USER MOD reduce.3.24.130724 H: found=0, std=0, add=773, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 771 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 16 TYR OH : rot 15:sc= 0.364 USER MOD Set 1.2: A 80 THR OG1 : rot 61:sc= 1.46 USER MOD Single : A 1 GLY N :NH3+ -179:sc= 0 (180deg=-0.00139) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 MET CE :methyl -178:sc= 0 (180deg=-0.00705) USER MOD Single : A 20 ASN : amide:sc= 0.304 K(o=0.3,f=-2.6!) USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.139 USER MOD Single : A 29 CYS SG : rot -159:sc= -0.0549 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ -92:sc= 0 (180deg=-0.981) USER MOD Single : A 36 GLN : amide:sc= -0.143 K(o=-0.14,f=-2.2!) USER MOD Single : A 40 ASN : amide:sc= -0.0993 X(o=-0.099,f=0) USER MOD Single : A 43 GLN :FLIP amide:sc= -0.371 F(o=-2.9!,f=-0.37) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 MET CE :methyl 146:sc= -1.94 (180deg=-2.2!) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ -156:sc= -0.0728 (180deg=-0.419) USER MOD Single : A 56 THR OG1 : rot 140:sc= -0.208 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 180:sc= -0.329 USER MOD Single : A 66 LYS NZ :NH3+ -118:sc= -3.45! (180deg=-6.39!) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 HIS : no HD1:sc= -0.734 X(o=-0.73,f=-0.7) USER MOD Single : A 72 LYS NZ :NH3+ 157:sc= -0.1 (180deg=-0.472) USER MOD Single : A 73 ASN : amide:sc= -0.37 K(o=-0.37,f=-3.3!) USER MOD Single : A 74 ASN : amide:sc= -4.36 K(o=-4.4,f=-9.3!) USER MOD Single : A 75 SER OG : rot 31:sc= 0.701 USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 91 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 100 ASN : amide:sc= -1.29 K(o=-1.3,f=-5.7!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 11.760 4.858 32.990 1.00 0.00 N ATOM 2 CA GLY A 1 10.678 4.004 33.442 1.00 0.00 C ATOM 3 C GLY A 1 10.902 2.547 33.087 1.00 0.00 C ATOM 4 O GLY A 1 10.707 1.661 33.918 1.00 0.00 O ATOM 0 H1 GLY A 1 11.568 5.840 33.272 1.00 0.00 H new ATOM 0 H2 GLY A 1 12.653 4.543 33.420 1.00 0.00 H new ATOM 0 H3 GLY A 1 11.836 4.803 31.954 1.00 0.00 H new ATOM 0 HA2 GLY A 1 10.571 4.099 34.523 1.00 0.00 H new ATOM 0 HA3 GLY A 1 9.742 4.343 32.998 1.00 0.00 H new ATOM 8 N SER A 2 11.312 2.299 31.847 1.00 0.00 N ATOM 9 CA SER A 2 11.557 0.939 31.381 1.00 0.00 C ATOM 10 C SER A 2 12.215 0.946 30.005 1.00 0.00 C ATOM 11 O SER A 2 12.030 1.878 29.221 1.00 0.00 O ATOM 12 CB SER A 2 10.247 0.151 31.328 1.00 0.00 C ATOM 13 OG SER A 2 10.488 -1.224 31.085 1.00 0.00 O ATOM 0 H SER A 2 11.481 3.022 31.147 1.00 0.00 H new ATOM 0 HA SER A 2 12.234 0.457 32.086 1.00 0.00 H new ATOM 0 HB2 SER A 2 9.710 0.268 32.269 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.607 0.555 30.544 1.00 0.00 H new ATOM 0 HG SER A 2 9.635 -1.706 31.057 1.00 0.00 H new ATOM 19 N SER A 3 12.984 -0.099 29.718 1.00 0.00 N ATOM 20 CA SER A 3 13.674 -0.212 28.438 1.00 0.00 C ATOM 21 C SER A 3 13.408 -1.570 27.796 1.00 0.00 C ATOM 22 O SER A 3 13.555 -2.611 28.435 1.00 0.00 O ATOM 23 CB SER A 3 15.179 -0.010 28.626 1.00 0.00 C ATOM 24 OG SER A 3 15.505 1.368 28.680 1.00 0.00 O ATOM 0 H SER A 3 13.145 -0.880 30.354 1.00 0.00 H new ATOM 0 HA SER A 3 13.290 0.565 27.777 1.00 0.00 H new ATOM 0 HB2 SER A 3 15.503 -0.500 29.544 1.00 0.00 H new ATOM 0 HB3 SER A 3 15.718 -0.483 27.805 1.00 0.00 H new ATOM 0 HG SER A 3 16.472 1.471 28.802 1.00 0.00 H new ATOM 30 N GLY A 4 13.015 -1.551 26.526 1.00 0.00 N ATOM 31 CA GLY A 4 12.734 -2.786 25.817 1.00 0.00 C ATOM 32 C GLY A 4 11.842 -2.572 24.610 1.00 0.00 C ATOM 33 O GLY A 4 11.407 -1.452 24.342 1.00 0.00 O ATOM 0 H GLY A 4 12.886 -0.702 25.975 1.00 0.00 H new ATOM 0 HA2 GLY A 4 13.672 -3.238 25.496 1.00 0.00 H new ATOM 0 HA3 GLY A 4 12.257 -3.491 26.497 1.00 0.00 H new ATOM 37 N SER A 5 11.571 -3.648 23.879 1.00 0.00 N ATOM 38 CA SER A 5 10.729 -3.572 22.691 1.00 0.00 C ATOM 39 C SER A 5 9.464 -4.406 22.867 1.00 0.00 C ATOM 40 O SER A 5 9.525 -5.574 23.251 1.00 0.00 O ATOM 41 CB SER A 5 11.502 -4.052 21.461 1.00 0.00 C ATOM 42 OG SER A 5 12.654 -3.257 21.240 1.00 0.00 O ATOM 0 H SER A 5 11.922 -4.583 24.088 1.00 0.00 H new ATOM 0 HA SER A 5 10.440 -2.531 22.547 1.00 0.00 H new ATOM 0 HB2 SER A 5 11.795 -5.093 21.595 1.00 0.00 H new ATOM 0 HB3 SER A 5 10.856 -4.013 20.584 1.00 0.00 H new ATOM 0 HG SER A 5 13.131 -3.585 20.450 1.00 0.00 H new ATOM 48 N SER A 6 8.317 -3.797 22.583 1.00 0.00 N ATOM 49 CA SER A 6 7.035 -4.481 22.714 1.00 0.00 C ATOM 50 C SER A 6 6.451 -4.806 21.343 1.00 0.00 C ATOM 51 O SER A 6 6.030 -5.934 21.087 1.00 0.00 O ATOM 52 CB SER A 6 6.052 -3.619 23.508 1.00 0.00 C ATOM 53 OG SER A 6 6.388 -3.598 24.884 1.00 0.00 O ATOM 0 H SER A 6 8.249 -2.832 22.261 1.00 0.00 H new ATOM 0 HA SER A 6 7.202 -5.415 23.250 1.00 0.00 H new ATOM 0 HB2 SER A 6 6.055 -2.603 23.114 1.00 0.00 H new ATOM 0 HB3 SER A 6 5.041 -4.006 23.383 1.00 0.00 H new ATOM 0 HG SER A 6 5.746 -3.039 25.369 1.00 0.00 H new ATOM 59 N GLY A 7 6.430 -3.809 20.463 1.00 0.00 N ATOM 60 CA GLY A 7 5.896 -4.009 19.128 1.00 0.00 C ATOM 61 C GLY A 7 6.974 -3.986 18.063 1.00 0.00 C ATOM 62 O GLY A 7 7.665 -2.981 17.891 1.00 0.00 O ATOM 0 H GLY A 7 6.773 -2.867 20.651 1.00 0.00 H new ATOM 0 HA2 GLY A 7 5.372 -4.964 19.089 1.00 0.00 H new ATOM 0 HA3 GLY A 7 5.161 -3.233 18.914 1.00 0.00 H new ATOM 66 N ARG A 8 7.120 -5.096 17.347 1.00 0.00 N ATOM 67 CA ARG A 8 8.124 -5.200 16.295 1.00 0.00 C ATOM 68 C ARG A 8 7.670 -4.469 15.036 1.00 0.00 C ATOM 69 O ARG A 8 6.561 -4.684 14.548 1.00 0.00 O ATOM 70 CB ARG A 8 8.405 -6.669 15.972 1.00 0.00 C ATOM 71 CG ARG A 8 7.176 -7.437 15.512 1.00 0.00 C ATOM 72 CD ARG A 8 7.455 -8.929 15.419 1.00 0.00 C ATOM 73 NE ARG A 8 6.256 -9.726 15.662 1.00 0.00 N ATOM 74 CZ ARG A 8 5.607 -9.742 16.821 1.00 0.00 C ATOM 75 NH1 ARG A 8 6.039 -9.008 17.837 1.00 0.00 N ATOM 76 NH2 ARG A 8 4.522 -10.493 16.965 1.00 0.00 N ATOM 0 H ARG A 8 6.556 -5.936 17.476 1.00 0.00 H new ATOM 0 HA ARG A 8 9.041 -4.733 16.655 1.00 0.00 H new ATOM 0 HB2 ARG A 8 9.168 -6.722 15.195 1.00 0.00 H new ATOM 0 HB3 ARG A 8 8.816 -7.155 16.857 1.00 0.00 H new ATOM 0 HG2 ARG A 8 6.355 -7.262 16.207 1.00 0.00 H new ATOM 0 HG3 ARG A 8 6.855 -7.064 14.539 1.00 0.00 H new ATOM 0 HD2 ARG A 8 7.852 -9.163 14.431 1.00 0.00 H new ATOM 0 HD3 ARG A 8 8.223 -9.200 16.143 1.00 0.00 H new ATOM 0 HE ARG A 8 5.897 -10.302 14.900 1.00 0.00 H new ATOM 0 HH11 ARG A 8 6.872 -8.429 17.730 1.00 0.00 H new ATOM 0 HH12 ARG A 8 5.539 -9.022 18.726 1.00 0.00 H new ATOM 0 HH21 ARG A 8 4.186 -11.058 16.185 1.00 0.00 H new ATOM 0 HH22 ARG A 8 4.024 -10.505 17.855 1.00 0.00 H new ATOM 90 N MET A 9 8.534 -3.605 14.515 1.00 0.00 N ATOM 91 CA MET A 9 8.222 -2.843 13.312 1.00 0.00 C ATOM 92 C MET A 9 8.614 -3.619 12.059 1.00 0.00 C ATOM 93 O MET A 9 9.639 -4.301 12.034 1.00 0.00 O ATOM 94 CB MET A 9 8.942 -1.493 13.335 1.00 0.00 C ATOM 95 CG MET A 9 8.816 -0.760 14.661 1.00 0.00 C ATOM 96 SD MET A 9 7.146 -0.829 15.337 1.00 0.00 S ATOM 97 CE MET A 9 6.247 0.122 14.115 1.00 0.00 C ATOM 0 H MET A 9 9.456 -3.415 14.907 1.00 0.00 H new ATOM 0 HA MET A 9 7.146 -2.672 13.291 1.00 0.00 H new ATOM 0 HB2 MET A 9 9.998 -1.650 13.115 1.00 0.00 H new ATOM 0 HB3 MET A 9 8.541 -0.863 12.541 1.00 0.00 H new ATOM 0 HG2 MET A 9 9.512 -1.193 15.379 1.00 0.00 H new ATOM 0 HG3 MET A 9 9.106 0.282 14.525 1.00 0.00 H new ATOM 0 HE1 MET A 9 5.201 0.200 14.412 1.00 0.00 H new ATOM 0 HE2 MET A 9 6.679 1.120 14.041 1.00 0.00 H new ATOM 0 HE3 MET A 9 6.313 -0.375 13.147 1.00 0.00 H new ATOM 107 N LEU A 10 7.792 -3.512 11.020 1.00 0.00 N ATOM 108 CA LEU A 10 8.053 -4.205 9.764 1.00 0.00 C ATOM 109 C LEU A 10 8.319 -3.211 8.638 1.00 0.00 C ATOM 110 O LEU A 10 7.499 -2.333 8.366 1.00 0.00 O ATOM 111 CB LEU A 10 6.869 -5.102 9.398 1.00 0.00 C ATOM 112 CG LEU A 10 6.382 -6.052 10.493 1.00 0.00 C ATOM 113 CD1 LEU A 10 5.094 -6.740 10.070 1.00 0.00 C ATOM 114 CD2 LEU A 10 7.455 -7.080 10.823 1.00 0.00 C ATOM 0 H LEU A 10 6.940 -2.952 11.023 1.00 0.00 H new ATOM 0 HA LEU A 10 8.942 -4.822 9.896 1.00 0.00 H new ATOM 0 HB2 LEU A 10 6.036 -4.466 9.100 1.00 0.00 H new ATOM 0 HB3 LEU A 10 7.145 -5.695 8.526 1.00 0.00 H new ATOM 0 HG LEU A 10 6.179 -5.467 11.390 1.00 0.00 H new ATOM 0 HD11 LEU A 10 4.763 -7.412 10.862 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.325 -5.990 9.885 1.00 0.00 H new ATOM 0 HD13 LEU A 10 5.269 -7.312 9.159 1.00 0.00 H new ATOM 0 HD21 LEU A 10 7.091 -7.748 11.604 1.00 0.00 H new ATOM 0 HD22 LEU A 10 7.690 -7.660 9.930 1.00 0.00 H new ATOM 0 HD23 LEU A 10 8.353 -6.570 11.171 1.00 0.00 H new ATOM 126 N ASP A 11 9.467 -3.355 7.987 1.00 0.00 N ATOM 127 CA ASP A 11 9.840 -2.471 6.888 1.00 0.00 C ATOM 128 C ASP A 11 9.229 -2.950 5.575 1.00 0.00 C ATOM 129 O ASP A 11 9.817 -3.769 4.867 1.00 0.00 O ATOM 130 CB ASP A 11 11.362 -2.396 6.760 1.00 0.00 C ATOM 131 CG ASP A 11 11.809 -1.311 5.800 1.00 0.00 C ATOM 132 OD1 ASP A 11 11.586 -1.469 4.581 1.00 0.00 O ATOM 133 OD2 ASP A 11 12.383 -0.305 6.266 1.00 0.00 O ATOM 0 H ASP A 11 10.156 -4.076 8.201 1.00 0.00 H new ATOM 0 HA ASP A 11 9.453 -1.476 7.106 1.00 0.00 H new ATOM 0 HB2 ASP A 11 11.798 -2.211 7.742 1.00 0.00 H new ATOM 0 HB3 ASP A 11 11.743 -3.359 6.419 1.00 0.00 H new ATOM 138 N PHE A 12 8.047 -2.435 5.256 1.00 0.00 N ATOM 139 CA PHE A 12 7.355 -2.812 4.028 1.00 0.00 C ATOM 140 C PHE A 12 7.780 -1.916 2.868 1.00 0.00 C ATOM 141 O PHE A 12 7.397 -0.749 2.798 1.00 0.00 O ATOM 142 CB PHE A 12 5.840 -2.726 4.224 1.00 0.00 C ATOM 143 CG PHE A 12 5.271 -3.874 5.008 1.00 0.00 C ATOM 144 CD1 PHE A 12 4.986 -5.079 4.389 1.00 0.00 C ATOM 145 CD2 PHE A 12 5.021 -3.747 6.365 1.00 0.00 C ATOM 146 CE1 PHE A 12 4.463 -6.138 5.107 1.00 0.00 C ATOM 147 CE2 PHE A 12 4.498 -4.802 7.089 1.00 0.00 C ATOM 148 CZ PHE A 12 4.218 -5.998 6.459 1.00 0.00 C ATOM 0 H PHE A 12 7.548 -1.756 5.830 1.00 0.00 H new ATOM 0 HA PHE A 12 7.626 -3.840 3.789 1.00 0.00 H new ATOM 0 HB2 PHE A 12 5.600 -1.793 4.735 1.00 0.00 H new ATOM 0 HB3 PHE A 12 5.357 -2.688 3.248 1.00 0.00 H new ATOM 0 HD1 PHE A 12 5.175 -5.193 3.332 1.00 0.00 H new ATOM 0 HD2 PHE A 12 5.237 -2.813 6.863 1.00 0.00 H new ATOM 0 HE1 PHE A 12 4.246 -7.073 4.612 1.00 0.00 H new ATOM 0 HE2 PHE A 12 4.309 -4.691 8.146 1.00 0.00 H new ATOM 0 HZ PHE A 12 3.808 -6.823 7.023 1.00 0.00 H new ATOM 158 N ARG A 13 8.576 -2.473 1.960 1.00 0.00 N ATOM 159 CA ARG A 13 9.055 -1.725 0.804 1.00 0.00 C ATOM 160 C ARG A 13 8.084 -1.852 -0.366 1.00 0.00 C ATOM 161 O ARG A 13 8.032 -2.884 -1.035 1.00 0.00 O ATOM 162 CB ARG A 13 10.440 -2.223 0.387 1.00 0.00 C ATOM 163 CG ARG A 13 11.045 -1.442 -0.769 1.00 0.00 C ATOM 164 CD ARG A 13 12.565 -1.443 -0.706 1.00 0.00 C ATOM 165 NE ARG A 13 13.140 -2.593 -1.399 1.00 0.00 N ATOM 166 CZ ARG A 13 13.064 -2.773 -2.713 1.00 0.00 C ATOM 167 NH1 ARG A 13 12.440 -1.883 -3.472 1.00 0.00 N ATOM 168 NH2 ARG A 13 13.613 -3.844 -3.270 1.00 0.00 N ATOM 0 H ARG A 13 8.902 -3.439 2.003 1.00 0.00 H new ATOM 0 HA ARG A 13 9.123 -0.674 1.085 1.00 0.00 H new ATOM 0 HB2 ARG A 13 11.111 -2.165 1.244 1.00 0.00 H new ATOM 0 HB3 ARG A 13 10.370 -3.274 0.107 1.00 0.00 H new ATOM 0 HG2 ARG A 13 10.718 -1.877 -1.714 1.00 0.00 H new ATOM 0 HG3 ARG A 13 10.679 -0.415 -0.747 1.00 0.00 H new ATOM 0 HD2 ARG A 13 12.947 -0.524 -1.150 1.00 0.00 H new ATOM 0 HD3 ARG A 13 12.885 -1.450 0.336 1.00 0.00 H new ATOM 0 HE ARG A 13 13.627 -3.297 -0.844 1.00 0.00 H new ATOM 0 HH11 ARG A 13 12.017 -1.058 -3.047 1.00 0.00 H new ATOM 0 HH12 ARG A 13 12.383 -2.023 -4.481 1.00 0.00 H new ATOM 0 HH21 ARG A 13 14.094 -4.531 -2.689 1.00 0.00 H new ATOM 0 HH22 ARG A 13 13.554 -3.981 -4.279 1.00 0.00 H new ATOM 182 N VAL A 14 7.315 -0.795 -0.608 1.00 0.00 N ATOM 183 CA VAL A 14 6.346 -0.787 -1.697 1.00 0.00 C ATOM 184 C VAL A 14 6.969 -0.259 -2.984 1.00 0.00 C ATOM 185 O VAL A 14 7.421 0.885 -3.042 1.00 0.00 O ATOM 186 CB VAL A 14 5.114 0.069 -1.347 1.00 0.00 C ATOM 187 CG1 VAL A 14 4.160 0.142 -2.529 1.00 0.00 C ATOM 188 CG2 VAL A 14 4.412 -0.487 -0.117 1.00 0.00 C ATOM 0 H VAL A 14 7.345 0.067 -0.064 1.00 0.00 H new ATOM 0 HA VAL A 14 6.031 -1.820 -1.847 1.00 0.00 H new ATOM 0 HB VAL A 14 5.449 1.081 -1.120 1.00 0.00 H new ATOM 0 HG11 VAL A 14 3.296 0.751 -2.262 1.00 0.00 H new ATOM 0 HG12 VAL A 14 4.670 0.590 -3.381 1.00 0.00 H new ATOM 0 HG13 VAL A 14 3.829 -0.863 -2.792 1.00 0.00 H new ATOM 0 HG21 VAL A 14 3.544 0.130 0.116 1.00 0.00 H new ATOM 0 HG22 VAL A 14 4.089 -1.509 -0.314 1.00 0.00 H new ATOM 0 HG23 VAL A 14 5.100 -0.480 0.729 1.00 0.00 H new ATOM 198 N GLU A 15 6.990 -1.099 -4.014 1.00 0.00 N ATOM 199 CA GLU A 15 7.559 -0.716 -5.300 1.00 0.00 C ATOM 200 C GLU A 15 6.469 -0.246 -6.259 1.00 0.00 C ATOM 201 O GLU A 15 5.727 -1.055 -6.817 1.00 0.00 O ATOM 202 CB GLU A 15 8.324 -1.890 -5.915 1.00 0.00 C ATOM 203 CG GLU A 15 9.193 -1.498 -7.098 1.00 0.00 C ATOM 204 CD GLU A 15 9.495 -2.668 -8.014 1.00 0.00 C ATOM 205 OE1 GLU A 15 8.702 -2.913 -8.946 1.00 0.00 O ATOM 206 OE2 GLU A 15 10.526 -3.339 -7.797 1.00 0.00 O ATOM 0 H GLU A 15 6.620 -2.049 -3.983 1.00 0.00 H new ATOM 0 HA GLU A 15 8.250 0.109 -5.131 1.00 0.00 H new ATOM 0 HB2 GLU A 15 8.952 -2.345 -5.149 1.00 0.00 H new ATOM 0 HB3 GLU A 15 7.611 -2.650 -6.235 1.00 0.00 H new ATOM 0 HG2 GLU A 15 8.692 -0.715 -7.668 1.00 0.00 H new ATOM 0 HG3 GLU A 15 10.129 -1.077 -6.732 1.00 0.00 H new ATOM 213 N TYR A 16 6.379 1.066 -6.445 1.00 0.00 N ATOM 214 CA TYR A 16 5.378 1.645 -7.333 1.00 0.00 C ATOM 215 C TYR A 16 6.040 2.360 -8.508 1.00 0.00 C ATOM 216 O TYR A 16 7.151 2.876 -8.388 1.00 0.00 O ATOM 217 CB TYR A 16 4.487 2.622 -6.564 1.00 0.00 C ATOM 218 CG TYR A 16 3.467 3.324 -7.433 1.00 0.00 C ATOM 219 CD1 TYR A 16 2.626 2.603 -8.272 1.00 0.00 C ATOM 220 CD2 TYR A 16 3.344 4.708 -7.413 1.00 0.00 C ATOM 221 CE1 TYR A 16 1.694 3.240 -9.067 1.00 0.00 C ATOM 222 CE2 TYR A 16 2.413 5.353 -8.204 1.00 0.00 C ATOM 223 CZ TYR A 16 1.591 4.615 -9.030 1.00 0.00 C ATOM 224 OH TYR A 16 0.662 5.253 -9.820 1.00 0.00 O ATOM 0 H TYR A 16 6.987 1.749 -5.993 1.00 0.00 H new ATOM 0 HA TYR A 16 4.764 0.834 -7.724 1.00 0.00 H new ATOM 0 HB2 TYR A 16 3.967 2.081 -5.773 1.00 0.00 H new ATOM 0 HB3 TYR A 16 5.115 3.369 -6.080 1.00 0.00 H new ATOM 0 HD1 TYR A 16 2.703 1.526 -8.303 1.00 0.00 H new ATOM 0 HD2 TYR A 16 3.987 5.289 -6.768 1.00 0.00 H new ATOM 0 HE1 TYR A 16 1.049 2.665 -9.714 1.00 0.00 H new ATOM 0 HE2 TYR A 16 2.329 6.429 -8.176 1.00 0.00 H new ATOM 0 HH TYR A 16 0.012 4.600 -10.154 1.00 0.00 H new ATOM 234 N ARG A 17 5.348 2.385 -9.642 1.00 0.00 N ATOM 235 CA ARG A 17 5.867 3.035 -10.839 1.00 0.00 C ATOM 236 C ARG A 17 6.691 4.267 -10.475 1.00 0.00 C ATOM 237 O ARG A 17 7.862 4.373 -10.839 1.00 0.00 O ATOM 238 CB ARG A 17 4.719 3.432 -11.769 1.00 0.00 C ATOM 239 CG ARG A 17 3.869 2.257 -12.223 1.00 0.00 C ATOM 240 CD ARG A 17 2.727 2.709 -13.120 1.00 0.00 C ATOM 241 NE ARG A 17 3.112 2.726 -14.529 1.00 0.00 N ATOM 242 CZ ARG A 17 3.131 1.643 -15.299 1.00 0.00 C ATOM 243 NH1 ARG A 17 2.788 0.464 -14.799 1.00 0.00 N ATOM 244 NH2 ARG A 17 3.493 1.739 -16.572 1.00 0.00 N ATOM 0 H ARG A 17 4.427 1.963 -9.757 1.00 0.00 H new ATOM 0 HA ARG A 17 6.514 2.326 -11.355 1.00 0.00 H new ATOM 0 HB2 ARG A 17 4.082 4.154 -11.258 1.00 0.00 H new ATOM 0 HB3 ARG A 17 5.130 3.933 -12.646 1.00 0.00 H new ATOM 0 HG2 ARG A 17 4.492 1.541 -12.759 1.00 0.00 H new ATOM 0 HG3 ARG A 17 3.466 1.740 -11.352 1.00 0.00 H new ATOM 0 HD2 ARG A 17 1.875 2.043 -12.985 1.00 0.00 H new ATOM 0 HD3 ARG A 17 2.403 3.706 -12.820 1.00 0.00 H new ATOM 0 HE ARG A 17 3.381 3.618 -14.945 1.00 0.00 H new ATOM 0 HH11 ARG A 17 2.509 0.387 -13.821 1.00 0.00 H new ATOM 0 HH12 ARG A 17 2.803 -0.366 -15.392 1.00 0.00 H new ATOM 0 HH21 ARG A 17 3.757 2.645 -16.960 1.00 0.00 H new ATOM 0 HH22 ARG A 17 3.507 0.907 -17.162 1.00 0.00 H new ATOM 258 N ASP A 18 6.070 5.195 -9.756 1.00 0.00 N ATOM 259 CA ASP A 18 6.745 6.420 -9.342 1.00 0.00 C ATOM 260 C ASP A 18 8.093 6.107 -8.700 1.00 0.00 C ATOM 261 O ASP A 18 9.138 6.537 -9.188 1.00 0.00 O ATOM 262 CB ASP A 18 5.870 7.204 -8.363 1.00 0.00 C ATOM 263 CG ASP A 18 6.290 8.656 -8.246 1.00 0.00 C ATOM 264 OD1 ASP A 18 7.414 8.912 -7.765 1.00 0.00 O ATOM 265 OD2 ASP A 18 5.495 9.536 -8.636 1.00 0.00 O ATOM 0 H ASP A 18 5.100 5.123 -9.448 1.00 0.00 H new ATOM 0 HA ASP A 18 6.918 7.028 -10.230 1.00 0.00 H new ATOM 0 HB2 ASP A 18 4.831 7.154 -8.689 1.00 0.00 H new ATOM 0 HB3 ASP A 18 5.919 6.734 -7.381 1.00 0.00 H new ATOM 270 N ARG A 19 8.061 5.357 -7.604 1.00 0.00 N ATOM 271 CA ARG A 19 9.280 4.988 -6.894 1.00 0.00 C ATOM 272 C ARG A 19 8.974 4.020 -5.755 1.00 0.00 C ATOM 273 O ARG A 19 7.815 3.704 -5.490 1.00 0.00 O ATOM 274 CB ARG A 19 9.972 6.237 -6.345 1.00 0.00 C ATOM 275 CG ARG A 19 9.175 6.951 -5.265 1.00 0.00 C ATOM 276 CD ARG A 19 9.922 8.161 -4.729 1.00 0.00 C ATOM 277 NE ARG A 19 11.217 7.797 -4.160 1.00 0.00 N ATOM 278 CZ ARG A 19 11.871 8.548 -3.281 1.00 0.00 C ATOM 279 NH1 ARG A 19 11.353 9.698 -2.872 1.00 0.00 N ATOM 280 NH2 ARG A 19 13.045 8.149 -2.809 1.00 0.00 N ATOM 0 H ARG A 19 7.204 4.993 -7.188 1.00 0.00 H new ATOM 0 HA ARG A 19 9.946 4.492 -7.599 1.00 0.00 H new ATOM 0 HB2 ARG A 19 10.944 5.955 -5.941 1.00 0.00 H new ATOM 0 HB3 ARG A 19 10.157 6.930 -7.166 1.00 0.00 H new ATOM 0 HG2 ARG A 19 8.213 7.266 -5.670 1.00 0.00 H new ATOM 0 HG3 ARG A 19 8.966 6.260 -4.448 1.00 0.00 H new ATOM 0 HD2 ARG A 19 10.069 8.882 -5.533 1.00 0.00 H new ATOM 0 HD3 ARG A 19 9.317 8.653 -3.967 1.00 0.00 H new ATOM 0 HE ARG A 19 11.643 6.918 -4.454 1.00 0.00 H new ATOM 0 HH11 ARG A 19 10.450 10.008 -3.232 1.00 0.00 H new ATOM 0 HH12 ARG A 19 11.857 10.273 -2.197 1.00 0.00 H new ATOM 0 HH21 ARG A 19 13.446 7.265 -3.121 1.00 0.00 H new ATOM 0 HH22 ARG A 19 13.546 8.727 -2.134 1.00 0.00 H new ATOM 294 N ASN A 20 10.023 3.553 -5.085 1.00 0.00 N ATOM 295 CA ASN A 20 9.866 2.620 -3.975 1.00 0.00 C ATOM 296 C ASN A 20 9.816 3.363 -2.643 1.00 0.00 C ATOM 297 O ASN A 20 10.792 3.990 -2.232 1.00 0.00 O ATOM 298 CB ASN A 20 11.015 1.610 -3.965 1.00 0.00 C ATOM 299 CG ASN A 20 12.332 2.227 -4.396 1.00 0.00 C ATOM 300 OD1 ASN A 20 12.503 2.606 -5.555 1.00 0.00 O ATOM 301 ND2 ASN A 20 13.270 2.332 -3.462 1.00 0.00 N ATOM 0 H ASN A 20 10.990 3.805 -5.291 1.00 0.00 H new ATOM 0 HA ASN A 20 8.924 2.088 -4.110 1.00 0.00 H new ATOM 0 HB2 ASN A 20 11.122 1.196 -2.963 1.00 0.00 H new ATOM 0 HB3 ASN A 20 10.771 0.780 -4.629 1.00 0.00 H new ATOM 0 HD21 ASN A 20 14.176 2.740 -3.693 1.00 0.00 H new ATOM 0 HD22 ASN A 20 13.085 2.005 -2.514 1.00 0.00 H new ATOM 308 N VAL A 21 8.671 3.286 -1.972 1.00 0.00 N ATOM 309 CA VAL A 21 8.492 3.949 -0.686 1.00 0.00 C ATOM 310 C VAL A 21 8.590 2.953 0.464 1.00 0.00 C ATOM 311 O VAL A 21 8.223 1.786 0.321 1.00 0.00 O ATOM 312 CB VAL A 21 7.135 4.672 -0.611 1.00 0.00 C ATOM 313 CG1 VAL A 21 5.994 3.666 -0.579 1.00 0.00 C ATOM 314 CG2 VAL A 21 7.085 5.586 0.605 1.00 0.00 C ATOM 0 H VAL A 21 7.853 2.771 -2.298 1.00 0.00 H new ATOM 0 HA VAL A 21 9.292 4.684 -0.595 1.00 0.00 H new ATOM 0 HB VAL A 21 7.021 5.286 -1.504 1.00 0.00 H new ATOM 0 HG11 VAL A 21 5.043 4.196 -0.526 1.00 0.00 H new ATOM 0 HG12 VAL A 21 6.020 3.057 -1.483 1.00 0.00 H new ATOM 0 HG13 VAL A 21 6.100 3.023 0.295 1.00 0.00 H new ATOM 0 HG21 VAL A 21 6.119 6.089 0.642 1.00 0.00 H new ATOM 0 HG22 VAL A 21 7.222 4.995 1.510 1.00 0.00 H new ATOM 0 HG23 VAL A 21 7.879 6.330 0.534 1.00 0.00 H new ATOM 324 N ASP A 22 9.086 3.420 1.604 1.00 0.00 N ATOM 325 CA ASP A 22 9.230 2.571 2.781 1.00 0.00 C ATOM 326 C ASP A 22 8.092 2.812 3.768 1.00 0.00 C ATOM 327 O ASP A 22 7.773 3.955 4.096 1.00 0.00 O ATOM 328 CB ASP A 22 10.575 2.829 3.461 1.00 0.00 C ATOM 329 CG ASP A 22 10.619 2.295 4.879 1.00 0.00 C ATOM 330 OD1 ASP A 22 10.439 1.073 5.059 1.00 0.00 O ATOM 331 OD2 ASP A 22 10.834 3.100 5.809 1.00 0.00 O ATOM 0 H ASP A 22 9.395 4.383 1.738 1.00 0.00 H new ATOM 0 HA ASP A 22 9.190 1.532 2.455 1.00 0.00 H new ATOM 0 HB2 ASP A 22 11.369 2.365 2.876 1.00 0.00 H new ATOM 0 HB3 ASP A 22 10.773 3.901 3.473 1.00 0.00 H new ATOM 336 N VAL A 23 7.483 1.728 4.237 1.00 0.00 N ATOM 337 CA VAL A 23 6.380 1.821 5.186 1.00 0.00 C ATOM 338 C VAL A 23 6.710 1.093 6.484 1.00 0.00 C ATOM 339 O VAL A 23 7.386 0.064 6.477 1.00 0.00 O ATOM 340 CB VAL A 23 5.082 1.237 4.598 1.00 0.00 C ATOM 341 CG1 VAL A 23 3.966 1.268 5.632 1.00 0.00 C ATOM 342 CG2 VAL A 23 4.678 1.996 3.343 1.00 0.00 C ATOM 0 H VAL A 23 7.735 0.775 3.975 1.00 0.00 H new ATOM 0 HA VAL A 23 6.230 2.880 5.395 1.00 0.00 H new ATOM 0 HB VAL A 23 5.263 0.197 4.325 1.00 0.00 H new ATOM 0 HG11 VAL A 23 3.057 0.851 5.199 1.00 0.00 H new ATOM 0 HG12 VAL A 23 4.258 0.677 6.500 1.00 0.00 H new ATOM 0 HG13 VAL A 23 3.783 2.298 5.939 1.00 0.00 H new ATOM 0 HG21 VAL A 23 3.759 1.570 2.940 1.00 0.00 H new ATOM 0 HG22 VAL A 23 4.515 3.045 3.589 1.00 0.00 H new ATOM 0 HG23 VAL A 23 5.471 1.917 2.599 1.00 0.00 H new ATOM 352 N VAL A 24 6.227 1.633 7.599 1.00 0.00 N ATOM 353 CA VAL A 24 6.468 1.033 8.906 1.00 0.00 C ATOM 354 C VAL A 24 5.196 1.016 9.746 1.00 0.00 C ATOM 355 O VAL A 24 4.600 2.061 10.010 1.00 0.00 O ATOM 356 CB VAL A 24 7.568 1.789 9.675 1.00 0.00 C ATOM 357 CG1 VAL A 24 7.522 1.438 11.154 1.00 0.00 C ATOM 358 CG2 VAL A 24 8.937 1.479 9.088 1.00 0.00 C ATOM 0 H VAL A 24 5.667 2.485 7.623 1.00 0.00 H new ATOM 0 HA VAL A 24 6.796 0.009 8.729 1.00 0.00 H new ATOM 0 HB VAL A 24 7.388 2.859 9.574 1.00 0.00 H new ATOM 0 HG11 VAL A 24 8.306 1.981 11.681 1.00 0.00 H new ATOM 0 HG12 VAL A 24 6.550 1.715 11.564 1.00 0.00 H new ATOM 0 HG13 VAL A 24 7.676 0.366 11.279 1.00 0.00 H new ATOM 0 HG21 VAL A 24 9.702 2.021 9.643 1.00 0.00 H new ATOM 0 HG22 VAL A 24 9.129 0.408 9.157 1.00 0.00 H new ATOM 0 HG23 VAL A 24 8.962 1.785 8.042 1.00 0.00 H new ATOM 368 N LEU A 25 4.786 -0.176 10.164 1.00 0.00 N ATOM 369 CA LEU A 25 3.584 -0.330 10.976 1.00 0.00 C ATOM 370 C LEU A 25 3.672 -1.579 11.847 1.00 0.00 C ATOM 371 O LEU A 25 4.094 -2.640 11.387 1.00 0.00 O ATOM 372 CB LEU A 25 2.346 -0.405 10.081 1.00 0.00 C ATOM 373 CG LEU A 25 2.072 -1.759 9.426 1.00 0.00 C ATOM 374 CD1 LEU A 25 0.774 -1.716 8.635 1.00 0.00 C ATOM 375 CD2 LEU A 25 3.233 -2.161 8.527 1.00 0.00 C ATOM 0 H LEU A 25 5.268 -1.050 9.954 1.00 0.00 H new ATOM 0 HA LEU A 25 3.502 0.540 11.627 1.00 0.00 H new ATOM 0 HB2 LEU A 25 1.475 -0.129 10.676 1.00 0.00 H new ATOM 0 HB3 LEU A 25 2.445 0.343 9.294 1.00 0.00 H new ATOM 0 HG LEU A 25 1.970 -2.507 10.212 1.00 0.00 H new ATOM 0 HD11 LEU A 25 0.595 -2.688 8.176 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -0.052 -1.473 9.304 1.00 0.00 H new ATOM 0 HD13 LEU A 25 0.847 -0.956 7.858 1.00 0.00 H new ATOM 0 HD21 LEU A 25 3.021 -3.127 8.069 1.00 0.00 H new ATOM 0 HD22 LEU A 25 3.366 -1.411 7.747 1.00 0.00 H new ATOM 0 HD23 LEU A 25 4.145 -2.233 9.120 1.00 0.00 H new ATOM 387 N GLU A 26 3.269 -1.446 13.107 1.00 0.00 N ATOM 388 CA GLU A 26 3.301 -2.565 14.041 1.00 0.00 C ATOM 389 C GLU A 26 2.522 -3.757 13.490 1.00 0.00 C ATOM 390 O GLU A 26 1.658 -3.601 12.627 1.00 0.00 O ATOM 391 CB GLU A 26 2.722 -2.146 15.394 1.00 0.00 C ATOM 392 CG GLU A 26 3.293 -2.924 16.568 1.00 0.00 C ATOM 393 CD GLU A 26 2.666 -2.528 17.891 1.00 0.00 C ATOM 394 OE1 GLU A 26 2.404 -1.322 18.084 1.00 0.00 O ATOM 395 OE2 GLU A 26 2.439 -3.422 18.732 1.00 0.00 O ATOM 0 H GLU A 26 2.917 -0.575 13.504 1.00 0.00 H new ATOM 0 HA GLU A 26 4.341 -2.863 14.175 1.00 0.00 H new ATOM 0 HB2 GLU A 26 2.911 -1.083 15.547 1.00 0.00 H new ATOM 0 HB3 GLU A 26 1.640 -2.278 15.373 1.00 0.00 H new ATOM 0 HG2 GLU A 26 3.139 -3.990 16.402 1.00 0.00 H new ATOM 0 HG3 GLU A 26 4.370 -2.762 16.617 1.00 0.00 H new ATOM 402 N ASP A 27 2.836 -4.945 13.995 1.00 0.00 N ATOM 403 CA ASP A 27 2.166 -6.163 13.554 1.00 0.00 C ATOM 404 C ASP A 27 0.704 -6.168 13.990 1.00 0.00 C ATOM 405 O ASP A 27 -0.069 -7.042 13.597 1.00 0.00 O ATOM 406 CB ASP A 27 2.882 -7.394 14.113 1.00 0.00 C ATOM 407 CG ASP A 27 2.795 -7.478 15.624 1.00 0.00 C ATOM 408 OD1 ASP A 27 3.680 -6.913 16.302 1.00 0.00 O ATOM 409 OD2 ASP A 27 1.843 -8.107 16.129 1.00 0.00 O ATOM 0 H ASP A 27 3.549 -5.091 14.709 1.00 0.00 H new ATOM 0 HA ASP A 27 2.201 -6.194 12.465 1.00 0.00 H new ATOM 0 HB2 ASP A 27 2.447 -8.293 13.676 1.00 0.00 H new ATOM 0 HB3 ASP A 27 3.930 -7.369 13.813 1.00 0.00 H new ATOM 414 N THR A 28 0.332 -5.186 14.805 1.00 0.00 N ATOM 415 CA THR A 28 -1.036 -5.078 15.296 1.00 0.00 C ATOM 416 C THR A 28 -1.936 -4.396 14.272 1.00 0.00 C ATOM 417 O THR A 28 -3.156 -4.561 14.296 1.00 0.00 O ATOM 418 CB THR A 28 -1.097 -4.293 16.620 1.00 0.00 C ATOM 419 OG1 THR A 28 -0.401 -3.049 16.485 1.00 0.00 O ATOM 420 CG2 THR A 28 -0.488 -5.099 17.757 1.00 0.00 C ATOM 0 H THR A 28 0.959 -4.454 15.139 1.00 0.00 H new ATOM 0 HA THR A 28 -1.391 -6.094 15.468 1.00 0.00 H new ATOM 0 HB THR A 28 -2.144 -4.100 16.853 1.00 0.00 H new ATOM 0 HG1 THR A 28 -0.446 -2.556 17.330 1.00 0.00 H new ATOM 0 HG21 THR A 28 -0.543 -4.524 18.681 1.00 0.00 H new ATOM 0 HG22 THR A 28 -1.039 -6.032 17.877 1.00 0.00 H new ATOM 0 HG23 THR A 28 0.555 -5.320 17.529 1.00 0.00 H new ATOM 428 N CYS A 29 -1.327 -3.631 13.373 1.00 0.00 N ATOM 429 CA CYS A 29 -2.074 -2.923 12.339 1.00 0.00 C ATOM 430 C CYS A 29 -2.719 -3.905 11.367 1.00 0.00 C ATOM 431 O CYS A 29 -2.228 -5.018 11.173 1.00 0.00 O ATOM 432 CB CYS A 29 -1.154 -1.965 11.581 1.00 0.00 C ATOM 433 SG CYS A 29 -0.776 -0.440 12.477 1.00 0.00 S ATOM 0 H CYS A 29 -0.318 -3.485 13.339 1.00 0.00 H new ATOM 0 HA CYS A 29 -2.863 -2.348 12.824 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -0.221 -2.480 11.352 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -1.619 -1.709 10.629 1.00 0.00 H new ATOM 0 HG CYS A 29 -0.386 0.472 11.636 1.00 0.00 H new ATOM 439 N THR A 30 -3.824 -3.486 10.757 1.00 0.00 N ATOM 440 CA THR A 30 -4.539 -4.329 9.807 1.00 0.00 C ATOM 441 C THR A 30 -3.971 -4.175 8.401 1.00 0.00 C ATOM 442 O THR A 30 -3.616 -3.073 7.980 1.00 0.00 O ATOM 443 CB THR A 30 -6.042 -3.996 9.781 1.00 0.00 C ATOM 444 OG1 THR A 30 -6.550 -3.915 11.117 1.00 0.00 O ATOM 445 CG2 THR A 30 -6.816 -5.048 9.002 1.00 0.00 C ATOM 0 H THR A 30 -4.243 -2.568 10.904 1.00 0.00 H new ATOM 0 HA THR A 30 -4.409 -5.359 10.138 1.00 0.00 H new ATOM 0 HB THR A 30 -6.169 -3.033 9.286 1.00 0.00 H new ATOM 0 HG1 THR A 30 -7.506 -3.701 11.091 1.00 0.00 H new ATOM 0 HG21 THR A 30 -7.875 -4.791 8.998 1.00 0.00 H new ATOM 0 HG22 THR A 30 -6.447 -5.086 7.977 1.00 0.00 H new ATOM 0 HG23 THR A 30 -6.681 -6.022 9.472 1.00 0.00 H new ATOM 453 N VAL A 31 -3.888 -5.286 7.676 1.00 0.00 N ATOM 454 CA VAL A 31 -3.365 -5.274 6.315 1.00 0.00 C ATOM 455 C VAL A 31 -3.952 -4.120 5.511 1.00 0.00 C ATOM 456 O VAL A 31 -3.330 -3.623 4.573 1.00 0.00 O ATOM 457 CB VAL A 31 -3.664 -6.598 5.587 1.00 0.00 C ATOM 458 CG1 VAL A 31 -2.952 -7.756 6.269 1.00 0.00 C ATOM 459 CG2 VAL A 31 -5.164 -6.845 5.527 1.00 0.00 C ATOM 0 H VAL A 31 -4.176 -6.206 8.009 1.00 0.00 H new ATOM 0 HA VAL A 31 -2.285 -5.147 6.392 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.289 -6.524 4.566 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -3.175 -8.683 5.740 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -1.876 -7.581 6.255 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -3.293 -7.836 7.301 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.358 -7.785 5.009 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.565 -6.899 6.539 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -5.646 -6.029 4.989 1.00 0.00 H new ATOM 469 N GLY A 32 -5.157 -3.698 5.884 1.00 0.00 N ATOM 470 CA GLY A 32 -5.809 -2.605 5.187 1.00 0.00 C ATOM 471 C GLY A 32 -5.056 -1.297 5.328 1.00 0.00 C ATOM 472 O GLY A 32 -5.003 -0.501 4.392 1.00 0.00 O ATOM 0 H GLY A 32 -5.693 -4.094 6.656 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -5.901 -2.856 4.130 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -6.820 -2.482 5.575 1.00 0.00 H new ATOM 476 N GLU A 33 -4.476 -1.073 6.503 1.00 0.00 N ATOM 477 CA GLU A 33 -3.725 0.149 6.763 1.00 0.00 C ATOM 478 C GLU A 33 -2.727 0.424 5.642 1.00 0.00 C ATOM 479 O GLU A 33 -2.799 1.455 4.972 1.00 0.00 O ATOM 480 CB GLU A 33 -2.991 0.048 8.102 1.00 0.00 C ATOM 481 CG GLU A 33 -3.813 0.531 9.285 1.00 0.00 C ATOM 482 CD GLU A 33 -5.218 -0.040 9.291 1.00 0.00 C ATOM 483 OE1 GLU A 33 -6.050 0.426 8.485 1.00 0.00 O ATOM 484 OE2 GLU A 33 -5.485 -0.951 10.102 1.00 0.00 O ATOM 0 H GLU A 33 -4.512 -1.722 7.289 1.00 0.00 H new ATOM 0 HA GLU A 33 -4.432 0.977 6.807 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -2.702 -0.989 8.271 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -2.071 0.631 8.047 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -3.308 0.254 10.211 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -3.867 1.619 9.265 1.00 0.00 H new ATOM 491 N ILE A 34 -1.797 -0.504 5.446 1.00 0.00 N ATOM 492 CA ILE A 34 -0.785 -0.362 4.407 1.00 0.00 C ATOM 493 C ILE A 34 -1.351 0.347 3.181 1.00 0.00 C ATOM 494 O ILE A 34 -0.672 1.156 2.549 1.00 0.00 O ATOM 495 CB ILE A 34 -0.221 -1.730 3.980 1.00 0.00 C ATOM 496 CG1 ILE A 34 0.317 -2.486 5.196 1.00 0.00 C ATOM 497 CG2 ILE A 34 0.870 -1.550 2.935 1.00 0.00 C ATOM 498 CD1 ILE A 34 0.963 -3.809 4.848 1.00 0.00 C ATOM 0 H ILE A 34 -1.723 -1.362 5.993 1.00 0.00 H new ATOM 0 HA ILE A 34 0.020 0.238 4.831 1.00 0.00 H new ATOM 0 HB ILE A 34 -1.026 -2.317 3.538 1.00 0.00 H new ATOM 0 HG12 ILE A 34 1.046 -1.859 5.710 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -0.501 -2.663 5.895 1.00 0.00 H new ATOM 0 HG21 ILE A 34 1.259 -2.526 2.643 1.00 0.00 H new ATOM 0 HG22 ILE A 34 0.457 -1.048 2.060 1.00 0.00 H new ATOM 0 HG23 ILE A 34 1.677 -0.948 3.352 1.00 0.00 H new ATOM 0 HD11 ILE A 34 1.321 -4.290 5.758 1.00 0.00 H new ATOM 0 HD12 ILE A 34 0.232 -4.454 4.361 1.00 0.00 H new ATOM 0 HD13 ILE A 34 1.802 -3.638 4.174 1.00 0.00 H new ATOM 510 N LYS A 35 -2.601 0.039 2.851 1.00 0.00 N ATOM 511 CA LYS A 35 -3.262 0.648 1.702 1.00 0.00 C ATOM 512 C LYS A 35 -3.446 2.147 1.913 1.00 0.00 C ATOM 513 O LYS A 35 -2.851 2.959 1.205 1.00 0.00 O ATOM 514 CB LYS A 35 -4.620 -0.014 1.459 1.00 0.00 C ATOM 515 CG LYS A 35 -4.535 -1.516 1.246 1.00 0.00 C ATOM 516 CD LYS A 35 -5.839 -2.077 0.704 1.00 0.00 C ATOM 517 CE LYS A 35 -5.858 -2.072 -0.817 1.00 0.00 C ATOM 518 NZ LYS A 35 -7.238 -1.911 -1.353 1.00 0.00 N ATOM 0 H LYS A 35 -3.177 -0.629 3.363 1.00 0.00 H new ATOM 0 HA LYS A 35 -2.629 0.497 0.827 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -5.271 0.188 2.310 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -5.086 0.443 0.586 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -3.725 -1.741 0.552 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -4.292 -2.005 2.189 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -5.977 -3.095 1.067 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -6.675 -1.488 1.081 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -5.228 -1.262 -1.186 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -5.430 -3.003 -1.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -7.660 -2.848 -1.512 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -7.816 -1.382 -0.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -7.202 -1.391 -2.253 1.00 0.00 H new ATOM 532 N GLN A 36 -4.271 2.506 2.891 1.00 0.00 N ATOM 533 CA GLN A 36 -4.532 3.908 3.194 1.00 0.00 C ATOM 534 C GLN A 36 -3.229 4.665 3.432 1.00 0.00 C ATOM 535 O GLN A 36 -3.037 5.767 2.917 1.00 0.00 O ATOM 536 CB GLN A 36 -5.436 4.027 4.422 1.00 0.00 C ATOM 537 CG GLN A 36 -6.224 5.326 4.474 1.00 0.00 C ATOM 538 CD GLN A 36 -7.506 5.262 3.667 1.00 0.00 C ATOM 539 OE1 GLN A 36 -8.045 4.183 3.419 1.00 0.00 O ATOM 540 NE2 GLN A 36 -8.003 6.422 3.252 1.00 0.00 N ATOM 0 H GLN A 36 -4.770 1.846 3.487 1.00 0.00 H new ATOM 0 HA GLN A 36 -5.037 4.351 2.336 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -6.132 3.189 4.433 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -4.826 3.946 5.321 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -6.463 5.560 5.511 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -5.603 6.139 4.098 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -7.524 7.293 3.480 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -8.864 6.442 2.705 1.00 0.00 H new ATOM 549 N ILE A 37 -2.338 4.067 4.215 1.00 0.00 N ATOM 550 CA ILE A 37 -1.053 4.685 4.520 1.00 0.00 C ATOM 551 C ILE A 37 -0.355 5.157 3.250 1.00 0.00 C ATOM 552 O ILE A 37 0.213 6.249 3.209 1.00 0.00 O ATOM 553 CB ILE A 37 -0.125 3.712 5.272 1.00 0.00 C ATOM 554 CG1 ILE A 37 -0.667 3.439 6.677 1.00 0.00 C ATOM 555 CG2 ILE A 37 1.286 4.276 5.343 1.00 0.00 C ATOM 556 CD1 ILE A 37 0.047 2.313 7.391 1.00 0.00 C ATOM 0 H ILE A 37 -2.482 3.156 4.650 1.00 0.00 H new ATOM 0 HA ILE A 37 -1.259 5.544 5.159 1.00 0.00 H new ATOM 0 HB ILE A 37 -0.092 2.769 4.727 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -0.583 4.348 7.273 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -1.728 3.200 6.608 1.00 0.00 H new ATOM 0 HG21 ILE A 37 1.930 3.578 5.877 1.00 0.00 H new ATOM 0 HG22 ILE A 37 1.670 4.425 4.334 1.00 0.00 H new ATOM 0 HG23 ILE A 37 1.270 5.230 5.869 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.389 2.175 8.380 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -0.059 1.393 6.816 1.00 0.00 H new ATOM 0 HD13 ILE A 37 1.104 2.558 7.492 1.00 0.00 H new ATOM 568 N LEU A 38 -0.402 4.328 2.213 1.00 0.00 N ATOM 569 CA LEU A 38 0.225 4.661 0.938 1.00 0.00 C ATOM 570 C LEU A 38 -0.391 5.922 0.341 1.00 0.00 C ATOM 571 O LEU A 38 0.243 6.618 -0.451 1.00 0.00 O ATOM 572 CB LEU A 38 0.082 3.496 -0.043 1.00 0.00 C ATOM 573 CG LEU A 38 0.992 2.292 0.206 1.00 0.00 C ATOM 574 CD1 LEU A 38 0.590 1.126 -0.683 1.00 0.00 C ATOM 575 CD2 LEU A 38 2.448 2.668 -0.028 1.00 0.00 C ATOM 0 H LEU A 38 -0.868 3.421 2.230 1.00 0.00 H new ATOM 0 HA LEU A 38 1.284 4.847 1.120 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -0.953 3.154 -0.022 1.00 0.00 H new ATOM 0 HB3 LEU A 38 0.274 3.869 -1.049 1.00 0.00 H new ATOM 0 HG LEU A 38 0.880 1.984 1.245 1.00 0.00 H new ATOM 0 HD11 LEU A 38 1.249 0.279 -0.492 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -0.440 0.841 -0.466 1.00 0.00 H new ATOM 0 HD13 LEU A 38 0.672 1.421 -1.729 1.00 0.00 H new ATOM 0 HD21 LEU A 38 3.082 1.800 0.154 1.00 0.00 H new ATOM 0 HD22 LEU A 38 2.577 3.002 -1.058 1.00 0.00 H new ATOM 0 HD23 LEU A 38 2.730 3.472 0.652 1.00 0.00 H new ATOM 587 N GLU A 39 -1.629 6.211 0.730 1.00 0.00 N ATOM 588 CA GLU A 39 -2.329 7.389 0.233 1.00 0.00 C ATOM 589 C GLU A 39 -1.834 8.651 0.934 1.00 0.00 C ATOM 590 O GLU A 39 -2.051 9.764 0.456 1.00 0.00 O ATOM 591 CB GLU A 39 -3.838 7.237 0.438 1.00 0.00 C ATOM 592 CG GLU A 39 -4.641 8.436 -0.039 1.00 0.00 C ATOM 593 CD GLU A 39 -6.096 8.368 0.381 1.00 0.00 C ATOM 594 OE1 GLU A 39 -6.652 7.251 0.414 1.00 0.00 O ATOM 595 OE2 GLU A 39 -6.679 9.432 0.677 1.00 0.00 O ATOM 0 H GLU A 39 -2.167 5.646 1.387 1.00 0.00 H new ATOM 0 HA GLU A 39 -2.122 7.481 -0.833 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -4.180 6.347 -0.091 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -4.038 7.075 1.497 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -4.195 9.348 0.357 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -4.583 8.498 -1.126 1.00 0.00 H new ATOM 602 N ASN A 40 -1.169 8.468 2.070 1.00 0.00 N ATOM 603 CA ASN A 40 -0.645 9.592 2.838 1.00 0.00 C ATOM 604 C ASN A 40 0.788 9.913 2.422 1.00 0.00 C ATOM 605 O ASN A 40 1.367 10.902 2.869 1.00 0.00 O ATOM 606 CB ASN A 40 -0.695 9.281 4.335 1.00 0.00 C ATOM 607 CG ASN A 40 -2.099 9.385 4.900 1.00 0.00 C ATOM 608 OD1 ASN A 40 -2.391 10.267 5.708 1.00 0.00 O ATOM 609 ND2 ASN A 40 -2.975 8.482 4.477 1.00 0.00 N ATOM 0 H ASN A 40 -0.980 7.553 2.479 1.00 0.00 H new ATOM 0 HA ASN A 40 -1.268 10.462 2.633 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -0.310 8.276 4.508 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -0.040 9.969 4.869 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -3.934 8.501 4.823 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -2.689 7.769 3.806 1.00 0.00 H new ATOM 616 N GLU A 41 1.352 9.070 1.563 1.00 0.00 N ATOM 617 CA GLU A 41 2.717 9.265 1.087 1.00 0.00 C ATOM 618 C GLU A 41 2.746 9.428 -0.430 1.00 0.00 C ATOM 619 O GLU A 41 3.541 10.199 -0.968 1.00 0.00 O ATOM 620 CB GLU A 41 3.598 8.084 1.501 1.00 0.00 C ATOM 621 CG GLU A 41 3.653 7.864 3.003 1.00 0.00 C ATOM 622 CD GLU A 41 4.780 8.634 3.665 1.00 0.00 C ATOM 623 OE1 GLU A 41 5.955 8.282 3.433 1.00 0.00 O ATOM 624 OE2 GLU A 41 4.486 9.588 4.415 1.00 0.00 O ATOM 0 H GLU A 41 0.886 8.246 1.183 1.00 0.00 H new ATOM 0 HA GLU A 41 3.106 10.177 1.540 1.00 0.00 H new ATOM 0 HB2 GLU A 41 3.225 7.178 1.023 1.00 0.00 H new ATOM 0 HB3 GLU A 41 4.609 8.248 1.129 1.00 0.00 H new ATOM 0 HG2 GLU A 41 2.703 8.165 3.445 1.00 0.00 H new ATOM 0 HG3 GLU A 41 3.776 6.800 3.206 1.00 0.00 H new ATOM 631 N LEU A 42 1.874 8.696 -1.114 1.00 0.00 N ATOM 632 CA LEU A 42 1.798 8.758 -2.570 1.00 0.00 C ATOM 633 C LEU A 42 0.583 9.563 -3.019 1.00 0.00 C ATOM 634 O LEU A 42 0.408 9.829 -4.207 1.00 0.00 O ATOM 635 CB LEU A 42 1.736 7.347 -3.158 1.00 0.00 C ATOM 636 CG LEU A 42 2.793 6.363 -2.655 1.00 0.00 C ATOM 637 CD1 LEU A 42 2.532 4.971 -3.208 1.00 0.00 C ATOM 638 CD2 LEU A 42 4.187 6.838 -3.036 1.00 0.00 C ATOM 0 H LEU A 42 1.209 8.052 -0.684 1.00 0.00 H new ATOM 0 HA LEU A 42 2.696 9.258 -2.935 1.00 0.00 H new ATOM 0 HB2 LEU A 42 0.751 6.930 -2.947 1.00 0.00 H new ATOM 0 HB3 LEU A 42 1.825 7.422 -4.242 1.00 0.00 H new ATOM 0 HG LEU A 42 2.731 6.317 -1.568 1.00 0.00 H new ATOM 0 HD11 LEU A 42 3.294 4.284 -2.839 1.00 0.00 H new ATOM 0 HD12 LEU A 42 1.549 4.629 -2.885 1.00 0.00 H new ATOM 0 HD13 LEU A 42 2.566 5.000 -4.297 1.00 0.00 H new ATOM 0 HD21 LEU A 42 4.927 6.126 -2.670 1.00 0.00 H new ATOM 0 HD22 LEU A 42 4.262 6.914 -4.121 1.00 0.00 H new ATOM 0 HD23 LEU A 42 4.373 7.815 -2.590 1.00 0.00 H new ATOM 650 N GLN A 43 -0.253 9.948 -2.059 1.00 0.00 N ATOM 651 CA GLN A 43 -1.451 10.724 -2.356 1.00 0.00 C ATOM 652 C GLN A 43 -2.369 9.964 -3.308 1.00 0.00 C ATOM 653 O GLN A 43 -3.159 10.566 -4.036 1.00 0.00 O ATOM 654 CB GLN A 43 -1.071 12.075 -2.965 1.00 0.00 C ATOM 655 CG GLN A 43 0.127 12.729 -2.296 1.00 0.00 C ATOM 656 CD GLN A 43 0.069 12.643 -0.783 1.00 0.00 C ATOM 657 OE1 GLN A 43 0.971 11.863 -0.199 1.00 0.00 O flip ATOM 658 NE2 GLN A 43 -0.778 13.271 -0.146 1.00 0.00 N flip ATOM 0 H GLN A 43 -0.122 9.735 -1.070 1.00 0.00 H new ATOM 0 HA GLN A 43 -1.986 10.892 -1.421 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -0.855 11.939 -4.025 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -1.926 12.748 -2.898 1.00 0.00 H new ATOM 0 HG2 GLN A 43 1.041 12.251 -2.649 1.00 0.00 H new ATOM 0 HG3 GLN A 43 0.179 13.776 -2.595 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -1.452 13.859 -0.636 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -0.805 13.203 0.871 1.00 0.00 H new ATOM 667 N ILE A 44 -2.260 8.640 -3.296 1.00 0.00 N ATOM 668 CA ILE A 44 -3.081 7.798 -4.158 1.00 0.00 C ATOM 669 C ILE A 44 -4.242 7.185 -3.382 1.00 0.00 C ATOM 670 O ILE A 44 -4.082 6.684 -2.269 1.00 0.00 O ATOM 671 CB ILE A 44 -2.252 6.669 -4.797 1.00 0.00 C ATOM 672 CG1 ILE A 44 -1.054 7.249 -5.551 1.00 0.00 C ATOM 673 CG2 ILE A 44 -3.120 5.838 -5.730 1.00 0.00 C ATOM 674 CD1 ILE A 44 -0.244 6.209 -6.292 1.00 0.00 C ATOM 0 H ILE A 44 -1.611 8.127 -2.699 1.00 0.00 H new ATOM 0 HA ILE A 44 -3.473 8.440 -4.947 1.00 0.00 H new ATOM 0 HB ILE A 44 -1.879 6.020 -4.005 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -1.409 7.995 -6.262 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -0.406 7.766 -4.844 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -2.520 5.044 -6.174 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -3.943 5.399 -5.166 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -3.520 6.475 -6.519 1.00 0.00 H new ATOM 0 HD11 ILE A 44 0.589 6.693 -6.803 1.00 0.00 H new ATOM 0 HD12 ILE A 44 0.142 5.476 -5.584 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.877 5.708 -7.024 1.00 0.00 H new ATOM 686 N PRO A 45 -5.441 7.224 -3.983 1.00 0.00 N ATOM 687 CA PRO A 45 -6.653 6.674 -3.368 1.00 0.00 C ATOM 688 C PRO A 45 -6.627 5.151 -3.297 1.00 0.00 C ATOM 689 O PRO A 45 -6.363 4.478 -4.293 1.00 0.00 O ATOM 690 CB PRO A 45 -7.770 7.148 -4.301 1.00 0.00 C ATOM 691 CG PRO A 45 -7.104 7.348 -5.618 1.00 0.00 C ATOM 692 CD PRO A 45 -5.705 7.806 -5.310 1.00 0.00 C ATOM 0 HA PRO A 45 -6.773 7.004 -2.336 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -8.569 6.409 -4.369 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -8.221 8.073 -3.941 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -7.094 6.423 -6.194 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -7.635 8.090 -6.215 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -4.992 7.450 -6.054 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -5.632 8.893 -5.294 1.00 0.00 H new ATOM 700 N VAL A 46 -6.904 4.613 -2.113 1.00 0.00 N ATOM 701 CA VAL A 46 -6.915 3.169 -1.913 1.00 0.00 C ATOM 702 C VAL A 46 -7.885 2.489 -2.872 1.00 0.00 C ATOM 703 O VAL A 46 -7.830 1.275 -3.070 1.00 0.00 O ATOM 704 CB VAL A 46 -7.300 2.806 -0.467 1.00 0.00 C ATOM 705 CG1 VAL A 46 -7.277 1.298 -0.271 1.00 0.00 C ATOM 706 CG2 VAL A 46 -6.370 3.495 0.520 1.00 0.00 C ATOM 0 H VAL A 46 -7.124 5.156 -1.278 1.00 0.00 H new ATOM 0 HA VAL A 46 -5.904 2.814 -2.112 1.00 0.00 H new ATOM 0 HB VAL A 46 -8.315 3.157 -0.280 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -7.552 1.060 0.757 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -7.987 0.832 -0.954 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -6.275 0.920 -0.476 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -6.656 3.228 1.537 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -5.344 3.177 0.336 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -6.443 4.575 0.395 1.00 0.00 H new ATOM 716 N SER A 47 -8.774 3.279 -3.466 1.00 0.00 N ATOM 717 CA SER A 47 -9.760 2.752 -4.402 1.00 0.00 C ATOM 718 C SER A 47 -9.132 2.506 -5.771 1.00 0.00 C ATOM 719 O SER A 47 -9.647 1.726 -6.572 1.00 0.00 O ATOM 720 CB SER A 47 -10.937 3.721 -4.536 1.00 0.00 C ATOM 721 OG SER A 47 -11.801 3.631 -3.416 1.00 0.00 O ATOM 0 H SER A 47 -8.832 4.286 -3.316 1.00 0.00 H new ATOM 0 HA SER A 47 -10.123 1.802 -4.011 1.00 0.00 H new ATOM 0 HB2 SER A 47 -10.564 4.741 -4.630 1.00 0.00 H new ATOM 0 HB3 SER A 47 -11.493 3.499 -5.447 1.00 0.00 H new ATOM 0 HG SER A 47 -12.544 4.261 -3.525 1.00 0.00 H new ATOM 727 N LYS A 48 -8.015 3.177 -6.031 1.00 0.00 N ATOM 728 CA LYS A 48 -7.314 3.032 -7.301 1.00 0.00 C ATOM 729 C LYS A 48 -6.023 2.239 -7.122 1.00 0.00 C ATOM 730 O LYS A 48 -5.274 2.032 -8.076 1.00 0.00 O ATOM 731 CB LYS A 48 -7.002 4.407 -7.895 1.00 0.00 C ATOM 732 CG LYS A 48 -8.232 5.278 -8.091 1.00 0.00 C ATOM 733 CD LYS A 48 -8.818 5.110 -9.483 1.00 0.00 C ATOM 734 CE LYS A 48 -10.166 5.802 -9.608 1.00 0.00 C ATOM 735 NZ LYS A 48 -11.291 4.895 -9.248 1.00 0.00 N ATOM 0 H LYS A 48 -7.576 3.827 -5.379 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.963 2.486 -7.986 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -6.300 4.925 -7.241 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.504 4.274 -8.856 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -8.984 5.020 -7.345 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -7.968 6.323 -7.930 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -8.128 5.519 -10.221 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -8.931 4.049 -9.706 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -10.185 6.679 -8.961 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -10.299 6.157 -10.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -12.192 5.404 -9.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -11.288 4.070 -9.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -11.179 4.576 -8.264 1.00 0.00 H new ATOM 749 N MET A 49 -5.770 1.798 -5.894 1.00 0.00 N ATOM 750 CA MET A 49 -4.570 1.026 -5.592 1.00 0.00 C ATOM 751 C MET A 49 -4.920 -0.430 -5.303 1.00 0.00 C ATOM 752 O MET A 49 -5.934 -0.721 -4.668 1.00 0.00 O ATOM 753 CB MET A 49 -3.835 1.634 -4.396 1.00 0.00 C ATOM 754 CG MET A 49 -3.584 3.127 -4.532 1.00 0.00 C ATOM 755 SD MET A 49 -3.797 4.011 -2.974 1.00 0.00 S ATOM 756 CE MET A 49 -2.315 3.517 -2.099 1.00 0.00 C ATOM 0 H MET A 49 -6.379 1.962 -5.093 1.00 0.00 H new ATOM 0 HA MET A 49 -3.917 1.058 -6.464 1.00 0.00 H new ATOM 0 HB2 MET A 49 -4.416 1.452 -3.492 1.00 0.00 H new ATOM 0 HB3 MET A 49 -2.880 1.123 -4.269 1.00 0.00 H new ATOM 0 HG2 MET A 49 -2.572 3.289 -4.902 1.00 0.00 H new ATOM 0 HG3 MET A 49 -4.265 3.540 -5.276 1.00 0.00 H new ATOM 0 HE1 MET A 49 -1.973 4.339 -1.470 1.00 0.00 H new ATOM 0 HE2 MET A 49 -2.533 2.650 -1.476 1.00 0.00 H new ATOM 0 HE3 MET A 49 -1.536 3.261 -2.818 1.00 0.00 H new ATOM 766 N LEU A 50 -4.074 -1.341 -5.771 1.00 0.00 N ATOM 767 CA LEU A 50 -4.294 -2.768 -5.562 1.00 0.00 C ATOM 768 C LEU A 50 -3.125 -3.395 -4.809 1.00 0.00 C ATOM 769 O LEU A 50 -2.072 -3.664 -5.388 1.00 0.00 O ATOM 770 CB LEU A 50 -4.488 -3.476 -6.905 1.00 0.00 C ATOM 771 CG LEU A 50 -5.497 -2.838 -7.860 1.00 0.00 C ATOM 772 CD1 LEU A 50 -5.254 -3.310 -9.285 1.00 0.00 C ATOM 773 CD2 LEU A 50 -6.920 -3.160 -7.425 1.00 0.00 C ATOM 0 H LEU A 50 -3.230 -1.117 -6.298 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.195 -2.887 -4.961 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -3.523 -3.527 -7.409 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -4.801 -4.502 -6.710 1.00 0.00 H new ATOM 0 HG LEU A 50 -5.365 -1.756 -7.829 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -5.981 -2.846 -9.951 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -4.247 -3.029 -9.595 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -5.359 -4.394 -9.332 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -7.625 -2.698 -8.116 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.065 -4.240 -7.427 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -7.090 -2.773 -6.420 1.00 0.00 H new ATOM 785 N LEU A 51 -3.318 -3.625 -3.515 1.00 0.00 N ATOM 786 CA LEU A 51 -2.281 -4.223 -2.681 1.00 0.00 C ATOM 787 C LEU A 51 -2.055 -5.684 -3.056 1.00 0.00 C ATOM 788 O LEU A 51 -2.957 -6.513 -2.936 1.00 0.00 O ATOM 789 CB LEU A 51 -2.662 -4.116 -1.203 1.00 0.00 C ATOM 790 CG LEU A 51 -1.499 -4.089 -0.210 1.00 0.00 C ATOM 791 CD1 LEU A 51 -0.501 -5.192 -0.527 1.00 0.00 C ATOM 792 CD2 LEU A 51 -0.817 -2.729 -0.225 1.00 0.00 C ATOM 0 H LEU A 51 -4.183 -3.407 -3.020 1.00 0.00 H new ATOM 0 HA LEU A 51 -1.353 -3.677 -2.851 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -3.252 -3.210 -1.065 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -3.308 -4.958 -0.953 1.00 0.00 H new ATOM 0 HG LEU A 51 -1.896 -4.263 0.790 1.00 0.00 H new ATOM 0 HD11 LEU A 51 0.319 -5.157 0.190 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -0.997 -6.161 -0.464 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -0.109 -5.050 -1.534 1.00 0.00 H new ATOM 0 HD21 LEU A 51 0.008 -2.728 0.487 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -0.433 -2.525 -1.225 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -1.536 -1.958 0.052 1.00 0.00 H new ATOM 804 N LYS A 52 -0.845 -5.994 -3.508 1.00 0.00 N ATOM 805 CA LYS A 52 -0.498 -7.356 -3.897 1.00 0.00 C ATOM 806 C LYS A 52 0.847 -7.764 -3.306 1.00 0.00 C ATOM 807 O LYS A 52 1.512 -6.970 -2.643 1.00 0.00 O ATOM 808 CB LYS A 52 -0.455 -7.477 -5.422 1.00 0.00 C ATOM 809 CG LYS A 52 -1.829 -7.499 -6.069 1.00 0.00 C ATOM 810 CD LYS A 52 -1.773 -8.066 -7.477 1.00 0.00 C ATOM 811 CE LYS A 52 -3.046 -7.761 -8.252 1.00 0.00 C ATOM 812 NZ LYS A 52 -4.173 -8.641 -7.837 1.00 0.00 N ATOM 0 H LYS A 52 -0.087 -5.320 -3.614 1.00 0.00 H new ATOM 0 HA LYS A 52 -1.265 -8.026 -3.507 1.00 0.00 H new ATOM 0 HB2 LYS A 52 0.115 -6.642 -5.828 1.00 0.00 H new ATOM 0 HB3 LYS A 52 0.079 -8.389 -5.691 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -2.509 -8.097 -5.462 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -2.234 -6.488 -6.099 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -0.916 -7.648 -8.005 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -1.624 -9.145 -7.430 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -3.324 -6.718 -8.098 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -2.861 -7.887 -9.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -5.022 -8.401 -8.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -3.918 -9.635 -8.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -4.367 -8.502 -6.825 1.00 0.00 H new ATOM 826 N GLY A 53 1.243 -9.009 -3.553 1.00 0.00 N ATOM 827 CA GLY A 53 2.508 -9.501 -3.039 1.00 0.00 C ATOM 828 C GLY A 53 2.328 -10.512 -1.924 1.00 0.00 C ATOM 829 O GLY A 53 3.169 -11.389 -1.730 1.00 0.00 O ATOM 0 H GLY A 53 0.710 -9.686 -4.100 1.00 0.00 H new ATOM 0 HA2 GLY A 53 3.074 -9.958 -3.851 1.00 0.00 H new ATOM 0 HA3 GLY A 53 3.099 -8.662 -2.672 1.00 0.00 H new ATOM 833 N TRP A 54 1.229 -10.387 -1.187 1.00 0.00 N ATOM 834 CA TRP A 54 0.942 -11.297 -0.084 1.00 0.00 C ATOM 835 C TRP A 54 1.357 -12.722 -0.431 1.00 0.00 C ATOM 836 O TRP A 54 0.905 -13.286 -1.428 1.00 0.00 O ATOM 837 CB TRP A 54 -0.547 -11.256 0.264 1.00 0.00 C ATOM 838 CG TRP A 54 -1.014 -9.905 0.715 1.00 0.00 C ATOM 839 CD1 TRP A 54 -1.872 -9.072 0.055 1.00 0.00 C ATOM 840 CD2 TRP A 54 -0.649 -9.231 1.924 1.00 0.00 C ATOM 841 NE1 TRP A 54 -2.061 -7.921 0.780 1.00 0.00 N ATOM 842 CE2 TRP A 54 -1.322 -7.994 1.932 1.00 0.00 C ATOM 843 CE3 TRP A 54 0.180 -9.553 3.002 1.00 0.00 C ATOM 844 CZ2 TRP A 54 -1.190 -7.081 2.975 1.00 0.00 C ATOM 845 CZ3 TRP A 54 0.311 -8.646 4.036 1.00 0.00 C ATOM 846 CH2 TRP A 54 -0.372 -7.423 4.017 1.00 0.00 C ATOM 0 H TRP A 54 0.523 -9.665 -1.333 1.00 0.00 H new ATOM 0 HA TRP A 54 1.519 -10.972 0.782 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -1.125 -11.560 -0.608 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -0.749 -11.984 1.050 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -2.334 -9.287 -0.897 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -2.655 -7.139 0.506 1.00 0.00 H new ATOM 0 HE3 TRP A 54 0.709 -10.494 3.026 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -1.714 -6.137 2.962 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 0.951 -8.884 4.873 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -0.250 -6.736 4.842 1.00 0.00 H new ATOM 857 N LYS A 55 2.219 -13.302 0.397 1.00 0.00 N ATOM 858 CA LYS A 55 2.694 -14.663 0.179 1.00 0.00 C ATOM 859 C LYS A 55 1.524 -15.625 0.003 1.00 0.00 C ATOM 860 O LYS A 55 1.585 -16.551 -0.807 1.00 0.00 O ATOM 861 CB LYS A 55 3.568 -15.114 1.351 1.00 0.00 C ATOM 862 CG LYS A 55 4.563 -16.202 0.985 1.00 0.00 C ATOM 863 CD LYS A 55 5.919 -15.618 0.625 1.00 0.00 C ATOM 864 CE LYS A 55 6.042 -15.377 -0.872 1.00 0.00 C ATOM 865 NZ LYS A 55 6.064 -16.653 -1.640 1.00 0.00 N ATOM 0 H LYS A 55 2.603 -12.850 1.227 1.00 0.00 H new ATOM 0 HA LYS A 55 3.289 -14.672 -0.734 1.00 0.00 H new ATOM 0 HB2 LYS A 55 4.111 -14.253 1.741 1.00 0.00 H new ATOM 0 HB3 LYS A 55 2.926 -15.476 2.154 1.00 0.00 H new ATOM 0 HG2 LYS A 55 4.673 -16.892 1.822 1.00 0.00 H new ATOM 0 HG3 LYS A 55 4.179 -16.779 0.144 1.00 0.00 H new ATOM 0 HD2 LYS A 55 6.065 -14.679 1.159 1.00 0.00 H new ATOM 0 HD3 LYS A 55 6.707 -16.297 0.951 1.00 0.00 H new ATOM 0 HE2 LYS A 55 5.207 -14.764 -1.211 1.00 0.00 H new ATOM 0 HE3 LYS A 55 6.953 -14.815 -1.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 6.539 -16.501 -2.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 6.579 -17.376 -1.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 5.089 -16.975 -1.807 1.00 0.00 H new ATOM 879 N THR A 56 0.459 -15.401 0.765 1.00 0.00 N ATOM 880 CA THR A 56 -0.725 -16.248 0.693 1.00 0.00 C ATOM 881 C THR A 56 -1.538 -15.951 -0.562 1.00 0.00 C ATOM 882 O THR A 56 -1.543 -14.825 -1.058 1.00 0.00 O ATOM 883 CB THR A 56 -1.625 -16.062 1.930 1.00 0.00 C ATOM 884 OG1 THR A 56 -2.117 -14.719 1.981 1.00 0.00 O ATOM 885 CG2 THR A 56 -0.860 -16.377 3.207 1.00 0.00 C ATOM 0 H THR A 56 0.392 -14.639 1.440 1.00 0.00 H new ATOM 0 HA THR A 56 -0.374 -17.279 0.660 1.00 0.00 H new ATOM 0 HB THR A 56 -2.465 -16.752 1.848 1.00 0.00 H new ATOM 0 HG1 THR A 56 -3.055 -14.725 2.266 1.00 0.00 H new ATOM 0 HG21 THR A 56 -1.515 -16.239 4.067 1.00 0.00 H new ATOM 0 HG22 THR A 56 -0.513 -17.410 3.178 1.00 0.00 H new ATOM 0 HG23 THR A 56 -0.003 -15.708 3.292 1.00 0.00 H new ATOM 893 N GLY A 57 -2.225 -16.969 -1.071 1.00 0.00 N ATOM 894 CA GLY A 57 -3.033 -16.795 -2.264 1.00 0.00 C ATOM 895 C GLY A 57 -3.667 -15.420 -2.340 1.00 0.00 C ATOM 896 O GLY A 57 -3.701 -14.803 -3.405 1.00 0.00 O ATOM 0 H GLY A 57 -2.237 -17.911 -0.679 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -2.412 -16.955 -3.146 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -3.815 -17.554 -2.283 1.00 0.00 H new ATOM 900 N ASP A 58 -4.171 -14.939 -1.209 1.00 0.00 N ATOM 901 CA ASP A 58 -4.808 -13.629 -1.152 1.00 0.00 C ATOM 902 C ASP A 58 -5.053 -13.206 0.293 1.00 0.00 C ATOM 903 O ASP A 58 -5.339 -14.038 1.154 1.00 0.00 O ATOM 904 CB ASP A 58 -6.129 -13.645 -1.923 1.00 0.00 C ATOM 905 CG ASP A 58 -5.933 -13.435 -3.412 1.00 0.00 C ATOM 906 OD1 ASP A 58 -5.616 -12.296 -3.813 1.00 0.00 O ATOM 907 OD2 ASP A 58 -6.097 -14.409 -4.176 1.00 0.00 O ATOM 0 H ASP A 58 -4.151 -15.437 -0.319 1.00 0.00 H new ATOM 0 HA ASP A 58 -4.136 -12.906 -1.614 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -6.632 -14.598 -1.756 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -6.784 -12.866 -1.532 1.00 0.00 H new ATOM 912 N VAL A 59 -4.939 -11.907 0.552 1.00 0.00 N ATOM 913 CA VAL A 59 -5.149 -11.374 1.893 1.00 0.00 C ATOM 914 C VAL A 59 -6.229 -10.298 1.894 1.00 0.00 C ATOM 915 O VAL A 59 -6.177 -9.352 1.108 1.00 0.00 O ATOM 916 CB VAL A 59 -3.850 -10.782 2.470 1.00 0.00 C ATOM 917 CG1 VAL A 59 -4.074 -10.285 3.891 1.00 0.00 C ATOM 918 CG2 VAL A 59 -2.730 -11.811 2.427 1.00 0.00 C ATOM 0 H VAL A 59 -4.702 -11.205 -0.149 1.00 0.00 H new ATOM 0 HA VAL A 59 -5.470 -12.207 2.518 1.00 0.00 H new ATOM 0 HB VAL A 59 -3.555 -9.932 1.855 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -3.145 -9.870 4.282 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -4.844 -9.513 3.889 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -4.394 -11.115 4.521 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -1.820 -11.375 2.839 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -3.014 -12.683 3.017 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -2.553 -12.113 1.395 1.00 0.00 H new ATOM 928 N GLU A 60 -7.207 -10.451 2.781 1.00 0.00 N ATOM 929 CA GLU A 60 -8.301 -9.492 2.883 1.00 0.00 C ATOM 930 C GLU A 60 -7.976 -8.403 3.901 1.00 0.00 C ATOM 931 O GLU A 60 -7.325 -8.659 4.914 1.00 0.00 O ATOM 932 CB GLU A 60 -9.597 -10.203 3.277 1.00 0.00 C ATOM 933 CG GLU A 60 -9.472 -11.044 4.536 1.00 0.00 C ATOM 934 CD GLU A 60 -10.786 -11.677 4.948 1.00 0.00 C ATOM 935 OE1 GLU A 60 -11.808 -10.960 4.978 1.00 0.00 O ATOM 936 OE2 GLU A 60 -10.793 -12.892 5.240 1.00 0.00 O ATOM 0 H GLU A 60 -7.264 -11.229 3.439 1.00 0.00 H new ATOM 0 HA GLU A 60 -8.433 -9.025 1.907 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -10.380 -9.459 3.424 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -9.916 -10.842 2.454 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -8.731 -11.827 4.373 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -9.103 -10.420 5.350 1.00 0.00 H new ATOM 943 N ASP A 61 -8.434 -7.187 3.624 1.00 0.00 N ATOM 944 CA ASP A 61 -8.193 -6.058 4.515 1.00 0.00 C ATOM 945 C ASP A 61 -8.669 -6.371 5.930 1.00 0.00 C ATOM 946 O ASP A 61 -8.288 -5.697 6.887 1.00 0.00 O ATOM 947 CB ASP A 61 -8.901 -4.807 3.991 1.00 0.00 C ATOM 948 CG ASP A 61 -10.411 -4.939 4.024 1.00 0.00 C ATOM 949 OD1 ASP A 61 -10.949 -5.785 3.279 1.00 0.00 O ATOM 950 OD2 ASP A 61 -11.054 -4.198 4.796 1.00 0.00 O ATOM 0 H ASP A 61 -8.974 -6.958 2.790 1.00 0.00 H new ATOM 0 HA ASP A 61 -7.119 -5.873 4.545 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -8.601 -3.946 4.589 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -8.579 -4.612 2.968 1.00 0.00 H new ATOM 955 N SER A 62 -9.503 -7.398 6.055 1.00 0.00 N ATOM 956 CA SER A 62 -10.035 -7.798 7.353 1.00 0.00 C ATOM 957 C SER A 62 -9.036 -8.674 8.102 1.00 0.00 C ATOM 958 O SER A 62 -9.330 -9.188 9.182 1.00 0.00 O ATOM 959 CB SER A 62 -11.357 -8.548 7.177 1.00 0.00 C ATOM 960 OG SER A 62 -12.408 -7.658 6.844 1.00 0.00 O ATOM 0 H SER A 62 -9.825 -7.969 5.273 1.00 0.00 H new ATOM 0 HA SER A 62 -10.213 -6.896 7.939 1.00 0.00 H new ATOM 0 HB2 SER A 62 -11.251 -9.299 6.395 1.00 0.00 H new ATOM 0 HB3 SER A 62 -11.603 -9.078 8.097 1.00 0.00 H new ATOM 0 HG SER A 62 -13.241 -8.162 6.735 1.00 0.00 H new ATOM 966 N THR A 63 -7.851 -8.840 7.522 1.00 0.00 N ATOM 967 CA THR A 63 -6.808 -9.654 8.133 1.00 0.00 C ATOM 968 C THR A 63 -5.743 -8.782 8.788 1.00 0.00 C ATOM 969 O THR A 63 -5.433 -7.693 8.303 1.00 0.00 O ATOM 970 CB THR A 63 -6.136 -10.575 7.098 1.00 0.00 C ATOM 971 OG1 THR A 63 -7.130 -11.325 6.391 1.00 0.00 O ATOM 972 CG2 THR A 63 -5.160 -11.526 7.773 1.00 0.00 C ATOM 0 H THR A 63 -7.590 -8.421 6.629 1.00 0.00 H new ATOM 0 HA THR A 63 -7.291 -10.267 8.894 1.00 0.00 H new ATOM 0 HB THR A 63 -5.583 -9.952 6.395 1.00 0.00 H new ATOM 0 HG1 THR A 63 -6.695 -11.907 5.734 1.00 0.00 H new ATOM 0 HG21 THR A 63 -4.698 -12.167 7.022 1.00 0.00 H new ATOM 0 HG22 THR A 63 -4.388 -10.952 8.285 1.00 0.00 H new ATOM 0 HG23 THR A 63 -5.694 -12.142 8.496 1.00 0.00 H new ATOM 980 N VAL A 64 -5.186 -9.266 9.893 1.00 0.00 N ATOM 981 CA VAL A 64 -4.153 -8.532 10.614 1.00 0.00 C ATOM 982 C VAL A 64 -2.764 -9.061 10.276 1.00 0.00 C ATOM 983 O VAL A 64 -2.602 -10.231 9.927 1.00 0.00 O ATOM 984 CB VAL A 64 -4.366 -8.614 12.137 1.00 0.00 C ATOM 985 CG1 VAL A 64 -4.249 -10.053 12.616 1.00 0.00 C ATOM 986 CG2 VAL A 64 -3.371 -7.720 12.863 1.00 0.00 C ATOM 0 H VAL A 64 -5.433 -10.164 10.309 1.00 0.00 H new ATOM 0 HA VAL A 64 -4.227 -7.491 10.300 1.00 0.00 H new ATOM 0 HB VAL A 64 -5.372 -8.261 12.365 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -4.402 -10.091 13.694 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -5.003 -10.664 12.120 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -3.257 -10.437 12.377 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -3.536 -7.790 13.938 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -2.356 -8.041 12.630 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -3.508 -6.687 12.542 1.00 0.00 H new ATOM 996 N LEU A 65 -1.764 -8.193 10.382 1.00 0.00 N ATOM 997 CA LEU A 65 -0.387 -8.573 10.089 1.00 0.00 C ATOM 998 C LEU A 65 0.060 -9.730 10.977 1.00 0.00 C ATOM 999 O LEU A 65 0.506 -10.768 10.487 1.00 0.00 O ATOM 1000 CB LEU A 65 0.546 -7.377 10.283 1.00 0.00 C ATOM 1001 CG LEU A 65 0.135 -6.084 9.578 1.00 0.00 C ATOM 1002 CD1 LEU A 65 0.619 -4.872 10.359 1.00 0.00 C ATOM 1003 CD2 LEU A 65 0.678 -6.056 8.156 1.00 0.00 C ATOM 0 H LEU A 65 -1.881 -7.221 10.669 1.00 0.00 H new ATOM 0 HA LEU A 65 -0.340 -8.898 9.050 1.00 0.00 H new ATOM 0 HB2 LEU A 65 0.628 -7.175 11.351 1.00 0.00 H new ATOM 0 HB3 LEU A 65 1.540 -7.657 9.935 1.00 0.00 H new ATOM 0 HG LEU A 65 -0.953 -6.049 9.531 1.00 0.00 H new ATOM 0 HD11 LEU A 65 0.317 -3.961 9.842 1.00 0.00 H new ATOM 0 HD12 LEU A 65 0.182 -4.884 11.357 1.00 0.00 H new ATOM 0 HD13 LEU A 65 1.706 -4.901 10.439 1.00 0.00 H new ATOM 0 HD21 LEU A 65 0.376 -5.129 7.669 1.00 0.00 H new ATOM 0 HD22 LEU A 65 1.766 -6.115 8.181 1.00 0.00 H new ATOM 0 HD23 LEU A 65 0.281 -6.904 7.598 1.00 0.00 H new ATOM 1015 N LYS A 66 -0.064 -9.546 12.287 1.00 0.00 N ATOM 1016 CA LYS A 66 0.323 -10.574 13.245 1.00 0.00 C ATOM 1017 C LYS A 66 -0.201 -11.941 12.818 1.00 0.00 C ATOM 1018 O LYS A 66 0.319 -12.975 13.237 1.00 0.00 O ATOM 1019 CB LYS A 66 -0.205 -10.227 14.639 1.00 0.00 C ATOM 1020 CG LYS A 66 -1.621 -10.713 14.891 1.00 0.00 C ATOM 1021 CD LYS A 66 -2.127 -10.273 16.255 1.00 0.00 C ATOM 1022 CE LYS A 66 -2.050 -8.763 16.418 1.00 0.00 C ATOM 1023 NZ LYS A 66 -0.698 -8.321 16.859 1.00 0.00 N ATOM 0 H LYS A 66 -0.430 -8.693 12.710 1.00 0.00 H new ATOM 0 HA LYS A 66 1.412 -10.615 13.275 1.00 0.00 H new ATOM 0 HB2 LYS A 66 0.458 -10.661 15.388 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -0.172 -9.146 14.772 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -2.282 -10.328 14.115 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -1.651 -11.801 14.824 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -3.158 -10.602 16.385 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -1.538 -10.755 17.035 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -2.298 -8.282 15.472 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -2.794 -8.438 17.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -0.770 -7.857 17.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -0.070 -9.146 16.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -0.309 -7.650 16.166 1.00 0.00 H new ATOM 1037 N SER A 67 -1.233 -11.939 11.980 1.00 0.00 N ATOM 1038 CA SER A 67 -1.829 -13.179 11.498 1.00 0.00 C ATOM 1039 C SER A 67 -0.915 -13.864 10.487 1.00 0.00 C ATOM 1040 O SER A 67 -0.649 -15.063 10.585 1.00 0.00 O ATOM 1041 CB SER A 67 -3.193 -12.901 10.862 1.00 0.00 C ATOM 1042 OG SER A 67 -3.993 -14.070 10.840 1.00 0.00 O ATOM 0 H SER A 67 -1.674 -11.092 11.621 1.00 0.00 H new ATOM 0 HA SER A 67 -1.962 -13.844 12.351 1.00 0.00 H new ATOM 0 HB2 SER A 67 -3.705 -12.117 11.420 1.00 0.00 H new ATOM 0 HB3 SER A 67 -3.055 -12.531 9.846 1.00 0.00 H new ATOM 0 HG SER A 67 -4.860 -13.866 10.431 1.00 0.00 H new ATOM 1048 N LEU A 68 -0.436 -13.094 9.515 1.00 0.00 N ATOM 1049 CA LEU A 68 0.449 -13.625 8.485 1.00 0.00 C ATOM 1050 C LEU A 68 1.871 -13.780 9.015 1.00 0.00 C ATOM 1051 O LEU A 68 2.641 -14.608 8.526 1.00 0.00 O ATOM 1052 CB LEU A 68 0.447 -12.708 7.260 1.00 0.00 C ATOM 1053 CG LEU A 68 -0.880 -12.595 6.509 1.00 0.00 C ATOM 1054 CD1 LEU A 68 -0.843 -11.430 5.533 1.00 0.00 C ATOM 1055 CD2 LEU A 68 -1.193 -13.894 5.781 1.00 0.00 C ATOM 0 H LEU A 68 -0.646 -12.100 9.419 1.00 0.00 H new ATOM 0 HA LEU A 68 0.079 -14.609 8.196 1.00 0.00 H new ATOM 0 HB2 LEU A 68 0.748 -11.710 7.578 1.00 0.00 H new ATOM 0 HB3 LEU A 68 1.207 -13.063 6.564 1.00 0.00 H new ATOM 0 HG LEU A 68 -1.672 -12.409 7.235 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -1.796 -11.365 5.008 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -0.666 -10.503 6.079 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.041 -11.585 4.812 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -2.141 -13.795 5.252 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.399 -14.111 5.066 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -1.263 -14.708 6.503 1.00 0.00 H new ATOM 1067 N HIS A 69 2.213 -12.980 10.020 1.00 0.00 N ATOM 1068 CA HIS A 69 3.542 -13.030 10.619 1.00 0.00 C ATOM 1069 C HIS A 69 4.616 -12.697 9.588 1.00 0.00 C ATOM 1070 O HIS A 69 5.555 -13.466 9.384 1.00 0.00 O ATOM 1071 CB HIS A 69 3.803 -14.413 11.216 1.00 0.00 C ATOM 1072 CG HIS A 69 2.994 -14.698 12.444 1.00 0.00 C ATOM 1073 ND1 HIS A 69 3.199 -14.055 13.646 1.00 0.00 N ATOM 1074 CD2 HIS A 69 1.973 -15.562 12.650 1.00 0.00 C ATOM 1075 CE1 HIS A 69 2.340 -14.512 14.540 1.00 0.00 C ATOM 1076 NE2 HIS A 69 1.585 -15.428 13.961 1.00 0.00 N ATOM 0 H HIS A 69 1.588 -12.290 10.437 1.00 0.00 H new ATOM 0 HA HIS A 69 3.584 -12.285 11.414 1.00 0.00 H new ATOM 0 HB2 HIS A 69 3.586 -15.171 10.464 1.00 0.00 H new ATOM 0 HB3 HIS A 69 4.862 -14.500 11.460 1.00 0.00 H new ATOM 0 HD2 HIS A 69 1.543 -16.232 11.920 1.00 0.00 H new ATOM 0 HE1 HIS A 69 2.268 -14.191 15.569 1.00 0.00 H new ATOM 0 HE2 HIS A 69 0.835 -15.951 14.414 1.00 0.00 H new ATOM 1085 N LEU A 70 4.471 -11.546 8.941 1.00 0.00 N ATOM 1086 CA LEU A 70 5.428 -11.110 7.930 1.00 0.00 C ATOM 1087 C LEU A 70 6.838 -11.047 8.507 1.00 0.00 C ATOM 1088 O LEU A 70 7.042 -10.729 9.679 1.00 0.00 O ATOM 1089 CB LEU A 70 5.029 -9.741 7.377 1.00 0.00 C ATOM 1090 CG LEU A 70 3.817 -9.721 6.444 1.00 0.00 C ATOM 1091 CD1 LEU A 70 4.096 -10.533 5.189 1.00 0.00 C ATOM 1092 CD2 LEU A 70 2.583 -10.250 7.161 1.00 0.00 C ATOM 0 H LEU A 70 3.700 -10.897 9.098 1.00 0.00 H new ATOM 0 HA LEU A 70 5.419 -11.838 7.119 1.00 0.00 H new ATOM 0 HB2 LEU A 70 4.826 -9.077 8.217 1.00 0.00 H new ATOM 0 HB3 LEU A 70 5.882 -9.325 6.841 1.00 0.00 H new ATOM 0 HG LEU A 70 3.627 -8.689 6.149 1.00 0.00 H new ATOM 0 HD11 LEU A 70 3.223 -10.507 4.537 1.00 0.00 H new ATOM 0 HD12 LEU A 70 4.953 -10.110 4.665 1.00 0.00 H new ATOM 0 HD13 LEU A 70 4.313 -11.565 5.464 1.00 0.00 H new ATOM 0 HD21 LEU A 70 1.731 -10.228 6.482 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.762 -11.275 7.486 1.00 0.00 H new ATOM 0 HD23 LEU A 70 2.371 -9.626 8.029 1.00 0.00 H new ATOM 1104 N PRO A 71 7.837 -11.354 7.665 1.00 0.00 N ATOM 1105 CA PRO A 71 9.246 -11.337 8.069 1.00 0.00 C ATOM 1106 C PRO A 71 9.760 -9.923 8.318 1.00 0.00 C ATOM 1107 O PRO A 71 9.161 -8.945 7.871 1.00 0.00 O ATOM 1108 CB PRO A 71 9.965 -11.964 6.872 1.00 0.00 C ATOM 1109 CG PRO A 71 9.068 -11.703 5.712 1.00 0.00 C ATOM 1110 CD PRO A 71 7.667 -11.742 6.255 1.00 0.00 C ATOM 0 HA PRO A 71 9.408 -11.868 9.007 1.00 0.00 H new ATOM 0 HB2 PRO A 71 10.947 -11.516 6.721 1.00 0.00 H new ATOM 0 HB3 PRO A 71 10.121 -13.033 7.019 1.00 0.00 H new ATOM 0 HG2 PRO A 71 9.285 -10.735 5.261 1.00 0.00 H new ATOM 0 HG3 PRO A 71 9.206 -12.455 4.935 1.00 0.00 H new ATOM 0 HD2 PRO A 71 7.011 -11.052 5.725 1.00 0.00 H new ATOM 0 HD3 PRO A 71 7.227 -12.735 6.162 1.00 0.00 H new ATOM 1118 N LYS A 72 10.874 -9.821 9.035 1.00 0.00 N ATOM 1119 CA LYS A 72 11.471 -8.527 9.343 1.00 0.00 C ATOM 1120 C LYS A 72 11.468 -7.621 8.116 1.00 0.00 C ATOM 1121 O LYS A 72 10.966 -6.499 8.164 1.00 0.00 O ATOM 1122 CB LYS A 72 12.903 -8.711 9.851 1.00 0.00 C ATOM 1123 CG LYS A 72 13.609 -7.403 10.166 1.00 0.00 C ATOM 1124 CD LYS A 72 14.634 -7.576 11.274 1.00 0.00 C ATOM 1125 CE LYS A 72 15.987 -7.999 10.721 1.00 0.00 C ATOM 1126 NZ LYS A 72 16.604 -6.930 9.888 1.00 0.00 N ATOM 0 H LYS A 72 11.382 -10.620 9.414 1.00 0.00 H new ATOM 0 HA LYS A 72 10.873 -8.055 10.123 1.00 0.00 H new ATOM 0 HB2 LYS A 72 12.885 -9.330 10.748 1.00 0.00 H new ATOM 0 HB3 LYS A 72 13.479 -9.254 9.101 1.00 0.00 H new ATOM 0 HG2 LYS A 72 14.102 -7.029 9.268 1.00 0.00 H new ATOM 0 HG3 LYS A 72 12.875 -6.654 10.462 1.00 0.00 H new ATOM 0 HD2 LYS A 72 14.740 -6.640 11.822 1.00 0.00 H new ATOM 0 HD3 LYS A 72 14.281 -8.323 11.985 1.00 0.00 H new ATOM 0 HE2 LYS A 72 16.655 -8.248 11.546 1.00 0.00 H new ATOM 0 HE3 LYS A 72 15.869 -8.903 10.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 17.634 -7.068 9.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 16.217 -6.974 8.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 16.393 -6.000 10.304 1.00 0.00 H new ATOM 1140 N ASN A 73 12.030 -8.116 7.019 1.00 0.00 N ATOM 1141 CA ASN A 73 12.090 -7.351 5.779 1.00 0.00 C ATOM 1142 C ASN A 73 10.999 -7.797 4.810 1.00 0.00 C ATOM 1143 O ASN A 73 10.921 -8.968 4.444 1.00 0.00 O ATOM 1144 CB ASN A 73 13.464 -7.508 5.124 1.00 0.00 C ATOM 1145 CG ASN A 73 13.650 -8.873 4.491 1.00 0.00 C ATOM 1146 OD1 ASN A 73 13.404 -9.901 5.122 1.00 0.00 O ATOM 1147 ND2 ASN A 73 14.087 -8.889 3.237 1.00 0.00 N ATOM 0 H ASN A 73 12.451 -9.044 6.963 1.00 0.00 H new ATOM 0 HA ASN A 73 11.928 -6.301 6.022 1.00 0.00 H new ATOM 0 HB2 ASN A 73 13.591 -6.738 4.364 1.00 0.00 H new ATOM 0 HB3 ASN A 73 14.240 -7.349 5.872 1.00 0.00 H new ATOM 0 HD21 ASN A 73 14.231 -9.778 2.759 1.00 0.00 H new ATOM 0 HD22 ASN A 73 14.278 -8.012 2.752 1.00 0.00 H new ATOM 1154 N ASN A 74 10.159 -6.852 4.399 1.00 0.00 N ATOM 1155 CA ASN A 74 9.072 -7.148 3.472 1.00 0.00 C ATOM 1156 C ASN A 74 9.227 -6.351 2.180 1.00 0.00 C ATOM 1157 O ASN A 74 9.897 -5.319 2.152 1.00 0.00 O ATOM 1158 CB ASN A 74 7.722 -6.833 4.120 1.00 0.00 C ATOM 1159 CG ASN A 74 7.350 -7.835 5.196 1.00 0.00 C ATOM 1160 OD1 ASN A 74 6.874 -8.932 4.901 1.00 0.00 O ATOM 1161 ND2 ASN A 74 7.565 -7.461 6.452 1.00 0.00 N ATOM 0 H ASN A 74 10.210 -5.876 4.693 1.00 0.00 H new ATOM 0 HA ASN A 74 9.113 -8.210 3.230 1.00 0.00 H new ATOM 0 HB2 ASN A 74 7.754 -5.833 4.554 1.00 0.00 H new ATOM 0 HB3 ASN A 74 6.947 -6.823 3.353 1.00 0.00 H new ATOM 0 HD21 ASN A 74 7.334 -8.093 7.219 1.00 0.00 H new ATOM 0 HD22 ASN A 74 7.961 -6.542 6.650 1.00 0.00 H new ATOM 1168 N SER A 75 8.602 -6.837 1.113 1.00 0.00 N ATOM 1169 CA SER A 75 8.672 -6.173 -0.183 1.00 0.00 C ATOM 1170 C SER A 75 7.350 -6.302 -0.933 1.00 0.00 C ATOM 1171 O SER A 75 7.022 -7.367 -1.459 1.00 0.00 O ATOM 1172 CB SER A 75 9.807 -6.763 -1.022 1.00 0.00 C ATOM 1173 OG SER A 75 9.622 -8.154 -1.223 1.00 0.00 O ATOM 0 H SER A 75 8.041 -7.689 1.120 1.00 0.00 H new ATOM 0 HA SER A 75 8.869 -5.115 -0.010 1.00 0.00 H new ATOM 0 HB2 SER A 75 9.853 -6.256 -1.986 1.00 0.00 H new ATOM 0 HB3 SER A 75 10.761 -6.588 -0.524 1.00 0.00 H new ATOM 0 HG SER A 75 8.663 -8.357 -1.240 1.00 0.00 H new ATOM 1179 N LEU A 76 6.593 -5.211 -0.978 1.00 0.00 N ATOM 1180 CA LEU A 76 5.305 -5.201 -1.663 1.00 0.00 C ATOM 1181 C LEU A 76 5.352 -4.307 -2.898 1.00 0.00 C ATOM 1182 O LEU A 76 6.381 -3.700 -3.198 1.00 0.00 O ATOM 1183 CB LEU A 76 4.205 -4.723 -0.715 1.00 0.00 C ATOM 1184 CG LEU A 76 3.775 -5.713 0.369 1.00 0.00 C ATOM 1185 CD1 LEU A 76 2.940 -5.013 1.430 1.00 0.00 C ATOM 1186 CD2 LEU A 76 3.000 -6.870 -0.244 1.00 0.00 C ATOM 0 H LEU A 76 6.849 -4.322 -0.548 1.00 0.00 H new ATOM 0 HA LEU A 76 5.083 -6.219 -1.983 1.00 0.00 H new ATOM 0 HB2 LEU A 76 4.544 -3.808 -0.229 1.00 0.00 H new ATOM 0 HB3 LEU A 76 3.329 -4.463 -1.309 1.00 0.00 H new ATOM 0 HG LEU A 76 4.670 -6.113 0.846 1.00 0.00 H new ATOM 0 HD11 LEU A 76 2.643 -5.733 2.193 1.00 0.00 H new ATOM 0 HD12 LEU A 76 3.528 -4.219 1.890 1.00 0.00 H new ATOM 0 HD13 LEU A 76 2.050 -4.585 0.969 1.00 0.00 H new ATOM 0 HD21 LEU A 76 2.702 -7.565 0.541 1.00 0.00 H new ATOM 0 HD22 LEU A 76 2.112 -6.487 -0.746 1.00 0.00 H new ATOM 0 HD23 LEU A 76 3.631 -7.388 -0.967 1.00 0.00 H new ATOM 1198 N TYR A 77 4.233 -4.229 -3.608 1.00 0.00 N ATOM 1199 CA TYR A 77 4.146 -3.409 -4.811 1.00 0.00 C ATOM 1200 C TYR A 77 2.705 -2.985 -5.078 1.00 0.00 C ATOM 1201 O TYR A 77 1.767 -3.742 -4.831 1.00 0.00 O ATOM 1202 CB TYR A 77 4.697 -4.174 -6.016 1.00 0.00 C ATOM 1203 CG TYR A 77 4.059 -5.531 -6.214 1.00 0.00 C ATOM 1204 CD1 TYR A 77 4.409 -6.608 -5.409 1.00 0.00 C ATOM 1205 CD2 TYR A 77 3.109 -5.736 -7.207 1.00 0.00 C ATOM 1206 CE1 TYR A 77 3.830 -7.850 -5.587 1.00 0.00 C ATOM 1207 CE2 TYR A 77 2.524 -6.973 -7.391 1.00 0.00 C ATOM 1208 CZ TYR A 77 2.888 -8.027 -6.579 1.00 0.00 C ATOM 1209 OH TYR A 77 2.308 -9.262 -6.760 1.00 0.00 O ATOM 0 H TYR A 77 3.373 -4.724 -3.372 1.00 0.00 H new ATOM 0 HA TYR A 77 4.746 -2.513 -4.654 1.00 0.00 H new ATOM 0 HB2 TYR A 77 4.547 -3.576 -6.915 1.00 0.00 H new ATOM 0 HB3 TYR A 77 5.773 -4.302 -5.894 1.00 0.00 H new ATOM 0 HD1 TYR A 77 5.146 -6.472 -4.631 1.00 0.00 H new ATOM 0 HD2 TYR A 77 2.823 -4.914 -7.846 1.00 0.00 H new ATOM 0 HE1 TYR A 77 4.113 -8.677 -4.953 1.00 0.00 H new ATOM 0 HE2 TYR A 77 1.786 -7.115 -8.166 1.00 0.00 H new ATOM 0 HH TYR A 77 1.665 -9.217 -7.498 1.00 0.00 H new ATOM 1219 N VAL A 78 2.538 -1.768 -5.587 1.00 0.00 N ATOM 1220 CA VAL A 78 1.213 -1.242 -5.890 1.00 0.00 C ATOM 1221 C VAL A 78 0.976 -1.186 -7.395 1.00 0.00 C ATOM 1222 O VAL A 78 1.822 -0.707 -8.151 1.00 0.00 O ATOM 1223 CB VAL A 78 1.019 0.167 -5.298 1.00 0.00 C ATOM 1224 CG1 VAL A 78 -0.183 0.852 -5.931 1.00 0.00 C ATOM 1225 CG2 VAL A 78 0.867 0.093 -3.787 1.00 0.00 C ATOM 0 H VAL A 78 3.304 -1.128 -5.798 1.00 0.00 H new ATOM 0 HA VAL A 78 0.491 -1.921 -5.436 1.00 0.00 H new ATOM 0 HB VAL A 78 1.905 0.762 -5.522 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -0.304 1.846 -5.500 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -0.028 0.939 -7.006 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -1.080 0.262 -5.741 1.00 0.00 H new ATOM 0 HG21 VAL A 78 0.731 1.097 -3.385 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -0.001 -0.518 -3.538 1.00 0.00 H new ATOM 0 HG23 VAL A 78 1.762 -0.353 -3.353 1.00 0.00 H new ATOM 1235 N LEU A 79 -0.181 -1.677 -7.824 1.00 0.00 N ATOM 1236 CA LEU A 79 -0.532 -1.683 -9.241 1.00 0.00 C ATOM 1237 C LEU A 79 -1.772 -0.833 -9.498 1.00 0.00 C ATOM 1238 O LEU A 79 -2.891 -1.232 -9.172 1.00 0.00 O ATOM 1239 CB LEU A 79 -0.772 -3.115 -9.721 1.00 0.00 C ATOM 1240 CG LEU A 79 0.368 -4.105 -9.478 1.00 0.00 C ATOM 1241 CD1 LEU A 79 -0.168 -5.525 -9.387 1.00 0.00 C ATOM 1242 CD2 LEU A 79 1.412 -3.996 -10.579 1.00 0.00 C ATOM 0 H LEU A 79 -0.892 -2.076 -7.212 1.00 0.00 H new ATOM 0 HA LEU A 79 0.301 -1.255 -9.799 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -1.668 -3.496 -9.230 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -0.981 -3.088 -10.790 1.00 0.00 H new ATOM 0 HG LEU A 79 0.843 -3.857 -8.529 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.658 -6.215 -9.214 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.877 -5.594 -8.562 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -0.669 -5.785 -10.319 1.00 0.00 H new ATOM 0 HD21 LEU A 79 2.216 -4.708 -10.390 1.00 0.00 H new ATOM 0 HD22 LEU A 79 0.950 -4.217 -11.541 1.00 0.00 H new ATOM 0 HD23 LEU A 79 1.819 -2.985 -10.596 1.00 0.00 H new ATOM 1254 N THR A 80 -1.568 0.341 -10.088 1.00 0.00 N ATOM 1255 CA THR A 80 -2.669 1.246 -10.390 1.00 0.00 C ATOM 1256 C THR A 80 -3.016 1.212 -11.874 1.00 0.00 C ATOM 1257 O THR A 80 -2.420 1.913 -12.692 1.00 0.00 O ATOM 1258 CB THR A 80 -2.333 2.694 -9.986 1.00 0.00 C ATOM 1259 OG1 THR A 80 -1.368 3.244 -10.891 1.00 0.00 O ATOM 1260 CG2 THR A 80 -1.791 2.748 -8.566 1.00 0.00 C ATOM 0 H THR A 80 -0.650 0.687 -10.366 1.00 0.00 H new ATOM 0 HA THR A 80 -3.527 0.905 -9.811 1.00 0.00 H new ATOM 0 HB THR A 80 -3.250 3.282 -10.031 1.00 0.00 H new ATOM 0 HG1 THR A 80 -1.739 3.254 -11.798 1.00 0.00 H new ATOM 0 HG21 THR A 80 -1.561 3.781 -8.303 1.00 0.00 H new ATOM 0 HG22 THR A 80 -2.538 2.356 -7.876 1.00 0.00 H new ATOM 0 HG23 THR A 80 -0.885 2.146 -8.499 1.00 0.00 H new ATOM 1268 N PRO A 81 -4.005 0.379 -12.232 1.00 0.00 N ATOM 1269 CA PRO A 81 -4.455 0.236 -13.620 1.00 0.00 C ATOM 1270 C PRO A 81 -5.185 1.476 -14.124 1.00 0.00 C ATOM 1271 O PRO A 81 -4.875 1.998 -15.195 1.00 0.00 O ATOM 1272 CB PRO A 81 -5.409 -0.960 -13.561 1.00 0.00 C ATOM 1273 CG PRO A 81 -5.899 -0.985 -12.155 1.00 0.00 C ATOM 1274 CD PRO A 81 -4.759 -0.486 -11.310 1.00 0.00 C ATOM 0 HA PRO A 81 -3.620 0.100 -14.307 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -6.233 -0.844 -14.265 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -4.897 -1.887 -13.818 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -6.778 -0.352 -12.037 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -6.190 -1.993 -11.861 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -5.115 0.067 -10.441 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -4.146 -1.306 -10.937 1.00 0.00 H new ATOM 1282 N ASP A 82 -6.156 1.942 -13.346 1.00 0.00 N ATOM 1283 CA ASP A 82 -6.929 3.122 -13.713 1.00 0.00 C ATOM 1284 C ASP A 82 -6.017 4.328 -13.916 1.00 0.00 C ATOM 1285 O ASP A 82 -6.097 5.016 -14.934 1.00 0.00 O ATOM 1286 CB ASP A 82 -7.971 3.431 -12.636 1.00 0.00 C ATOM 1287 CG ASP A 82 -9.141 2.467 -12.670 1.00 0.00 C ATOM 1288 OD1 ASP A 82 -9.906 2.497 -13.657 1.00 0.00 O ATOM 1289 OD2 ASP A 82 -9.292 1.683 -11.710 1.00 0.00 O ATOM 0 H ASP A 82 -6.426 1.520 -12.457 1.00 0.00 H new ATOM 0 HA ASP A 82 -7.440 2.913 -14.653 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -7.498 3.390 -11.655 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -8.338 4.448 -12.771 1.00 0.00 H new ATOM 1294 N LEU A 83 -5.152 4.580 -12.940 1.00 0.00 N ATOM 1295 CA LEU A 83 -4.225 5.704 -13.010 1.00 0.00 C ATOM 1296 C LEU A 83 -3.300 5.572 -14.215 1.00 0.00 C ATOM 1297 O LEU A 83 -2.679 4.533 -14.442 1.00 0.00 O ATOM 1298 CB LEU A 83 -3.399 5.790 -11.726 1.00 0.00 C ATOM 1299 CG LEU A 83 -3.994 6.637 -10.600 1.00 0.00 C ATOM 1300 CD1 LEU A 83 -5.430 6.221 -10.321 1.00 0.00 C ATOM 1301 CD2 LEU A 83 -3.149 6.520 -9.340 1.00 0.00 C ATOM 0 H LEU A 83 -5.073 4.021 -12.090 1.00 0.00 H new ATOM 0 HA LEU A 83 -4.808 6.618 -13.121 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -3.243 4.779 -11.350 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -2.417 6.192 -11.976 1.00 0.00 H new ATOM 0 HG LEU A 83 -3.994 7.680 -10.917 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -5.837 6.834 -9.517 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -6.030 6.358 -11.221 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -5.454 5.172 -10.025 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -3.588 7.129 -8.550 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -3.116 5.479 -9.019 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -2.137 6.868 -9.547 1.00 0.00 H new ATOM 1313 N PRO A 84 -3.202 6.650 -15.008 1.00 0.00 N ATOM 1314 CA PRO A 84 -2.353 6.681 -16.202 1.00 0.00 C ATOM 1315 C PRO A 84 -0.868 6.679 -15.857 1.00 0.00 C ATOM 1316 O PRO A 84 -0.444 7.205 -14.827 1.00 0.00 O ATOM 1317 CB PRO A 84 -2.742 7.996 -16.881 1.00 0.00 C ATOM 1318 CG PRO A 84 -3.255 8.855 -15.777 1.00 0.00 C ATOM 1319 CD PRO A 84 -3.914 7.922 -14.799 1.00 0.00 C ATOM 0 HA PRO A 84 -2.501 5.802 -16.829 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -1.885 8.455 -17.375 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -3.503 7.837 -17.645 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -2.444 9.408 -15.303 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -3.965 9.591 -16.153 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -3.811 8.276 -13.773 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -4.981 7.822 -14.996 1.00 0.00 H new ATOM 1327 N PRO A 85 -0.056 6.074 -16.737 1.00 0.00 N ATOM 1328 CA PRO A 85 1.396 5.990 -16.547 1.00 0.00 C ATOM 1329 C PRO A 85 2.079 7.345 -16.698 1.00 0.00 C ATOM 1330 O PRO A 85 1.906 8.046 -17.695 1.00 0.00 O ATOM 1331 CB PRO A 85 1.844 5.038 -17.658 1.00 0.00 C ATOM 1332 CG PRO A 85 0.799 5.166 -18.712 1.00 0.00 C ATOM 1333 CD PRO A 85 -0.492 5.426 -17.985 1.00 0.00 C ATOM 0 HA PRO A 85 1.658 5.650 -15.545 1.00 0.00 H new ATOM 0 HB2 PRO A 85 2.827 5.311 -18.041 1.00 0.00 H new ATOM 0 HB3 PRO A 85 1.917 4.013 -17.295 1.00 0.00 H new ATOM 0 HG2 PRO A 85 1.033 5.982 -19.396 1.00 0.00 H new ATOM 0 HG3 PRO A 85 0.734 4.257 -19.310 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -1.155 6.070 -18.562 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -1.036 4.502 -17.789 1.00 0.00 H new ATOM 1341 N PRO A 86 2.875 7.723 -15.687 1.00 0.00 N ATOM 1342 CA PRO A 86 3.602 8.996 -15.685 1.00 0.00 C ATOM 1343 C PRO A 86 4.729 9.022 -16.712 1.00 0.00 C ATOM 1344 O PRO A 86 5.833 8.545 -16.448 1.00 0.00 O ATOM 1345 CB PRO A 86 4.169 9.079 -14.266 1.00 0.00 C ATOM 1346 CG PRO A 86 4.272 7.663 -13.816 1.00 0.00 C ATOM 1347 CD PRO A 86 3.128 6.937 -14.468 1.00 0.00 C ATOM 0 HA PRO A 86 2.957 9.834 -15.950 1.00 0.00 H new ATOM 0 HB2 PRO A 86 5.143 9.569 -14.257 1.00 0.00 H new ATOM 0 HB3 PRO A 86 3.515 9.656 -13.612 1.00 0.00 H new ATOM 0 HG2 PRO A 86 5.228 7.229 -14.110 1.00 0.00 H new ATOM 0 HG3 PRO A 86 4.210 7.593 -12.730 1.00 0.00 H new ATOM 0 HD2 PRO A 86 3.389 5.905 -14.702 1.00 0.00 H new ATOM 0 HD3 PRO A 86 2.251 6.905 -13.821 1.00 0.00 H new ATOM 1355 N SER A 87 4.444 9.582 -17.883 1.00 0.00 N ATOM 1356 CA SER A 87 5.434 9.667 -18.951 1.00 0.00 C ATOM 1357 C SER A 87 6.266 10.939 -18.820 1.00 0.00 C ATOM 1358 O SER A 87 7.494 10.901 -18.897 1.00 0.00 O ATOM 1359 CB SER A 87 4.746 9.632 -20.316 1.00 0.00 C ATOM 1360 OG SER A 87 5.635 9.180 -21.324 1.00 0.00 O ATOM 0 H SER A 87 3.536 9.984 -18.117 1.00 0.00 H new ATOM 0 HA SER A 87 6.100 8.808 -18.866 1.00 0.00 H new ATOM 0 HB2 SER A 87 3.877 8.975 -20.272 1.00 0.00 H new ATOM 0 HB3 SER A 87 4.381 10.628 -20.568 1.00 0.00 H new ATOM 0 HG SER A 87 5.171 9.165 -22.187 1.00 0.00 H new ATOM 1366 N SER A 88 5.588 12.065 -18.623 1.00 0.00 N ATOM 1367 CA SER A 88 6.263 13.350 -18.486 1.00 0.00 C ATOM 1368 C SER A 88 7.211 13.341 -17.291 1.00 0.00 C ATOM 1369 O SER A 88 7.056 12.541 -16.367 1.00 0.00 O ATOM 1370 CB SER A 88 5.237 14.474 -18.328 1.00 0.00 C ATOM 1371 OG SER A 88 4.630 14.788 -19.570 1.00 0.00 O ATOM 0 H SER A 88 4.571 12.113 -18.555 1.00 0.00 H new ATOM 0 HA SER A 88 6.847 13.524 -19.390 1.00 0.00 H new ATOM 0 HB2 SER A 88 4.472 14.175 -17.611 1.00 0.00 H new ATOM 0 HB3 SER A 88 5.724 15.361 -17.923 1.00 0.00 H new ATOM 0 HG SER A 88 3.977 15.508 -19.442 1.00 0.00 H new ATOM 1377 N SER A 89 8.194 14.236 -17.316 1.00 0.00 N ATOM 1378 CA SER A 89 9.171 14.329 -16.237 1.00 0.00 C ATOM 1379 C SER A 89 8.572 15.029 -15.021 1.00 0.00 C ATOM 1380 O SER A 89 8.748 16.232 -14.834 1.00 0.00 O ATOM 1381 CB SER A 89 10.415 15.082 -16.712 1.00 0.00 C ATOM 1382 OG SER A 89 11.378 15.178 -15.677 1.00 0.00 O ATOM 0 H SER A 89 8.335 14.907 -18.071 1.00 0.00 H new ATOM 0 HA SER A 89 9.455 13.317 -15.948 1.00 0.00 H new ATOM 0 HB2 SER A 89 10.849 14.569 -17.570 1.00 0.00 H new ATOM 0 HB3 SER A 89 10.134 16.081 -17.046 1.00 0.00 H new ATOM 0 HG SER A 89 12.164 15.662 -16.006 1.00 0.00 H new ATOM 1388 N SER A 90 7.862 14.265 -14.197 1.00 0.00 N ATOM 1389 CA SER A 90 7.233 14.811 -13.000 1.00 0.00 C ATOM 1390 C SER A 90 8.278 15.134 -11.936 1.00 0.00 C ATOM 1391 O SER A 90 9.458 14.815 -12.091 1.00 0.00 O ATOM 1392 CB SER A 90 6.208 13.822 -12.440 1.00 0.00 C ATOM 1393 OG SER A 90 5.111 13.670 -13.325 1.00 0.00 O ATOM 0 H SER A 90 7.708 13.266 -14.336 1.00 0.00 H new ATOM 0 HA SER A 90 6.724 15.734 -13.277 1.00 0.00 H new ATOM 0 HB2 SER A 90 6.683 12.855 -12.275 1.00 0.00 H new ATOM 0 HB3 SER A 90 5.852 14.172 -11.471 1.00 0.00 H new ATOM 0 HG SER A 90 4.471 13.032 -12.946 1.00 0.00 H new ATOM 1399 N HIS A 91 7.836 15.768 -10.855 1.00 0.00 N ATOM 1400 CA HIS A 91 8.732 16.134 -9.764 1.00 0.00 C ATOM 1401 C HIS A 91 9.043 14.925 -8.887 1.00 0.00 C ATOM 1402 O HIS A 91 8.306 13.940 -8.889 1.00 0.00 O ATOM 1403 CB HIS A 91 8.112 17.247 -8.918 1.00 0.00 C ATOM 1404 CG HIS A 91 7.770 18.476 -9.703 1.00 0.00 C ATOM 1405 ND1 HIS A 91 6.497 19.003 -9.759 1.00 0.00 N ATOM 1406 CD2 HIS A 91 8.544 19.284 -10.464 1.00 0.00 C ATOM 1407 CE1 HIS A 91 6.503 20.081 -10.523 1.00 0.00 C ATOM 1408 NE2 HIS A 91 7.733 20.273 -10.963 1.00 0.00 N ATOM 0 H HIS A 91 6.863 16.039 -10.711 1.00 0.00 H new ATOM 0 HA HIS A 91 9.664 16.495 -10.198 1.00 0.00 H new ATOM 0 HB2 HIS A 91 7.209 16.868 -8.440 1.00 0.00 H new ATOM 0 HB3 HIS A 91 8.806 17.516 -8.121 1.00 0.00 H new ATOM 0 HD2 HIS A 91 9.603 19.172 -10.645 1.00 0.00 H new ATOM 0 HE1 HIS A 91 5.647 20.700 -10.749 1.00 0.00 H new ATOM 0 HE2 HIS A 91 8.032 21.033 -11.574 1.00 0.00 H new ATOM 1417 N ALA A 92 10.138 15.009 -8.139 1.00 0.00 N ATOM 1418 CA ALA A 92 10.545 13.922 -7.256 1.00 0.00 C ATOM 1419 C ALA A 92 10.290 14.277 -5.795 1.00 0.00 C ATOM 1420 O ALA A 92 9.628 13.534 -5.073 1.00 0.00 O ATOM 1421 CB ALA A 92 12.014 13.590 -7.472 1.00 0.00 C ATOM 0 H ALA A 92 10.759 15.818 -8.127 1.00 0.00 H new ATOM 0 HA ALA A 92 9.946 13.045 -7.499 1.00 0.00 H new ATOM 0 HB1 ALA A 92 12.305 12.777 -6.807 1.00 0.00 H new ATOM 0 HB2 ALA A 92 12.170 13.285 -8.507 1.00 0.00 H new ATOM 0 HB3 ALA A 92 12.621 14.469 -7.257 1.00 0.00 H new ATOM 1427 N GLY A 93 10.821 15.418 -5.366 1.00 0.00 N ATOM 1428 CA GLY A 93 10.640 15.850 -3.993 1.00 0.00 C ATOM 1429 C GLY A 93 11.044 17.296 -3.782 1.00 0.00 C ATOM 1430 O GLY A 93 12.061 17.746 -4.308 1.00 0.00 O ATOM 0 H GLY A 93 11.373 16.051 -5.945 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.595 15.723 -3.710 1.00 0.00 H new ATOM 0 HA3 GLY A 93 11.228 15.212 -3.334 1.00 0.00 H new ATOM 1434 N ALA A 94 10.244 18.026 -3.012 1.00 0.00 N ATOM 1435 CA ALA A 94 10.523 19.429 -2.733 1.00 0.00 C ATOM 1436 C ALA A 94 11.902 19.599 -2.104 1.00 0.00 C ATOM 1437 O ALA A 94 12.301 18.821 -1.236 1.00 0.00 O ATOM 1438 CB ALA A 94 9.451 20.010 -1.823 1.00 0.00 C ATOM 0 H ALA A 94 9.397 17.669 -2.570 1.00 0.00 H new ATOM 0 HA ALA A 94 10.514 19.971 -3.679 1.00 0.00 H new ATOM 0 HB1 ALA A 94 9.672 21.058 -1.623 1.00 0.00 H new ATOM 0 HB2 ALA A 94 8.479 19.931 -2.309 1.00 0.00 H new ATOM 0 HB3 ALA A 94 9.433 19.458 -0.884 1.00 0.00 H new ATOM 1444 N LEU A 95 12.627 20.620 -2.548 1.00 0.00 N ATOM 1445 CA LEU A 95 13.963 20.892 -2.029 1.00 0.00 C ATOM 1446 C LEU A 95 13.962 20.909 -0.504 1.00 0.00 C ATOM 1447 O LEU A 95 13.446 21.839 0.115 1.00 0.00 O ATOM 1448 CB LEU A 95 14.477 22.230 -2.564 1.00 0.00 C ATOM 1449 CG LEU A 95 15.997 22.379 -2.650 1.00 0.00 C ATOM 1450 CD1 LEU A 95 16.376 23.353 -3.755 1.00 0.00 C ATOM 1451 CD2 LEU A 95 16.564 22.838 -1.315 1.00 0.00 C ATOM 0 H LEU A 95 12.312 21.273 -3.266 1.00 0.00 H new ATOM 0 HA LEU A 95 14.625 20.094 -2.365 1.00 0.00 H new ATOM 0 HB2 LEU A 95 14.060 22.385 -3.559 1.00 0.00 H new ATOM 0 HB3 LEU A 95 14.089 23.026 -1.928 1.00 0.00 H new ATOM 0 HG LEU A 95 16.425 21.406 -2.889 1.00 0.00 H new ATOM 0 HD11 LEU A 95 17.461 23.446 -3.801 1.00 0.00 H new ATOM 0 HD12 LEU A 95 16.002 22.983 -4.710 1.00 0.00 H new ATOM 0 HD13 LEU A 95 15.936 24.328 -3.547 1.00 0.00 H new ATOM 0 HD21 LEU A 95 17.646 22.939 -1.395 1.00 0.00 H new ATOM 0 HD22 LEU A 95 16.129 23.801 -1.047 1.00 0.00 H new ATOM 0 HD23 LEU A 95 16.324 22.104 -0.546 1.00 0.00 H new ATOM 1463 N GLN A 96 14.545 19.875 0.095 1.00 0.00 N ATOM 1464 CA GLN A 96 14.612 19.773 1.548 1.00 0.00 C ATOM 1465 C GLN A 96 16.011 19.370 2.001 1.00 0.00 C ATOM 1466 O GLN A 96 16.448 18.243 1.769 1.00 0.00 O ATOM 1467 CB GLN A 96 13.586 18.758 2.057 1.00 0.00 C ATOM 1468 CG GLN A 96 13.629 18.553 3.562 1.00 0.00 C ATOM 1469 CD GLN A 96 12.436 17.773 4.079 1.00 0.00 C ATOM 1470 OE1 GLN A 96 12.332 16.563 3.870 1.00 0.00 O ATOM 1471 NE2 GLN A 96 11.526 18.462 4.758 1.00 0.00 N ATOM 0 H GLN A 96 14.977 19.097 -0.403 1.00 0.00 H new ATOM 0 HA GLN A 96 14.382 20.753 1.967 1.00 0.00 H new ATOM 0 HB2 GLN A 96 12.587 19.089 1.772 1.00 0.00 H new ATOM 0 HB3 GLN A 96 13.758 17.802 1.563 1.00 0.00 H new ATOM 0 HG2 GLN A 96 14.545 18.026 3.827 1.00 0.00 H new ATOM 0 HG3 GLN A 96 13.665 19.524 4.056 1.00 0.00 H new ATOM 0 HE21 GLN A 96 11.652 19.463 4.908 1.00 0.00 H new ATOM 0 HE22 GLN A 96 10.702 17.990 5.129 1.00 0.00 H new ATOM 1480 N GLU A 97 16.708 20.298 2.649 1.00 0.00 N ATOM 1481 CA GLU A 97 18.059 20.039 3.133 1.00 0.00 C ATOM 1482 C GLU A 97 18.048 18.989 4.240 1.00 0.00 C ATOM 1483 O GLU A 97 17.392 19.162 5.268 1.00 0.00 O ATOM 1484 CB GLU A 97 18.697 21.331 3.647 1.00 0.00 C ATOM 1485 CG GLU A 97 19.139 22.274 2.540 1.00 0.00 C ATOM 1486 CD GLU A 97 19.914 23.467 3.065 1.00 0.00 C ATOM 1487 OE1 GLU A 97 20.864 23.258 3.847 1.00 0.00 O ATOM 1488 OE2 GLU A 97 19.570 24.608 2.693 1.00 0.00 O ATOM 0 H GLU A 97 16.360 21.235 2.851 1.00 0.00 H new ATOM 0 HA GLU A 97 18.649 19.658 2.300 1.00 0.00 H new ATOM 0 HB2 GLU A 97 17.984 21.848 4.290 1.00 0.00 H new ATOM 0 HB3 GLU A 97 19.559 21.080 4.265 1.00 0.00 H new ATOM 0 HG2 GLU A 97 19.758 21.728 1.828 1.00 0.00 H new ATOM 0 HG3 GLU A 97 18.262 22.626 1.996 1.00 0.00 H new ATOM 1495 N SER A 98 18.778 17.900 4.023 1.00 0.00 N ATOM 1496 CA SER A 98 18.849 16.819 4.999 1.00 0.00 C ATOM 1497 C SER A 98 19.382 17.328 6.335 1.00 0.00 C ATOM 1498 O SER A 98 18.733 17.182 7.372 1.00 0.00 O ATOM 1499 CB SER A 98 19.740 15.690 4.479 1.00 0.00 C ATOM 1500 OG SER A 98 19.347 15.289 3.178 1.00 0.00 O ATOM 0 H SER A 98 19.329 17.743 3.179 1.00 0.00 H new ATOM 0 HA SER A 98 17.841 16.435 5.152 1.00 0.00 H new ATOM 0 HB2 SER A 98 20.779 16.020 4.463 1.00 0.00 H new ATOM 0 HB3 SER A 98 19.687 14.838 5.157 1.00 0.00 H new ATOM 0 HG SER A 98 19.933 14.568 2.867 1.00 0.00 H new ATOM 1506 N LEU A 99 20.567 17.927 6.302 1.00 0.00 N ATOM 1507 CA LEU A 99 21.189 18.459 7.510 1.00 0.00 C ATOM 1508 C LEU A 99 20.712 19.881 7.787 1.00 0.00 C ATOM 1509 O LEU A 99 20.023 20.486 6.967 1.00 0.00 O ATOM 1510 CB LEU A 99 22.713 18.438 7.374 1.00 0.00 C ATOM 1511 CG LEU A 99 23.397 17.109 7.698 1.00 0.00 C ATOM 1512 CD1 LEU A 99 23.095 16.076 6.624 1.00 0.00 C ATOM 1513 CD2 LEU A 99 24.899 17.305 7.845 1.00 0.00 C ATOM 0 H LEU A 99 21.117 18.057 5.453 1.00 0.00 H new ATOM 0 HA LEU A 99 20.896 17.827 8.348 1.00 0.00 H new ATOM 0 HB2 LEU A 99 22.971 18.717 6.352 1.00 0.00 H new ATOM 0 HB3 LEU A 99 23.127 19.206 8.028 1.00 0.00 H new ATOM 0 HG LEU A 99 23.004 16.742 8.646 1.00 0.00 H new ATOM 0 HD11 LEU A 99 23.590 15.137 6.872 1.00 0.00 H new ATOM 0 HD12 LEU A 99 22.019 15.914 6.567 1.00 0.00 H new ATOM 0 HD13 LEU A 99 23.459 16.435 5.661 1.00 0.00 H new ATOM 0 HD21 LEU A 99 25.370 16.349 8.075 1.00 0.00 H new ATOM 0 HD22 LEU A 99 25.308 17.696 6.913 1.00 0.00 H new ATOM 0 HD23 LEU A 99 25.097 18.011 8.652 1.00 0.00 H new ATOM 1525 N ASN A 100 21.085 20.409 8.948 1.00 0.00 N ATOM 1526 CA ASN A 100 20.697 21.761 9.333 1.00 0.00 C ATOM 1527 C ASN A 100 21.900 22.549 9.842 1.00 0.00 C ATOM 1528 O ASN A 100 22.384 22.314 10.949 1.00 0.00 O ATOM 1529 CB ASN A 100 19.611 21.714 10.410 1.00 0.00 C ATOM 1530 CG ASN A 100 19.128 23.097 10.804 1.00 0.00 C ATOM 1531 OD1 ASN A 100 19.912 24.044 10.874 1.00 0.00 O ATOM 1532 ND2 ASN A 100 17.832 23.219 11.065 1.00 0.00 N ATOM 0 H ASN A 100 21.656 19.921 9.639 1.00 0.00 H new ATOM 0 HA ASN A 100 20.303 22.265 8.450 1.00 0.00 H new ATOM 0 HB2 ASN A 100 18.767 21.127 10.046 1.00 0.00 H new ATOM 0 HB3 ASN A 100 19.999 21.203 11.291 1.00 0.00 H new ATOM 0 HD21 ASN A 100 17.449 24.125 11.336 1.00 0.00 H new ATOM 0 HD22 ASN A 100 17.219 22.407 10.994 1.00 0.00 H new TER 1539 ASN A 100