -1.416 1.00 0.00 O ATOM 1132 NE2 GLN A 72 -13.474 16.663 -0.650 1.00 0.00 N ATOM 0 H GLN A 72 -9.181 15.692 0.705 1.00 0.00 H new ATOM 0 HA GLN A 72 -11.298 15.430 -1.329 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -9.391 17.748 -0.741 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -10.463 17.689 -2.126 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -11.436 17.637 0.760 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -11.269 19.105 -0.182 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -12.992 15.910 -0.159 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -14.419 16.517 -1.005 1.00 0.00 H new ATOM 1141 N ALA A 73 -8.212 14.776 -1.646 1.00 0.00 N ATOM 1142 CA ALA A 73 -7.074 14.282 -2.414 1.00 0.00 C ATOM 1143 C ALA A 73 -7.236 12.879 -3.043 1.00 0.00 C ATOM 1144 O ALA A 73 -6.328 12.080 -2.841 1.00 0.00 O ATOM 1145 CB ALA A 73 -5.817 14.403 -1.533 1.00 0.00 C ATOM 0 H ALA A 73 -8.032 14.716 -0.644 1.00 0.00 H new ATOM 0 HA ALA A 73 -6.986 14.910 -3.300 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -4.950 14.040 -2.084 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -5.663 15.447 -1.261 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -5.948 13.808 -0.629 1.00 0.00 H new ATOM 1151 N GLU A 74 -8.406 12.460 -3.550 1.00 0.00 N ATOM 1152 CA GLU A 74 -8.657 11.097 -4.051 1.00 0.00 C ATOM 1153 C GLU A 74 -7.452 10.645 -4.927 1.00 0.00 C ATOM 1154 O GLU A 74 -7.199 11.227 -5.983 1.00 0.00 O ATOM 1155 CB GLU A 74 -9.997 11.012 -4.839 1.00 0.00 C ATOM 1156 CG GLU A 74 -11.282 11.772 -4.400 1.00 0.00 C ATOM 1157 CD GLU A 74 -12.389 11.040 -3.589 1.00 0.00 C ATOM 1158 OE1 GLU A 74 -12.195 10.035 -2.857 1.00 0.00 O ATOM 1159 OE2 GLU A 74 -13.562 11.487 -3.629 1.00 0.00 O ATOM 0 H GLU A 74 -9.220 13.070 -3.625 1.00 0.00 H new ATOM 0 HA GLU A 74 -8.754 10.421 -3.201 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -9.779 11.333 -5.858 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -10.262 9.956 -4.888 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -10.963 12.630 -3.808 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -11.750 12.164 -5.303 1.00 0.00 H new ATOM 1166 N TYR A 75 -6.691 9.635 -4.480 1.00 0.00 N ATOM 1167 CA TYR A 75 -5.525 9.071 -5.182 1.00 0.00 C ATOM 1168 C TYR A 75 -5.941 8.023 -6.209 1.00 0.00 C ATOM 1169 O TYR A 75 -7.046 7.494 -6.118 1.00 0.00 O ATOM 1170 CB TYR A 75 -4.478 8.536 -4.177 1.00 0.00 C ATOM 1171 CG TYR A 75 -3.552 9.594 -3.598 1.00 0.00 C ATOM 1172 CD1 TYR A 75 -3.891 10.376 -2.477 1.00 0.00 C ATOM 1173 CD2 TYR A 75 -2.314 9.800 -4.235 1.00 0.00 C ATOM 1174 CE1 TYR A 75 -3.006 11.368 -2.000 1.00 0.00 C ATOM 1175 CE2 TYR A 75 -1.426 10.777 -3.760 1.00 0.00 C ATOM 1176 CZ TYR A 75 -1.763 11.569 -2.646 1.00 0.00 C ATOM 1177 OH TYR A 75 -0.870 12.514 -2.243 1.00 0.00 O ATOM 0 H TYR A 75 -6.875 9.172 -3.590 1.00 0.00 H new ATOM 0 HA TYR A 75 -5.046 9.875 -5.742 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -5.001 8.043 -3.357 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -3.874 7.776 -4.673 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -4.835 10.216 -1.978 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -2.046 9.203 -5.094 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -3.277 11.971 -1.146 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -0.476 10.923 -4.253 1.00 0.00 H new ATOM 0 HH TYR A 75 -1.011 12.714 -1.294 1.00 0.00 H new ATOM 1187 N PHE A 76 -5.066 7.680 -7.159 1.00 0.00 N ATOM 1188 CA PHE A 76 -5.349 6.680 -8.189 1.00 0.00 C ATOM 1189 C PHE A 76 -4.422 5.500 -7.863 1.00 0.00 C ATOM 1190 O PHE A 76 -3.326 5.734 -7.352 1.00 0.00 O ATOM 1191 CB PHE A 76 -5.025 7.265 -9.574 1.00 0.00 C ATOM 1192 CG PHE A 76 -5.736 6.595 -10.733 1.00 0.00 C ATOM 1193 CD1 PHE A 76 -5.416 5.305 -11.186 1.00 0.00 C ATOM 1194 CD2 PHE A 76 -6.808 7.285 -11.333 1.00 0.00 C ATOM 1195 CE1 PHE A 76 -6.159 4.711 -12.215 1.00 0.00 C ATOM 1196 CE2 PHE A 76 -7.560 6.692 -12.358 1.00 0.00 C ATOM 1197 CZ PHE A 76 -7.245 5.391 -12.788 1.00 0.00 C ATOM 0 H PHE A 76 -4.136 8.092 -7.234 1.00 0.00 H new ATOM 0 HA PHE A 76 -6.395 6.373 -8.205 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -5.281 8.325 -9.574 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -3.950 7.197 -9.738 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -4.593 4.768 -10.739 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -7.054 8.282 -11.000 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -5.895 3.725 -12.569 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -8.376 7.232 -12.814 1.00 0.00 H new ATOM 0 HZ PHE A 76 -7.837 4.916 -13.557 1.00 0.00 H new ATOM 1207 N TYR A 77 -4.791 4.255 -8.161 1.00 0.00 N ATOM 1208 CA TYR A 77 -3.931 3.087 -7.980 1.00 0.00 C ATOM 1209 C TYR A 77 -3.992 2.164 -9.196 1.00 0.00 C ATOM 1210 O TYR A 77 -4.954 2.222 -9.967 1.00 0.00 O ATOM 1211 CB TYR A 77 -4.351 2.307 -6.717 1.00 0.00 C ATOM 1212 CG TYR A 77 -5.631 1.490 -6.866 1.00 0.00 C ATOM 1213 CD1 TYR A 77 -5.598 0.252 -7.541 1.00 0.00 C ATOM 1214 CD2 TYR A 77 -6.857 1.963 -6.361 1.00 0.00 C ATOM 1215 CE1 TYR A 77 -6.779 -0.463 -7.775 1.00 0.00 C ATOM 1216 CE2 TYR A 77 -8.034 1.206 -6.519 1.00 0.00 C ATOM 1217 CZ TYR A 77 -7.994 -0.015 -7.229 1.00 0.00 C ATOM 1218 OH TYR A 77 -9.105 -0.784 -7.369 1.00 0.00 O ATOM 0 H TYR A 77 -5.710 4.026 -8.541 1.00 0.00 H new ATOM 0 HA TYR A 77 -2.906 3.440 -7.865 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -3.539 1.636 -6.434 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -4.481 3.013 -5.897 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -4.654 -0.148 -7.880 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -6.895 2.913 -5.849 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -6.756 -1.360 -8.376 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -8.965 1.558 -6.099 1.00 0.00 H new ATOM 0 HH TYR A 77 -8.902 -1.551 -7.944 1.00 0.00 H new ATOM 1228 N GLU A 78 -3.003 1.277 -9.336 1.00 0.00 N ATOM 1229 CA GLU A 78 -2.990 0.240 -10.357 1.00 0.00 C ATOM 1230 C GLU A 78 -2.102 -0.898 -9.860 1.00 0.00 C ATOM 1231 O GLU A 78 -1.093 -0.666 -9.197 1.00 0.00 O ATOM 1232 CB GLU A 78 -2.599 0.795 -11.742 1.00 0.00 C ATOM 1233 CG GLU A 78 -2.566 -0.314 -12.807 1.00 0.00 C ATOM 1234 CD GLU A 78 -2.519 0.232 -14.239 1.00 0.00 C ATOM 1235 OE1 GLU A 78 -3.615 0.431 -14.813 1.00 0.00 O ATOM 1236 OE2 GLU A 78 -1.394 0.405 -14.758 1.00 0.00 O ATOM 0 H GLU A 78 -2.181 1.264 -8.733 1.00 0.00 H new ATOM 0 HA GLU A 78 -3.993 -0.157 -10.514 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -3.310 1.565 -12.040 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -1.620 1.271 -11.681 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -1.696 -0.948 -12.637 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -3.447 -0.945 -12.694 1.00 0.00 H new ATOM 1243 N PHE A 79 -2.532 -2.136 -10.089 1.00 0.00 N ATOM 1244 CA PHE A 79 -1.873 -3.349 -9.621 1.00 0.00 C ATOM 1245 C PHE A 79 -0.839 -3.808 -10.656 1.00 0.00 C ATOM 1246 O PHE A 79 -1.192 -4.403 -11.674 1.00 0.00 O ATOM 1247 CB PHE A 79 -2.924 -4.449 -9.350 1.00 0.00 C ATOM 1248 CG PHE A 79 -3.742 -4.338 -8.065 1.00 0.00 C ATOM 1249 CD1 PHE A 79 -4.876 -3.510 -7.997 1.00 0.00 C ATOM 1250 CD2 PHE A 79 -3.406 -5.113 -6.939 1.00 0.00 C ATOM 1251 CE1 PHE A 79 -5.647 -3.445 -6.822 1.00 0.00 C ATOM 1252 CE2 PHE A 79 -4.161 -5.025 -5.751 1.00 0.00 C ATOM 1253 CZ PHE A 79 -5.283 -4.181 -5.688 1.00 0.00 C ATOM 0 H PHE A 79 -3.379 -2.327 -10.625 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.351 -3.145 -8.686 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -3.618 -4.466 -10.191 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.411 -5.410 -9.341 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -5.158 -2.918 -8.855 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -2.560 -5.783 -6.985 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -6.528 -2.821 -6.794 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -3.876 -5.608 -4.887 1.00 0.00 H new ATOM 0 HZ PHE A 79 -5.857 -4.101 -4.777 1.00 0.00 H new ATOM 1263 N LEU A 80 0.445 -3.568 -10.372 1.00 0.00 N ATOM 1264 CA LEU A 80 1.585 -4.004 -11.179 1.00 0.00 C ATOM 1265 C LEU A 80 1.759 -5.520 -11.019 1.00 0.00 C ATOM 1266 O LEU A 80 1.875 -6.250 -12.008 1.00 0.00 O ATOM 1267 CB LEU A 80 2.834 -3.223 -10.720 1.00 0.00 C ATOM 1268 CG LEU A 80 3.982 -3.157 -11.745 1.00 0.00 C ATOM 1269 CD1 LEU A 80 5.091 -2.248 -11.204 1.00 0.00 C ATOM 1270 CD2 LEU A 80 4.586 -4.519 -12.099 1.00 0.00 C ATOM 0 H LEU A 80 0.727 -3.045 -9.543 1.00 0.00 H new ATOM 0 HA LEU A 80 1.425 -3.800 -12.238 1.00 0.00 H new ATOM 0 HB2 LEU A 80 2.534 -2.206 -10.469 1.00 0.00 H new ATOM 0 HB3 LEU A 80 3.212 -3.679 -9.805 1.00 0.00 H new ATOM 0 HG LEU A 80 3.547 -2.762 -12.663 1.00 0.00 H new ATOM 0 HD11 LEU A 80 5.906 -2.198 -11.926 1.00 0.00 H new ATOM 0 HD12 LEU A 80 4.692 -1.247 -11.037 1.00 0.00 H new ATOM 0 HD13 LEU A 80 5.465 -2.651 -10.263 1.00 0.00 H new ATOM 0 HD21 LEU A 80 5.387 -4.384 -12.826 1.00 0.00 H new ATOM 0 HD22 LEU A 80 4.988 -4.984 -11.199 1.00 0.00 H new ATOM 0 HD23 LEU A 80 3.814 -5.160 -12.525 1.00 0.00 H new ATOM 1282 N SER A 81 1.735 -6.008 -9.777 1.00 0.00 N ATOM 1283 CA SER A 81 1.843 -7.409 -9.421 1.00 0.00 C ATOM 1284 C SER A 81 0.760 -7.809 -8.434 1.00 0.00 C ATOM 1285 O SER A 81 0.450 -7.075 -7.495 1.00 0.00 O ATOM 1286 CB SER A 81 3.204 -7.722 -8.794 1.00 0.00 C ATOM 1287 OG SER A 81 4.266 -7.701 -9.725 1.00 0.00 O ATOM 0 H SER A 81 1.635 -5.404 -8.961 1.00 0.00 H new ATOM 0 HA SER A 81 1.728 -7.975 -10.345 1.00 0.00 H new ATOM 0 HB2 SER A 81 3.408 -6.998 -8.005 1.00 0.00 H new ATOM 0 HB3 SER A 81 3.162 -8.704 -8.323 1.00 0.00 H new ATOM 0 HG SER A 81 4.771 -8.538 -9.664 1.00 0.00 H new ATOM 1293 N LEU A 82 0.192 -8.992 -8.669 1.00 0.00 N ATOM 1294 CA LEU A 82 -0.762 -9.682 -7.818 1.00 0.00 C ATOM 1295 C LEU A 82 -0.813 -11.081 -8.465 1.00 0.00 C ATOM 1296 O LEU A 82 -1.589 -11.277 -9.398 1.00 0.00 O ATOM 1297 CB LEU A 82 -2.118 -8.919 -7.853 1.00 0.00 C ATOM 1298 CG LEU A 82 -3.076 -9.169 -6.675 1.00 0.00 C ATOM 1299 CD1 LEU A 82 -3.284 -10.632 -6.373 1.00 0.00 C ATOM 1300 CD2 LEU A 82 -2.641 -8.481 -5.381 1.00 0.00 C ATOM 0 H LEU A 82 0.403 -9.523 -9.514 1.00 0.00 H new ATOM 0 HA LEU A 82 -0.507 -9.742 -6.760 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.907 -7.851 -7.901 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -2.635 -9.184 -8.775 1.00 0.00 H new ATOM 0 HG LEU A 82 -4.014 -8.733 -7.018 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -3.970 -10.736 -5.532 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -3.705 -11.128 -7.248 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -2.328 -11.091 -6.120 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -3.361 -8.700 -4.593 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -1.658 -8.848 -5.086 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -2.593 -7.404 -5.540 1.00 0.00 H new ATOM 1312 N ARG A 83 -0.004 -12.057 -8.021 1.00 0.00 N ATOM 1313 CA ARG A 83 0.087 -13.392 -8.687 1.00 0.00 C ATOM 1314 C ARG A 83 0.776 -14.437 -7.810 1.00 0.00 C ATOM 1315 O ARG A 83 1.606 -14.045 -6.990 1.00 0.00 O ATOM 1316 CB ARG A 83 0.938 -13.350 -9.984 1.00 0.00 C ATOM 1317 CG ARG A 83 0.287 -12.852 -11.291 1.00 0.00 C ATOM 1318 CD ARG A 83 0.537 -11.392 -11.697 1.00 0.00 C ATOM 1319 NE ARG A 83 1.963 -11.030 -11.738 1.00 0.00 N ATOM 1320 CZ ARG A 83 2.444 -9.833 -12.081 1.00 0.00 C ATOM 1321 NH1 ARG A 83 1.656 -8.925 -12.655 1.00 0.00 N ATOM 1322 NH2 ARG A 83 3.701 -9.547 -11.791 1.00 0.00 N ATOM 0 H ARG A 83 0.601 -11.959 -7.205 1.00 0.00 H new ATOM 0 HA ARG A 83 -0.951 -13.654 -8.890 1.00 0.00 H new ATOM 0 HB2 ARG A 83 1.806 -12.720 -9.788 1.00 0.00 H new ATOM 0 HB3 ARG A 83 1.311 -14.358 -10.166 1.00 0.00 H new ATOM 0 HG2 ARG A 83 0.633 -13.491 -12.104 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -0.790 -12.998 -11.207 1.00 0.00 H new ATOM 0 HD2 ARG A 83 0.097 -11.216 -12.679 1.00 0.00 H new ATOM 0 HD3 ARG A 83 0.024 -10.735 -10.995 1.00 0.00 H new ATOM 0 HE ARG A 83 2.638 -11.752 -11.484 1.00 0.00 H new ATOM 0 HH11 ARG A 83 0.676 -9.142 -12.836 1.00 0.00 H new ATOM 0 HH12 ARG A 83 2.033 -8.013 -12.913 1.00 0.00 H new ATOM 0 HH21 ARG A 83 4.284 -10.235 -11.314 1.00 0.00 H new ATOM 0 HH22 ARG A 83 4.089 -8.638 -12.044 1.00 0.00 H new ATOM 1336 N SER A 84 0.502 -15.741 -7.991 1.00 0.00 N ATOM 1337 CA SER A 84 1.232 -16.786 -7.272 1.00 0.00 C ATOM 1338 C SER A 84 2.685 -16.839 -7.747 1.00 0.00 C ATOM 1339 O SER A 84 3.034 -16.367 -8.829 1.00 0.00 O ATOM 1340 CB SER A 84 0.597 -18.169 -7.474 1.00 0.00 C ATOM 1341 OG SER A 84 0.988 -19.050 -6.430 1.00 0.00 O ATOM 0 H SER A 84 -0.216 -16.089 -8.626 1.00 0.00 H new ATOM 0 HA SER A 84 1.189 -16.535 -6.212 1.00 0.00 H new ATOM 0 HB2 SER A 84 -0.489 -18.078 -7.494 1.00 0.00 H new ATOM 0 HB3 SER A 84 0.901 -18.579 -8.437 1.00 0.00 H new ATOM 0 HG SER A 84 0.401 -18.921 -5.656 1.00 0.00 H new ATOM 1347 N LEU A 85 3.531 -17.459 -6.925 1.00 0.00 N ATOM 1348 CA LEU A 85 4.929 -17.745 -7.202 1.00 0.00 C ATOM 1349 C LEU A 85 5.271 -19.229 -7.011 1.00 0.00 C ATOM 1350 O LEU A 85 6.444 -19.587 -7.210 1.00 0.00 O ATOM 1351 CB LEU A 85 5.824 -16.862 -6.316 1.00 0.00 C ATOM 1352 CG LEU A 85 5.786 -15.353 -6.619 1.00 0.00 C ATOM 1353 CD1 LEU A 85 6.684 -14.656 -5.592 1.00 0.00 C ATOM 1354 CD2 LEU A 85 6.279 -15.013 -8.029 1.00 0.00 C ATOM 0 H LEU A 85 3.241 -17.789 -6.005 1.00 0.00 H new ATOM 0 HA LEU A 85 5.114 -17.514 -8.251 1.00 0.00 H new ATOM 0 HB2 LEU A 85 5.535 -17.012 -5.276 1.00 0.00 H new ATOM 0 HB3 LEU A 85 6.853 -17.207 -6.413 1.00 0.00 H new ATOM 0 HG LEU A 85 4.751 -15.016 -6.560 1.00 0.00 H new ATOM 0 HD11 LEU A 85 6.682 -13.582 -5.776 1.00 0.00 H new ATOM 0 HD12 LEU A 85 6.309 -14.853 -4.588 1.00 0.00 H new ATOM 0 HD13 LEU A 85 7.701 -15.037 -5.680 1.00 0.00 H new ATOM 0 HD21 LEU A 85 6.228 -13.935 -8.182 1.00 0.00 H new ATOM 0 HD22 LEU A 85 7.310 -15.348 -8.145 1.00 0.00 H new ATOM 0 HD23 LEU A 85 5.650 -15.514 -8.765 1.00 0.00 H new ATOM 1366 N ASP A 86 4.340 -20.102 -6.577 1.00 0.00 N ATOM 1367 CA ASP A 86 4.725 -21.495 -6.310 1.00 0.00 C ATOM 1368 C ASP A 86 4.363 -22.431 -7.476 1.00 0.00 C ATOM 1369 O ASP A 86 3.713 -22.038 -8.436 1.00 0.00 O ATOM 1370 CB ASP A 86 4.378 -22.026 -4.908 1.00 0.00 C ATOM 1371 CG ASP A 86 5.313 -23.212 -4.644 1.00 0.00 C ATOM 1372 OD1 ASP A 86 6.539 -22.951 -4.614 1.00 0.00 O ATOM 1373 OD2 ASP A 86 4.881 -24.374 -4.790 1.00 0.00 O ATOM 0 H ASP A 86 3.359 -19.879 -6.411 1.00 0.00 H new ATOM 0 HA ASP A 86 5.814 -21.486 -6.267 1.00 0.00 H new ATOM 0 HB2 ASP A 86 4.515 -21.250 -4.155 1.00 0.00 H new ATOM 0 HB3 ASP A 86 3.334 -22.337 -4.859 1.00 0.00 H new ATOM 1378 N LYS A 87 4.869 -23.663 -7.427 1.00 0.00 N ATOM 1379 CA LYS A 87 4.823 -24.719 -8.417 1.00 0.00 C ATOM 1380 C LYS A 87 3.903 -25.856 -7.984 1.00 0.00 C ATOM 1381 O LYS A 87 3.125 -26.360 -8.780 1.00 0.00 O ATOM 1382 CB LYS A 87 6.249 -25.275 -8.519 1.00 0.00 C ATOM 1383 CG LYS A 87 7.252 -24.411 -9.314 1.00 0.00 C ATOM 1384 CD LYS A 87 7.614 -23.026 -8.730 1.00 0.00 C ATOM 1385 CE LYS A 87 8.071 -23.123 -7.264 1.00 0.00 C ATOM 1386 NZ LYS A 87 8.157 -21.817 -6.574 1.00 0.00 N ATOM 0 H LYS A 87 5.376 -23.971 -6.597 1.00 0.00 H new ATOM 0 HA LYS A 87 4.448 -24.322 -9.360 1.00 0.00 H new ATOM 0 HB2 LYS A 87 6.638 -25.414 -7.510 1.00 0.00 H new ATOM 0 HB3 LYS A 87 6.202 -26.261 -8.981 1.00 0.00 H new ATOM 0 HG2 LYS A 87 8.174 -24.981 -9.426 1.00 0.00 H new ATOM 0 HG3 LYS A 87 6.848 -24.260 -10.315 1.00 0.00 H new ATOM 0 HD2 LYS A 87 8.406 -22.576 -9.328 1.00 0.00 H new ATOM 0 HD3 LYS A 87 6.749 -22.366 -8.798 1.00 0.00 H new ATOM 0 HE2 LYS A 87 7.379 -23.765 -6.720 1.00 0.00 H new ATOM 0 HE3 LYS A 87 9.048 -23.606 -7.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 9.153 -21.525 -6.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 7.624 -21.104 -7.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 7.755 -21.902 -5.619 1.00 0.00 H new ATOM 1400 N GLY A 88 4.073 -26.328 -6.753 1.00 0.00 N ATOM 1401 CA GLY A 88 3.337 -27.432 -6.172 1.00 0.00 C ATOM 1402 C GLY A 88 2.309 -26.961 -5.150 1.00 0.00 C ATOM 1403 O GLY A 88 1.165 -27.411 -5.169 1.00 0.00 O ATOM 0 H GLY A 88 4.758 -25.931 -6.110 1.00 0.00 H new ATOM 0 HA2 GLY A 88 2.833 -27.987 -6.963 1.00 0.00 H new ATOM 0 HA3 GLY A 88 4.034 -28.120 -5.694 1.00 0.00 H new ATOM 1407 N ILE A 89 2.721 -26.080 -4.234 1.00 0.00 N ATOM 1408 CA ILE A 89 1.887 -25.489 -3.184 1.00 0.00 C ATOM 1409 C ILE A 89 1.068 -24.324 -3.791 1.00 0.00 C ATOM 1410 O ILE A 89 0.494 -23.508 -3.080 1.00 0.00 O ATOM 1411 CB ILE A 89 2.796 -25.074 -1.990 1.00 0.00 C ATOM 1412 CG1 ILE A 89 3.790 -26.176 -1.546 1.00 0.00 C ATOM 1413 CG2 ILE A 89 2.002 -24.691 -0.729 1.00 0.00 C ATOM 1414 CD1 ILE A 89 5.207 -25.942 -2.074 1.00 0.00 C ATOM 0 H ILE A 89 3.684 -25.746 -4.203 1.00 0.00 H new ATOM 0 HA ILE A 89 1.164 -26.202 -2.788 1.00 0.00 H new ATOM 0 HB ILE A 89 3.336 -24.215 -2.390 1.00 0.00 H new ATOM 0 HG12 ILE A 89 3.815 -26.219 -0.457 1.00 0.00 H new ATOM 0 HG13 ILE A 89 3.432 -27.144 -1.895 1.00 0.00 H new ATOM 0 HG21 ILE A 89 2.694 -24.412 0.066 1.00 0.00 H new ATOM 0 HG22 ILE A 89 1.348 -23.848 -0.953 1.00 0.00 H new ATOM 0 HG23 ILE A 89 1.401 -25.541 -0.405 1.00 0.00 H new ATOM 0 HD11 ILE A 89 5.860 -26.745 -1.732 1.00 0.00 H new ATOM 0 HD12 ILE A 89 5.191 -25.927 -3.164 1.00 0.00 H new ATOM 0 HD13 ILE A 89 5.580 -24.987 -1.703 1.00 0.00 H new ATOM 1426 N MET A 90 1.006 -24.260 -5.123 1.00 0.00 N ATOM 1427 CA MET A 90 0.428 -23.234 -5.971 1.00 0.00 C ATOM 1428 C MET A 90 -0.918 -22.808 -5.396 1.00 0.00 C ATOM 1429 O MET A 90 -1.754 -23.627 -5.007 1.00 0.00 O ATOM 1430 CB MET A 90 0.309 -23.853 -7.363 1.00 0.00 C ATOM 1431 CG MET A 90 -0.030 -22.907 -8.517 1.00 0.00 C ATOM 1432 SD MET A 90 -0.442 -23.777 -10.066 1.00 0.00 S ATOM 1433 CE MET A 90 0.689 -25.198 -10.039 1.00 0.00 C ATOM 0 H MET A 90 1.405 -25.011 -5.687 1.00 0.00 H new ATOM 0 HA MET A 90 1.037 -22.332 -6.026 1.00 0.00 H new ATOM 0 HB2 MET A 90 1.252 -24.347 -7.596 1.00 0.00 H new ATOM 0 HB3 MET A 90 -0.456 -24.628 -7.325 1.00 0.00 H new ATOM 0 HG2 MET A 90 -0.872 -22.278 -8.227 1.00 0.00 H new ATOM 0 HG3 MET A 90 0.817 -22.244 -8.695 1.00 0.00 H new ATOM 0 HE1 MET A 90 0.558 -25.784 -10.949 1.00 0.00 H new ATOM 0 HE2 MET A 90 1.718 -24.843 -9.981 1.00 0.00 H new ATOM 0 HE3 MET A 90 0.470 -25.821 -9.171 1.00 0.00 H new ATOM 1443 N ALA A 91 -1.066 -21.499 -5.287 1.00 0.00 N ATOM 1444 CA ALA A 91 -2.172 -20.818 -4.658 1.00 0.00 C ATOM 1445 C ALA A 91 -2.219 -19.433 -5.251 1.00 0.00 C ATOM 1446 O ALA A 91 -1.262 -18.674 -5.056 1.00 0.00 O ATOM 1447 CB ALA A 91 -1.941 -20.710 -3.142 1.00 0.00 C ATOM 0 H ALA A 91 -0.373 -20.849 -5.659 1.00 0.00 H new ATOM 0 HA ALA A 91 -3.102 -21.361 -4.823 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -2.783 -20.194 -2.681 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -1.850 -21.709 -2.716 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -1.025 -20.150 -2.952 1.00 0.00 H new ATOM 1453 N ASP A 92 -3.283 -19.127 -5.978 1.00 0.00 N ATOM 1454 CA ASP A 92 -3.360 -17.852 -6.685 1.00 0.00 C ATOM 1455 C ASP A 92 -4.128 -16.832 -5.879 1.00 0.00 C ATOM 1456 O ASP A 92 -5.207 -17.135 -5.373 1.00 0.00 O ATOM 1457 CB ASP A 92 -3.765 -17.927 -8.160 1.00 0.00 C ATOM 1458 CG ASP A 92 -2.531 -18.275 -8.992 1.00 0.00 C ATOM 1459 OD1 ASP A 92 -1.777 -17.317 -9.299 1.00 0.00 O ATOM 1460 OD2 ASP A 92 -2.280 -19.481 -9.200 1.00 0.00 O ATOM 0 H ASP A 92 -4.096 -19.732 -6.095 1.00 0.00 H new ATOM 0 HA ASP A 92 -2.331 -17.500 -6.763 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -4.540 -18.680 -8.301 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -4.183 -16.975 -8.485 1.00 0.00 H new ATOM 1465 N PRO A 93 -3.563 -15.635 -5.684 1.00 0.00 N ATOM 1466 CA PRO A 93 -4.255 -14.567 -5.007 1.00 0.00 C ATOM 1467 C PRO A 93 -5.300 -13.956 -5.942 1.00 0.00 C ATOM 1468 O PRO A 93 -5.128 -13.876 -7.158 1.00 0.00 O ATOM 1469 CB PRO A 93 -3.153 -13.581 -4.645 1.00 0.00 C ATOM 1470 CG PRO A 93 -2.201 -13.707 -5.838 1.00 0.00 C ATOM 1471 CD PRO A 93 -2.253 -15.194 -6.136 1.00 0.00 C ATOM 0 HA PRO A 93 -4.802 -14.889 -4.121 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -3.535 -12.566 -4.534 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -2.665 -13.842 -3.706 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -2.532 -13.110 -6.688 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -1.192 -13.377 -5.590 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -2.120 -15.386 -7.201 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -1.458 -15.727 -5.614 1.00 0.00 H new ATOM 1479 N THR A 94 -6.371 -13.459 -5.348 1.00 0.00 N ATOM 1480 CA THR A 94 -7.441 -12.732 -6.020 1.00 0.00 C ATOM 1481 C THR A 94 -7.721 -11.459 -5.218 1.00 0.00 C ATOM 1482 O THR A 94 -7.455 -11.440 -4.017 1.00 0.00 O ATOM 1483 CB THR A 94 -8.671 -13.655 -6.141 1.00 0.00 C ATOM 1484 OG1 THR A 94 -8.970 -14.276 -4.903 1.00 0.00 O ATOM 1485 CG2 THR A 94 -8.455 -14.769 -7.172 1.00 0.00 C ATOM 0 H THR A 94 -6.528 -13.553 -4.345 1.00 0.00 H new ATOM 0 HA THR A 94 -7.166 -12.436 -7.032 1.00 0.00 H new ATOM 0 HB THR A 94 -9.494 -13.014 -6.457 1.00 0.00 H new ATOM 0 HG1 THR A 94 -8.137 -14.471 -4.425 1.00 0.00 H new ATOM 0 HG21 THR A 94 -9.346 -15.394 -7.224 1.00 0.00 H new ATOM 0 HG22 THR A 94 -8.264 -14.327 -8.150 1.00 0.00 H new ATOM 0 HG23 THR A 94 -7.601 -15.378 -6.876 1.00 0.00 H new ATOM 1493 N VAL A 95 -8.267 -10.410 -5.838 1.00 0.00 N ATOM 1494 CA VAL A 95 -8.622 -9.156 -5.174 1.00 0.00 C ATOM 1495 C VAL A 95 -10.093 -8.827 -5.431 1.00 0.00 C ATOM 1496 O VAL A 95 -10.660 -9.224 -6.447 1.00 0.00 O ATOM 1497 CB VAL A 95 -7.686 -8.011 -5.606 1.00 0.00 C ATOM 1498 CG1 VAL A 95 -6.312 -8.152 -4.947 1.00 0.00 C ATOM 1499 CG2 VAL A 95 -7.514 -7.880 -7.129 1.00 0.00 C ATOM 0 H VAL A 95 -8.478 -10.410 -6.836 1.00 0.00 H new ATOM 0 HA VAL A 95 -8.489 -9.276 -4.099 1.00 0.00 H new ATOM 0 HB VAL A 95 -8.175 -7.098 -5.266 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -5.669 -7.332 -5.267 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -6.424 -8.123 -3.863 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -5.863 -9.101 -5.241 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -6.841 -7.051 -7.349 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -7.095 -8.804 -7.529 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -8.484 -7.692 -7.590 1.00 0.00 H new ATOM 1509 N ASN A 96 -10.702 -8.086 -4.504 1.00 0.00 N ATOM 1510 CA ASN A 96 -12.112 -7.691 -4.527 1.00 0.00 C ATOM 1511 C ASN A 96 -12.371 -6.412 -5.326 1.00 0.00 C ATOM 1512 O ASN A 96 -13.431 -5.802 -5.196 1.00 0.00 O ATOM 1513 CB ASN A 96 -12.568 -7.451 -3.083 1.00 0.00 C ATOM 1514 CG ASN A 96 -14.076 -7.533 -2.919 1.00 0.00 C ATOM 1515 OD1 ASN A 96 -14.702 -8.531 -3.249 1.00 0.00 O ATOM 1516 ND2 ASN A 96 -14.658 -6.524 -2.305 1.00 0.00 N ATOM 0 H ASN A 96 -10.208 -7.731 -3.685 1.00 0.00 H new ATOM 0 HA ASN A 96 -12.665 -8.496 -5.012 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -12.096 -8.186 -2.431 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -12.225 -6.469 -2.757 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -15.655 -6.562 -2.093 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -14.112 -5.704 -2.041 1.00 0.00 H new ATOM 1523 N VAL A 97 -11.383 -5.948 -6.079 1.00 0.00 N ATOM 1524 CA VAL A 97 -11.420 -4.682 -6.796 1.00 0.00 C ATOM 1525 C VAL A 97 -10.835 -4.863 -8.197 1.00 0.00 C ATOM 1526 O VAL A 97 -10.182 -5.879 -8.453 1.00 0.00 O ATOM 1527 CB VAL A 97 -10.658 -3.598 -6.006 1.00 0.00 C ATOM 1528 CG1 VAL A 97 -11.373 -3.222 -4.706 1.00 0.00 C ATOM 1529 CG2 VAL A 97 -9.191 -3.961 -5.718 1.00 0.00 C ATOM 0 H VAL A 97 -10.509 -6.457 -6.211 1.00 0.00 H new ATOM 0 HA VAL A 97 -12.455 -4.354 -6.897 1.00 0.00 H new ATOM 0 HB VAL A 97 -10.649 -2.729 -6.664 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -10.800 -2.456 -4.184 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -12.367 -2.838 -4.935 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -11.462 -4.104 -4.072 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -8.719 -3.153 -5.160 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -9.152 -4.879 -5.131 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -8.661 -4.109 -6.659 1.00 0.00 H new ATOM 1539 N PRO A 98 -11.071 -3.913 -9.118 1.00 0.00 N ATOM 1540 CA PRO A 98 -10.437 -3.951 -10.421 1.00 0.00 C ATOM 1541 C PRO A 98 -8.923 -3.759 -10.268 1.00 0.00 C ATOM 1542 O PRO A 98 -8.447 -3.224 -9.261 1.00 0.00 O ATOM 1543 CB PRO A 98 -11.061 -2.813 -11.234 1.00 0.00 C ATOM 1544 CG PRO A 98 -12.216 -2.273 -10.388 1.00 0.00 C ATOM 1545 CD PRO A 98 -11.875 -2.711 -8.968 1.00 0.00 C ATOM 0 HA PRO A 98 -10.589 -4.907 -10.921 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -10.328 -2.032 -11.438 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -11.419 -3.173 -12.198 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -12.292 -1.188 -10.463 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -13.173 -2.682 -10.712 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -11.324 -1.933 -8.438 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -12.778 -2.912 -8.391 1.00 0.00 H new ATOM 1553 N LEU A 99 -8.183 -4.135 -11.317 1.00 0.00 N ATOM 1554 CA LEU A 99 -6.726 -4.023 -11.378 1.00 0.00 C ATOM 1555 C LEU A 99 -6.255 -2.564 -11.369 1.00 0.00 C ATOM 1556 O LEU A 99 -5.069 -2.335 -11.191 1.00 0.00 O ATOM 1557 CB LEU A 99 -6.162 -4.763 -12.612 1.00 0.00 C ATOM 1558 CG LEU A 99 -5.988 -6.285 -12.516 1.00 0.00 C ATOM 1559 CD1 LEU A 99 -4.783 -6.610 -11.653 1.00 0.00 C ATOM 1560 CD2 LEU A 99 -7.220 -7.037 -11.997 1.00 0.00 C ATOM 0 H LEU A 99 -8.591 -4.533 -12.163 1.00 0.00 H new ATOM 0 HA LEU A 99 -6.337 -4.498 -10.477 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -6.818 -4.554 -13.457 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -5.190 -4.329 -12.848 1.00 0.00 H new ATOM 0 HG LEU A 99 -5.840 -6.633 -13.538 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -4.663 -7.691 -11.588 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.889 -6.172 -12.097 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -4.930 -6.200 -10.654 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -7.006 -8.105 -11.962 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -7.467 -6.684 -10.996 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -8.064 -6.857 -12.663 1.00 0.00 H new ATOM 1572 N LEU A 100 -7.136 -1.580 -11.539 1.00 0.00 N ATOM 1573 CA LEU A 100 -6.839 -0.158 -11.419 1.00 0.00 C ATOM 1574 C LEU A 100 -8.048 0.519 -10.778 1.00 0.00 C ATOM 1575 O LEU A 100 -9.138 -0.061 -10.764 1.00 0.00 O ATOM 1576 CB LEU A 100 -6.443 0.499 -12.754 1.00 0.00 C ATOM 1577 CG LEU A 100 -7.588 0.810 -13.732 1.00 0.00 C ATOM 1578 CD1 LEU A 100 -7.024 1.481 -14.986 1.00 0.00 C ATOM 1579 CD2 LEU A 100 -8.345 -0.460 -14.133 1.00 0.00 C ATOM 0 H LEU A 100 -8.112 -1.760 -11.773 1.00 0.00 H new ATOM 0 HA LEU A 100 -5.959 -0.032 -10.788 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -5.920 1.430 -12.534 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.732 -0.155 -13.258 1.00 0.00 H new ATOM 0 HG LEU A 100 -8.287 1.479 -13.229 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -7.837 1.701 -15.678 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -6.523 2.408 -14.708 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -6.309 0.813 -15.466 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -9.147 -0.202 -14.825 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -7.659 -1.155 -14.616 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -8.769 -0.927 -13.244 1.00 0.00 H new ATOM 1591 N GLY A 101 -7.904 1.740 -10.281 1.00 0.00 N ATOM 1592 CA GLY A 101 -9.009 2.430 -9.632 1.00 0.00 C ATOM 1593 C GLY A 101 -8.501 3.628 -8.858 1.00 0.00 C ATOM 1594 O GLY A 101 -7.405 4.114 -9.116 1.00 0.00 O ATOM 0 H GLY A 101 -7.034 2.272 -10.315 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -9.734 2.753 -10.379 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -9.527 1.747 -8.959 1.00 0.00 H new ATOM 1598 N THR A 102 -9.292 4.121 -7.912 1.00 0.00 N ATOM 1599 CA THR A 102 -8.888 5.215 -7.047 1.00 0.00 C ATOM 1600 C THR A 102 -8.995 4.790 -5.585 1.00 0.00 C ATOM 1601 O THR A 102 -9.779 3.902 -5.242 1.00 0.00 O ATOM 1602 CB THR A 102 -9.709 6.479 -7.380 1.00 0.00 C ATOM 1603 OG1 THR A 102 -11.090 6.180 -7.514 1.00 0.00 O ATOM 1604 CG2 THR A 102 -9.257 7.133 -8.693 1.00 0.00 C ATOM 0 H THR A 102 -10.232 3.771 -7.726 1.00 0.00 H new ATOM 0 HA THR A 102 -7.842 5.468 -7.221 1.00 0.00 H new ATOM 0 HB THR A 102 -9.543 7.163 -6.548 1.00 0.00 H new ATOM 0 HG1 THR A 102 -11.584 7.000 -7.723 1.00 0.00 H new ATOM 0 HG21 THR A 102 -9.863 8.018 -8.886 1.00 0.00 H new ATOM 0 HG22 THR A 102 -8.209 7.421 -8.614 1.00 0.00 H new ATOM 0 HG23 THR A 102 -9.378 6.425 -9.513 1.00 0.00 H new ATOM 1612 N VAL A 103 -8.172 5.393 -4.727 1.00 0.00 N ATOM 1613 CA VAL A 103 -8.217 5.218 -3.289 1.00 0.00 C ATOM 1614 C VAL A 103 -9.082 6.404 -2.830 1.00 0.00 C ATOM 1615 O VAL A 103 -8.643 7.553 -2.945 1.00 0.00 O ATOM 1616 CB VAL A 103 -6.788 5.234 -2.705 1.00 0.00 C ATOM 1617 CG1 VAL A 103 -6.846 4.922 -1.208 1.00 0.00 C ATOM 1618 CG2 VAL A 103 -5.861 4.218 -3.392 1.00 0.00 C ATOM 0 H VAL A 103 -7.438 6.033 -5.029 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.633 4.267 -2.956 1.00 0.00 H new ATOM 0 HB VAL A 103 -6.378 6.229 -2.879 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -5.837 4.933 -0.795 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -7.453 5.673 -0.703 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -7.289 3.937 -1.058 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -4.869 4.270 -2.944 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -6.264 3.213 -3.265 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -5.792 4.449 -4.455 1.00 0.00 H new ATOM 1628 N PRO A 104 -10.291 6.164 -2.300 1.00 0.00 N ATOM 1629 CA PRO A 104 -11.233 7.226 -1.967 1.00 0.00 C ATOM 1630 C PRO A 104 -11.179 7.613 -0.495 1.00 0.00 C ATOM 1631 O PRO A 104 -10.744 6.828 0.328 1.00 0.00 O ATOM 1632 CB PRO A 104 -12.574 6.586 -2.332 1.00 0.00 C ATOM 1633 CG PRO A 104 -12.394 5.142 -1.846 1.00 0.00 C ATOM 1634 CD PRO A 104 -10.941 4.862 -2.205 1.00 0.00 C ATOM 0 HA PRO A 104 -11.029 8.160 -2.490 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -13.409 7.081 -1.835 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -12.768 6.633 -3.404 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -12.575 5.047 -0.775 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -13.077 4.456 -2.347 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -10.464 4.243 -1.445 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -10.870 4.321 -3.148 1.00 0.00 H new ATOM 1642 N HIS A 105 -11.683 8.782 -0.099 1.00 0.00 N ATOM 1643 CA HIS A 105 -11.545 9.240 1.300 1.00 0.00 C ATOM 1644 C HIS A 105 -12.304 8.413 2.320 1.00 0.00 C ATOM 1645 O HIS A 105 -12.061 8.471 3.526 1.00 0.00 O ATOM 1646 CB HIS A 105 -11.974 10.699 1.448 1.00 0.00 C ATOM 1647 CG HIS A 105 -11.224 11.500 0.457 1.00 0.00 C ATOM 1648 ND1 HIS A 105 -9.871 11.590 0.471 1.00 0.00 N ATOM 1649 CD2 HIS A 105 -11.670 12.004 -0.725 1.00 0.00 C ATOM 1650 CE1 HIS A 105 -9.485 12.199 -0.643 1.00 0.00 C ATOM 1651 NE2 HIS A 105 -10.551 12.490 -1.393 1.00 0.00 N ATOM 0 H HIS A 105 -12.185 9.427 -0.710 1.00 0.00 H new ATOM 0 HA HIS A 105 -10.483 9.119 1.515 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -13.047 10.799 1.285 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -11.771 11.055 2.458 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -12.691 12.023 -1.076 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -8.462 12.425 -0.904 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -10.546 12.978 -2.289 1.00 0.00 H new ATOM 1659 N LYS A 106 -13.280 7.679 1.822 1.00 0.00 N ATOM 1660 CA LYS A 106 -14.202 6.919 2.616 1.00 0.00 C ATOM 1661 C LYS A 106 -13.525 5.570 2.811 1.00 0.00 C ATOM 1662 O LYS A 106 -13.301 4.903 1.800 1.00 0.00 O ATOM 1663 CB LYS A 106 -15.568 6.855 1.914 1.00 0.00 C ATOM 1664 CG LYS A 106 -15.969 8.226 1.318 1.00 0.00 C ATOM 1665 CD LYS A 106 -15.641 8.318 -0.193 1.00 0.00 C ATOM 1666 CE LYS A 106 -15.372 9.744 -0.717 1.00 0.00 C ATOM 1667 NZ LYS A 106 -14.820 9.757 -2.099 1.00 0.00 N ATOM 0 H LYS A 106 -13.451 7.598 0.820 1.00 0.00 H new ATOM 0 HA LYS A 106 -14.421 7.358 3.589 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -15.535 6.109 1.120 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -16.328 6.531 2.625 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -17.036 8.389 1.468 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -15.447 9.020 1.852 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -14.766 7.701 -0.398 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -16.471 7.891 -0.756 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -16.300 10.315 -0.696 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -14.674 10.246 -0.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -14.738 10.739 -2.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -13.880 9.311 -2.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -15.455 9.230 -2.731 1.00 0.00 H new ATOM 1681 N ALA A 107 -13.148 5.221 4.047 1.00 0.00 N ATOM 1682 CA ALA A 107 -12.412 3.995 4.358 1.00 0.00 C ATOM 1683 C ALA A 107 -13.076 2.817 3.652 1.00 0.00 C ATOM 1684 O ALA A 107 -14.222 2.484 3.953 1.00 0.00 O ATOM 1685 CB ALA A 107 -12.302 3.785 5.875 1.00 0.00 C ATOM 0 H ALA A 107 -13.349 5.791 4.868 1.00 0.00 H new ATOM 0 HA ALA A 107 -11.390 4.079 3.989 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -11.750 2.867 6.076 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -11.777 4.629 6.322 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -13.301 3.710 6.305 1.00 0.00 H new ATOM 1691 N SER A 108 -12.380 2.263 2.664 1.00 0.00 N ATOM 1692 CA SER A 108 -12.878 1.208 1.803 1.00 0.00 C ATOM 1693 C SER A 108 -12.003 -0.010 2.035 1.00 0.00 C ATOM 1694 O SER A 108 -10.793 0.115 2.228 1.00 0.00 O ATOM 1695 CB SER A 108 -12.842 1.660 0.344 1.00 0.00 C ATOM 1696 OG SER A 108 -13.673 2.789 0.147 1.00 0.00 O ATOM 0 H SER A 108 -11.427 2.547 2.438 1.00 0.00 H new ATOM 0 HA SER A 108 -13.916 0.965 2.032 1.00 0.00 H new ATOM 0 HB2 SER A 108 -11.818 1.902 0.059 1.00 0.00 H new ATOM 0 HB3 SER A 108 -13.169 0.845 -0.302 1.00 0.00 H new ATOM 0 HG SER A 108 -13.456 3.475 0.812 1.00 0.00 H new ATOM 1702 N VAL A 109 -12.628 -1.178 1.987 1.00 0.00 N ATOM 1703 CA VAL A 109 -12.006 -2.447 2.310 1.00 0.00 C ATOM 1704 C VAL A 109 -11.758 -3.199 1.002 1.00 0.00 C ATOM 1705 O VAL A 109 -12.607 -3.202 0.106 1.00 0.00 O ATOM 1706 CB VAL A 109 -12.909 -3.219 3.299 1.00 0.00 C ATOM 1707 CG1 VAL A 109 -12.160 -4.414 3.889 1.00 0.00 C ATOM 1708 CG2 VAL A 109 -13.403 -2.348 4.472 1.00 0.00 C ATOM 0 H VAL A 109 -13.607 -1.268 1.715 1.00 0.00 H new ATOM 0 HA VAL A 109 -11.044 -2.316 2.806 1.00 0.00 H new ATOM 0 HB VAL A 109 -13.773 -3.543 2.718 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -12.812 -4.945 4.583 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -11.859 -5.087 3.086 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -11.275 -4.063 4.419 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -14.032 -2.947 5.131 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -12.547 -1.972 5.032 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -13.980 -1.509 4.084 1.00 0.00 H new ATOM 1718 N VAL A 110 -10.601 -3.844 0.894 1.00 0.00 N ATOM 1719 CA VAL A 110 -10.167 -4.612 -0.256 1.00 0.00 C ATOM 1720 C VAL A 110 -9.902 -6.022 0.259 1.00 0.00 C ATOM 1721 O VAL A 110 -8.896 -6.264 0.930 1.00 0.00 O ATOM 1722 CB VAL A 110 -8.922 -3.948 -0.893 1.00 0.00 C ATOM 1723 CG1 VAL A 110 -8.444 -4.721 -2.133 1.00 0.00 C ATOM 1724 CG2 VAL A 110 -9.212 -2.496 -1.307 1.00 0.00 C ATOM 0 H VAL A 110 -9.911 -3.842 1.645 1.00 0.00 H new ATOM 0 HA VAL A 110 -10.914 -4.649 -1.049 1.00 0.00 H new ATOM 0 HB VAL A 110 -8.141 -3.963 -0.132 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -7.569 -4.227 -2.555 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -8.183 -5.740 -1.848 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -9.241 -4.744 -2.877 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -8.318 -2.059 -1.751 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -10.023 -2.480 -2.035 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -9.501 -1.918 -0.429 1.00 0.00 H new ATOM 1734 N GLN A 111 -10.823 -6.950 -0.020 1.00 0.00 N ATOM 1735 CA GLN A 111 -10.600 -8.349 0.308 1.00 0.00 C ATOM 1736 C GLN A 111 -9.581 -8.894 -0.690 1.00 0.00 C ATOM 1737 O GLN A 111 -9.577 -8.508 -1.864 1.00 0.00 O ATOM 1738 CB GLN A 111 -11.916 -9.152 0.307 1.00 0.00 C ATOM 1739 CG GLN A 111 -11.742 -10.544 0.931 1.00 0.00 C ATOM 1740 CD GLN A 111 -13.063 -11.110 1.437 1.00 0.00 C ATOM 1741 OE1 GLN A 111 -13.221 -11.363 2.625 1.00 0.00 O ATOM 1742 NE2 GLN A 111 -14.039 -11.319 0.566 1.00 0.00 N ATOM 0 H GLN A 111 -11.719 -6.754 -0.467 1.00 0.00 H new ATOM 0 HA GLN A 111 -10.209 -8.446 1.321 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -12.677 -8.600 0.858 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -12.276 -9.256 -0.716 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -11.316 -11.222 0.192 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -11.032 -10.486 1.756 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -13.896 -11.105 -0.421 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -14.933 -11.694 0.882 1.00 0.00 H new ATOM 1751 N VAL A 112 -8.758 -9.827 -0.231 1.00 0.00 N ATOM 1752 CA VAL A 112 -7.754 -10.521 -1.007 1.00 0.00 C ATOM 1753 C VAL A 112 -7.979 -11.999 -0.687 1.00 0.00 C ATOM 1754 O VAL A 112 -7.848 -12.383 0.475 1.00 0.00 O ATOM 1755 CB VAL A 112 -6.334 -10.040 -0.626 1.00 0.00 C ATOM 1756 CG1 VAL A 112 -5.351 -10.362 -1.759 1.00 0.00 C ATOM 1757 CG2 VAL A 112 -6.229 -8.531 -0.331 1.00 0.00 C ATOM 0 H VAL A 112 -8.778 -10.131 0.742 1.00 0.00 H new ATOM 0 HA VAL A 112 -7.837 -10.331 -2.077 1.00 0.00 H new ATOM 0 HB VAL A 112 -6.091 -10.572 0.294 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -4.353 -10.020 -1.483 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -5.332 -11.438 -1.929 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -5.669 -9.856 -2.671 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -5.200 -8.281 -0.073 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -6.529 -7.966 -1.214 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -6.884 -8.277 0.502 1.00 0.00 H new ATOM 1767 N GLY A 113 -8.399 -12.813 -1.656 1.00 0.00 N ATOM 1768 CA GLY A 113 -8.707 -14.217 -1.492 1.00 0.00 C ATOM 1769 C GLY A 113 -7.557 -15.075 -1.986 1.00 0.00 C ATOM 1770 O GLY A 113 -6.915 -14.697 -2.960 1.00 0.00 O ATOM 0 H GLY A 113 -8.537 -12.489 -2.613 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -8.904 -14.432 -0.442 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -9.615 -14.463 -2.043 1.00 0.00 H new ATOM 1774 N PHE A 114 -7.306 -16.233 -1.371 1.00 0.00 N ATOM 1775 CA PHE A 114 -6.154 -17.073 -1.680 1.00 0.00 C ATOM 1776 C PHE A 114 -6.567 -18.543 -1.923 1.00 0.00 C ATOM 1777 O PHE A 114 -6.332 -19.400 -1.052 1.00 0.00 O ATOM 1778 CB PHE A 114 -5.121 -17.002 -0.525 1.00 0.00 C ATOM 1779 CG PHE A 114 -4.825 -15.663 0.118 1.00 0.00 C ATOM 1780 CD1 PHE A 114 -4.675 -14.502 -0.654 1.00 0.00 C ATOM 1781 CD2 PHE A 114 -4.650 -15.592 1.515 1.00 0.00 C ATOM 1782 CE1 PHE A 114 -4.440 -13.276 -0.021 1.00 0.00 C ATOM 1783 CE2 PHE A 114 -4.367 -14.365 2.136 1.00 0.00 C ATOM 1784 CZ PHE A 114 -4.303 -13.189 1.371 1.00 0.00 C ATOM 0 H PHE A 114 -7.904 -16.615 -0.638 1.00 0.00 H new ATOM 0 HA PHE A 114 -5.705 -16.695 -2.598 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -5.461 -17.676 0.261 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -4.179 -17.401 -0.902 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -4.740 -14.554 -1.731 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -4.734 -16.488 2.112 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -4.363 -12.379 -0.617 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -4.199 -14.326 3.202 1.00 0.00 H new ATOM 0 HZ PHE A 114 -4.151 -12.232 1.848 1.00 0.00 H new ATOM 1794 N PRO A 115 -7.193 -18.879 -3.062 1.00 0.00 N ATOM 1795 CA PRO A 115 -7.483 -20.263 -3.416 1.00 0.00 C ATOM 1796 C PRO A 115 -6.160 -21.017 -3.617 1.00 0.00 C ATOM 1797 O PRO A 115 -5.354 -20.652 -4.479 1.00 0.00 O ATOM 1798 CB PRO A 115 -8.339 -20.209 -4.689 1.00 0.00 C ATOM 1799 CG PRO A 115 -8.065 -18.819 -5.264 1.00 0.00 C ATOM 1800 CD PRO A 115 -7.838 -17.981 -4.008 1.00 0.00 C ATOM 0 HA PRO A 115 -8.028 -20.798 -2.638 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -8.058 -20.994 -5.392 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -9.397 -20.346 -4.464 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -7.193 -18.815 -5.918 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -8.906 -18.450 -5.852 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -7.210 -17.116 -4.220 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -8.780 -17.602 -3.612 1.00 0.00 H new ATOM 1808 N CYS A 116 -5.915 -22.034 -2.778 1.00 0.00 N ATOM 1809 CA CYS A 116 -4.771 -22.925 -2.921 1.00 0.00 C ATOM 1810 C CYS A 116 -5.216 -24.140 -3.717 1.00 0.00 C ATOM 1811 O CYS A 116 -6.333 -24.616 -3.516 1.00 0.00 O ATOM 1812 CB CYS A 116 -4.202 -23.379 -1.569 1.00 0.00 C ATOM 1813 SG CYS A 116 -2.531 -24.040 -1.754 1.00 0.00 S ATOM 0 H CYS A 116 -6.511 -22.256 -1.981 1.00 0.00 H new ATOM 0 HA CYS A 116 -3.976 -22.381 -3.432 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -4.189 -22.538 -0.876 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -4.851 -24.140 -1.135 1.00 0.00 H new ATOM 1818 N LEU A 117 -4.331 -24.674 -4.558 1.00 0.00 N ATOM 1819 CA LEU A 117 -4.632 -25.824 -5.401 1.00 0.00 C ATOM 1820 C LEU A 117 -4.539 -27.134 -4.605 1.00 0.00 C ATOM 1821 O LEU A 117 -4.940 -28.179 -5.108 1.00 0.00 O ATOM 1822 CB LEU A 117 -3.710 -25.871 -6.637 1.00 0.00 C ATOM 1823 CG LEU A 117 -3.609 -24.616 -7.548 1.00 0.00 C ATOM 1824 CD1 LEU A 117 -3.466 -25.061 -9.005 1.00 0.00 C ATOM 1825 CD2 LEU A 117 -4.743 -23.583 -7.466 1.00 0.00 C ATOM 0 H LEU A 117 -3.382 -24.318 -4.672 1.00 0.00 H new ATOM 0 HA LEU A 117 -5.658 -25.712 -5.752 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -2.704 -26.107 -6.289 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -4.036 -26.704 -7.259 1.00 0.00 H new ATOM 0 HG LEU A 117 -2.735 -24.091 -7.163 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -3.395 -24.184 -9.648 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -2.565 -25.665 -9.114 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -4.336 -25.652 -9.292 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -4.539 -22.763 -8.155 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -5.687 -24.057 -7.735 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -4.809 -23.195 -6.450 1.00 0.00 H new ATOM 1837 N GLY A 118 -4.001 -27.091 -3.379 1.00 0.00 N ATOM 1838 CA GLY A 118 -3.945 -28.198 -2.433 1.00 0.00 C ATOM 1839 C GLY A 118 -3.283 -29.459 -2.983 1.00 0.00 C ATOM 1840 O GLY A 118 -3.707 -30.566 -2.656 1.00 0.00 O ATOM 0 H GLY A 118 -3.575 -26.241 -3.009 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -3.403 -27.875 -1.544 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -4.959 -28.442 -2.116 1.00 0.00 H new ATOM 1844 N LYS A 119 -2.279 -29.323 -3.857 1.00 0.00 N ATOM 1845 CA LYS A 119 -1.637 -30.479 -4.477 1.00 0.00 C ATOM 1846 C LYS A 119 -0.410 -30.892 -3.678 1.00 0.00 C ATOM 1847 O LYS A 119 -0.387 -32.009 -3.171 1.00 0.00 O ATOM 1848 CB LYS A 119 -1.365 -30.264 -5.956 1.00 0.00 C ATOM 1849 CG LYS A 119 -2.647 -30.368 -6.803 1.00 0.00 C ATOM 1850 CD LYS A 119 -3.624 -31.540 -6.564 1.00 0.00 C ATOM 1851 CE LYS A 119 -4.749 -31.166 -5.587 1.00 0.00 C ATOM 1852 NZ LYS A 119 -5.251 -32.330 -4.837 1.00 0.00 N ATOM 0 H LYS A 119 -1.897 -28.423 -4.148 1.00 0.00 H new ATOM 0 HA LYS A 119 -2.331 -31.319 -4.447 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -0.913 -29.283 -6.102 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -0.642 -31.002 -6.302 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -3.206 -29.443 -6.664 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -2.345 -30.403 -7.850 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -4.058 -31.849 -7.515 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -3.074 -32.396 -6.172 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -4.383 -30.416 -4.886 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -5.571 -30.712 -6.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -5.960 -32.017 -4.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -5.686 -33.006 -5.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -4.461 -32.790 -4.341 1.00 0.00 H new ATOM 1866 N GLN A 120 0.606 -30.037 -3.584 1.00 0.00 N ATOM 1867 CA GLN A 120 1.765 -30.293 -2.738 1.00 0.00 C ATOM 1868 C GLN A 120 1.546 -29.581 -1.401 1.00 0.00 C ATOM 1869 O GLN A 120 0.882 -28.542 -1.335 1.00 0.00 O ATOM 1870 CB GLN A 120 3.021 -29.803 -3.480 1.00 0.00 C ATOM 1871 CG GLN A 120 4.394 -29.998 -2.818 1.00 0.00 C ATOM 1872 CD GLN A 120 4.605 -31.386 -2.227 1.00 0.00 C ATOM 1873 OE1 GLN A 120 4.760 -31.468 -0.915 1.00 0.00 O flip ATOM 1874 NE2 GLN A 120 4.624 -32.379 -2.940 1.00 0.00 N flip ATOM 0 H GLN A 120 0.648 -29.152 -4.090 1.00 0.00 H new ATOM 0 HA GLN A 120 1.900 -31.354 -2.529 1.00 0.00 H new ATOM 0 HB2 GLN A 120 3.048 -30.302 -4.449 1.00 0.00 H new ATOM 0 HB3 GLN A 120 2.896 -28.738 -3.673 1.00 0.00 H new ATOM 0 HG2 GLN A 120 5.173 -29.807 -3.556 1.00 0.00 H new ATOM 0 HG3 GLN A 120 4.514 -29.256 -2.029 1.00 0.00 H new ATOM 0 HE21 GLN A 120 4.502 -32.285 -3.948 1.00 0.00 H new ATOM 0 HE22 GLN A 120 4.762 -33.301 -2.527 1.00 0.00 H new ATOM 1883 N ASP A 121 2.190 -30.096 -0.362 1.00 0.00 N ATOM 1884 CA ASP A 121 2.203 -29.539 0.987 1.00 0.00 C ATOM 1885 C ASP A 121 3.431 -28.645 1.099 1.00 0.00 C ATOM 1886 O ASP A 121 4.456 -28.916 0.461 1.00 0.00 O ATOM 1887 CB ASP A 121 2.398 -30.614 2.072 1.00 0.00 C ATOM 1888 CG ASP A 121 1.471 -31.805 1.946 1.00 0.00 C ATOM 1889 OD1 ASP A 121 1.795 -32.677 1.112 1.00 0.00 O ATOM 1890 OD2 ASP A 121 0.452 -31.807 2.668 1.00 0.00 O ATOM 0 H ASP A 121 2.742 -30.950 -0.438 1.00 0.00 H new ATOM 0 HA ASP A 121 1.250 -29.031 1.138 1.00 0.00 H new ATOM 0 HB2 ASP A 121 3.429 -30.966 2.036 1.00 0.00 H new ATOM 0 HB3 ASP A 121 2.251 -30.156 3.050 1.00 0.00 H new ATOM 1895 N GLY A 122 3.382 -27.628 1.957 1.00 0.00 N ATOM 1896 CA GLY A 122 4.500 -26.718 2.162 1.00 0.00 C ATOM 1897 C GLY A 122 3.996 -25.296 2.288 1.00 0.00 C ATOM 1898 O GLY A 122 2.875 -25.062 2.738 1.00 0.00 O ATOM 0 H GLY A 122 2.565 -27.414 2.528 1.00 0.00 H new ATOM 0 HA2 GLY A 122 5.048 -26.999 3.061 1.00 0.00 H new ATOM 0 HA3 GLY A 122 5.197 -26.792 1.328 1.00 0.00 H new ATOM 1902 N VAL A 123 4.838 -24.338 1.910 1.00 0.00 N ATOM 1903 CA VAL A 123 4.498 -22.924 1.945 1.00 0.00 C ATOM 1904 C VAL A 123 4.782 -22.326 0.570 1.00 0.00 C ATOM 1905 O VAL A 123 5.932 -22.297 0.130 1.00 0.00 O ATOM 1906 CB VAL A 123 5.265 -22.198 3.076 1.00 0.00 C ATOM 1907 CG1 VAL A 123 4.720 -20.779 3.287 1.00 0.00 C ATOM 1908 CG2 VAL A 123 5.197 -22.932 4.427 1.00 0.00 C ATOM 0 H VAL A 123 5.781 -24.525 1.569 1.00 0.00 H new ATOM 0 HA VAL A 123 3.439 -22.796 2.170 1.00 0.00 H new ATOM 0 HB VAL A 123 6.304 -22.173 2.746 1.00 0.00 H new ATOM 0 HG11 VAL A 123 5.276 -20.291 4.087 1.00 0.00 H new ATOM 0 HG12 VAL A 123 4.831 -20.206 2.366 1.00 0.00 H new ATOM 0 HG13 VAL A 123 3.665 -20.831 3.558 1.00 0.00 H new ATOM 0 HG21 VAL A 123 5.755 -22.369 5.175 1.00 0.00 H new ATOM 0 HG22 VAL A 123 4.157 -23.021 4.741 1.00 0.00 H new ATOM 0 HG23 VAL A 123 5.631 -23.927 4.323 1.00 0.00 H new ATOM 1918 N ALA A 124 3.723 -21.901 -0.116 1.00 0.00 N ATOM 1919 CA ALA A 124 3.792 -21.183 -1.372 1.00 0.00 C ATOM 1920 C ALA A 124 3.994 -19.709 -1.050 1.00 0.00 C ATOM 1921 O ALA A 124 3.894 -19.273 0.101 1.00 0.00 O ATOM 1922 CB ALA A 124 2.493 -21.360 -2.169 1.00 0.00 C ATOM 0 H ALA A 124 2.767 -22.055 0.203 1.00 0.00 H new ATOM 0 HA ALA A 124 4.614 -21.568 -1.975 1.00 0.00 H new ATOM 0 HB1 ALA A 124 2.565 -20.813 -3.109 1.00 0.00 H new ATOM 0 HB2 ALA A 124 2.335 -22.418 -2.376 1.00 0.00 H new ATOM 0 HB3 ALA A 124 1.655 -20.975 -1.589 1.00 0.00 H new ATOM 1928 N ALA A 125 4.216 -18.928 -2.097 1.00 0.00 N ATOM 1929 CA ALA A 125 4.315 -17.483 -2.038 1.00 0.00 C ATOM 1930 C ALA A 125 3.484 -16.868 -3.160 1.00 0.00 C ATOM 1931 O ALA A 125 3.197 -17.559 -4.139 1.00 0.00 O ATOM 1932 CB ALA A 125 5.791 -17.104 -2.172 1.00 0.00 C ATOM 0 H ALA A 125 4.336 -19.298 -3.040 1.00 0.00 H new ATOM 0 HA ALA A 125 3.929 -17.104 -1.092 1.00 0.00 H new ATOM 0 HB1 ALA A 125 5.893 -16.020 -2.131 1.00 0.00 H new ATOM 0 HB2 ALA A 125 6.358 -17.553 -1.356 1.00 0.00 H new ATOM 0 HB3 ALA A 125 6.175 -17.469 -3.125 1.00 0.00 H new ATOM 1938 N PHE A 126 3.118 -15.593 -3.029 1.00 0.00 N ATOM 1939 CA PHE A 126 2.446 -14.819 -4.066 1.00 0.00 C ATOM 1940 C PHE A 126 2.938 -13.375 -3.945 1.00 0.00 C ATOM 1941 O PHE A 126 3.178 -12.898 -2.832 1.00 0.00 O ATOM 1942 CB PHE A 126 0.912 -14.984 -4.015 1.00 0.00 C ATOM 1943 CG PHE A 126 0.104 -14.178 -3.020 1.00 0.00 C ATOM 1944 CD1 PHE A 126 -0.099 -12.793 -3.209 1.00 0.00 C ATOM 1945 CD2 PHE A 126 -0.600 -14.849 -2.002 1.00 0.00 C ATOM 1946 CE1 PHE A 126 -0.942 -12.089 -2.336 1.00 0.00 C ATOM 1947 CE2 PHE A 126 -1.428 -14.137 -1.120 1.00 0.00 C ATOM 1948 CZ PHE A 126 -1.577 -12.750 -1.279 1.00 0.00 C ATOM 0 H PHE A 126 3.286 -15.059 -2.176 1.00 0.00 H new ATOM 0 HA PHE A 126 2.701 -15.188 -5.059 1.00 0.00 H new ATOM 0 HB2 PHE A 126 0.527 -14.756 -5.009 1.00 0.00 H new ATOM 0 HB3 PHE A 126 0.704 -16.037 -3.827 1.00 0.00 H new ATOM 0 HD1 PHE A 126 0.392 -12.278 -4.022 1.00 0.00 H new ATOM 0 HD2 PHE A 126 -0.502 -15.920 -1.899 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -1.102 -11.031 -2.481 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -1.947 -14.652 -0.325 1.00 0.00 H new ATOM 0 HZ PHE A 126 -2.184 -12.191 -0.582 1.00 0.00 H new ATOM 1958 N GLU A 127 3.161 -12.706 -5.073 1.00 0.00 N ATOM 1959 CA GLU A 127 3.711 -11.363 -5.157 1.00 0.00 C ATOM 1960 C GLU A 127 2.606 -10.318 -5.237 1.00 0.00 C ATOM 1961 O GLU A 127 1.556 -10.588 -5.840 1.00 0.00 O ATOM 1962 CB GLU A 127 4.603 -11.227 -6.416 1.00 0.00 C ATOM 1963 CG GLU A 127 3.951 -11.726 -7.732 1.00 0.00 C ATOM 1964 CD GLU A 127 4.519 -11.146 -9.039 1.00 0.00 C ATOM 1965 OE1 GLU A 127 5.185 -10.087 -9.037 1.00 0.00 O ATOM 1966 OE2 GLU A 127 4.158 -11.671 -10.116 1.00 0.00 O ATOM 0 H GLU A 127 2.954 -13.104 -5.989 1.00 0.00 H new ATOM 0 HA GLU A 127 4.300 -11.196 -4.256 1.00 0.00 H new ATOM 0 HB2 GLU A 127 4.878 -10.179 -6.538 1.00 0.00 H new ATOM 0 HB3 GLU A 127 5.527 -11.782 -6.251 1.00 0.00 H new ATOM 0 HG2 GLU A 127 4.046 -12.811 -7.770 1.00 0.00 H new ATOM 0 HG3 GLU A 127 2.885 -11.500 -7.693 1.00 0.00 H new ATOM 1973 N VAL A 128 2.885 -9.133 -4.670 1.00 0.00 N ATOM 1974 CA VAL A 128 2.044 -7.947 -4.738 1.00 0.00 C ATOM 1975 C VAL A 128 2.934 -6.715 -4.946 1.00 0.00 C ATOM 1976 O VAL A 128 3.966 -6.576 -4.290 1.00 0.00 O ATOM 1977 CB VAL A 128 1.203 -7.794 -3.454 1.00 0.00 C ATOM 1978 CG1 VAL A 128 0.189 -6.645 -3.581 1.00 0.00 C ATOM 1979 CG2 VAL A 128 0.453 -9.089 -3.128 1.00 0.00 C ATOM 0 H VAL A 128 3.738 -8.978 -4.133 1.00 0.00 H new ATOM 0 HA VAL A 128 1.354 -8.046 -5.576 1.00 0.00 H new ATOM 0 HB VAL A 128 1.898 -7.567 -2.646 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -0.387 -6.565 -2.659 1.00 0.00 H new ATOM 0 HG12 VAL A 128 0.719 -5.710 -3.760 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -0.485 -6.845 -4.414 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -0.131 -8.952 -2.218 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -0.214 -9.341 -3.953 1.00 0.00 H new ATOM 0 HG23 VAL A 128 1.169 -9.897 -2.981 1.00 0.00 H new ATOM 1989 N ASP A 129 2.534 -5.824 -5.852 1.00 0.00 N ATOM 1990 CA ASP A 129 3.144 -4.523 -6.121 1.00 0.00 C ATOM 1991 C ASP A 129 2.024 -3.692 -6.736 1.00 0.00 C ATOM 1992 O ASP A 129 1.418 -4.113 -7.720 1.00 0.00 O ATOM 1993 CB ASP A 129 4.348 -4.601 -7.073 1.00 0.00 C ATOM 1994 CG ASP A 129 5.048 -3.248 -7.271 1.00 0.00 C ATOM 1995 OD1 ASP A 129 4.491 -2.187 -6.915 1.00 0.00 O ATOM 1996 OD2 ASP A 129 6.193 -3.264 -7.779 1.00 0.00 O ATOM 0 H ASP A 129 1.729 -6.001 -6.453 1.00 0.00 H new ATOM 0 HA ASP A 129 3.547 -4.091 -5.205 1.00 0.00 H new ATOM 0 HB2 ASP A 129 5.067 -5.321 -6.682 1.00 0.00 H new ATOM 0 HB3 ASP A 129 4.015 -4.976 -8.041 1.00 0.00 H new ATOM 2001 N VAL A 130 1.660 -2.572 -6.124 1.00 0.00 N ATOM 2002 CA VAL A 130 0.615 -1.689 -6.589 1.00 0.00 C ATOM 2003 C VAL A 130 1.229 -0.302 -6.575 1.00 0.00 C ATOM 2004 O VAL A 130 1.789 0.134 -5.559 1.00 0.00 O ATOM 2005 CB VAL A 130 -0.644 -1.836 -5.715 1.00 0.00 C ATOM 2006 CG1 VAL A 130 -1.831 -0.999 -6.208 1.00 0.00 C ATOM 2007 CG2 VAL A 130 -1.099 -3.298 -5.724 1.00 0.00 C ATOM 0 H VAL A 130 2.102 -2.249 -5.263 1.00 0.00 H new ATOM 0 HA VAL A 130 0.267 -1.922 -7.596 1.00 0.00 H new ATOM 0 HB VAL A 130 -0.363 -1.488 -4.721 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -2.683 -1.151 -5.546 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -1.556 0.056 -6.210 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -2.098 -1.306 -7.219 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -1.990 -3.405 -5.106 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -1.327 -3.602 -6.746 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -0.304 -3.929 -5.327 1.00 0.00 H new ATOM 2017 N ILE A 131 1.191 0.339 -7.733 1.00 0.00 N ATOM 2018 CA ILE A 131 1.601 1.713 -7.910 1.00 0.00 C ATOM 2019 C ILE A 131 0.375 2.583 -7.644 1.00 0.00 C ATOM 2020 O ILE A 131 -0.769 2.125 -7.590 1.00 0.00 O ATOM 2021 CB ILE A 131 2.235 1.978 -9.297 1.00 0.00 C ATOM 2022 CG1 ILE A 131 1.270 1.734 -10.467 1.00 0.00 C ATOM 2023 CG2 ILE A 131 3.571 1.241 -9.476 1.00 0.00 C ATOM 2024 CD1 ILE A 131 1.176 0.264 -10.934 1.00 0.00 C ATOM 0 H ILE A 131 0.865 -0.098 -8.595 1.00 0.00 H new ATOM 0 HA ILE A 131 2.396 1.960 -7.206 1.00 0.00 H new ATOM 0 HB ILE A 131 2.457 3.045 -9.321 1.00 0.00 H new ATOM 0 HG12 ILE A 131 0.276 2.072 -10.176 1.00 0.00 H new ATOM 0 HG13 ILE A 131 1.582 2.349 -11.311 1.00 0.00 H new ATOM 0 HG21 ILE A 131 3.977 1.458 -10.464 1.00 0.00 H new ATOM 0 HG22 ILE A 131 4.275 1.574 -8.713 1.00 0.00 H new ATOM 0 HG23 ILE A 131 3.410 0.167 -9.378 1.00 0.00 H new ATOM 0 HD11 ILE A 131 0.472 0.190 -11.763 1.00 0.00 H new ATOM 0 HD12 ILE A 131 2.158 -0.077 -11.261 1.00 0.00 H new ATOM 0 HD13 ILE A 131 0.832 -0.359 -10.108 1.00 0.00 H new ATOM 2036 N VAL A 132 0.636 3.865 -7.491 1.00 0.00 N ATOM 2037 CA VAL A 132 -0.307 4.893 -7.128 1.00 0.00 C ATOM 2038 C VAL A 132 0.140 6.143 -7.860 1.00 0.00 C ATOM 2039 O VAL A 132 1.330 6.489 -7.885 1.00 0.00 O ATOM 2040 CB VAL A 132 -0.347 5.063 -5.600 1.00 0.00 C ATOM 2041 CG1 VAL A 132 -0.904 6.418 -5.133 1.00 0.00 C ATOM 2042 CG2 VAL A 132 -1.147 3.943 -4.913 1.00 0.00 C ATOM 0 H VAL A 132 1.576 4.237 -7.627 1.00 0.00 H new ATOM 0 HA VAL A 132 -1.329 4.647 -7.415 1.00 0.00 H new ATOM 0 HB VAL A 132 0.700 5.011 -5.303 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -0.898 6.458 -4.044 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -0.284 7.222 -5.529 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -1.925 6.536 -5.495 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -1.148 4.105 -3.835 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -2.173 3.950 -5.282 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -0.688 2.979 -5.135 1.00 0.00 H new ATOM 2052 N MET A 133 -0.832 6.813 -8.458 1.00 0.00 N ATOM 2053 CA MET A 133 -0.630 7.985 -9.284 1.00 0.00 C ATOM 2054 C MET A 133 -1.710 9.008 -8.964 1.00 0.00 C ATOM 2055 O MET A 133 -2.592 8.767 -8.133 1.00 0.00 O ATOM 2056 CB MET A 133 -0.709 7.616 -10.782 1.00 0.00 C ATOM 2057 CG MET A 133 0.150 6.424 -11.232 1.00 0.00 C ATOM 2058 SD MET A 133 -0.757 5.022 -11.940 1.00 0.00 S ATOM 2059 CE MET A 133 -2.028 4.725 -10.684 1.00 0.00 C ATOM 0 H MET A 133 -1.813 6.545 -8.377 1.00 0.00 H new ATOM 0 HA MET A 133 0.357 8.397 -9.077 1.00 0.00 H new ATOM 0 HB2 MET A 133 -1.749 7.401 -11.028 1.00 0.00 H new ATOM 0 HB3 MET A 133 -0.417 8.489 -11.366 1.00 0.00 H new ATOM 0 HG2 MET A 133 0.870 6.777 -11.970 1.00 0.00 H new ATOM 0 HG3 MET A 133 0.721 6.068 -10.375 1.00 0.00 H new ATOM 0 HE1 MET A 133 -2.645 3.878 -10.984 1.00 0.00 H new ATOM 0 HE2 MET A 133 -1.551 4.507 -9.728 1.00 0.00 H new ATOM 0 HE3 MET A 133 -2.654 5.612 -10.583 1.00 0.00 H new ATOM 2069 N ASN A 134 -1.593 10.183 -9.571 1.00 0.00 N ATOM 2070 CA ASN A 134 -2.615 11.213 -9.491 1.00 0.00 C ATOM 2071 C ASN A 134 -3.616 10.909 -10.625 1.00 0.00 C ATOM 2072 O ASN A 134 -3.413 9.957 -11.386 1.00 0.00 O ATOM 2073 CB ASN A 134 -1.990 12.616 -9.482 1.00 0.00 C ATOM 2074 CG ASN A 134 -1.577 13.189 -10.833 1.00 0.00 C ATOM 2075 OD1 ASN A 134 -1.470 12.504 -11.848 1.00 0.00 O ATOM 2076 ND2 ASN A 134 -1.277 14.474 -10.840 1.00 0.00 N ATOM 0 H ASN A 134 -0.784 10.446 -10.133 1.00 0.00 H new ATOM 0 HA ASN A 134 -3.168 11.204 -8.552 1.00 0.00 H new ATOM 0 HB2 ASN A 134 -2.702 13.303 -9.024 1.00 0.00 H new ATOM 0 HB3 ASN A 134 -1.110 12.593 -8.839 1.00 0.00 H new ATOM 0 HD21 ASN A 134 -0.949 14.917 -11.699 1.00 0.00 H new ATOM 0 HD22 ASN A 134 -1.373 15.025 -9.987 1.00 0.00 H new ATOM 2083 N SER A 135 -4.716 11.654 -10.743 1.00 0.00 N ATOM 2084 CA SER A 135 -5.763 11.325 -11.713 1.00 0.00 C ATOM 2085 C SER A 135 -5.313 11.452 -13.176 1.00 0.00 C ATOM 2086 O SER A 135 -6.028 10.965 -14.052 1.00 0.00 O ATOM 2087 CB SER A 135 -6.996 12.198 -11.449 1.00 0.00 C ATOM 2088 OG SER A 135 -8.119 11.681 -12.138 1.00 0.00 O ATOM 0 H SER A 135 -4.905 12.485 -10.183 1.00 0.00 H new ATOM 0 HA SER A 135 -6.008 10.272 -11.571 1.00 0.00 H new ATOM 0 HB2 SER A 135 -7.202 12.235 -10.379 1.00 0.00 H new ATOM 0 HB3 SER A 135 -6.802 13.221 -11.772 1.00 0.00 H new ATOM 0 HG SER A 135 -7.824 11.251 -12.968 1.00 0.00 H new ATOM 2094 N GLU A 136 -4.178 12.091 -13.457 1.00 0.00 N ATOM 2095 CA GLU A 136 -3.617 12.224 -14.795 1.00 0.00 C ATOM 2096 C GLU A 136 -2.582 11.126 -15.081 1.00 0.00 C ATOM 2097 O GLU A 136 -2.072 11.053 -16.198 1.00 0.00 O ATOM 2098 CB GLU A 136 -3.017 13.624 -15.018 1.00 0.00 C ATOM 2099 CG GLU A 136 -3.864 14.790 -14.478 1.00 0.00 C ATOM 2100 CD GLU A 136 -3.481 15.113 -13.030 1.00 0.00 C ATOM 2101 OE1 GLU A 136 -2.487 15.855 -12.857 1.00 0.00 O ATOM 2102 OE2 GLU A 136 -4.106 14.559 -12.095 1.00 0.00 O ATOM 0 H GLU A 136 -3.610 12.541 -12.739 1.00 0.00 H new ATOM 0 HA GLU A 136 -4.436 12.099 -15.504 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -2.034 13.661 -14.548 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -2.864 13.771 -16.087 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -3.719 15.671 -15.103 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -4.922 14.532 -14.531 1.00 0.00 H new ATOM 2109 N GLY A 137 -2.266 10.277 -14.096 1.00 0.00 N ATOM 2110 CA GLY A 137 -1.358 9.148 -14.249 1.00 0.00 C ATOM 2111 C GLY A 137 0.077 9.451 -13.819 1.00 0.00 C ATOM 2112 O GLY A 137 0.956 8.627 -14.058 1.00 0.00 O ATOM 0 H GLY A 137 -2.645 10.363 -13.153 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -1.734 8.309 -13.664 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -1.356 8.833 -15.293 1.00 0.00 H new ATOM 2116 N ASN A 138 0.353 10.597 -13.181 1.00 0.00 N ATOM 2117 CA ASN A 138 1.694 10.867 -12.662 1.00 0.00 C ATOM 2118 C ASN A 138 1.911 10.022 -11.416 1.00 0.00 C ATOM 2119 O ASN A 138 1.201 10.206 -10.426 1.00 0.00 O ATOM 2120 CB ASN A 138 1.926 12.324 -12.267 1.00 0.00 C ATOM 2121 CG ASN A 138 1.742 13.306 -13.410 1.00 0.00 C ATOM 2122 OD1 ASN A 138 2.675 13.598 -14.149 1.00 0.00 O ATOM 2123 ND2 ASN A 138 0.542 13.839 -13.567 1.00 0.00 N ATOM 0 H ASN A 138 -0.326 11.340 -13.015 1.00 0.00 H new ATOM 0 HA ASN A 138 2.388 10.628 -13.468 1.00 0.00 H new ATOM 0 HB2 ASN A 138 1.240 12.586 -11.462 1.00 0.00 H new ATOM 0 HB3 ASN A 138 2.936 12.427 -11.871 1.00 0.00 H new ATOM 0 HD21 ASN A 138 0.376 14.510 -14.317 1.00 0.00 H new ATOM 0 HD22 ASN A 138 -0.218 13.579 -12.938 1.00 0.00 H new ATOM 2130 N THR A 139 2.866 9.103 -11.452 1.00 0.00 N ATOM 2131 CA THR A 139 3.149 8.183 -10.356 1.00 0.00 C ATOM 2132 C THR A 139 3.766 8.962 -9.192 1.00 0.00 C ATOM 2133 O THR A 139 4.569 9.872 -9.407 1.00 0.00 O ATOM 2134 CB THR A 139 4.093 7.072 -10.843 1.00 0.00 C ATOM 2135 OG1 THR A 139 3.745 6.670 -12.155 1.00 0.00 O ATOM 2136 CG2 THR A 139 4.059 5.836 -9.935 1.00 0.00 C ATOM 0 H THR A 139 3.478 8.973 -12.258 1.00 0.00 H new ATOM 0 HA THR A 139 2.226 7.716 -10.011 1.00 0.00 H new ATOM 0 HB THR A 139 5.099 7.490 -10.822 1.00 0.00 H new ATOM 0 HG1 THR A 139 4.355 5.963 -12.453 1.00 0.00 H new ATOM 0 HG21 THR A 139 4.743 5.081 -10.323 1.00 0.00 H new ATOM 0 HG22 THR A 139 4.362 6.117 -8.926 1.00 0.00 H new ATOM 0 HG23 THR A 139 3.047 5.431 -9.910 1.00 0.00 H new ATOM 2144 N ILE A 140 3.430 8.572 -7.962 1.00 0.00 N ATOM 2145 CA ILE A 140 3.906 9.205 -6.733 1.00 0.00 C ATOM 2146 C ILE A 140 4.251 8.203 -5.627 1.00 0.00 C ATOM 2147 O ILE A 140 5.191 8.429 -4.867 1.00 0.00 O ATOM 2148 CB ILE A 140 2.908 10.255 -6.210 1.00 0.00 C ATOM 2149 CG1 ILE A 140 1.431 9.783 -6.192 1.00 0.00 C ATOM 2150 CG2 ILE A 140 3.168 11.606 -6.912 1.00 0.00 C ATOM 2151 CD1 ILE A 140 0.436 10.702 -6.903 1.00 0.00 C ATOM 0 H ILE A 140 2.803 7.786 -7.789 1.00 0.00 H new ATOM 0 HA ILE A 140 4.834 9.707 -7.007 1.00 0.00 H new ATOM 0 HB ILE A 140 3.093 10.406 -5.147 1.00 0.00 H new ATOM 0 HG12 ILE A 140 1.378 8.796 -6.650 1.00 0.00 H new ATOM 0 HG13 ILE A 140 1.117 9.670 -5.154 1.00 0.00 H new ATOM 0 HG21 ILE A 140 2.462 12.350 -6.543 1.00 0.00 H new ATOM 0 HG22 ILE A 140 4.186 11.935 -6.702 1.00 0.00 H new ATOM 0 HG23 ILE A 140 3.040 11.487 -7.988 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -0.566 10.279 -6.831 1.00 0.00 H new ATOM 0 HD12 ILE A 140 0.449 11.686 -6.433 1.00 0.00 H new ATOM 0 HD13 ILE A 140 0.715 10.797 -7.952 1.00 0.00 H new ATOM 2163 N LEU A 141 3.500 7.110 -5.513 1.00 0.00 N ATOM 2164 CA LEU A 141 3.640 6.107 -4.457 1.00 0.00 C ATOM 2165 C LEU A 141 3.660 4.738 -5.143 1.00 0.00 C ATOM 2166 O LEU A 141 3.023 4.550 -6.179 1.00 0.00 O ATOM 2167 CB LEU A 141 2.502 6.356 -3.436 1.00 0.00 C ATOM 2168 CG LEU A 141 2.297 5.433 -2.214 1.00 0.00 C ATOM 2169 CD1 LEU A 141 1.882 3.991 -2.526 1.00 0.00 C ATOM 2170 CD2 LEU A 141 3.534 5.443 -1.313 1.00 0.00 C ATOM 0 H LEU A 141 2.754 6.890 -6.173 1.00 0.00 H new ATOM 0 HA LEU A 141 4.563 6.161 -3.880 1.00 0.00 H new ATOM 0 HB2 LEU A 141 2.638 7.366 -3.050 1.00 0.00 H new ATOM 0 HB3 LEU A 141 1.567 6.352 -3.996 1.00 0.00 H new ATOM 0 HG LEU A 141 1.440 5.864 -1.695 1.00 0.00 H new ATOM 0 HD11 LEU A 141 1.767 3.436 -1.595 1.00 0.00 H new ATOM 0 HD12 LEU A 141 0.935 3.994 -3.066 1.00 0.00 H new ATOM 0 HD13 LEU A 141 2.648 3.516 -3.139 1.00 0.00 H new ATOM 0 HD21 LEU A 141 3.367 4.786 -0.459 1.00 0.00 H new ATOM 0 HD22 LEU A 141 4.398 5.092 -1.877 1.00 0.00 H new ATOM 0 HD23 LEU A 141 3.719 6.458 -0.960 1.00 0.00 H new ATOM 2182 N GLN A 142 4.428 3.790 -4.609 1.00 0.00 N ATOM 2183 CA GLN A 142 4.515 2.425 -5.107 1.00 0.00 C ATOM 2184 C GLN A 142 4.728 1.505 -3.914 1.00 0.00 C ATOM 2185 O GLN A 142 5.311 1.916 -2.908 1.00 0.00 O ATOM 2186 CB GLN A 142 5.605 2.350 -6.182 1.00 0.00 C ATOM 2187 CG GLN A 142 5.942 0.962 -6.760 1.00 0.00 C ATOM 2188 CD GLN A 142 7.022 0.183 -6.010 1.00 0.00 C ATOM 2189 OE1 GLN A 142 7.648 0.664 -5.068 1.00 0.00 O ATOM 2190 NE2 GLN A 142 7.289 -1.037 -6.429 1.00 0.00 N ATOM 0 H GLN A 142 5.021 3.958 -3.797 1.00 0.00 H new ATOM 0 HA GLN A 142 3.599 2.096 -5.599 1.00 0.00 H new ATOM 0 HB2 GLN A 142 5.307 2.995 -7.009 1.00 0.00 H new ATOM 0 HB3 GLN A 142 6.519 2.771 -5.763 1.00 0.00 H new ATOM 0 HG2 GLN A 142 5.031 0.363 -6.776 1.00 0.00 H new ATOM 0 HG3 GLN A 142 6.260 1.086 -7.795 1.00 0.00 H new ATOM 0 HE21 GLN A 142 6.768 -1.433 -7.211 1.00 0.00 H new ATOM 0 HE22 GLN A 142 8.017 -1.585 -5.971 1.00 0.00 H new ATOM 2199 N THR A 143 4.191 0.293 -4.003 1.00 0.00 N ATOM 2200 CA THR A 143 4.333 -0.719 -2.967 1.00 0.00 C ATOM 2201 C THR A 143 5.730 -1.316 -3.135 1.00 0.00 C ATOM 2202 O THR A 143 5.967 -2.015 -4.118 1.00 0.00 O ATOM 2203 CB THR A 143 3.221 -1.759 -3.133 1.00 0.00 C ATOM 2204 OG1 THR A 143 1.962 -1.112 -3.109 1.00 0.00 O ATOM 2205 CG2 THR A 143 3.222 -2.814 -2.024 1.00 0.00 C ATOM 0 H THR A 143 3.640 -0.016 -4.804 1.00 0.00 H new ATOM 0 HA THR A 143 4.235 -0.314 -1.960 1.00 0.00 H new ATOM 0 HB THR A 143 3.403 -2.259 -4.084 1.00 0.00 H new ATOM 0 HG1 THR A 143 1.836 -0.611 -3.942 1.00 0.00 H new ATOM 0 HG21 THR A 143 2.412 -3.523 -2.196 1.00 0.00 H new ATOM 0 HG22 THR A 143 4.175 -3.344 -2.027 1.00 0.00 H new ATOM 0 HG23 THR A 143 3.080 -2.328 -1.059 1.00 0.00 H new ATOM 2213 N PRO A 144 6.659 -1.125 -2.185 1.00 0.00 N ATOM 2214 CA PRO A 144 8.023 -1.560 -2.386 1.00 0.00 C ATOM 2215 C PRO A 144 8.094 -3.071 -2.510 1.00 0.00 C ATOM 2216 O PRO A 144 7.404 -3.825 -1.810 1.00 0.00 O ATOM 2217 CB PRO A 144 8.820 -1.067 -1.195 1.00 0.00 C ATOM 2218 CG PRO A 144 7.753 -0.976 -0.104 1.00 0.00 C ATOM 2219 CD PRO A 144 6.489 -0.570 -0.859 1.00 0.00 C ATOM 0 HA PRO A 144 8.430 -1.154 -3.312 1.00 0.00 H new ATOM 0 HB2 PRO A 144 9.619 -1.758 -0.926 1.00 0.00 H new ATOM 0 HB3 PRO A 144 9.286 -0.101 -1.389 1.00 0.00 H new ATOM 0 HG2 PRO A 144 7.623 -1.929 0.408 1.00 0.00 H new ATOM 0 HG3 PRO A 144 8.019 -0.240 0.655 1.00 0.00 H new ATOM 0 HD2 PRO A 144 5.595 -0.965 -0.376 1.00 0.00 H new ATOM 0 HD3 PRO A 144 6.380 0.514 -0.894 1.00 0.00 H new ATOM 2227 N GLN A 145 9.007 -3.510 -3.369 1.00 0.00 N ATOM 2228 CA GLN A 145 9.091 -4.904 -3.684 1.00 0.00 C ATOM 2229 C GLN A 145 9.863 -5.551 -2.544 1.00 0.00 C ATOM 2230 O GLN A 145 11.031 -5.256 -2.310 1.00 0.00 O ATOM 2231 CB GLN A 145 9.738 -5.111 -5.063 1.00 0.00 C ATOM 2232 CG GLN A 145 8.871 -4.482 -6.173 1.00 0.00 C ATOM 2233 CD GLN A 145 9.380 -4.752 -7.588 1.00 0.00 C ATOM 2234 OE1 GLN A 145 10.480 -5.258 -7.796 1.00 0.00 O ATOM 2235 NE2 GLN A 145 8.588 -4.408 -8.587 1.00 0.00 N ATOM 0 H GLN A 145 9.686 -2.917 -3.847 1.00 0.00 H new ATOM 0 HA GLN A 145 8.109 -5.371 -3.766 1.00 0.00 H new ATOM 0 HB2 GLN A 145 10.732 -4.664 -5.074 1.00 0.00 H new ATOM 0 HB3 GLN A 145 9.865 -6.177 -5.254 1.00 0.00 H new ATOM 0 HG2 GLN A 145 7.854 -4.863 -6.085 1.00 0.00 H new ATOM 0 HG3 GLN A 145 8.822 -3.405 -6.015 1.00 0.00 H new ATOM 0 HE21 GLN A 145 7.678 -3.989 -8.395 1.00 0.00 H new ATOM 0 HE22 GLN A 145 8.886 -4.561 -9.550 1.00 0.00 H new ATOM 2244 N ASN A 146 9.122 -6.371 -1.812 1.00 0.00 N ATOM 2245 CA ASN A 146 9.297 -7.322 -0.711 1.00 0.00 C ATOM 2246 C ASN A 146 7.936 -7.813 -0.214 1.00 0.00 C ATOM 2247 O ASN A 146 7.889 -8.781 0.544 1.00 0.00 O ATOM 2248 CB ASN A 146 10.346 -7.040 0.389 1.00 0.00 C ATOM 2249 CG ASN A 146 11.788 -7.430 0.062 1.00 0.00 C ATOM 2250 OD1 ASN A 146 12.216 -8.512 0.448 1.00 0.00 O ATOM 2251 ND2 ASN A 146 12.584 -6.610 -0.592 1.00 0.00 N ATOM 0 H ASN A 146 8.129 -6.381 -2.043 1.00 0.00 H new ATOM 0 HA ASN A 146 9.833 -8.150 -1.174 1.00 0.00 H new ATOM 0 HB2 ASN A 146 10.323 -5.975 0.620 1.00 0.00 H new ATOM 0 HB3 ASN A 146 10.045 -7.569 1.293 1.00 0.00 H new ATOM 0 HD21 ASN A 146 13.551 -6.876 -0.775 1.00 0.00 H new ATOM 0 HD22 ASN A 146 12.233 -5.709 -0.915 1.00 0.00 H new ATOM 2258 N ALA A 147 6.848 -7.132 -0.615 1.00 0.00 N ATOM 2259 CA ALA A 147 5.457 -7.487 -0.370 1.00 0.00 C ATOM 2260 C ALA A 147 5.121 -8.809 -1.084 1.00 0.00 C ATOM 2261 O ALA A 147 4.498 -8.859 -2.148 1.00 0.00 O ATOM 2262 CB ALA A 147 4.559 -6.316 -0.797 1.00 0.00 C ATOM 0 H ALA A 147 6.932 -6.268 -1.151 1.00 0.00 H new ATOM 0 HA ALA A 147 5.279 -7.659 0.692 1.00 0.00 H new ATOM 0 HB1 ALA A 147 3.515 -6.573 -0.617 1.00 0.00 H new ATOM 0 HB2 ALA A 147 4.819 -5.429 -0.219 1.00 0.00 H new ATOM 0 HB3 ALA A 147 4.705 -6.114 -1.858 1.00 0.00 H new ATOM 2268 N ILE A 148 5.573 -9.897 -0.469 1.00 0.00 N ATOM 2269 CA ILE A 148 5.322 -11.268 -0.854 1.00 0.00 C ATOM 2270 C ILE A 148 4.521 -11.847 0.308 1.00 0.00 C ATOM 2271 O ILE A 148 4.959 -11.743 1.458 1.00 0.00 O ATOM 2272 CB ILE A 148 6.626 -12.034 -1.093 1.00 0.00 C ATOM 2273 CG1 ILE A 148 7.576 -11.346 -2.082 1.00 0.00 C ATOM 2274 CG2 ILE A 148 6.311 -13.456 -1.590 1.00 0.00 C ATOM 2275 CD1 ILE A 148 7.074 -11.194 -3.515 1.00 0.00 C ATOM 0 H ILE A 148 6.160 -9.833 0.363 1.00 0.00 H new ATOM 0 HA ILE A 148 4.781 -11.342 -1.797 1.00 0.00 H new ATOM 0 HB ILE A 148 7.143 -12.063 -0.134 1.00 0.00 H new ATOM 0 HG12 ILE A 148 7.811 -10.354 -1.696 1.00 0.00 H new ATOM 0 HG13 ILE A 148 8.510 -11.908 -2.105 1.00 0.00 H new ATOM 0 HG21 ILE A 148 7.242 -13.997 -1.759 1.00 0.00 H new ATOM 0 HG22 ILE A 148 5.717 -13.980 -0.841 1.00 0.00 H new ATOM 0 HG23 ILE A 148 5.750 -13.399 -2.523 1.00 0.00 H new ATOM 0 HD11 ILE A 148 7.834 -10.694 -4.116 1.00 0.00 H new ATOM 0 HD12 ILE A 148 6.869 -12.179 -3.935 1.00 0.00 H new ATOM 0 HD13 ILE A 148 6.160 -10.601 -3.519 1.00 0.00 H new ATOM 2287 N PHE A 149 3.353 -12.415 0.035 1.00 0.00 N ATOM 2288 CA PHE A 149 2.562 -13.113 1.038 1.00 0.00 C ATOM 2289 C PHE A 149 2.956 -14.590 0.920 1.00 0.00 C ATOM 2290 O PHE A 149 3.388 -15.027 -0.150 1.00 0.00 O ATOM 2291 CB PHE A 149 1.058 -12.903 0.798 1.00 0.00 C ATOM 2292 CG PHE A 149 0.488 -11.487 0.868 1.00 0.00 C ATOM 2293 CD1 PHE A 149 1.028 -10.412 0.127 1.00 0.00 C ATOM 2294 CD2 PHE A 149 -0.709 -11.278 1.582 1.00 0.00 C ATOM 2295 CE1 PHE A 149 0.398 -9.156 0.133 1.00 0.00 C ATOM 2296 CE2 PHE A 149 -1.360 -10.032 1.557 1.00 0.00 C ATOM 2297 CZ PHE A 149 -0.807 -8.970 0.827 1.00 0.00 C ATOM 0 H PHE A 149 2.927 -12.404 -0.892 1.00 0.00 H new ATOM 0 HA PHE A 149 2.756 -12.735 2.042 1.00 0.00 H new ATOM 0 HB2 PHE A 149 0.823 -13.304 -0.188 1.00 0.00 H new ATOM 0 HB3 PHE A 149 0.520 -13.511 1.526 1.00 0.00 H new ATOM 0 HD1 PHE A 149 1.931 -10.557 -0.448 1.00 0.00 H new ATOM 0 HD2 PHE A 149 -1.133 -12.088 2.157 1.00 0.00 H new ATOM 0 HE1 PHE A 149 0.844 -8.329 -0.400 1.00 0.00 H new ATOM 0 HE2 PHE A 149 -2.284 -9.893 2.099 1.00 0.00 H new ATOM 0 HZ PHE A 149 -1.307 -8.013 0.799 1.00 0.00 H new ATOM 2307 N PHE A 150 2.811 -15.381 1.986 1.00 0.00 N ATOM 2308 CA PHE A 150 3.272 -16.767 2.025 1.00 0.00 C ATOM 2309 C PHE A 150 2.144 -17.643 2.548 1.00 0.00 C ATOM 2310 O PHE A 150 1.789 -17.533 3.720 1.00 0.00 O ATOM 2311 CB PHE A 150 4.530 -16.857 2.912 1.00 0.00 C ATOM 2312 CG PHE A 150 5.740 -16.185 2.285 1.00 0.00 C ATOM 2313 CD1 PHE A 150 5.943 -14.805 2.462 1.00 0.00 C ATOM 2314 CD2 PHE A 150 6.598 -16.905 1.431 1.00 0.00 C ATOM 2315 CE1 PHE A 150 6.958 -14.141 1.758 1.00 0.00 C ATOM 2316 CE2 PHE A 150 7.614 -16.236 0.720 1.00 0.00 C ATOM 2317 CZ PHE A 150 7.769 -14.845 0.853 1.00 0.00 C ATOM 0 H PHE A 150 2.367 -15.074 2.851 1.00 0.00 H new ATOM 0 HA PHE A 150 3.541 -17.118 1.029 1.00 0.00 H new ATOM 0 HB2 PHE A 150 4.323 -16.395 3.877 1.00 0.00 H new ATOM 0 HB3 PHE A 150 4.760 -17.905 3.103 1.00 0.00 H new ATOM 0 HD1 PHE A 150 5.313 -14.253 3.144 1.00 0.00 H new ATOM 0 HD2 PHE A 150 6.477 -17.973 1.321 1.00 0.00 H new ATOM 0 HE1 PHE A 150 7.117 -13.084 1.912 1.00 0.00 H new ATOM 0 HE2 PHE A 150 8.275 -16.793 0.072 1.00 0.00 H new ATOM 0 HZ PHE A 150 8.507 -14.321 0.263 1.00 0.00 H new ATOM 2327 N LYS A 151 1.587 -18.536 1.725 1.00 0.00 N ATOM 2328 CA LYS A 151 0.458 -19.366 2.137 1.00 0.00 C ATOM 2329 C LYS A 151 0.939 -20.789 2.359 1.00 0.00 C ATOM 2330 O LYS A 151 1.453 -21.422 1.443 1.00 0.00 O ATOM 2331 CB LYS A 151 -0.742 -19.263 1.177 1.00 0.00 C ATOM 2332 CG LYS A 151 -1.925 -20.060 1.765 1.00 0.00 C ATOM 2333 CD LYS A 151 -3.297 -19.720 1.168 1.00 0.00 C ATOM 2334 CE LYS A 151 -4.324 -20.651 1.829 1.00 0.00 C ATOM 2335 NZ LYS A 151 -5.731 -20.261 1.599 1.00 0.00 N ATOM 0 H LYS A 151 1.902 -18.701 0.769 1.00 0.00 H new ATOM 0 HA LYS A 151 0.071 -18.989 3.084 1.00 0.00 H new ATOM 0 HB2 LYS A 151 -1.024 -18.219 1.037 1.00 0.00 H new ATOM 0 HB3 LYS A 151 -0.474 -19.655 0.196 1.00 0.00 H new ATOM 0 HG2 LYS A 151 -1.735 -21.123 1.619 1.00 0.00 H new ATOM 0 HG3 LYS A 151 -1.961 -19.887 2.841 1.00 0.00 H new ATOM 0 HD2 LYS A 151 -3.549 -18.676 1.353 1.00 0.00 H new ATOM 0 HD3 LYS A 151 -3.291 -19.859 0.087 1.00 0.00 H new ATOM 0 HE2 LYS A 151 -4.174 -21.664 1.455 1.00 0.00 H new ATOM 0 HE3 LYS A 151 -4.137 -20.677 2.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 -6.351 -21.075 1.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 -5.984 -19.481 2.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 -5.849 -19.952 0.613 1.00 0.00 H new ATOM 2349 N THR A 152 0.732 -21.302 3.561 1.00 0.00 N ATOM 2350 CA THR A 152 1.022 -22.668 3.933 1.00 0.00 C ATOM 2351 C THR A 152 -0.182 -23.481 3.483 1.00 0.00 C ATOM 2352 O THR A 152 -1.282 -23.228 3.980 1.00 0.00 O ATOM 2353 CB THR A 152 1.166 -22.751 5.460 1.00 0.00 C ATOM 2354 OG1 THR A 152 2.090 -21.786 5.931 1.00 0.00 O ATOM 2355 CG2 THR A 152 1.581 -24.137 5.956 1.00 0.00 C ATOM 0 H THR A 152 0.343 -20.755 4.329 1.00 0.00 H new ATOM 0 HA THR A 152 1.944 -23.034 3.481 1.00 0.00 H new ATOM 0 HB THR A 152 0.174 -22.547 5.863 1.00 0.00 H new ATOM 0 HG1 THR A 152 2.166 -21.854 6.906 1.00 0.00 H new ATOM 0 HG21 THR A 152 1.664 -24.125 7.043 1.00 0.00 H new ATOM 0 HG22 THR A 152 0.831 -24.870 5.658 1.00 0.00 H new ATOM 0 HG23 THR A 152 2.544 -24.406 5.521 1.00 0.00 H new ATOM 2363 N CYS A 153 0.003 -24.418 2.556 1.00 0.00 N ATOM 2364 CA CYS A 153 -1.036 -25.347 2.134 1.00 0.00 C ATOM 2365 C CYS A 153 -0.604 -26.774 2.447 1.00 0.00 C ATOM 2366 O CYS A 153 0.558 -27.034 2.767 1.00 0.00 O ATOM 2367 CB CYS A 153 -1.411 -25.207 0.659 1.00 0.00 C ATOM 2368 SG CYS A 153 -1.601 -23.555 -0.019 1.00 0.00 S ATOM 0 H CYS A 153 0.891 -24.553 2.072 1.00 0.00 H new ATOM 0 HA CYS A 153 -1.936 -25.099 2.697 1.00 0.00 H new ATOM 0 HB2 CYS A 153 -0.650 -25.721 0.072 1.00 0.00 H new ATOM 0 HB3 CYS A 153 -2.349 -25.740 0.502 1.00 0.00 H new ATOM 2373 N LEU A 154 -1.567 -27.686 2.373 1.00 0.00 N ATOM 2374 CA LEU A 154 -1.384 -29.114 2.537 1.00 0.00 C ATOM 2375 C LEU A 154 -2.095 -29.808 1.376 1.00 0.00 C ATOM 2376 O LEU A 154 -2.946 -29.190 0.723 1.00 0.00 O ATOM 2377 CB LEU A 154 -1.855 -29.546 3.938 1.00 0.00 C ATOM 2378 CG LEU A 154 -3.329 -29.289 4.312 1.00 0.00 C ATOM 2379 CD1 LEU A 154 -4.310 -30.304 3.718 1.00 0.00 C ATOM 2380 CD2 LEU A 154 -3.459 -29.332 5.841 1.00 0.00 C ATOM 0 H LEU A 154 -2.538 -27.433 2.189 1.00 0.00 H new ATOM 0 HA LEU A 154 -0.335 -29.407 2.494 1.00 0.00 H new ATOM 0 HB2 LEU A 154 -1.665 -30.614 4.041 1.00 0.00 H new ATOM 0 HB3 LEU A 154 -1.230 -29.039 4.673 1.00 0.00 H new ATOM 0 HG LEU A 154 -3.591 -28.316 3.897 1.00 0.00 H new ATOM 0 HD11 LEU A 154 -5.325 -30.054 4.028 1.00 0.00 H new ATOM 0 HD12 LEU A 154 -4.246 -30.278 2.630 1.00 0.00 H new ATOM 0 HD13 LEU A 154 -4.059 -31.304 4.073 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -4.496 -29.152 6.123 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -3.149 -30.311 6.205 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -2.824 -28.563 6.282 1.00 0.00 H new ATOM 2392 N GLN A 155 -1.724 -31.054 1.113 1.00 0.00 N ATOM 2393 CA GLN A 155 -2.322 -31.917 0.110 1.00 0.00 C ATOM 2394 C GLN A 155 -3.747 -32.289 0.532 1.00 0.00 C ATOM 2395 O GLN A 155 -3.957 -32.807 1.629 1.00 0.00 O ATOM 2396 CB GLN A 155 -1.430 -33.154 -0.075 1.00 0.00 C ATOM 2397 CG GLN A 155 -1.985 -34.147 -1.108 1.00 0.00 C ATOM 2398 CD GLN A 155 -0.923 -35.152 -1.548 1.00 0.00 C ATOM 2399 OE1 GLN A 155 -0.943 -36.322 -1.183 1.00 0.00 O ATOM 2400 NE2 GLN A 155 0.023 -34.720 -2.366 1.00 0.00 N ATOM 0 H GLN A 155 -0.963 -31.509 1.618 1.00 0.00 H new ATOM 0 HA GLN A 155 -2.393 -31.403 -0.849 1.00 0.00 H new ATOM 0 HB2 GLN A 155 -0.435 -32.834 -0.385 1.00 0.00 H new ATOM 0 HB3 GLN A 155 -1.318 -33.661 0.884 1.00 0.00 H new ATOM 0 HG2 GLN A 155 -2.836 -34.679 -0.682 1.00 0.00 H new ATOM 0 HG3 GLN A 155 -2.353 -33.601 -1.977 1.00 0.00 H new ATOM 0 HE21 GLN A 155 0.032 -33.745 -2.665 1.00 0.00 H new ATOM 0 HE22 GLN A 155 0.743 -35.362 -2.698 1.00 0.00 H new ATOM 2409 N ALA A 156 -4.725 -32.030 -0.338 1.00 0.00 N ATOM 2410 CA ALA A 156 -6.116 -32.423 -0.167 1.00 0.00 C ATOM 2411 C ALA A 156 -6.690 -32.723 -1.550 1.00 0.00 C ATOM 2412 O ALA A 156 -6.552 -31.907 -2.465 1.00 0.00 O ATOM 2413 CB ALA A 156 -6.901 -31.299 0.518 1.00 0.00 C ATOM 0 H ALA A 156 -4.560 -31.524 -1.208 1.00 0.00 H new ATOM 0 HA ALA A 156 -6.190 -33.308 0.465 1.00 0.00 H new ATOM 0 HB1 ALA A 156 -7.940 -31.604 0.641 1.00 0.00 H new ATOM 0 HB2 ALA A 156 -6.465 -31.094 1.496 1.00 0.00 H new ATOM 0 HB3 ALA A 156 -6.857 -30.399 -0.095 1.00 0.00 H new ATOM 2419 N GLU A 157 -7.298 -33.889 -1.724 1.00 0.00 N ATOM 2420 CA GLU A 157 -8.017 -34.345 -2.902 1.00 0.00 C ATOM 2421 C GLU A 157 -9.187 -35.168 -2.370 1.00 0.00 C ATOM 2422 O GLU A 157 -9.007 -35.752 -1.274 1.00 0.00 O ATOM 2423 CB GLU A 157 -7.065 -35.157 -3.801 1.00 0.00 C ATOM 2424 CG GLU A 157 -7.552 -35.266 -5.260 1.00 0.00 C ATOM 2425 CD GLU A 157 -6.390 -35.432 -6.257 1.00 0.00 C ATOM 2426 OE1 GLU A 157 -5.674 -34.418 -6.459 1.00 0.00 O ATOM 2427 OE2 GLU A 157 -6.216 -36.531 -6.825 1.00 0.00 O ATOM 2428 OXT GLU A 157 -10.257 -35.125 -3.008 1.00 0.00 O ATOM 0 H GLU A 157 -7.300 -34.594 -0.987 1.00 0.00 H new ATOM 0 HA GLU A 157 -8.391 -33.532 -3.524 1.00 0.00 H new ATOM 0 HB2 GLU A 157 -6.079 -34.693 -3.788 1.00 0.00 H new ATOM 0 HB3 GLU A 157 -6.951 -36.159 -3.387 1.00 0.00 H new ATOM 0 HG2 GLU A 157 -8.229 -36.115 -5.351 1.00 0.00 H new ATOM 0 HG3 GLU A 157 -8.123 -34.374 -5.517 1.00 0.00 H new TER 2435 GLU A 157