USER MOD reduce.3.24.130724 H: found=0, std=0, add=819, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 822 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: F 39 SER OG : rot -87:sc= 0.38 USER MOD Set 1.2: F 40 GLN : amide:sc= -0.143 K(o=0.24,f=-1.6) USER MOD Set 2.1: F 23 ASN : amide:sc=0.000357 X(o=-0.83,f=-1.3) USER MOD Set 2.2: F 26 GLN : amide:sc= -0.818 X(o=-0.83,f=-0.84) USER MOD Set 2.3: F 55 GLN : amide:sc= -0.0113 K(o=-0.83,f=-4) USER MOD Set 3.1: E 23 ASN : amide:sc= -2.78! K(o=-4.2!,f=-0.4) USER MOD Set 3.2: E 55 GLN : amide:sc= -1.4 K(o=-4.2,f=-1.2) USER MOD Single : C 16 LYS NZ :NH3+ -128:sc= -0.182! (180deg=-3.49!) USER MOD Single : C 26 SER OG : rot -60:sc= 0.312 USER MOD Single : C 27 ASN : amide:sc= -0.167 X(o=-0.17,f=-0.2) USER MOD Single : C 28 LYS NZ :NH3+ -166:sc=-0.00104 (180deg=-0.229) USER MOD Single : C 35 MET CE :methyl -168:sc= -1.87! (180deg=-2.2!) USER MOD Single : E 18 TYR OH : rot 138:sc= 0.936 USER MOD Single : E 21 ASN : amide:sc= -1.92! X(o=-1.9!,f=-2) USER MOD Single : E 26 GLN : amide:sc= -2.52 K(o=-2.5,f=-0.82) USER MOD Single : E 32 HIS : no HD1:sc= -1.21 K(o=-0.32,f=-6.6!) USER MOD Single : E 33 SER OG : rot 150:sc= -0.174 USER MOD Single : E 35 HIS : no HD1:sc= -0.798 X(o=-0.8,f=-0.38) USER MOD Single : E 39 SER OG : rot 180:sc= 0 USER MOD Single : E 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : E 41 SER OG : rot -91:sc= 0.935 USER MOD Single : E 43 ASN : amide:sc=-0.00871 X(o=-0.0087,f=0) USER MOD Single : E 49 LYS NZ :NH3+ 147:sc= 0.81 (180deg=0.291) USER MOD Single : E 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 52 ASN : amide:sc= -0.1 K(o=-0.1,f=-2.2!) USER MOD Single : F 18 TYR OH : rot -89:sc= 0.596 USER MOD Single : F 21 ASN : amide:sc= -0.231 X(o=-0.23,f=-0.4) USER MOD Single : F 32 HIS : no HD1:sc= 0 X(o=0,f=-0.01) USER MOD Single : F 33 SER OG : rot -59:sc= -0.17 USER MOD Single : F 35 HIS : no HD1:sc= -0.693 K(o=-0.69,f=-1.7!) USER MOD Single : F 41 SER OG : rot -85:sc= 0.0226 USER MOD Single : F 43 ASN : amide:sc=-0.00685 X(o=-0.0068,f=0) USER MOD Single : F 49 LYS NZ :NH3+ -175:sc= 1.03 (180deg=1.01) USER MOD Single : F 50 LYS NZ :NH3+ -120:sc= 0.693 (180deg=0.155) USER MOD Single : F 52 ASN : amide:sc= 0.734 K(o=0.73,f=-0.86) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS C 16 126.327 -9.485 -3.909 1.00 0.00 N ATOM 2 CA LYS C 16 125.131 -9.431 -3.067 1.00 0.00 C ATOM 3 C LYS C 16 124.535 -8.009 -3.028 1.00 0.00 C ATOM 4 O LYS C 16 125.235 -7.053 -2.679 1.00 0.00 O ATOM 5 CB LYS C 16 125.571 -9.866 -1.661 1.00 0.00 C ATOM 6 CG LYS C 16 124.369 -10.159 -0.745 1.00 0.00 C ATOM 7 CD LYS C 16 123.877 -8.882 -0.038 1.00 0.00 C ATOM 8 CE LYS C 16 125.019 -8.194 0.736 1.00 0.00 C ATOM 9 NZ LYS C 16 125.355 -6.901 0.077 1.00 0.00 N ATOM 0 HA LYS C 16 124.353 -10.084 -3.463 1.00 0.00 H new ATOM 0 HB2 LYS C 16 126.195 -10.756 -1.736 1.00 0.00 H new ATOM 0 HB3 LYS C 16 126.184 -9.083 -1.215 1.00 0.00 H new ATOM 0 HG2 LYS C 16 123.557 -10.587 -1.333 1.00 0.00 H new ATOM 0 HG3 LYS C 16 124.650 -10.904 -0.000 1.00 0.00 H new ATOM 0 HD2 LYS C 16 123.467 -8.191 -0.775 1.00 0.00 H new ATOM 0 HD3 LYS C 16 123.069 -9.133 0.649 1.00 0.00 H new ATOM 0 HE2 LYS C 16 124.720 -8.021 1.770 1.00 0.00 H new ATOM 0 HE3 LYS C 16 125.896 -8.840 0.762 1.00 0.00 H new ATOM 0 HZ1 LYS C 16 126.378 -6.860 -0.105 1.00 0.00 H new ATOM 0 HZ2 LYS C 16 124.839 -6.826 -0.823 1.00 0.00 H new ATOM 0 HZ3 LYS C 16 125.082 -6.113 0.699 1.00 0.00 H new ATOM 23 N LEU C 17 123.235 -7.885 -3.367 1.00 0.00 N ATOM 24 CA LEU C 17 122.535 -6.581 -3.348 1.00 0.00 C ATOM 25 C LEU C 17 121.654 -6.466 -2.101 1.00 0.00 C ATOM 26 O LEU C 17 121.021 -7.443 -1.688 1.00 0.00 O ATOM 27 CB LEU C 17 121.627 -6.419 -4.587 1.00 0.00 C ATOM 28 CG LEU C 17 122.300 -5.586 -5.696 1.00 0.00 C ATOM 29 CD1 LEU C 17 122.750 -4.213 -5.177 1.00 0.00 C ATOM 30 CD2 LEU C 17 123.499 -6.348 -6.262 1.00 0.00 C ATOM 0 H LEU C 17 122.649 -8.668 -3.656 1.00 0.00 H new ATOM 0 HA LEU C 17 123.300 -5.804 -3.347 1.00 0.00 H new ATOM 0 HB2 LEU C 17 121.371 -7.403 -4.979 1.00 0.00 H new ATOM 0 HB3 LEU C 17 120.693 -5.941 -4.291 1.00 0.00 H new ATOM 0 HG LEU C 17 121.565 -5.421 -6.484 1.00 0.00 H new ATOM 0 HD11 LEU C 17 123.220 -3.654 -5.986 1.00 0.00 H new ATOM 0 HD12 LEU C 17 121.885 -3.661 -4.810 1.00 0.00 H new ATOM 0 HD13 LEU C 17 123.466 -4.347 -4.366 1.00 0.00 H new ATOM 0 HD21 LEU C 17 123.971 -5.754 -7.045 1.00 0.00 H new ATOM 0 HD22 LEU C 17 124.219 -6.536 -5.466 1.00 0.00 H new ATOM 0 HD23 LEU C 17 123.163 -7.297 -6.679 1.00 0.00 H new ATOM 42 N VAL C 18 121.609 -5.260 -1.521 1.00 0.00 N ATOM 43 CA VAL C 18 120.787 -4.999 -0.326 1.00 0.00 C ATOM 44 C VAL C 18 120.075 -3.654 -0.471 1.00 0.00 C ATOM 45 O VAL C 18 120.697 -2.678 -0.873 1.00 0.00 O ATOM 46 CB VAL C 18 121.668 -4.978 0.938 1.00 0.00 C ATOM 47 CG1 VAL C 18 120.781 -4.959 2.192 1.00 0.00 C ATOM 48 CG2 VAL C 18 122.566 -6.221 0.971 1.00 0.00 C ATOM 0 H VAL C 18 122.130 -4.450 -1.857 1.00 0.00 H new ATOM 0 HA VAL C 18 120.049 -5.795 -0.231 1.00 0.00 H new ATOM 0 HB VAL C 18 122.290 -4.083 0.919 1.00 0.00 H new ATOM 0 HG11 VAL C 18 121.410 -4.944 3.082 1.00 0.00 H new ATOM 0 HG12 VAL C 18 120.151 -4.070 2.178 1.00 0.00 H new ATOM 0 HG13 VAL C 18 120.152 -5.849 2.207 1.00 0.00 H new ATOM 0 HG21 VAL C 18 123.186 -6.199 1.868 1.00 0.00 H new ATOM 0 HG22 VAL C 18 121.946 -7.118 0.981 1.00 0.00 H new ATOM 0 HG23 VAL C 18 123.205 -6.231 0.088 1.00 0.00 H new ATOM 58 N PHE C 19 118.783 -3.607 -0.124 1.00 0.00 N ATOM 59 CA PHE C 19 118.001 -2.370 -0.204 1.00 0.00 C ATOM 60 C PHE C 19 117.763 -1.827 1.194 1.00 0.00 C ATOM 61 O PHE C 19 117.325 -2.557 2.077 1.00 0.00 O ATOM 62 CB PHE C 19 116.638 -2.624 -0.885 1.00 0.00 C ATOM 63 CG PHE C 19 116.624 -1.979 -2.254 1.00 0.00 C ATOM 64 CD1 PHE C 19 117.474 -2.474 -3.251 1.00 0.00 C ATOM 65 CD2 PHE C 19 115.777 -0.884 -2.528 1.00 0.00 C ATOM 66 CE1 PHE C 19 117.486 -1.888 -4.515 1.00 0.00 C ATOM 67 CE2 PHE C 19 115.797 -0.302 -3.803 1.00 0.00 C ATOM 68 CZ PHE C 19 116.653 -0.806 -4.794 1.00 0.00 C ATOM 0 H PHE C 19 118.258 -4.413 0.215 1.00 0.00 H new ATOM 0 HA PHE C 19 118.562 -1.648 -0.797 1.00 0.00 H new ATOM 0 HB2 PHE C 19 116.460 -3.696 -0.975 1.00 0.00 H new ATOM 0 HB3 PHE C 19 115.833 -2.218 -0.273 1.00 0.00 H new ATOM 0 HD1 PHE C 19 118.122 -3.312 -3.040 1.00 0.00 H new ATOM 0 HD2 PHE C 19 115.120 -0.498 -1.763 1.00 0.00 H new ATOM 0 HE1 PHE C 19 118.143 -2.273 -5.281 1.00 0.00 H new ATOM 0 HE2 PHE C 19 115.152 0.536 -4.023 1.00 0.00 H new ATOM 0 HZ PHE C 19 116.666 -0.355 -5.775 1.00 0.00 H new ATOM 78 N PHE C 20 118.047 -0.544 1.378 1.00 0.00 N ATOM 79 CA PHE C 20 117.849 0.106 2.685 1.00 0.00 C ATOM 80 C PHE C 20 117.315 1.531 2.521 1.00 0.00 C ATOM 81 O PHE C 20 117.498 2.156 1.472 1.00 0.00 O ATOM 82 CB PHE C 20 119.165 0.134 3.464 1.00 0.00 C ATOM 83 CG PHE C 20 120.152 1.004 2.750 1.00 0.00 C ATOM 84 CD1 PHE C 20 120.161 2.382 2.984 1.00 0.00 C ATOM 85 CD2 PHE C 20 121.040 0.436 1.845 1.00 0.00 C ATOM 86 CE1 PHE C 20 121.065 3.192 2.306 1.00 0.00 C ATOM 87 CE2 PHE C 20 121.941 1.241 1.168 1.00 0.00 C ATOM 88 CZ PHE C 20 121.957 2.625 1.396 1.00 0.00 C ATOM 0 H PHE C 20 118.413 0.070 0.651 1.00 0.00 H new ATOM 0 HA PHE C 20 117.111 -0.474 3.239 1.00 0.00 H new ATOM 0 HB2 PHE C 20 118.995 0.512 4.472 1.00 0.00 H new ATOM 0 HB3 PHE C 20 119.561 -0.876 3.565 1.00 0.00 H new ATOM 0 HD1 PHE C 20 119.468 2.816 3.689 1.00 0.00 H new ATOM 0 HD2 PHE C 20 121.028 -0.630 1.670 1.00 0.00 H new ATOM 0 HE1 PHE C 20 121.076 4.257 2.483 1.00 0.00 H new ATOM 0 HE2 PHE C 20 122.632 0.803 0.464 1.00 0.00 H new ATOM 0 HZ PHE C 20 122.660 3.251 0.867 1.00 0.00 H new ATOM 98 N ALA C 21 116.671 2.045 3.577 1.00 0.00 N ATOM 99 CA ALA C 21 116.132 3.398 3.567 1.00 0.00 C ATOM 100 C ALA C 21 116.741 4.199 4.715 1.00 0.00 C ATOM 101 O ALA C 21 116.755 3.726 5.853 1.00 0.00 O ATOM 102 CB ALA C 21 114.611 3.338 3.723 1.00 0.00 C ATOM 0 H ALA C 21 116.514 1.538 4.448 1.00 0.00 H new ATOM 0 HA ALA C 21 116.379 3.884 2.623 1.00 0.00 H new ATOM 0 HB1 ALA C 21 114.204 4.349 3.716 1.00 0.00 H new ATOM 0 HB2 ALA C 21 114.183 2.769 2.898 1.00 0.00 H new ATOM 0 HB3 ALA C 21 114.361 2.853 4.667 1.00 0.00 H new ATOM 108 N GLU C 22 117.231 5.411 4.418 1.00 0.00 N ATOM 109 CA GLU C 22 117.824 6.269 5.459 1.00 0.00 C ATOM 110 C GLU C 22 116.863 7.402 5.794 1.00 0.00 C ATOM 111 O GLU C 22 116.410 8.112 4.904 1.00 0.00 O ATOM 112 CB GLU C 22 119.193 6.834 5.028 1.00 0.00 C ATOM 113 CG GLU C 22 119.143 7.405 3.608 1.00 0.00 C ATOM 114 CD GLU C 22 120.398 8.241 3.342 1.00 0.00 C ATOM 115 OE1 GLU C 22 121.471 7.661 3.276 1.00 0.00 O ATOM 116 OE2 GLU C 22 120.270 9.450 3.219 1.00 0.00 O ATOM 0 H GLU C 22 117.230 5.816 3.482 1.00 0.00 H new ATOM 0 HA GLU C 22 117.993 5.658 6.346 1.00 0.00 H new ATOM 0 HB2 GLU C 22 119.501 7.614 5.724 1.00 0.00 H new ATOM 0 HB3 GLU C 22 119.945 6.046 5.078 1.00 0.00 H new ATOM 0 HG2 GLU C 22 119.074 6.595 2.882 1.00 0.00 H new ATOM 0 HG3 GLU C 22 118.252 8.020 3.485 1.00 0.00 H new ATOM 123 N ASP C 23 116.543 7.542 7.083 1.00 0.00 N ATOM 124 CA ASP C 23 115.611 8.560 7.548 1.00 0.00 C ATOM 125 C ASP C 23 116.159 9.961 7.305 1.00 0.00 C ATOM 126 O ASP C 23 117.181 10.356 7.870 1.00 0.00 O ATOM 127 CB ASP C 23 115.328 8.359 9.045 1.00 0.00 C ATOM 128 CG ASP C 23 114.236 9.324 9.517 1.00 0.00 C ATOM 129 OD1 ASP C 23 113.072 9.003 9.338 1.00 0.00 O ATOM 130 OD2 ASP C 23 114.581 10.369 10.047 1.00 0.00 O ATOM 0 H ASP C 23 116.922 6.955 7.826 1.00 0.00 H new ATOM 0 HA ASP C 23 114.684 8.458 6.984 1.00 0.00 H new ATOM 0 HB2 ASP C 23 115.017 7.330 9.228 1.00 0.00 H new ATOM 0 HB3 ASP C 23 116.240 8.523 9.619 1.00 0.00 H new ATOM 135 N VAL C 24 115.447 10.697 6.456 1.00 0.00 N ATOM 136 CA VAL C 24 115.809 12.070 6.106 1.00 0.00 C ATOM 137 C VAL C 24 114.581 12.990 6.168 1.00 0.00 C ATOM 138 O VAL C 24 113.611 12.824 5.431 1.00 0.00 O ATOM 139 CB VAL C 24 116.449 12.102 4.702 1.00 0.00 C ATOM 140 CG1 VAL C 24 117.812 11.391 4.761 1.00 0.00 C ATOM 141 CG2 VAL C 24 115.545 11.397 3.672 1.00 0.00 C ATOM 0 H VAL C 24 114.604 10.360 5.991 1.00 0.00 H new ATOM 0 HA VAL C 24 116.536 12.437 6.830 1.00 0.00 H new ATOM 0 HB VAL C 24 116.576 13.140 4.393 1.00 0.00 H new ATOM 0 HG11 VAL C 24 118.274 11.407 3.774 1.00 0.00 H new ATOM 0 HG12 VAL C 24 118.459 11.903 5.473 1.00 0.00 H new ATOM 0 HG13 VAL C 24 117.670 10.358 5.078 1.00 0.00 H new ATOM 0 HG21 VAL C 24 116.016 11.432 2.690 1.00 0.00 H new ATOM 0 HG22 VAL C 24 115.398 10.358 3.967 1.00 0.00 H new ATOM 0 HG23 VAL C 24 114.580 11.902 3.629 1.00 0.00 H new ATOM 151 N GLY C 25 114.643 13.965 7.067 1.00 0.00 N ATOM 152 CA GLY C 25 113.554 14.932 7.249 1.00 0.00 C ATOM 153 C GLY C 25 113.644 16.071 6.228 1.00 0.00 C ATOM 154 O GLY C 25 113.005 17.113 6.398 1.00 0.00 O ATOM 0 H GLY C 25 115.439 14.112 7.688 1.00 0.00 H new ATOM 0 HA2 GLY C 25 112.594 14.425 7.148 1.00 0.00 H new ATOM 0 HA3 GLY C 25 113.593 15.342 8.258 1.00 0.00 H new ATOM 158 N SER C 26 114.440 15.861 5.171 1.00 0.00 N ATOM 159 CA SER C 26 114.623 16.865 4.117 1.00 0.00 C ATOM 160 C SER C 26 113.441 16.860 3.140 1.00 0.00 C ATOM 161 O SER C 26 113.630 16.930 1.923 1.00 0.00 O ATOM 162 CB SER C 26 115.930 16.579 3.366 1.00 0.00 C ATOM 163 OG SER C 26 116.248 17.685 2.528 1.00 0.00 O ATOM 0 H SER C 26 114.969 15.001 5.024 1.00 0.00 H new ATOM 0 HA SER C 26 114.672 17.852 4.578 1.00 0.00 H new ATOM 0 HB2 SER C 26 116.738 16.403 4.076 1.00 0.00 H new ATOM 0 HB3 SER C 26 115.828 15.674 2.768 1.00 0.00 H new ATOM 0 HG SER C 26 115.524 17.826 1.883 1.00 0.00 H new ATOM 169 N ASN C 27 112.226 16.779 3.690 1.00 0.00 N ATOM 170 CA ASN C 27 111.004 16.757 2.884 1.00 0.00 C ATOM 171 C ASN C 27 110.992 15.524 1.967 1.00 0.00 C ATOM 172 O ASN C 27 110.516 15.574 0.828 1.00 0.00 O ATOM 173 CB ASN C 27 110.886 18.057 2.063 1.00 0.00 C ATOM 174 CG ASN C 27 109.458 18.236 1.552 1.00 0.00 C ATOM 175 OD1 ASN C 27 109.204 18.115 0.353 1.00 0.00 O ATOM 176 ND2 ASN C 27 108.504 18.517 2.395 1.00 0.00 N ATOM 0 H ASN C 27 112.063 16.727 4.696 1.00 0.00 H new ATOM 0 HA ASN C 27 110.142 16.693 3.548 1.00 0.00 H new ATOM 0 HB2 ASN C 27 111.168 18.911 2.679 1.00 0.00 H new ATOM 0 HB3 ASN C 27 111.579 18.028 1.222 1.00 0.00 H new ATOM 0 HD21 ASN C 27 107.548 18.637 2.061 1.00 0.00 H new ATOM 0 HD22 ASN C 27 108.714 18.617 3.388 1.00 0.00 H new ATOM 183 N LYS C 28 111.517 14.413 2.496 1.00 0.00 N ATOM 184 CA LYS C 28 111.577 13.139 1.764 1.00 0.00 C ATOM 185 C LYS C 28 111.220 11.963 2.679 1.00 0.00 C ATOM 186 O LYS C 28 110.848 10.888 2.200 1.00 0.00 O ATOM 187 CB LYS C 28 112.983 12.916 1.196 1.00 0.00 C ATOM 188 CG LYS C 28 113.289 13.973 0.130 1.00 0.00 C ATOM 189 CD LYS C 28 114.586 13.606 -0.600 1.00 0.00 C ATOM 190 CE LYS C 28 114.957 14.717 -1.588 1.00 0.00 C ATOM 191 NZ LYS C 28 113.944 14.767 -2.681 1.00 0.00 N ATOM 0 H LYS C 28 111.910 14.369 3.436 1.00 0.00 H new ATOM 0 HA LYS C 28 110.854 13.191 0.950 1.00 0.00 H new ATOM 0 HB2 LYS C 28 113.721 12.970 1.997 1.00 0.00 H new ATOM 0 HB3 LYS C 28 113.056 11.918 0.763 1.00 0.00 H new ATOM 0 HG2 LYS C 28 112.465 14.036 -0.581 1.00 0.00 H new ATOM 0 HG3 LYS C 28 113.386 14.955 0.594 1.00 0.00 H new ATOM 0 HD2 LYS C 28 115.392 13.463 0.120 1.00 0.00 H new ATOM 0 HD3 LYS C 28 114.461 12.662 -1.130 1.00 0.00 H new ATOM 0 HE2 LYS C 28 115.000 15.677 -1.073 1.00 0.00 H new ATOM 0 HE3 LYS C 28 115.948 14.533 -2.004 1.00 0.00 H new ATOM 0 HZ1 LYS C 28 114.308 15.344 -3.466 1.00 0.00 H new ATOM 0 HZ2 LYS C 28 113.751 13.803 -3.020 1.00 0.00 H new ATOM 0 HZ3 LYS C 28 113.065 15.189 -2.320 1.00 0.00 H new ATOM 205 N GLY C 29 111.362 12.173 3.993 1.00 0.00 N ATOM 206 CA GLY C 29 111.084 11.129 4.978 1.00 0.00 C ATOM 207 C GLY C 29 112.269 10.178 5.058 1.00 0.00 C ATOM 208 O GLY C 29 112.979 10.159 6.059 1.00 0.00 O ATOM 0 H GLY C 29 111.668 13.059 4.396 1.00 0.00 H new ATOM 0 HA2 GLY C 29 110.896 11.576 5.954 1.00 0.00 H new ATOM 0 HA3 GLY C 29 110.183 10.582 4.699 1.00 0.00 H new ATOM 212 N ALA C 30 112.488 9.412 3.985 1.00 0.00 N ATOM 213 CA ALA C 30 113.616 8.490 3.909 1.00 0.00 C ATOM 214 C ALA C 30 114.101 8.369 2.453 1.00 0.00 C ATOM 215 O ALA C 30 113.309 8.552 1.522 1.00 0.00 O ATOM 216 CB ALA C 30 113.222 7.122 4.463 1.00 0.00 C ATOM 0 H ALA C 30 111.894 9.415 3.156 1.00 0.00 H new ATOM 0 HA ALA C 30 114.433 8.881 4.515 1.00 0.00 H new ATOM 0 HB1 ALA C 30 114.074 6.445 4.400 1.00 0.00 H new ATOM 0 HB2 ALA C 30 112.917 7.225 5.504 1.00 0.00 H new ATOM 0 HB3 ALA C 30 112.394 6.719 3.881 1.00 0.00 H new ATOM 222 N ILE C 31 115.399 8.061 2.258 1.00 0.00 N ATOM 223 CA ILE C 31 115.966 7.924 0.904 1.00 0.00 C ATOM 224 C ILE C 31 116.233 6.463 0.601 1.00 0.00 C ATOM 225 O ILE C 31 116.875 5.775 1.396 1.00 0.00 O ATOM 226 CB ILE C 31 117.318 8.661 0.749 1.00 0.00 C ATOM 227 CG1 ILE C 31 117.288 10.031 1.439 1.00 0.00 C ATOM 228 CG2 ILE C 31 117.608 8.867 -0.743 1.00 0.00 C ATOM 229 CD1 ILE C 31 118.529 10.852 1.048 1.00 0.00 C ATOM 0 H ILE C 31 116.067 7.904 3.013 1.00 0.00 H new ATOM 0 HA ILE C 31 115.234 8.358 0.223 1.00 0.00 H new ATOM 0 HB ILE C 31 118.094 8.054 1.215 1.00 0.00 H new ATOM 0 HG12 ILE C 31 116.383 10.569 1.156 1.00 0.00 H new ATOM 0 HG13 ILE C 31 117.256 9.901 2.521 1.00 0.00 H new ATOM 0 HG21 ILE C 31 118.559 9.386 -0.860 1.00 0.00 H new ATOM 0 HG22 ILE C 31 117.659 7.899 -1.241 1.00 0.00 H new ATOM 0 HG23 ILE C 31 116.812 9.463 -1.189 1.00 0.00 H new ATOM 0 HD11 ILE C 31 118.495 11.822 1.545 1.00 0.00 H new ATOM 0 HD12 ILE C 31 119.429 10.319 1.354 1.00 0.00 H new ATOM 0 HD13 ILE C 31 118.543 10.998 -0.032 1.00 0.00 H new ATOM 241 N ILE C 32 115.787 6.013 -0.568 1.00 0.00 N ATOM 242 CA ILE C 32 116.027 4.639 -0.984 1.00 0.00 C ATOM 243 C ILE C 32 117.417 4.539 -1.585 1.00 0.00 C ATOM 244 O ILE C 32 117.716 5.178 -2.596 1.00 0.00 O ATOM 245 CB ILE C 32 114.964 4.168 -2.005 1.00 0.00 C ATOM 246 CG1 ILE C 32 113.772 3.548 -1.256 1.00 0.00 C ATOM 247 CG2 ILE C 32 115.544 3.120 -2.980 1.00 0.00 C ATOM 248 CD1 ILE C 32 114.210 2.271 -0.511 1.00 0.00 C ATOM 0 H ILE C 32 115.262 6.576 -1.238 1.00 0.00 H new ATOM 0 HA ILE C 32 115.955 3.989 -0.112 1.00 0.00 H new ATOM 0 HB ILE C 32 114.643 5.036 -2.581 1.00 0.00 H new ATOM 0 HG12 ILE C 32 113.365 4.269 -0.547 1.00 0.00 H new ATOM 0 HG13 ILE C 32 112.975 3.310 -1.961 1.00 0.00 H new ATOM 0 HG21 ILE C 32 114.771 2.811 -3.684 1.00 0.00 H new ATOM 0 HG22 ILE C 32 116.380 3.556 -3.528 1.00 0.00 H new ATOM 0 HG23 ILE C 32 115.891 2.253 -2.418 1.00 0.00 H new ATOM 0 HD11 ILE C 32 113.355 1.845 0.014 1.00 0.00 H new ATOM 0 HD12 ILE C 32 114.595 1.545 -1.228 1.00 0.00 H new ATOM 0 HD13 ILE C 32 114.990 2.519 0.208 1.00 0.00 H new ATOM 260 N GLY C 33 118.233 3.707 -0.964 1.00 0.00 N ATOM 261 CA GLY C 33 119.586 3.460 -1.418 1.00 0.00 C ATOM 262 C GLY C 33 119.899 1.995 -1.213 1.00 0.00 C ATOM 263 O GLY C 33 119.345 1.362 -0.311 1.00 0.00 O ATOM 0 H GLY C 33 117.974 3.183 -0.128 1.00 0.00 H new ATOM 0 HA2 GLY C 33 119.687 3.726 -2.470 1.00 0.00 H new ATOM 0 HA3 GLY C 33 120.291 4.079 -0.864 1.00 0.00 H new ATOM 267 N LEU C 34 120.767 1.453 -2.051 1.00 0.00 N ATOM 268 CA LEU C 34 121.129 0.042 -1.942 1.00 0.00 C ATOM 269 C LEU C 34 122.625 -0.131 -1.822 1.00 0.00 C ATOM 270 O LEU C 34 123.405 0.745 -2.196 1.00 0.00 O ATOM 271 CB LEU C 34 120.617 -0.758 -3.139 1.00 0.00 C ATOM 272 CG LEU C 34 120.867 0.012 -4.435 1.00 0.00 C ATOM 273 CD1 LEU C 34 121.243 -0.982 -5.545 1.00 0.00 C ATOM 274 CD2 LEU C 34 119.605 0.815 -4.808 1.00 0.00 C ATOM 0 H LEU C 34 121.231 1.957 -2.806 1.00 0.00 H new ATOM 0 HA LEU C 34 120.656 -0.339 -1.037 1.00 0.00 H new ATOM 0 HB2 LEU C 34 121.118 -1.725 -3.180 1.00 0.00 H new ATOM 0 HB3 LEU C 34 119.551 -0.955 -3.025 1.00 0.00 H new ATOM 0 HG LEU C 34 121.690 0.715 -4.305 1.00 0.00 H new ATOM 0 HD11 LEU C 34 121.423 -0.440 -6.473 1.00 0.00 H new ATOM 0 HD12 LEU C 34 122.146 -1.522 -5.259 1.00 0.00 H new ATOM 0 HD13 LEU C 34 120.427 -1.690 -5.691 1.00 0.00 H new ATOM 0 HD21 LEU C 34 119.783 1.364 -5.732 1.00 0.00 H new ATOM 0 HD22 LEU C 34 118.767 0.132 -4.948 1.00 0.00 H new ATOM 0 HD23 LEU C 34 119.371 1.517 -4.008 1.00 0.00 H new ATOM 286 N MET C 35 122.999 -1.281 -1.293 1.00 0.00 N ATOM 287 CA MET C 35 124.405 -1.630 -1.094 1.00 0.00 C ATOM 288 C MET C 35 124.842 -2.644 -2.153 1.00 0.00 C ATOM 289 O MET C 35 124.041 -3.480 -2.581 1.00 0.00 O ATOM 290 CB MET C 35 124.607 -2.151 0.349 1.00 0.00 C ATOM 291 CG MET C 35 124.957 -3.646 0.381 1.00 0.00 C ATOM 292 SD MET C 35 124.867 -4.256 2.078 1.00 0.00 S ATOM 293 CE MET C 35 126.078 -3.119 2.778 1.00 0.00 C ATOM 0 H MET C 35 122.344 -2.001 -0.988 1.00 0.00 H new ATOM 0 HA MET C 35 125.036 -0.750 -1.215 1.00 0.00 H new ATOM 0 HB2 MET C 35 125.403 -1.583 0.831 1.00 0.00 H new ATOM 0 HB3 MET C 35 123.698 -1.980 0.926 1.00 0.00 H new ATOM 0 HG2 MET C 35 124.268 -4.204 -0.253 1.00 0.00 H new ATOM 0 HG3 MET C 35 125.958 -3.804 -0.020 1.00 0.00 H new ATOM 0 HE1 MET C 35 126.347 -3.447 3.782 1.00 0.00 H new ATOM 0 HE2 MET C 35 126.969 -3.104 2.150 1.00 0.00 H new ATOM 0 HE3 MET C 35 125.651 -2.117 2.826 1.00 0.00 H new ATOM 303 N VAL C 36 126.103 -2.542 -2.585 1.00 0.00 N ATOM 304 CA VAL C 36 126.636 -3.430 -3.620 1.00 0.00 C ATOM 305 C VAL C 36 128.003 -4.013 -3.217 1.00 0.00 C ATOM 306 O VAL C 36 128.951 -3.266 -2.962 1.00 0.00 O ATOM 307 CB VAL C 36 126.817 -2.645 -4.938 1.00 0.00 C ATOM 308 CG1 VAL C 36 126.925 -3.624 -6.114 1.00 0.00 C ATOM 309 CG2 VAL C 36 125.634 -1.688 -5.171 1.00 0.00 C ATOM 0 H VAL C 36 126.771 -1.855 -2.235 1.00 0.00 H new ATOM 0 HA VAL C 36 125.925 -4.246 -3.748 1.00 0.00 H new ATOM 0 HB VAL C 36 127.732 -2.056 -4.865 1.00 0.00 H new ATOM 0 HG11 VAL C 36 127.053 -3.066 -7.042 1.00 0.00 H new ATOM 0 HG12 VAL C 36 127.783 -4.280 -5.964 1.00 0.00 H new ATOM 0 HG13 VAL C 36 126.016 -4.223 -6.173 1.00 0.00 H new ATOM 0 HG21 VAL C 36 125.783 -1.146 -6.105 1.00 0.00 H new ATOM 0 HG22 VAL C 36 124.708 -2.261 -5.228 1.00 0.00 H new ATOM 0 HG23 VAL C 36 125.572 -0.979 -4.346 1.00 0.00 H new ATOM 319 N GLY C 37 128.105 -5.346 -3.221 1.00 0.00 N ATOM 320 CA GLY C 37 129.372 -6.037 -2.922 1.00 0.00 C ATOM 321 C GLY C 37 129.601 -6.258 -1.443 1.00 0.00 C ATOM 322 O GLY C 37 129.875 -5.314 -0.699 1.00 0.00 O ATOM 0 H GLY C 37 127.327 -5.972 -3.428 1.00 0.00 H new ATOM 0 HA2 GLY C 37 129.381 -7.001 -3.431 1.00 0.00 H new ATOM 0 HA3 GLY C 37 130.199 -5.455 -3.327 1.00 0.00 H new ATOM 326 N GLY C 38 129.495 -7.528 -1.027 1.00 0.00 N ATOM 327 CA GLY C 38 129.692 -7.901 0.366 1.00 0.00 C ATOM 328 C GLY C 38 128.662 -7.218 1.239 1.00 0.00 C ATOM 329 O GLY C 38 127.787 -6.513 0.736 1.00 0.00 O ATOM 0 H GLY C 38 129.273 -8.310 -1.643 1.00 0.00 H new ATOM 0 HA2 GLY C 38 129.613 -8.983 0.475 1.00 0.00 H new ATOM 0 HA3 GLY C 38 130.695 -7.621 0.687 1.00 0.00 H new ATOM 333 N VAL C 39 128.765 -7.422 2.540 1.00 0.00 N ATOM 334 CA VAL C 39 127.823 -6.815 3.466 1.00 0.00 C ATOM 335 C VAL C 39 128.574 -6.107 4.605 1.00 0.00 C ATOM 336 O VAL C 39 129.657 -6.542 5.008 1.00 0.00 O ATOM 337 CB VAL C 39 126.884 -7.906 4.019 1.00 0.00 C ATOM 338 CG1 VAL C 39 127.698 -8.971 4.771 1.00 0.00 C ATOM 339 CG2 VAL C 39 125.839 -7.285 4.965 1.00 0.00 C ATOM 0 H VAL C 39 129.484 -7.998 2.977 1.00 0.00 H new ATOM 0 HA VAL C 39 127.228 -6.066 2.944 1.00 0.00 H new ATOM 0 HB VAL C 39 126.367 -8.375 3.182 1.00 0.00 H new ATOM 0 HG11 VAL C 39 127.026 -9.737 5.158 1.00 0.00 H new ATOM 0 HG12 VAL C 39 128.416 -9.428 4.090 1.00 0.00 H new ATOM 0 HG13 VAL C 39 128.231 -8.504 5.599 1.00 0.00 H new ATOM 0 HG21 VAL C 39 125.184 -8.068 5.347 1.00 0.00 H new ATOM 0 HG22 VAL C 39 126.346 -6.798 5.798 1.00 0.00 H new ATOM 0 HG23 VAL C 39 125.247 -6.550 4.420 1.00 0.00 H new ATOM 349 N VAL C 40 127.990 -5.019 5.118 1.00 0.00 N ATOM 350 CA VAL C 40 128.604 -4.254 6.212 1.00 0.00 C ATOM 351 C VAL C 40 127.558 -3.386 6.928 1.00 0.00 C ATOM 352 O VAL C 40 126.682 -2.861 6.257 1.00 0.00 O ATOM 353 CB VAL C 40 129.756 -3.379 5.664 1.00 0.00 C ATOM 354 CG1 VAL C 40 129.224 -2.334 4.666 1.00 0.00 C ATOM 355 CG2 VAL C 40 130.468 -2.662 6.825 1.00 0.00 C ATOM 356 OXT VAL C 40 127.651 -3.259 8.139 1.00 0.00 O ATOM 0 H VAL C 40 127.096 -4.648 4.796 1.00 0.00 H new ATOM 0 HA VAL C 40 129.011 -4.956 6.940 1.00 0.00 H new ATOM 0 HB VAL C 40 130.461 -4.029 5.147 1.00 0.00 H new ATOM 0 HG11 VAL C 40 130.052 -1.731 4.295 1.00 0.00 H new ATOM 0 HG12 VAL C 40 128.741 -2.841 3.831 1.00 0.00 H new ATOM 0 HG13 VAL C 40 128.501 -1.689 5.165 1.00 0.00 H new ATOM 0 HG21 VAL C 40 131.278 -2.048 6.431 1.00 0.00 H new ATOM 0 HG22 VAL C 40 129.755 -2.028 7.353 1.00 0.00 H new ATOM 0 HG23 VAL C 40 130.876 -3.402 7.514 1.00 0.00 H new TER 366 VAL C 40 ATOM 367 N GLY E 14 131.511 -2.321 0.854 1.00 0.00 N ATOM 368 CA GLY E 14 130.838 -2.353 -0.444 1.00 0.00 C ATOM 369 C GLY E 14 130.472 -0.957 -0.946 1.00 0.00 C ATOM 370 O GLY E 14 130.463 0.012 -0.183 1.00 0.00 O ATOM 0 HA2 GLY E 14 131.485 -2.840 -1.174 1.00 0.00 H new ATOM 0 HA3 GLY E 14 129.934 -2.957 -0.366 1.00 0.00 H new ATOM 374 N GLU E 15 130.131 -0.889 -2.237 1.00 0.00 N ATOM 375 CA GLU E 15 129.714 0.361 -2.878 1.00 0.00 C ATOM 376 C GLU E 15 128.232 0.576 -2.615 1.00 0.00 C ATOM 377 O GLU E 15 127.439 -0.342 -2.791 1.00 0.00 O ATOM 378 CB GLU E 15 129.981 0.277 -4.394 1.00 0.00 C ATOM 379 CG GLU E 15 129.393 1.502 -5.116 1.00 0.00 C ATOM 380 CD GLU E 15 129.651 1.404 -6.621 1.00 0.00 C ATOM 381 OE1 GLU E 15 130.807 1.465 -7.011 1.00 0.00 O ATOM 382 OE2 GLU E 15 128.690 1.268 -7.363 1.00 0.00 O ATOM 0 H GLU E 15 130.136 -1.694 -2.863 1.00 0.00 H new ATOM 0 HA GLU E 15 130.279 1.199 -2.470 1.00 0.00 H new ATOM 0 HB2 GLU E 15 131.054 0.221 -4.577 1.00 0.00 H new ATOM 0 HB3 GLU E 15 129.540 -0.635 -4.796 1.00 0.00 H new ATOM 0 HG2 GLU E 15 128.321 1.565 -4.927 1.00 0.00 H new ATOM 0 HG3 GLU E 15 129.840 2.415 -4.722 1.00 0.00 H new ATOM 389 N ILE E 16 127.866 1.786 -2.188 1.00 0.00 N ATOM 390 CA ILE E 16 126.466 2.091 -1.891 1.00 0.00 C ATOM 391 C ILE E 16 125.887 3.081 -2.913 1.00 0.00 C ATOM 392 O ILE E 16 126.469 4.132 -3.193 1.00 0.00 O ATOM 393 CB ILE E 16 126.350 2.610 -0.442 1.00 0.00 C ATOM 394 CG1 ILE E 16 126.990 1.550 0.517 1.00 0.00 C ATOM 395 CG2 ILE E 16 124.871 2.847 -0.099 1.00 0.00 C ATOM 396 CD1 ILE E 16 126.201 1.382 1.830 1.00 0.00 C ATOM 0 H ILE E 16 128.511 2.562 -2.041 1.00 0.00 H new ATOM 0 HA ILE E 16 125.871 1.181 -1.974 1.00 0.00 H new ATOM 0 HB ILE E 16 126.878 3.557 -0.328 1.00 0.00 H new ATOM 0 HG12 ILE E 16 127.044 0.589 0.005 1.00 0.00 H new ATOM 0 HG13 ILE E 16 128.013 1.846 0.748 1.00 0.00 H new ATOM 0 HG21 ILE E 16 124.789 3.213 0.924 1.00 0.00 H new ATOM 0 HG22 ILE E 16 124.453 3.585 -0.783 1.00 0.00 H new ATOM 0 HG23 ILE E 16 124.321 1.911 -0.194 1.00 0.00 H new ATOM 0 HD11 ILE E 16 126.690 0.635 2.455 1.00 0.00 H new ATOM 0 HD12 ILE E 16 126.169 2.334 2.360 1.00 0.00 H new ATOM 0 HD13 ILE E 16 125.185 1.058 1.605 1.00 0.00 H new ATOM 408 N VAL E 17 124.739 2.682 -3.472 1.00 0.00 N ATOM 409 CA VAL E 17 124.016 3.446 -4.502 1.00 0.00 C ATOM 410 C VAL E 17 122.731 4.082 -3.955 1.00 0.00 C ATOM 411 O VAL E 17 122.042 3.495 -3.124 1.00 0.00 O ATOM 412 CB VAL E 17 123.655 2.485 -5.654 1.00 0.00 C ATOM 413 CG1 VAL E 17 122.690 3.153 -6.654 1.00 0.00 C ATOM 414 CG2 VAL E 17 124.934 2.056 -6.382 1.00 0.00 C ATOM 0 H VAL E 17 124.278 1.808 -3.220 1.00 0.00 H new ATOM 0 HA VAL E 17 124.661 4.255 -4.846 1.00 0.00 H new ATOM 0 HB VAL E 17 123.158 1.613 -5.230 1.00 0.00 H new ATOM 0 HG11 VAL E 17 122.453 2.452 -7.455 1.00 0.00 H new ATOM 0 HG12 VAL E 17 121.773 3.439 -6.139 1.00 0.00 H new ATOM 0 HG13 VAL E 17 123.161 4.041 -7.076 1.00 0.00 H new ATOM 0 HG21 VAL E 17 124.679 1.377 -7.196 1.00 0.00 H new ATOM 0 HG22 VAL E 17 125.435 2.936 -6.787 1.00 0.00 H new ATOM 0 HG23 VAL E 17 125.599 1.550 -5.682 1.00 0.00 H new ATOM 424 N TYR E 18 122.410 5.275 -4.472 1.00 0.00 N ATOM 425 CA TYR E 18 121.189 5.999 -4.094 1.00 0.00 C ATOM 426 C TYR E 18 120.422 6.408 -5.355 1.00 0.00 C ATOM 427 O TYR E 18 120.991 7.058 -6.239 1.00 0.00 O ATOM 428 CB TYR E 18 121.541 7.243 -3.262 1.00 0.00 C ATOM 429 CG TYR E 18 121.929 6.825 -1.870 1.00 0.00 C ATOM 430 CD1 TYR E 18 123.250 6.474 -1.589 1.00 0.00 C ATOM 431 CD2 TYR E 18 120.961 6.795 -0.859 1.00 0.00 C ATOM 432 CE1 TYR E 18 123.606 6.093 -0.296 1.00 0.00 C ATOM 433 CE2 TYR E 18 121.318 6.412 0.430 1.00 0.00 C ATOM 434 CZ TYR E 18 122.642 6.061 0.718 1.00 0.00 C ATOM 435 OH TYR E 18 122.997 5.690 1.998 1.00 0.00 O ATOM 0 H TYR E 18 122.985 5.763 -5.159 1.00 0.00 H new ATOM 0 HA TYR E 18 120.562 5.345 -3.489 1.00 0.00 H new ATOM 0 HB2 TYR E 18 122.361 7.787 -3.731 1.00 0.00 H new ATOM 0 HB3 TYR E 18 120.689 7.921 -3.225 1.00 0.00 H new ATOM 0 HD1 TYR E 18 123.995 6.497 -2.371 1.00 0.00 H new ATOM 0 HD2 TYR E 18 119.940 7.068 -1.079 1.00 0.00 H new ATOM 0 HE1 TYR E 18 124.628 5.822 -0.076 1.00 0.00 H new ATOM 0 HE2 TYR E 18 120.572 6.385 1.210 1.00 0.00 H new ATOM 0 HH TYR E 18 122.554 6.279 2.644 1.00 0.00 H new ATOM 445 N LEU E 19 119.132 6.032 -5.429 1.00 0.00 N ATOM 446 CA LEU E 19 118.294 6.377 -6.591 1.00 0.00 C ATOM 447 C LEU E 19 117.029 7.145 -6.145 1.00 0.00 C ATOM 448 O LEU E 19 115.907 6.771 -6.508 1.00 0.00 O ATOM 449 CB LEU E 19 117.863 5.108 -7.371 1.00 0.00 C ATOM 450 CG LEU E 19 119.029 4.118 -7.569 1.00 0.00 C ATOM 451 CD1 LEU E 19 118.477 2.745 -7.980 1.00 0.00 C ATOM 452 CD2 LEU E 19 119.988 4.624 -8.659 1.00 0.00 C ATOM 0 H LEU E 19 118.652 5.495 -4.707 1.00 0.00 H new ATOM 0 HA LEU E 19 118.895 7.010 -7.245 1.00 0.00 H new ATOM 0 HB2 LEU E 19 117.055 4.611 -6.834 1.00 0.00 H new ATOM 0 HB3 LEU E 19 117.467 5.399 -8.344 1.00 0.00 H new ATOM 0 HG LEU E 19 119.574 4.033 -6.629 1.00 0.00 H new ATOM 0 HD11 LEU E 19 119.303 2.048 -8.119 1.00 0.00 H new ATOM 0 HD12 LEU E 19 117.814 2.371 -7.200 1.00 0.00 H new ATOM 0 HD13 LEU E 19 117.922 2.841 -8.913 1.00 0.00 H new ATOM 0 HD21 LEU E 19 120.804 3.912 -8.784 1.00 0.00 H new ATOM 0 HD22 LEU E 19 119.448 4.726 -9.600 1.00 0.00 H new ATOM 0 HD23 LEU E 19 120.393 5.593 -8.366 1.00 0.00 H new ATOM 464 N PRO E 20 117.172 8.223 -5.394 1.00 0.00 N ATOM 465 CA PRO E 20 115.999 9.037 -4.938 1.00 0.00 C ATOM 466 C PRO E 20 115.263 9.665 -6.118 1.00 0.00 C ATOM 467 O PRO E 20 114.138 10.150 -5.975 1.00 0.00 O ATOM 468 CB PRO E 20 116.609 10.119 -4.039 1.00 0.00 C ATOM 469 CG PRO E 20 118.059 10.175 -4.393 1.00 0.00 C ATOM 470 CD PRO E 20 118.443 8.786 -4.900 1.00 0.00 C ATOM 0 HA PRO E 20 115.259 8.429 -4.418 1.00 0.00 H new ATOM 0 HB2 PRO E 20 116.128 11.083 -4.207 1.00 0.00 H new ATOM 0 HB3 PRO E 20 116.473 9.874 -2.986 1.00 0.00 H new ATOM 0 HG2 PRO E 20 118.241 10.930 -5.158 1.00 0.00 H new ATOM 0 HG3 PRO E 20 118.659 10.449 -3.525 1.00 0.00 H new ATOM 0 HD2 PRO E 20 119.189 8.842 -5.692 1.00 0.00 H new ATOM 0 HD3 PRO E 20 118.868 8.174 -4.105 1.00 0.00 H new ATOM 478 N ASN E 21 115.926 9.661 -7.275 1.00 0.00 N ATOM 479 CA ASN E 21 115.371 10.239 -8.491 1.00 0.00 C ATOM 480 C ASN E 21 114.460 9.250 -9.218 1.00 0.00 C ATOM 481 O ASN E 21 113.832 9.613 -10.215 1.00 0.00 O ATOM 482 CB ASN E 21 116.522 10.649 -9.420 1.00 0.00 C ATOM 483 CG ASN E 21 117.434 11.670 -8.734 1.00 0.00 C ATOM 484 OD1 ASN E 21 116.979 12.469 -7.913 1.00 0.00 O ATOM 485 ND2 ASN E 21 118.705 11.697 -9.029 1.00 0.00 N ATOM 0 H ASN E 21 116.856 9.259 -7.392 1.00 0.00 H new ATOM 0 HA ASN E 21 114.773 11.108 -8.216 1.00 0.00 H new ATOM 0 HB2 ASN E 21 117.100 9.769 -9.701 1.00 0.00 H new ATOM 0 HB3 ASN E 21 116.120 11.073 -10.340 1.00 0.00 H new ATOM 0 HD21 ASN E 21 119.318 12.378 -8.581 1.00 0.00 H new ATOM 0 HD22 ASN E 21 119.085 11.037 -9.708 1.00 0.00 H new ATOM 492 N LEU E 22 114.393 8.005 -8.724 1.00 0.00 N ATOM 493 CA LEU E 22 113.560 6.979 -9.349 1.00 0.00 C ATOM 494 C LEU E 22 112.198 6.900 -8.675 1.00 0.00 C ATOM 495 O LEU E 22 112.100 6.859 -7.445 1.00 0.00 O ATOM 496 CB LEU E 22 114.268 5.617 -9.270 1.00 0.00 C ATOM 497 CG LEU E 22 115.177 5.409 -10.499 1.00 0.00 C ATOM 498 CD1 LEU E 22 116.131 6.605 -10.689 1.00 0.00 C ATOM 499 CD2 LEU E 22 115.992 4.112 -10.318 1.00 0.00 C ATOM 0 H LEU E 22 114.904 7.690 -7.899 1.00 0.00 H new ATOM 0 HA LEU E 22 113.406 7.247 -10.394 1.00 0.00 H new ATOM 0 HB2 LEU E 22 114.862 5.561 -8.358 1.00 0.00 H new ATOM 0 HB3 LEU E 22 113.528 4.818 -9.218 1.00 0.00 H new ATOM 0 HG LEU E 22 114.550 5.331 -11.387 1.00 0.00 H new ATOM 0 HD11 LEU E 22 116.761 6.433 -11.562 1.00 0.00 H new ATOM 0 HD12 LEU E 22 115.549 7.515 -10.835 1.00 0.00 H new ATOM 0 HD13 LEU E 22 116.759 6.714 -9.805 1.00 0.00 H new ATOM 0 HD21 LEU E 22 116.635 3.963 -11.185 1.00 0.00 H new ATOM 0 HD22 LEU E 22 116.605 4.190 -9.420 1.00 0.00 H new ATOM 0 HD23 LEU E 22 115.312 3.266 -10.220 1.00 0.00 H new ATOM 511 N ASN E 23 111.155 6.868 -9.502 1.00 0.00 N ATOM 512 CA ASN E 23 109.782 6.780 -9.008 1.00 0.00 C ATOM 513 C ASN E 23 109.538 5.389 -8.413 1.00 0.00 C ATOM 514 O ASN E 23 110.275 4.451 -8.729 1.00 0.00 O ATOM 515 CB ASN E 23 108.802 7.039 -10.163 1.00 0.00 C ATOM 516 CG ASN E 23 108.810 8.521 -10.546 1.00 0.00 C ATOM 517 OD1 ASN E 23 107.751 9.137 -10.665 1.00 0.00 O ATOM 518 ND2 ASN E 23 109.946 9.132 -10.747 1.00 0.00 N ATOM 0 H ASN E 23 111.234 6.902 -10.518 1.00 0.00 H new ATOM 0 HA ASN E 23 109.625 7.530 -8.233 1.00 0.00 H new ATOM 0 HB2 ASN E 23 109.078 6.432 -11.026 1.00 0.00 H new ATOM 0 HB3 ASN E 23 107.796 6.738 -9.870 1.00 0.00 H new ATOM 0 HD21 ASN E 23 109.956 10.119 -11.003 1.00 0.00 H new ATOM 0 HD22 ASN E 23 110.824 8.622 -10.648 1.00 0.00 H new ATOM 525 N PRO E 24 108.527 5.219 -7.573 1.00 0.00 N ATOM 526 CA PRO E 24 108.219 3.884 -6.956 1.00 0.00 C ATOM 527 C PRO E 24 108.088 2.793 -8.021 1.00 0.00 C ATOM 528 O PRO E 24 108.444 1.635 -7.787 1.00 0.00 O ATOM 529 CB PRO E 24 106.891 4.109 -6.223 1.00 0.00 C ATOM 530 CG PRO E 24 106.816 5.581 -5.975 1.00 0.00 C ATOM 531 CD PRO E 24 107.579 6.257 -7.116 1.00 0.00 C ATOM 0 HA PRO E 24 109.011 3.542 -6.289 1.00 0.00 H new ATOM 0 HB2 PRO E 24 106.048 3.769 -6.825 1.00 0.00 H new ATOM 0 HB3 PRO E 24 106.860 3.551 -5.287 1.00 0.00 H new ATOM 0 HG2 PRO E 24 105.779 5.917 -5.950 1.00 0.00 H new ATOM 0 HG3 PRO E 24 107.257 5.834 -5.011 1.00 0.00 H new ATOM 0 HD2 PRO E 24 106.908 6.566 -7.917 1.00 0.00 H new ATOM 0 HD3 PRO E 24 108.100 7.151 -6.774 1.00 0.00 H new ATOM 539 N ASP E 25 107.604 3.192 -9.199 1.00 0.00 N ATOM 540 CA ASP E 25 107.455 2.270 -10.321 1.00 0.00 C ATOM 541 C ASP E 25 108.833 1.816 -10.795 1.00 0.00 C ATOM 542 O ASP E 25 109.075 0.624 -10.994 1.00 0.00 O ATOM 543 CB ASP E 25 106.735 2.973 -11.479 1.00 0.00 C ATOM 544 CG ASP E 25 105.328 3.407 -11.051 1.00 0.00 C ATOM 545 OD1 ASP E 25 104.514 2.536 -10.788 1.00 0.00 O ATOM 546 OD2 ASP E 25 105.086 4.602 -10.998 1.00 0.00 O ATOM 0 H ASP E 25 107.309 4.148 -9.398 1.00 0.00 H new ATOM 0 HA ASP E 25 106.872 1.408 -9.998 1.00 0.00 H new ATOM 0 HB2 ASP E 25 107.309 3.843 -11.798 1.00 0.00 H new ATOM 0 HB3 ASP E 25 106.670 2.302 -12.336 1.00 0.00 H new ATOM 551 N GLN E 26 109.726 2.794 -10.971 1.00 0.00 N ATOM 552 CA GLN E 26 111.086 2.532 -11.422 1.00 0.00 C ATOM 553 C GLN E 26 111.853 1.702 -10.392 1.00 0.00 C ATOM 554 O GLN E 26 112.546 0.747 -10.755 1.00 0.00 O ATOM 555 CB GLN E 26 111.806 3.866 -11.660 1.00 0.00 C ATOM 556 CG GLN E 26 111.129 4.637 -12.806 1.00 0.00 C ATOM 557 CD GLN E 26 111.311 3.894 -14.127 1.00 0.00 C ATOM 558 OE1 GLN E 26 110.336 3.593 -14.815 1.00 0.00 O ATOM 559 NE2 GLN E 26 112.510 3.576 -14.519 1.00 0.00 N ATOM 0 H GLN E 26 109.524 3.780 -10.805 1.00 0.00 H new ATOM 0 HA GLN E 26 111.044 1.964 -12.351 1.00 0.00 H new ATOM 0 HB2 GLN E 26 111.789 4.465 -10.749 1.00 0.00 H new ATOM 0 HB3 GLN E 26 112.853 3.684 -11.903 1.00 0.00 H new ATOM 0 HG2 GLN E 26 110.067 4.759 -12.593 1.00 0.00 H new ATOM 0 HG3 GLN E 26 111.556 5.637 -12.882 1.00 0.00 H new ATOM 0 HE21 GLN E 26 113.317 3.826 -13.947 1.00 0.00 H new ATOM 0 HE22 GLN E 26 112.643 3.076 -15.398 1.00 0.00 H new ATOM 568 N LEU E 27 111.721 2.065 -9.107 1.00 0.00 N ATOM 569 CA LEU E 27 112.405 1.328 -8.044 1.00 0.00 C ATOM 570 C LEU E 27 111.868 -0.100 -7.969 1.00 0.00 C ATOM 571 O LEU E 27 112.642 -1.048 -7.850 1.00 0.00 O ATOM 572 CB LEU E 27 112.228 2.024 -6.681 1.00 0.00 C ATOM 573 CG LEU E 27 112.915 3.405 -6.683 1.00 0.00 C ATOM 574 CD1 LEU E 27 112.668 4.113 -5.341 1.00 0.00 C ATOM 575 CD2 LEU E 27 114.432 3.250 -6.889 1.00 0.00 C ATOM 0 H LEU E 27 111.156 2.851 -8.786 1.00 0.00 H new ATOM 0 HA LEU E 27 113.469 1.305 -8.280 1.00 0.00 H new ATOM 0 HB2 LEU E 27 111.167 2.140 -6.461 1.00 0.00 H new ATOM 0 HB3 LEU E 27 112.651 1.403 -5.892 1.00 0.00 H new ATOM 0 HG LEU E 27 112.497 3.995 -7.499 1.00 0.00 H new ATOM 0 HD11 LEU E 27 113.156 5.088 -5.349 1.00 0.00 H new ATOM 0 HD12 LEU E 27 111.596 4.245 -5.191 1.00 0.00 H new ATOM 0 HD13 LEU E 27 113.076 3.509 -4.531 1.00 0.00 H new ATOM 0 HD21 LEU E 27 114.902 4.234 -6.888 1.00 0.00 H new ATOM 0 HD22 LEU E 27 114.849 2.648 -6.082 1.00 0.00 H new ATOM 0 HD23 LEU E 27 114.621 2.759 -7.843 1.00 0.00 H new ATOM 587 N CYS E 28 110.542 -0.245 -8.059 1.00 0.00 N ATOM 588 CA CYS E 28 109.917 -1.569 -8.015 1.00 0.00 C ATOM 589 C CYS E 28 110.358 -2.407 -9.217 1.00 0.00 C ATOM 590 O CYS E 28 110.622 -3.606 -9.084 1.00 0.00 O ATOM 591 CB CYS E 28 108.390 -1.437 -8.002 1.00 0.00 C ATOM 592 SG CYS E 28 107.645 -3.065 -7.740 1.00 0.00 S ATOM 0 H CYS E 28 109.887 0.530 -8.162 1.00 0.00 H new ATOM 0 HA CYS E 28 110.236 -2.070 -7.101 1.00 0.00 H new ATOM 0 HB2 CYS E 28 108.080 -0.752 -7.212 1.00 0.00 H new ATOM 0 HB3 CYS E 28 108.043 -1.014 -8.945 1.00 0.00 H new ATOM 597 N ALA E 29 110.441 -1.760 -10.386 1.00 0.00 N ATOM 598 CA ALA E 29 110.861 -2.438 -11.614 1.00 0.00 C ATOM 599 C ALA E 29 112.295 -2.942 -11.472 1.00 0.00 C ATOM 600 O ALA E 29 112.609 -4.084 -11.821 1.00 0.00 O ATOM 601 CB ALA E 29 110.785 -1.458 -12.793 1.00 0.00 C ATOM 0 H ALA E 29 110.223 -0.771 -10.505 1.00 0.00 H new ATOM 0 HA ALA E 29 110.199 -3.285 -11.794 1.00 0.00 H new ATOM 0 HB1 ALA E 29 111.098 -1.963 -13.707 1.00 0.00 H new ATOM 0 HB2 ALA E 29 109.760 -1.104 -12.907 1.00 0.00 H new ATOM 0 HB3 ALA E 29 111.443 -0.610 -12.604 1.00 0.00 H new ATOM 607 N PHE E 30 113.149 -2.064 -10.952 1.00 0.00 N ATOM 608 CA PHE E 30 114.561 -2.371 -10.740 1.00 0.00 C ATOM 609 C PHE E 30 114.731 -3.453 -9.668 1.00 0.00 C ATOM 610 O PHE E 30 115.428 -4.442 -9.883 1.00 0.00 O ATOM 611 CB PHE E 30 115.274 -1.071 -10.327 1.00 0.00 C ATOM 612 CG PHE E 30 116.710 -1.327 -9.912 1.00 0.00 C ATOM 613 CD1 PHE E 30 117.612 -1.934 -10.797 1.00 0.00 C ATOM 614 CD2 PHE E 30 117.141 -0.939 -8.635 1.00 0.00 C ATOM 615 CE1 PHE E 30 118.938 -2.153 -10.401 1.00 0.00 C ATOM 616 CE2 PHE E 30 118.466 -1.157 -8.246 1.00 0.00 C ATOM 617 CZ PHE E 30 119.361 -1.762 -9.126 1.00 0.00 C ATOM 0 H PHE E 30 112.883 -1.122 -10.666 1.00 0.00 H new ATOM 0 HA PHE E 30 115.000 -2.761 -11.659 1.00 0.00 H new ATOM 0 HB2 PHE E 30 115.255 -0.366 -11.158 1.00 0.00 H new ATOM 0 HB3 PHE E 30 114.734 -0.606 -9.502 1.00 0.00 H new ATOM 0 HD1 PHE E 30 117.285 -2.232 -11.782 1.00 0.00 H new ATOM 0 HD2 PHE E 30 116.448 -0.471 -7.951 1.00 0.00 H new ATOM 0 HE1 PHE E 30 119.634 -2.624 -11.080 1.00 0.00 H new ATOM 0 HE2 PHE E 30 118.796 -0.856 -7.263 1.00 0.00 H new ATOM 0 HZ PHE E 30 120.384 -1.930 -8.823 1.00 0.00 H new ATOM 627 N ILE E 31 114.094 -3.235 -8.518 1.00 0.00 N ATOM 628 CA ILE E 31 114.167 -4.161 -7.380 1.00 0.00 C ATOM 629 C ILE E 31 113.685 -5.574 -7.737 1.00 0.00 C ATOM 630 O ILE E 31 114.237 -6.555 -7.227 1.00 0.00 O ATOM 631 CB ILE E 31 113.348 -3.566 -6.214 1.00 0.00 C ATOM 632 CG1 ILE E 31 114.121 -2.379 -5.626 1.00 0.00 C ATOM 633 CG2 ILE E 31 113.105 -4.594 -5.099 1.00 0.00 C ATOM 634 CD1 ILE E 31 113.228 -1.590 -4.667 1.00 0.00 C ATOM 0 H ILE E 31 113.513 -2.414 -8.346 1.00 0.00 H new ATOM 0 HA ILE E 31 115.211 -4.272 -7.086 1.00 0.00 H new ATOM 0 HB ILE E 31 112.379 -3.256 -6.606 1.00 0.00 H new ATOM 0 HG12 ILE E 31 115.006 -2.737 -5.099 1.00 0.00 H new ATOM 0 HG13 ILE E 31 114.469 -1.729 -6.429 1.00 0.00 H new ATOM 0 HG21 ILE E 31 112.525 -4.133 -4.299 1.00 0.00 H new ATOM 0 HG22 ILE E 31 112.555 -5.445 -5.502 1.00 0.00 H new ATOM 0 HG23 ILE E 31 114.062 -4.935 -4.704 1.00 0.00 H new ATOM 0 HD11 ILE E 31 113.788 -0.750 -4.256 1.00 0.00 H new ATOM 0 HD12 ILE E 31 112.357 -1.217 -5.205 1.00 0.00 H new ATOM 0 HD13 ILE E 31 112.902 -2.240 -3.855 1.00 0.00 H new ATOM 646 N HIS E 32 112.671 -5.685 -8.600 1.00 0.00 N ATOM 647 CA HIS E 32 112.162 -7.005 -8.983 1.00 0.00 C ATOM 648 C HIS E 32 113.225 -7.764 -9.768 1.00 0.00 C ATOM 649 O HIS E 32 113.545 -8.913 -9.453 1.00 0.00 O ATOM 650 CB HIS E 32 110.886 -6.861 -9.834 1.00 0.00 C ATOM 651 CG HIS E 32 109.667 -6.956 -8.951 1.00 0.00 C ATOM 652 ND1 HIS E 32 108.921 -5.843 -8.592 1.00 0.00 N ATOM 653 CD2 HIS E 32 109.051 -8.029 -8.354 1.00 0.00 C ATOM 654 CE1 HIS E 32 107.907 -6.270 -7.813 1.00 0.00 C ATOM 655 NE2 HIS E 32 107.941 -7.593 -7.636 1.00 0.00 N ATOM 0 H HIS E 32 112.195 -4.896 -9.038 1.00 0.00 H new ATOM 0 HA HIS E 32 111.919 -7.562 -8.078 1.00 0.00 H new ATOM 0 HB2 HIS E 32 110.893 -5.905 -10.357 1.00 0.00 H new ATOM 0 HB3 HIS E 32 110.856 -7.641 -10.595 1.00 0.00 H new ATOM 0 HD2 HIS E 32 109.378 -9.055 -8.430 1.00 0.00 H new ATOM 0 HE1 HIS E 32 107.158 -5.621 -7.384 1.00 0.00 H new ATOM 0 HE2 HIS E 32 107.293 -8.162 -7.092 1.00 0.00 H new ATOM 664 N SER E 33 113.772 -7.102 -10.784 1.00 0.00 N ATOM 665 CA SER E 33 114.810 -7.694 -11.623 1.00 0.00 C ATOM 666 C SER E 33 116.094 -7.927 -10.824 1.00 0.00 C ATOM 667 O SER E 33 116.764 -8.949 -10.992 1.00 0.00 O ATOM 668 CB SER E 33 115.089 -6.760 -12.804 1.00 0.00 C ATOM 669 OG SER E 33 116.001 -7.380 -13.705 1.00 0.00 O ATOM 0 H SER E 33 113.512 -6.151 -11.047 1.00 0.00 H new ATOM 0 HA SER E 33 114.462 -8.661 -11.988 1.00 0.00 H new ATOM 0 HB2 SER E 33 114.158 -6.523 -13.320 1.00 0.00 H new ATOM 0 HB3 SER E 33 115.503 -5.818 -12.444 1.00 0.00 H new ATOM 0 HG SER E 33 115.825 -7.065 -14.616 1.00 0.00 H new ATOM 675 N LEU E 34 116.417 -6.963 -9.962 1.00 0.00 N ATOM 676 CA LEU E 34 117.614 -7.028 -9.122 1.00 0.00 C ATOM 677 C LEU E 34 117.565 -8.264 -8.221 1.00 0.00 C ATOM 678 O LEU E 34 118.591 -8.905 -7.978 1.00 0.00 O ATOM 679 CB LEU E 34 117.680 -5.752 -8.267 1.00 0.00 C ATOM 680 CG LEU E 34 119.067 -5.589 -7.634 1.00 0.00 C ATOM 681 CD1 LEU E 34 120.123 -5.416 -8.743 1.00 0.00 C ATOM 682 CD2 LEU E 34 119.059 -4.351 -6.715 1.00 0.00 C ATOM 0 H LEU E 34 115.860 -6.119 -9.826 1.00 0.00 H new ATOM 0 HA LEU E 34 118.502 -7.101 -9.750 1.00 0.00 H new ATOM 0 HB2 LEU E 34 117.453 -4.883 -8.885 1.00 0.00 H new ATOM 0 HB3 LEU E 34 116.922 -5.794 -7.485 1.00 0.00 H new ATOM 0 HG LEU E 34 119.313 -6.474 -7.047 1.00 0.00 H new ATOM 0 HD11 LEU E 34 121.109 -5.300 -8.292 1.00 0.00 H new ATOM 0 HD12 LEU E 34 120.120 -6.294 -9.388 1.00 0.00 H new ATOM 0 HD13 LEU E 34 119.888 -4.531 -9.334 1.00 0.00 H new ATOM 0 HD21 LEU E 34 120.042 -4.229 -6.261 1.00 0.00 H new ATOM 0 HD22 LEU E 34 118.817 -3.464 -7.301 1.00 0.00 H new ATOM 0 HD23 LEU E 34 118.312 -4.484 -5.932 1.00 0.00 H new ATOM 694 N HIS E 35 116.363 -8.577 -7.728 1.00 0.00 N ATOM 695 CA HIS E 35 116.162 -9.727 -6.845 1.00 0.00 C ATOM 696 C HIS E 35 116.028 -11.035 -7.634 1.00 0.00 C ATOM 697 O HIS E 35 116.718 -12.015 -7.340 1.00 0.00 O ATOM 698 CB HIS E 35 114.899 -9.508 -6.009 1.00 0.00 C ATOM 699 CG HIS E 35 114.820 -10.560 -4.930 1.00 0.00 C ATOM 700 ND1 HIS E 35 115.491 -10.430 -3.724 1.00 0.00 N ATOM 701 CD2 HIS E 35 114.167 -11.766 -4.866 1.00 0.00 C ATOM 702 CE1 HIS E 35 115.228 -11.529 -2.992 1.00 0.00 C ATOM 703 NE2 HIS E 35 114.426 -12.376 -3.642 1.00 0.00 N ATOM 0 H HIS E 35 115.514 -8.048 -7.927 1.00 0.00 H new ATOM 0 HA HIS E 35 117.037 -9.812 -6.200 1.00 0.00 H new ATOM 0 HB2 HIS E 35 114.914 -8.514 -5.562 1.00 0.00 H new ATOM 0 HB3 HIS E 35 114.016 -9.558 -6.646 1.00 0.00 H new ATOM 0 HD2 HIS E 35 113.546 -12.179 -5.647 1.00 0.00 H new ATOM 0 HE1 HIS E 35 115.618 -11.704 -2.000 1.00 0.00 H new ATOM 0 HE2 HIS E 35 114.078 -13.276 -3.312 1.00 0.00 H new ATOM 712 N ASP E 36 115.114 -11.048 -8.611 1.00 0.00 N ATOM 713 CA ASP E 36 114.859 -12.245 -9.422 1.00 0.00 C ATOM 714 C ASP E 36 116.106 -12.702 -10.185 1.00 0.00 C ATOM 715 O ASP E 36 116.336 -13.907 -10.325 1.00 0.00 O ATOM 716 CB ASP E 36 113.722 -11.969 -10.424 1.00 0.00 C ATOM 717 CG ASP E 36 112.397 -11.662 -9.704 1.00 0.00 C ATOM 718 OD1 ASP E 36 112.164 -12.208 -8.632 1.00 0.00 O ATOM 719 OD2 ASP E 36 111.617 -10.897 -10.250 1.00 0.00 O ATOM 0 H ASP E 36 114.538 -10.243 -8.860 1.00 0.00 H new ATOM 0 HA ASP E 36 114.572 -13.044 -8.738 1.00 0.00 H new ATOM 0 HB2 ASP E 36 113.994 -11.128 -11.062 1.00 0.00 H new ATOM 0 HB3 ASP E 36 113.592 -12.833 -11.075 1.00 0.00 H new ATOM 724 N ASP E 37 116.889 -11.743 -10.688 1.00 0.00 N ATOM 725 CA ASP E 37 118.102 -12.055 -11.457 1.00 0.00 C ATOM 726 C ASP E 37 119.336 -11.387 -10.828 1.00 0.00 C ATOM 727 O ASP E 37 119.781 -10.328 -11.287 1.00 0.00 O ATOM 728 CB ASP E 37 117.926 -11.584 -12.912 1.00 0.00 C ATOM 729 CG ASP E 37 116.789 -12.358 -13.586 1.00 0.00 C ATOM 730 OD1 ASP E 37 115.643 -11.985 -13.385 1.00 0.00 O ATOM 731 OD2 ASP E 37 117.080 -13.313 -14.289 1.00 0.00 O ATOM 0 H ASP E 37 116.707 -10.745 -10.578 1.00 0.00 H new ATOM 0 HA ASP E 37 118.257 -13.134 -11.442 1.00 0.00 H new ATOM 0 HB2 ASP E 37 117.710 -10.516 -12.932 1.00 0.00 H new ATOM 0 HB3 ASP E 37 118.854 -11.732 -13.464 1.00 0.00 H new ATOM 736 N PRO E 38 119.897 -11.979 -9.784 1.00 0.00 N ATOM 737 CA PRO E 38 121.099 -11.418 -9.094 1.00 0.00 C ATOM 738 C PRO E 38 122.374 -11.580 -9.928 1.00 0.00 C ATOM 739 O PRO E 38 123.343 -10.836 -9.742 1.00 0.00 O ATOM 740 CB PRO E 38 121.177 -12.213 -7.788 1.00 0.00 C ATOM 741 CG PRO E 38 120.508 -13.517 -8.078 1.00 0.00 C ATOM 742 CD PRO E 38 119.454 -13.242 -9.155 1.00 0.00 C ATOM 0 HA PRO E 38 121.014 -10.344 -8.930 1.00 0.00 H new ATOM 0 HB2 PRO E 38 122.212 -12.362 -7.480 1.00 0.00 H new ATOM 0 HB3 PRO E 38 120.676 -11.686 -6.976 1.00 0.00 H new ATOM 0 HG2 PRO E 38 121.232 -14.255 -8.425 1.00 0.00 H new ATOM 0 HG3 PRO E 38 120.045 -13.923 -7.178 1.00 0.00 H new ATOM 0 HD2 PRO E 38 119.406 -14.053 -9.882 1.00 0.00 H new ATOM 0 HD3 PRO E 38 118.459 -13.143 -8.722 1.00 0.00 H new ATOM 750 N SER E 39 122.362 -12.555 -10.843 1.00 0.00 N ATOM 751 CA SER E 39 123.516 -12.812 -11.709 1.00 0.00 C ATOM 752 C SER E 39 123.848 -11.571 -12.540 1.00 0.00 C ATOM 753 O SER E 39 125.020 -11.249 -12.751 1.00 0.00 O ATOM 754 CB SER E 39 123.220 -13.994 -12.639 1.00 0.00 C ATOM 755 OG SER E 39 122.836 -15.123 -11.863 1.00 0.00 O ATOM 0 H SER E 39 121.569 -13.177 -11.002 1.00 0.00 H new ATOM 0 HA SER E 39 124.374 -13.054 -11.081 1.00 0.00 H new ATOM 0 HB2 SER E 39 122.425 -13.731 -13.337 1.00 0.00 H new ATOM 0 HB3 SER E 39 124.101 -14.231 -13.235 1.00 0.00 H new ATOM 0 HG SER E 39 122.645 -15.879 -12.457 1.00 0.00 H new ATOM 761 N GLN E 40 122.799 -10.882 -13.000 1.00 0.00 N ATOM 762 CA GLN E 40 122.949 -9.664 -13.805 1.00 0.00 C ATOM 763 C GLN E 40 122.812 -8.411 -12.938 1.00 0.00 C ATOM 764 O GLN E 40 122.652 -7.314 -13.463 1.00 0.00 O ATOM 765 CB GLN E 40 121.871 -9.624 -14.902 1.00 0.00 C ATOM 766 CG GLN E 40 122.065 -10.784 -15.878 1.00 0.00 C ATOM 767 CD GLN E 40 121.066 -10.679 -17.029 1.00 0.00 C ATOM 768 OE1 GLN E 40 121.274 -9.908 -17.965 1.00 0.00 O ATOM 769 NE2 GLN E 40 119.986 -11.410 -17.013 1.00 0.00 N ATOM 0 H GLN E 40 121.830 -11.149 -12.827 1.00 0.00 H new ATOM 0 HA GLN E 40 123.943 -9.681 -14.253 1.00 0.00 H new ATOM 0 HB2 GLN E 40 120.881 -9.681 -14.450 1.00 0.00 H new ATOM 0 HB3 GLN E 40 121.923 -8.676 -15.438 1.00 0.00 H new ATOM 0 HG2 GLN E 40 123.083 -10.774 -16.268 1.00 0.00 H new ATOM 0 HG3 GLN E 40 121.933 -11.733 -15.358 1.00 0.00 H new ATOM 0 HE21 GLN E 40 119.814 -12.049 -16.237 1.00 0.00 H new ATOM 0 HE22 GLN E 40 119.313 -11.343 -17.777 1.00 0.00 H new ATOM 778 N SER E 41 122.848 -8.579 -11.609 1.00 0.00 N ATOM 779 CA SER E 41 122.686 -7.449 -10.678 1.00 0.00 C ATOM 780 C SER E 41 123.608 -6.265 -11.000 1.00 0.00 C ATOM 781 O SER E 41 123.193 -5.113 -10.870 1.00 0.00 O ATOM 782 CB SER E 41 122.940 -7.916 -9.249 1.00 0.00 C ATOM 783 OG SER E 41 124.285 -8.354 -9.120 1.00 0.00 O ATOM 0 H SER E 41 122.987 -9.481 -11.154 1.00 0.00 H new ATOM 0 HA SER E 41 121.661 -7.096 -10.790 1.00 0.00 H new ATOM 0 HB2 SER E 41 122.744 -7.103 -8.550 1.00 0.00 H new ATOM 0 HB3 SER E 41 122.257 -8.727 -8.994 1.00 0.00 H new ATOM 0 HG SER E 41 124.336 -9.314 -9.310 1.00 0.00 H new ATOM 789 N ALA E 42 124.837 -6.552 -11.429 1.00 0.00 N ATOM 790 CA ALA E 42 125.778 -5.485 -11.772 1.00 0.00 C ATOM 791 C ALA E 42 125.320 -4.755 -13.038 1.00 0.00 C ATOM 792 O ALA E 42 125.269 -3.522 -13.068 1.00 0.00 O ATOM 793 CB ALA E 42 127.181 -6.063 -11.981 1.00 0.00 C ATOM 0 H ALA E 42 125.200 -7.498 -11.546 1.00 0.00 H new ATOM 0 HA ALA E 42 125.808 -4.773 -10.948 1.00 0.00 H new ATOM 0 HB1 ALA E 42 127.872 -5.259 -12.236 1.00 0.00 H new ATOM 0 HB2 ALA E 42 127.514 -6.551 -11.065 1.00 0.00 H new ATOM 0 HB3 ALA E 42 127.157 -6.791 -12.792 1.00 0.00 H new ATOM 799 N ASN E 43 124.970 -5.528 -14.074 1.00 0.00 N ATOM 800 CA ASN E 43 124.501 -4.943 -15.333 1.00 0.00 C ATOM 801 C ASN E 43 123.195 -4.192 -15.116 1.00 0.00 C ATOM 802 O ASN E 43 123.024 -3.075 -15.607 1.00 0.00 O ATOM 803 CB ASN E 43 124.286 -6.040 -16.383 1.00 0.00 C ATOM 804 CG ASN E 43 125.626 -6.480 -16.961 1.00 0.00 C ATOM 805 OD1 ASN E 43 126.074 -7.602 -16.724 1.00 0.00 O ATOM 806 ND2 ASN E 43 126.292 -5.653 -17.716 1.00 0.00 N ATOM 0 H ASN E 43 125.002 -6.547 -14.065 1.00 0.00 H new ATOM 0 HA ASN E 43 125.261 -4.247 -15.688 1.00 0.00 H new ATOM 0 HB2 ASN E 43 123.778 -6.892 -15.931 1.00 0.00 H new ATOM 0 HB3 ASN E 43 123.641 -5.670 -17.180 1.00 0.00 H new ATOM 0 HD21 ASN E 43 127.188 -5.934 -18.113 1.00 0.00 H new ATOM 0 HD22 ASN E 43 125.917 -4.724 -17.910 1.00 0.00 H new ATOM 813 N LEU E 44 122.286 -4.823 -14.369 1.00 0.00 N ATOM 814 CA LEU E 44 120.981 -4.239 -14.063 1.00 0.00 C ATOM 815 C LEU E 44 121.149 -2.909 -13.336 1.00 0.00 C ATOM 816 O LEU E 44 120.388 -1.966 -13.572 1.00 0.00 O ATOM 817 CB LEU E 44 120.168 -5.204 -13.187 1.00 0.00 C ATOM 818 CG LEU E 44 119.827 -6.481 -13.977 1.00 0.00 C ATOM 819 CD1 LEU E 44 119.416 -7.597 -13.005 1.00 0.00 C ATOM 820 CD2 LEU E 44 118.668 -6.200 -14.946 1.00 0.00 C ATOM 0 H LEU E 44 122.434 -5.747 -13.962 1.00 0.00 H new ATOM 0 HA LEU E 44 120.452 -4.065 -15.000 1.00 0.00 H new ATOM 0 HB2 LEU E 44 120.736 -5.462 -12.293 1.00 0.00 H new ATOM 0 HB3 LEU E 44 119.251 -4.719 -12.853 1.00 0.00 H new ATOM 0 HG LEU E 44 120.705 -6.794 -14.542 1.00 0.00 H new ATOM 0 HD11 LEU E 44 119.175 -8.499 -13.568 1.00 0.00 H new ATOM 0 HD12 LEU E 44 120.239 -7.805 -12.321 1.00 0.00 H new ATOM 0 HD13 LEU E 44 118.542 -7.280 -12.436 1.00 0.00 H new ATOM 0 HD21 LEU E 44 118.431 -7.107 -15.502 1.00 0.00 H new ATOM 0 HD22 LEU E 44 117.792 -5.881 -14.382 1.00 0.00 H new ATOM 0 HD23 LEU E 44 118.958 -5.413 -15.642 1.00 0.00 H new ATOM 832 N LEU E 45 122.153 -2.841 -12.458 1.00 0.00 N ATOM 833 CA LEU E 45 122.411 -1.617 -11.713 1.00 0.00 C ATOM 834 C LEU E 45 122.810 -0.498 -12.667 1.00 0.00 C ATOM 835 O LEU E 45 122.418 0.652 -12.476 1.00 0.00 O ATOM 836 CB LEU E 45 123.521 -1.830 -10.663 1.00 0.00 C ATOM 837 CG LEU E 45 123.071 -1.299 -9.289 1.00 0.00 C ATOM 838 CD1 LEU E 45 124.270 -1.289 -8.332 1.00 0.00 C ATOM 839 CD2 LEU E 45 122.487 0.127 -9.428 1.00 0.00 C ATOM 0 H LEU E 45 122.790 -3.610 -12.251 1.00 0.00 H new ATOM 0 HA LEU E 45 121.495 -1.339 -11.192 1.00 0.00 H new ATOM 0 HB2 LEU E 45 123.761 -2.891 -10.589 1.00 0.00 H new ATOM 0 HB3 LEU E 45 124.431 -1.318 -10.977 1.00 0.00 H new ATOM 0 HG LEU E 45 122.294 -1.950 -8.889 1.00 0.00 H new ATOM 0 HD11 LEU E 45 123.955 -0.914 -7.358 1.00 0.00 H new ATOM 0 HD12 LEU E 45 124.657 -2.302 -8.223 1.00 0.00 H new ATOM 0 HD13 LEU E 45 125.051 -0.644 -8.734 1.00 0.00 H new ATOM 0 HD21 LEU E 45 122.173 0.489 -8.449 1.00 0.00 H new ATOM 0 HD22 LEU E 45 123.248 0.794 -9.835 1.00 0.00 H new ATOM 0 HD23 LEU E 45 121.628 0.105 -10.099 1.00 0.00 H new ATOM 851 N ALA E 46 123.572 -0.850 -13.708 1.00 0.00 N ATOM 852 CA ALA E 46 124.002 0.131 -14.708 1.00 0.00 C ATOM 853 C ALA E 46 122.779 0.813 -15.314 1.00 0.00 C ATOM 854 O ALA E 46 122.801 2.006 -15.617 1.00 0.00 O ATOM 855 CB ALA E 46 124.805 -0.571 -15.812 1.00 0.00 C ATOM 0 H ALA E 46 123.901 -1.800 -13.879 1.00 0.00 H new ATOM 0 HA ALA E 46 124.632 0.880 -14.230 1.00 0.00 H new ATOM 0 HB1 ALA E 46 125.123 0.162 -16.553 1.00 0.00 H new ATOM 0 HB2 ALA E 46 125.682 -1.049 -15.376 1.00 0.00 H new ATOM 0 HB3 ALA E 46 124.181 -1.325 -16.292 1.00 0.00 H new ATOM 861 N GLU E 47 121.713 0.030 -15.468 1.00 0.00 N ATOM 862 CA GLU E 47 120.457 0.522 -16.028 1.00 0.00 C ATOM 863 C GLU E 47 119.780 1.473 -15.067 1.00 0.00 C ATOM 864 O GLU E 47 119.257 2.510 -15.478 1.00 0.00 O ATOM 865 CB GLU E 47 119.497 -0.645 -16.276 1.00 0.00 C ATOM 866 CG GLU E 47 120.271 -1.815 -16.874 1.00 0.00 C ATOM 867 CD GLU E 47 119.328 -2.895 -17.431 1.00 0.00 C ATOM 868 OE1 GLU E 47 118.289 -3.136 -16.830 1.00 0.00 O ATOM 869 OE2 GLU E 47 119.662 -3.470 -18.455 1.00 0.00 O ATOM 0 H GLU E 47 121.695 -0.957 -15.210 1.00 0.00 H new ATOM 0 HA GLU E 47 120.691 1.034 -16.961 1.00 0.00 H new ATOM 0 HB2 GLU E 47 119.024 -0.947 -15.342 1.00 0.00 H new ATOM 0 HB3 GLU E 47 118.700 -0.338 -16.953 1.00 0.00 H new ATOM 0 HG2 GLU E 47 120.920 -1.453 -17.671 1.00 0.00 H new ATOM 0 HG3 GLU E 47 120.916 -2.253 -16.112 1.00 0.00 H new ATOM 876 N ALA E 48 119.775 1.099 -13.786 1.00 0.00 N ATOM 877 CA ALA E 48 119.134 1.915 -12.785 1.00 0.00 C ATOM 878 C ALA E 48 119.942 3.176 -12.551 1.00 0.00 C ATOM 879 O ALA E 48 119.383 4.233 -12.276 1.00 0.00 O ATOM 880 CB ALA E 48 118.928 1.149 -11.485 1.00 0.00 C ATOM 0 H ALA E 48 120.205 0.245 -13.432 1.00 0.00 H new ATOM 0 HA ALA E 48 118.146 2.193 -13.153 1.00 0.00 H new ATOM 0 HB1 ALA E 48 118.443 1.796 -10.754 1.00 0.00 H new ATOM 0 HB2 ALA E 48 118.300 0.278 -11.672 1.00 0.00 H new ATOM 0 HB3 ALA E 48 119.894 0.824 -11.097 1.00 0.00 H new ATOM 886 N LYS E 49 121.265 3.057 -12.681 1.00 0.00 N ATOM 887 CA LYS E 49 122.136 4.205 -12.515 1.00 0.00 C ATOM 888 C LYS E 49 121.921 5.157 -13.677 1.00 0.00 C ATOM 889 O LYS E 49 121.804 6.369 -13.484 1.00 0.00 O ATOM 890 CB LYS E 49 123.594 3.766 -12.406 1.00 0.00 C ATOM 891 CG LYS E 49 123.833 3.234 -10.994 1.00 0.00 C ATOM 892 CD LYS E 49 125.194 2.548 -10.932 1.00 0.00 C ATOM 893 CE LYS E 49 125.443 2.019 -9.531 1.00 0.00 C ATOM 894 NZ LYS E 49 126.802 1.406 -9.467 1.00 0.00 N ATOM 0 H LYS E 49 121.746 2.184 -12.898 1.00 0.00 H new ATOM 0 HA LYS E 49 121.892 4.723 -11.588 1.00 0.00 H new ATOM 0 HB2 LYS E 49 123.814 2.995 -13.144 1.00 0.00 H new ATOM 0 HB3 LYS E 49 124.259 4.604 -12.613 1.00 0.00 H new ATOM 0 HG2 LYS E 49 123.793 4.052 -10.274 1.00 0.00 H new ATOM 0 HG3 LYS E 49 123.047 2.530 -10.721 1.00 0.00 H new ATOM 0 HD2 LYS E 49 125.231 1.730 -11.651 1.00 0.00 H new ATOM 0 HD3 LYS E 49 125.979 3.252 -11.209 1.00 0.00 H new ATOM 0 HE2 LYS E 49 125.362 2.828 -8.805 1.00 0.00 H new ATOM 0 HE3 LYS E 49 124.686 1.280 -9.270 1.00 0.00 H new ATOM 0 HZ1 LYS E 49 127.204 1.550 -8.519 1.00 0.00 H new ATOM 0 HZ2 LYS E 49 126.733 0.387 -9.662 1.00 0.00 H new ATOM 0 HZ3 LYS E 49 127.418 1.853 -10.176 1.00 0.00 H new ATOM 908 N LYS E 50 121.794 4.589 -14.884 1.00 0.00 N ATOM 909 CA LYS E 50 121.499 5.390 -16.063 1.00 0.00 C ATOM 910 C LYS E 50 120.136 6.046 -15.840 1.00 0.00 C ATOM 911 O LYS E 50 119.898 7.176 -16.264 1.00 0.00 O ATOM 912 CB LYS E 50 121.492 4.503 -17.314 1.00 0.00 C ATOM 913 CG LYS E 50 122.941 4.146 -17.700 1.00 0.00 C ATOM 914 CD LYS E 50 122.975 2.883 -18.582 1.00 0.00 C ATOM 915 CE LYS E 50 122.090 3.072 -19.818 1.00 0.00 C ATOM 916 NZ LYS E 50 122.498 2.105 -20.878 1.00 0.00 N ATOM 0 H LYS E 50 121.891 3.589 -15.061 1.00 0.00 H new ATOM 0 HA LYS E 50 122.259 6.157 -16.216 1.00 0.00 H new ATOM 0 HB2 LYS E 50 120.920 3.594 -17.125 1.00 0.00 H new ATOM 0 HB3 LYS E 50 121.002 5.022 -18.138 1.00 0.00 H new ATOM 0 HG2 LYS E 50 123.396 4.980 -18.233 1.00 0.00 H new ATOM 0 HG3 LYS E 50 123.533 3.982 -16.799 1.00 0.00 H new ATOM 0 HD2 LYS E 50 124.000 2.673 -18.889 1.00 0.00 H new ATOM 0 HD3 LYS E 50 122.631 2.022 -18.009 1.00 0.00 H new ATOM 0 HE2 LYS E 50 121.043 2.919 -19.555 1.00 0.00 H new ATOM 0 HE3 LYS E 50 122.179 4.093 -20.189 1.00 0.00 H new ATOM 0 HZ1 LYS E 50 121.896 2.235 -21.716 1.00 0.00 H new ATOM 0 HZ2 LYS E 50 123.492 2.271 -21.136 1.00 0.00 H new ATOM 0 HZ3 LYS E 50 122.391 1.134 -20.522 1.00 0.00 H new ATOM 930 N LEU E 51 119.273 5.321 -15.109 1.00 0.00 N ATOM 931 CA LEU E 51 117.945 5.811 -14.740 1.00 0.00 C ATOM 932 C LEU E 51 118.104 6.935 -13.715 1.00 0.00 C ATOM 933 O LEU E 51 117.393 7.942 -13.766 1.00 0.00 O ATOM 934 CB LEU E 51 117.133 4.663 -14.110 1.00 0.00 C ATOM 935 CG LEU E 51 115.885 4.286 -14.924 1.00 0.00 C ATOM 936 CD1 LEU E 51 114.844 5.417 -14.871 1.00 0.00 C ATOM 937 CD2 LEU E 51 116.250 3.965 -16.387 1.00 0.00 C ATOM 0 H LEU E 51 119.480 4.385 -14.761 1.00 0.00 H new ATOM 0 HA LEU E 51 117.426 6.180 -15.625 1.00 0.00 H new ATOM 0 HB2 LEU E 51 117.773 3.786 -14.011 1.00 0.00 H new ATOM 0 HB3 LEU E 51 116.829 4.951 -13.104 1.00 0.00 H new ATOM 0 HG LEU E 51 115.454 3.390 -14.478 1.00 0.00 H new ATOM 0 HD11 LEU E 51 113.967 5.132 -15.453 1.00 0.00 H new ATOM 0 HD12 LEU E 51 114.551 5.594 -13.836 1.00 0.00 H new ATOM 0 HD13 LEU E 51 115.275 6.328 -15.286 1.00 0.00 H new ATOM 0 HD21 LEU E 51 115.347 3.702 -16.938 1.00 0.00 H new ATOM 0 HD22 LEU E 51 116.714 4.838 -16.846 1.00 0.00 H new ATOM 0 HD23 LEU E 51 116.948 3.128 -16.413 1.00 0.00 H new ATOM 949 N ASN E 52 119.064 6.745 -12.789 1.00 0.00 N ATOM 950 CA ASN E 52 119.353 7.736 -11.749 1.00 0.00 C ATOM 951 C ASN E 52 119.684 9.064 -12.424 1.00 0.00 C ATOM 952 O ASN E 52 119.250 10.132 -11.982 1.00 0.00 O ATOM 953 CB ASN E 52 120.536 7.264 -10.862 1.00 0.00 C ATOM 954 CG ASN E 52 120.626 8.108 -9.585 1.00 0.00 C ATOM 955 OD1 ASN E 52 119.656 8.749 -9.179 1.00 0.00 O ATOM 956 ND2 ASN E 52 121.748 8.144 -8.920 1.00 0.00 N ATOM 0 H ASN E 52 119.650 5.911 -12.745 1.00 0.00 H new ATOM 0 HA ASN E 52 118.483 7.859 -11.103 1.00 0.00 H new ATOM 0 HB2 ASN E 52 120.405 6.214 -10.601 1.00 0.00 H new ATOM 0 HB3 ASN E 52 121.469 7.340 -11.421 1.00 0.00 H new ATOM 0 HD21 ASN E 52 121.818 8.701 -8.068 1.00 0.00 H new ATOM 0 HD22 ASN E 52 122.555 7.615 -9.252 1.00 0.00 H new ATOM 963 N ASP E 53 120.425 8.960 -13.531 1.00 0.00 N ATOM 964 CA ASP E 53 120.798 10.121 -14.333 1.00 0.00 C ATOM 965 C ASP E 53 119.628 10.545 -15.240 1.00 0.00 C ATOM 966 O ASP E 53 119.470 11.726 -15.558 1.00 0.00 O ATOM 967 CB ASP E 53 122.023 9.783 -15.194 1.00 0.00 C ATOM 968 CG ASP E 53 122.504 11.030 -15.941 1.00 0.00 C ATOM 969 OD1 ASP E 53 123.245 11.802 -15.351 1.00 0.00 O ATOM 970 OD2 ASP E 53 122.123 11.196 -17.089 1.00 0.00 O ATOM 0 H ASP E 53 120.779 8.074 -13.892 1.00 0.00 H new ATOM 0 HA ASP E 53 121.040 10.946 -13.664 1.00 0.00 H new ATOM 0 HB2 ASP E 53 122.824 9.396 -14.564 1.00 0.00 H new ATOM 0 HB3 ASP E 53 121.770 8.998 -15.907 1.00 0.00 H new ATOM 975 N ALA E 54 118.828 9.557 -15.664 1.00 0.00 N ATOM 976 CA ALA E 54 117.681 9.796 -16.550 1.00 0.00 C ATOM 977 C ALA E 54 116.591 10.619 -15.866 1.00 0.00 C ATOM 978 O ALA E 54 115.845 11.336 -16.538 1.00 0.00 O ATOM 979 CB ALA E 54 117.069 8.462 -16.997 1.00 0.00 C ATOM 0 H ALA E 54 118.956 8.579 -15.405 1.00 0.00 H new ATOM 0 HA ALA E 54 118.056 10.354 -17.408 1.00 0.00 H new ATOM 0 HB1 ALA E 54 116.220 8.653 -17.653 1.00 0.00 H new ATOM 0 HB2 ALA E 54 117.818 7.880 -17.533 1.00 0.00 H new ATOM 0 HB3 ALA E 54 116.734 7.904 -16.123 1.00 0.00 H new ATOM 985 N GLN E 55 116.493 10.492 -14.539 1.00 0.00 N ATOM 986 CA GLN E 55 115.472 11.211 -13.762 1.00 0.00 C ATOM 987 C GLN E 55 116.124 12.154 -12.754 1.00 0.00 C ATOM 988 O GLN E 55 115.450 12.743 -11.904 1.00 0.00 O ATOM 989 CB GLN E 55 114.553 10.203 -13.056 1.00 0.00 C ATOM 990 CG GLN E 55 113.904 9.299 -14.120 1.00 0.00 C ATOM 991 CD GLN E 55 112.762 8.453 -13.542 1.00 0.00 C ATOM 992 OE1 GLN E 55 112.133 7.691 -14.277 1.00 0.00 O ATOM 993 NE2 GLN E 55 112.444 8.537 -12.280 1.00 0.00 N ATOM 0 H GLN E 55 117.106 9.900 -13.979 1.00 0.00 H new ATOM 0 HA GLN E 55 114.872 11.816 -14.441 1.00 0.00 H new ATOM 0 HB2 GLN E 55 115.124 9.603 -12.347 1.00 0.00 H new ATOM 0 HB3 GLN E 55 113.786 10.726 -12.485 1.00 0.00 H new ATOM 0 HG2 GLN E 55 113.522 9.915 -14.934 1.00 0.00 H new ATOM 0 HG3 GLN E 55 114.661 8.641 -14.547 1.00 0.00 H new ATOM 0 HE21 GLN E 55 112.960 9.166 -11.665 1.00 0.00 H new ATOM 0 HE22 GLN E 55 111.679 7.974 -11.908 1.00 0.00 H new ATOM 1002 N ALA E 56 117.444 12.276 -12.871 1.00 0.00 N ATOM 1003 CA ALA E 56 118.240 13.115 -12.005 1.00 0.00 C ATOM 1004 C ALA E 56 117.753 14.564 -12.008 1.00 0.00 C ATOM 1005 O ALA E 56 117.038 14.996 -12.918 1.00 0.00 O ATOM 1006 CB ALA E 56 119.703 13.050 -12.453 1.00 0.00 C ATOM 0 H ALA E 56 117.989 11.786 -13.581 1.00 0.00 H new ATOM 0 HA ALA E 56 118.142 12.744 -10.985 1.00 0.00 H new ATOM 0 HB1 ALA E 56 120.311 13.681 -11.804 1.00 0.00 H new ATOM 0 HB2 ALA E 56 120.057 12.021 -12.393 1.00 0.00 H new ATOM 0 HB3 ALA E 56 119.785 13.402 -13.481 1.00 0.00 H new TER 1012 ALA E 56 ATOM 1013 N GLY F 14 119.521 10.537 9.307 1.00 0.00 N ATOM 1014 CA GLY F 14 118.911 9.948 10.502 1.00 0.00 C ATOM 1015 C GLY F 14 119.142 8.448 10.560 1.00 0.00 C ATOM 1016 O GLY F 14 120.131 7.935 10.026 1.00 0.00 O ATOM 0 HA2 GLY F 14 119.328 10.417 11.394 1.00 0.00 H new ATOM 0 HA3 GLY F 14 117.840 10.153 10.505 1.00 0.00 H new ATOM 1020 N GLU F 15 118.215 7.751 11.214 1.00 0.00 N ATOM 1021 CA GLU F 15 118.304 6.307 11.349 1.00 0.00 C ATOM 1022 C GLU F 15 118.198 5.654 9.991 1.00 0.00 C ATOM 1023 O GLU F 15 117.464 6.129 9.123 1.00 0.00 O ATOM 1024 CB GLU F 15 117.167 5.779 12.216 1.00 0.00 C ATOM 1025 CG GLU F 15 117.455 4.320 12.597 1.00 0.00 C ATOM 1026 CD GLU F 15 116.322 3.703 13.441 1.00 0.00 C ATOM 1027 OE1 GLU F 15 115.501 4.442 13.970 1.00 0.00 O ATOM 1028 OE2 GLU F 15 116.305 2.486 13.557 1.00 0.00 O ATOM 0 H GLU F 15 117.396 8.167 11.657 1.00 0.00 H new ATOM 0 HA GLU F 15 119.263 6.072 11.811 1.00 0.00 H new ATOM 0 HB2 GLU F 15 117.066 6.388 13.114 1.00 0.00 H new ATOM 0 HB3 GLU F 15 116.222 5.846 11.677 1.00 0.00 H new ATOM 0 HG2 GLU F 15 117.593 3.730 11.691 1.00 0.00 H new ATOM 0 HG3 GLU F 15 118.390 4.270 13.155 1.00 0.00 H new ATOM 1035 N ILE F 16 118.912 4.552 9.826 1.00 0.00 N ATOM 1036 CA ILE F 16 118.882 3.810 8.579 1.00 0.00 C ATOM 1037 C ILE F 16 118.318 2.412 8.816 1.00 0.00 C ATOM 1038 O ILE F 16 118.574 1.790 9.852 1.00 0.00 O ATOM 1039 CB ILE F 16 120.280 3.728 7.977 1.00 0.00 C ATOM 1040 CG1 ILE F 16 120.842 5.155 7.765 1.00 0.00 C ATOM 1041 CG2 ILE F 16 120.198 2.981 6.634 1.00 0.00 C ATOM 1042 CD1 ILE F 16 122.197 5.111 7.039 1.00 0.00 C ATOM 0 H ILE F 16 119.519 4.153 10.541 1.00 0.00 H new ATOM 0 HA ILE F 16 118.235 4.332 7.874 1.00 0.00 H new ATOM 0 HB ILE F 16 120.946 3.190 8.651 1.00 0.00 H new ATOM 0 HG12 ILE F 16 120.134 5.746 7.185 1.00 0.00 H new ATOM 0 HG13 ILE F 16 120.958 5.651 8.729 1.00 0.00 H new ATOM 0 HG21 ILE F 16 121.193 2.916 6.193 1.00 0.00 H new ATOM 0 HG22 ILE F 16 119.808 1.977 6.799 1.00 0.00 H new ATOM 0 HG23 ILE F 16 119.536 3.521 5.957 1.00 0.00 H new ATOM 0 HD11 ILE F 16 122.570 6.126 6.903 1.00 0.00 H new ATOM 0 HD12 ILE F 16 122.910 4.539 7.633 1.00 0.00 H new ATOM 0 HD13 ILE F 16 122.073 4.636 6.066 1.00 0.00 H new ATOM 1054 N VAL F 17 117.533 1.950 7.846 1.00 0.00 N ATOM 1055 CA VAL F 17 116.884 0.644 7.911 1.00 0.00 C ATOM 1056 C VAL F 17 117.265 -0.206 6.699 1.00 0.00 C ATOM 1057 O VAL F 17 117.034 0.200 5.561 1.00 0.00 O ATOM 1058 CB VAL F 17 115.370 0.891 7.942 1.00 0.00 C ATOM 1059 CG1 VAL F 17 114.586 -0.379 7.567 1.00 0.00 C ATOM 1060 CG2 VAL F 17 114.966 1.356 9.350 1.00 0.00 C ATOM 0 H VAL F 17 117.329 2.471 6.993 1.00 0.00 H new ATOM 0 HA VAL F 17 117.203 0.100 8.800 1.00 0.00 H new ATOM 0 HB VAL F 17 115.129 1.660 7.208 1.00 0.00 H new ATOM 0 HG11 VAL F 17 113.517 -0.169 7.599 1.00 0.00 H new ATOM 0 HG12 VAL F 17 114.864 -0.695 6.561 1.00 0.00 H new ATOM 0 HG13 VAL F 17 114.821 -1.174 8.275 1.00 0.00 H new ATOM 0 HG21 VAL F 17 113.891 1.534 9.380 1.00 0.00 H new ATOM 0 HG22 VAL F 17 115.227 0.586 10.076 1.00 0.00 H new ATOM 0 HG23 VAL F 17 115.493 2.278 9.594 1.00 0.00 H new ATOM 1070 N TYR F 18 117.827 -1.391 6.963 1.00 0.00 N ATOM 1071 CA TYR F 18 118.232 -2.312 5.898 1.00 0.00 C ATOM 1072 C TYR F 18 117.191 -3.406 5.704 1.00 0.00 C ATOM 1073 O TYR F 18 116.659 -3.953 6.674 1.00 0.00 O ATOM 1074 CB TYR F 18 119.605 -2.935 6.231 1.00 0.00 C ATOM 1075 CG TYR F 18 120.702 -2.089 5.613 1.00 0.00 C ATOM 1076 CD1 TYR F 18 120.778 -0.724 5.908 1.00 0.00 C ATOM 1077 CD2 TYR F 18 121.624 -2.661 4.723 1.00 0.00 C ATOM 1078 CE1 TYR F 18 121.764 0.065 5.319 1.00 0.00 C ATOM 1079 CE2 TYR F 18 122.610 -1.865 4.132 1.00 0.00 C ATOM 1080 CZ TYR F 18 122.681 -0.501 4.429 1.00 0.00 C ATOM 1081 OH TYR F 18 123.652 0.284 3.846 1.00 0.00 O ATOM 0 H TYR F 18 118.011 -1.734 7.906 1.00 0.00 H new ATOM 0 HA TYR F 18 118.313 -1.749 4.968 1.00 0.00 H new ATOM 0 HB2 TYR F 18 119.739 -2.992 7.311 1.00 0.00 H new ATOM 0 HB3 TYR F 18 119.657 -3.954 5.849 1.00 0.00 H new ATOM 0 HD1 TYR F 18 120.071 -0.281 6.594 1.00 0.00 H new ATOM 0 HD2 TYR F 18 121.572 -3.715 4.495 1.00 0.00 H new ATOM 0 HE1 TYR F 18 121.820 1.118 5.551 1.00 0.00 H new ATOM 0 HE2 TYR F 18 123.318 -2.305 3.445 1.00 0.00 H new ATOM 0 HH TYR F 18 123.307 0.665 3.012 1.00 0.00 H new ATOM 1091 N LEU F 19 116.911 -3.707 4.429 1.00 0.00 N ATOM 1092 CA LEU F 19 115.926 -4.737 4.067 1.00 0.00 C ATOM 1093 C LEU F 19 116.614 -5.896 3.305 1.00 0.00 C ATOM 1094 O LEU F 19 116.443 -6.035 2.088 1.00 0.00 O ATOM 1095 CB LEU F 19 114.812 -4.127 3.174 1.00 0.00 C ATOM 1096 CG LEU F 19 113.923 -3.092 3.919 1.00 0.00 C ATOM 1097 CD1 LEU F 19 113.509 -3.596 5.312 1.00 0.00 C ATOM 1098 CD2 LEU F 19 114.650 -1.744 4.043 1.00 0.00 C ATOM 0 H LEU F 19 117.353 -3.252 3.630 1.00 0.00 H new ATOM 0 HA LEU F 19 115.482 -5.122 4.985 1.00 0.00 H new ATOM 0 HB2 LEU F 19 115.271 -3.646 2.310 1.00 0.00 H new ATOM 0 HB3 LEU F 19 114.181 -4.930 2.793 1.00 0.00 H new ATOM 0 HG LEU F 19 113.018 -2.956 3.327 1.00 0.00 H new ATOM 0 HD11 LEU F 19 112.889 -2.845 5.801 1.00 0.00 H new ATOM 0 HD12 LEU F 19 112.944 -4.523 5.211 1.00 0.00 H new ATOM 0 HD13 LEU F 19 114.400 -3.778 5.913 1.00 0.00 H new ATOM 0 HD21 LEU F 19 114.011 -1.033 4.567 1.00 0.00 H new ATOM 0 HD22 LEU F 19 115.576 -1.880 4.601 1.00 0.00 H new ATOM 0 HD23 LEU F 19 114.879 -1.361 3.048 1.00 0.00 H new ATOM 1110 N PRO F 20 117.387 -6.729 3.992 1.00 0.00 N ATOM 1111 CA PRO F 20 118.100 -7.885 3.357 1.00 0.00 C ATOM 1112 C PRO F 20 117.195 -9.106 3.143 1.00 0.00 C ATOM 1113 O PRO F 20 117.072 -9.605 2.021 1.00 0.00 O ATOM 1114 CB PRO F 20 119.218 -8.196 4.357 1.00 0.00 C ATOM 1115 CG PRO F 20 118.674 -7.796 5.690 1.00 0.00 C ATOM 1116 CD PRO F 20 117.675 -6.660 5.440 1.00 0.00 C ATOM 0 HA PRO F 20 118.458 -7.642 2.357 1.00 0.00 H new ATOM 0 HB2 PRO F 20 119.479 -9.254 4.340 1.00 0.00 H new ATOM 0 HB3 PRO F 20 120.125 -7.640 4.119 1.00 0.00 H new ATOM 0 HG2 PRO F 20 118.185 -8.640 6.177 1.00 0.00 H new ATOM 0 HG3 PRO F 20 119.476 -7.467 6.351 1.00 0.00 H new ATOM 0 HD2 PRO F 20 116.769 -6.792 6.031 1.00 0.00 H new ATOM 0 HD3 PRO F 20 118.097 -5.693 5.715 1.00 0.00 H new ATOM 1124 N ASN F 21 116.581 -9.587 4.231 1.00 0.00 N ATOM 1125 CA ASN F 21 115.700 -10.766 4.176 1.00 0.00 C ATOM 1126 C ASN F 21 114.286 -10.399 3.711 1.00 0.00 C ATOM 1127 O ASN F 21 113.401 -11.259 3.662 1.00 0.00 O ATOM 1128 CB ASN F 21 115.618 -11.417 5.567 1.00 0.00 C ATOM 1129 CG ASN F 21 117.001 -11.846 6.055 1.00 0.00 C ATOM 1130 OD1 ASN F 21 117.826 -12.326 5.276 1.00 0.00 O ATOM 1131 ND2 ASN F 21 117.298 -11.707 7.314 1.00 0.00 N ATOM 0 H ASN F 21 116.676 -9.180 5.161 1.00 0.00 H new ATOM 0 HA ASN F 21 116.127 -11.463 3.454 1.00 0.00 H new ATOM 0 HB2 ASN F 21 115.181 -10.714 6.276 1.00 0.00 H new ATOM 0 HB3 ASN F 21 114.958 -12.283 5.528 1.00 0.00 H new ATOM 0 HD21 ASN F 21 118.214 -11.995 7.657 1.00 0.00 H new ATOM 0 HD22 ASN F 21 116.614 -11.310 7.958 1.00 0.00 H new ATOM 1138 N LEU F 22 114.082 -9.127 3.373 1.00 0.00 N ATOM 1139 CA LEU F 22 112.776 -8.648 2.917 1.00 0.00 C ATOM 1140 C LEU F 22 112.529 -9.076 1.466 1.00 0.00 C ATOM 1141 O LEU F 22 113.464 -9.112 0.661 1.00 0.00 O ATOM 1142 CB LEU F 22 112.739 -7.117 3.016 1.00 0.00 C ATOM 1143 CG LEU F 22 111.312 -6.631 3.350 1.00 0.00 C ATOM 1144 CD1 LEU F 22 111.186 -6.337 4.866 1.00 0.00 C ATOM 1145 CD2 LEU F 22 111.010 -5.363 2.531 1.00 0.00 C ATOM 0 H LEU F 22 114.805 -8.408 3.406 1.00 0.00 H new ATOM 0 HA LEU F 22 111.997 -9.079 3.546 1.00 0.00 H new ATOM 0 HB2 LEU F 22 113.434 -6.780 3.785 1.00 0.00 H new ATOM 0 HB3 LEU F 22 113.068 -6.678 2.074 1.00 0.00 H new ATOM 0 HG LEU F 22 110.592 -7.409 3.094 1.00 0.00 H new ATOM 0 HD11 LEU F 22 110.175 -5.995 5.088 1.00 0.00 H new ATOM 0 HD12 LEU F 22 111.394 -7.245 5.431 1.00 0.00 H new ATOM 0 HD13 LEU F 22 111.900 -5.563 5.147 1.00 0.00 H new ATOM 0 HD21 LEU F 22 110.004 -5.013 2.761 1.00 0.00 H new ATOM 0 HD22 LEU F 22 111.731 -4.586 2.784 1.00 0.00 H new ATOM 0 HD23 LEU F 22 111.081 -5.591 1.468 1.00 0.00 H new ATOM 1157 N ASN F 23 111.267 -9.383 1.134 1.00 0.00 N ATOM 1158 CA ASN F 23 110.921 -9.790 -0.229 1.00 0.00 C ATOM 1159 C ASN F 23 110.870 -8.554 -1.130 1.00 0.00 C ATOM 1160 O ASN F 23 110.529 -7.467 -0.658 1.00 0.00 O ATOM 1161 CB ASN F 23 109.559 -10.498 -0.236 1.00 0.00 C ATOM 1162 CG ASN F 23 109.655 -11.827 0.511 1.00 0.00 C ATOM 1163 OD1 ASN F 23 109.595 -12.893 -0.104 1.00 0.00 O ATOM 1164 ND2 ASN F 23 109.801 -11.829 1.805 1.00 0.00 N ATOM 0 H ASN F 23 110.481 -9.357 1.783 1.00 0.00 H new ATOM 0 HA ASN F 23 111.677 -10.480 -0.602 1.00 0.00 H new ATOM 0 HB2 ASN F 23 108.807 -9.862 0.232 1.00 0.00 H new ATOM 0 HB3 ASN F 23 109.236 -10.671 -1.262 1.00 0.00 H new ATOM 0 HD21 ASN F 23 109.866 -12.713 2.310 1.00 0.00 H new ATOM 0 HD22 ASN F 23 109.851 -10.946 2.314 1.00 0.00 H new ATOM 1171 N PRO F 24 111.196 -8.676 -2.404 1.00 0.00 N ATOM 1172 CA PRO F 24 111.167 -7.507 -3.330 1.00 0.00 C ATOM 1173 C PRO F 24 109.756 -6.953 -3.462 1.00 0.00 C ATOM 1174 O PRO F 24 109.563 -5.740 -3.576 1.00 0.00 O ATOM 1175 CB PRO F 24 111.688 -8.063 -4.661 1.00 0.00 C ATOM 1176 CG PRO F 24 111.463 -9.536 -4.580 1.00 0.00 C ATOM 1177 CD PRO F 24 111.612 -9.908 -3.104 1.00 0.00 C ATOM 0 HA PRO F 24 111.773 -6.673 -2.974 1.00 0.00 H new ATOM 0 HB2 PRO F 24 111.154 -7.628 -5.506 1.00 0.00 H new ATOM 0 HB3 PRO F 24 112.744 -7.832 -4.798 1.00 0.00 H new ATOM 0 HG2 PRO F 24 110.472 -9.800 -4.950 1.00 0.00 H new ATOM 0 HG3 PRO F 24 112.186 -10.075 -5.192 1.00 0.00 H new ATOM 0 HD2 PRO F 24 110.982 -10.756 -2.836 1.00 0.00 H new ATOM 0 HD3 PRO F 24 112.638 -10.184 -2.859 1.00 0.00 H new ATOM 1185 N ASP F 25 108.767 -7.851 -3.400 1.00 0.00 N ATOM 1186 CA ASP F 25 107.369 -7.435 -3.460 1.00 0.00 C ATOM 1187 C ASP F 25 107.091 -6.543 -2.251 1.00 0.00 C ATOM 1188 O ASP F 25 106.404 -5.523 -2.355 1.00 0.00 O ATOM 1189 CB ASP F 25 106.442 -8.661 -3.438 1.00 0.00 C ATOM 1190 CG ASP F 25 106.682 -9.536 -4.674 1.00 0.00 C ATOM 1191 OD1 ASP F 25 106.409 -9.072 -5.770 1.00 0.00 O ATOM 1192 OD2 ASP F 25 107.140 -10.656 -4.506 1.00 0.00 O ATOM 0 H ASP F 25 108.909 -8.857 -3.309 1.00 0.00 H new ATOM 0 HA ASP F 25 107.180 -6.890 -4.385 1.00 0.00 H new ATOM 0 HB2 ASP F 25 106.619 -9.242 -2.533 1.00 0.00 H new ATOM 0 HB3 ASP F 25 105.401 -8.337 -3.410 1.00 0.00 H new ATOM 1197 N GLN F 26 107.678 -6.934 -1.112 1.00 0.00 N ATOM 1198 CA GLN F 26 107.549 -6.178 0.114 1.00 0.00 C ATOM 1199 C GLN F 26 108.240 -4.818 -0.045 1.00 0.00 C ATOM 1200 O GLN F 26 107.743 -3.803 0.446 1.00 0.00 O ATOM 1201 CB GLN F 26 108.166 -6.971 1.270 1.00 0.00 C ATOM 1202 CG GLN F 26 107.702 -6.393 2.606 1.00 0.00 C ATOM 1203 CD GLN F 26 106.224 -6.709 2.831 1.00 0.00 C ATOM 1204 OE1 GLN F 26 105.845 -7.876 2.924 1.00 0.00 O ATOM 1205 NE2 GLN F 26 105.363 -5.734 2.925 1.00 0.00 N ATOM 0 H GLN F 26 108.247 -7.776 -1.027 1.00 0.00 H new ATOM 0 HA GLN F 26 106.495 -6.006 0.334 1.00 0.00 H new ATOM 0 HB2 GLN F 26 107.877 -8.019 1.198 1.00 0.00 H new ATOM 0 HB3 GLN F 26 109.254 -6.935 1.207 1.00 0.00 H new ATOM 0 HG2 GLN F 26 108.298 -6.809 3.418 1.00 0.00 H new ATOM 0 HG3 GLN F 26 107.857 -5.314 2.618 1.00 0.00 H new ATOM 0 HE21 GLN F 26 105.677 -4.767 2.848 1.00 0.00 H new ATOM 0 HE22 GLN F 26 104.375 -5.939 3.076 1.00 0.00 H new ATOM 1214 N LEU F 27 109.384 -4.810 -0.756 1.00 0.00 N ATOM 1215 CA LEU F 27 110.127 -3.565 -0.996 1.00 0.00 C ATOM 1216 C LEU F 27 109.281 -2.592 -1.815 1.00 0.00 C ATOM 1217 O LEU F 27 109.291 -1.394 -1.553 1.00 0.00 O ATOM 1218 CB LEU F 27 111.446 -3.828 -1.750 1.00 0.00 C ATOM 1219 CG LEU F 27 112.527 -4.370 -0.799 1.00 0.00 C ATOM 1220 CD1 LEU F 27 113.767 -4.785 -1.606 1.00 0.00 C ATOM 1221 CD2 LEU F 27 112.926 -3.282 0.212 1.00 0.00 C ATOM 0 H LEU F 27 109.807 -5.642 -1.168 1.00 0.00 H new ATOM 0 HA LEU F 27 110.358 -3.135 -0.022 1.00 0.00 H new ATOM 0 HB2 LEU F 27 111.273 -4.543 -2.554 1.00 0.00 H new ATOM 0 HB3 LEU F 27 111.794 -2.905 -2.214 1.00 0.00 H new ATOM 0 HG LEU F 27 112.129 -5.234 -0.267 1.00 0.00 H new ATOM 0 HD11 LEU F 27 114.530 -5.168 -0.929 1.00 0.00 H new ATOM 0 HD12 LEU F 27 113.493 -5.561 -2.321 1.00 0.00 H new ATOM 0 HD13 LEU F 27 114.159 -3.920 -2.142 1.00 0.00 H new ATOM 0 HD21 LEU F 27 113.692 -3.672 0.883 1.00 0.00 H new ATOM 0 HD22 LEU F 27 113.317 -2.416 -0.321 1.00 0.00 H new ATOM 0 HD23 LEU F 27 112.052 -2.986 0.792 1.00 0.00 H new ATOM 1233 N CYS F 28 108.553 -3.114 -2.812 1.00 0.00 N ATOM 1234 CA CYS F 28 107.707 -2.262 -3.654 1.00 0.00 C ATOM 1235 C CYS F 28 106.632 -1.590 -2.803 1.00 0.00 C ATOM 1236 O CYS F 28 106.404 -0.383 -2.916 1.00 0.00 O ATOM 1237 CB CYS F 28 107.055 -3.091 -4.768 1.00 0.00 C ATOM 1238 SG CYS F 28 108.329 -3.645 -5.928 1.00 0.00 S ATOM 0 H CYS F 28 108.533 -4.105 -3.051 1.00 0.00 H new ATOM 0 HA CYS F 28 108.330 -1.493 -4.111 1.00 0.00 H new ATOM 0 HB2 CYS F 28 106.537 -3.950 -4.342 1.00 0.00 H new ATOM 0 HB3 CYS F 28 106.307 -2.495 -5.290 1.00 0.00 H new ATOM 1243 N ALA F 29 105.999 -2.376 -1.929 1.00 0.00 N ATOM 1244 CA ALA F 29 104.974 -1.847 -1.035 1.00 0.00 C ATOM 1245 C ALA F 29 105.610 -0.846 -0.071 1.00 0.00 C ATOM 1246 O ALA F 29 105.028 0.199 0.238 1.00 0.00 O ATOM 1247 CB ALA F 29 104.326 -2.990 -0.242 1.00 0.00 C ATOM 0 H ALA F 29 106.179 -3.375 -1.824 1.00 0.00 H new ATOM 0 HA ALA F 29 104.206 -1.348 -1.625 1.00 0.00 H new ATOM 0 HB1 ALA F 29 103.563 -2.585 0.422 1.00 0.00 H new ATOM 0 HB2 ALA F 29 103.868 -3.698 -0.933 1.00 0.00 H new ATOM 0 HB3 ALA F 29 105.087 -3.500 0.348 1.00 0.00 H new ATOM 1253 N PHE F 30 106.817 -1.182 0.390 1.00 0.00 N ATOM 1254 CA PHE F 30 107.557 -0.329 1.315 1.00 0.00 C ATOM 1255 C PHE F 30 107.872 1.020 0.665 1.00 0.00 C ATOM 1256 O PHE F 30 107.552 2.067 1.219 1.00 0.00 O ATOM 1257 CB PHE F 30 108.860 -1.049 1.721 1.00 0.00 C ATOM 1258 CG PHE F 30 109.743 -0.148 2.566 1.00 0.00 C ATOM 1259 CD1 PHE F 30 109.227 0.451 3.723 1.00 0.00 C ATOM 1260 CD2 PHE F 30 111.080 0.089 2.188 1.00 0.00 C ATOM 1261 CE1 PHE F 30 110.035 1.282 4.500 1.00 0.00 C ATOM 1262 CE2 PHE F 30 111.884 0.923 2.972 1.00 0.00 C ATOM 1263 CZ PHE F 30 111.360 1.518 4.126 1.00 0.00 C ATOM 0 H PHE F 30 107.302 -2.042 0.135 1.00 0.00 H new ATOM 0 HA PHE F 30 106.951 -0.140 2.201 1.00 0.00 H new ATOM 0 HB2 PHE F 30 108.620 -1.954 2.278 1.00 0.00 H new ATOM 0 HB3 PHE F 30 109.401 -1.359 0.827 1.00 0.00 H new ATOM 0 HD1 PHE F 30 108.203 0.269 4.014 1.00 0.00 H new ATOM 0 HD2 PHE F 30 111.482 -0.371 1.297 1.00 0.00 H new ATOM 0 HE1 PHE F 30 109.636 1.743 5.391 1.00 0.00 H new ATOM 0 HE2 PHE F 30 112.909 1.108 2.687 1.00 0.00 H new ATOM 0 HZ PHE F 30 111.983 2.162 4.729 1.00 0.00 H new ATOM 1273 N ILE F 31 108.494 0.980 -0.510 1.00 0.00 N ATOM 1274 CA ILE F 31 108.855 2.204 -1.230 1.00 0.00 C ATOM 1275 C ILE F 31 107.609 3.016 -1.579 1.00 0.00 C ATOM 1276 O ILE F 31 107.625 4.252 -1.503 1.00 0.00 O ATOM 1277 CB ILE F 31 109.671 1.842 -2.482 1.00 0.00 C ATOM 1278 CG1 ILE F 31 110.975 1.165 -2.026 1.00 0.00 C ATOM 1279 CG2 ILE F 31 110.013 3.106 -3.290 1.00 0.00 C ATOM 1280 CD1 ILE F 31 111.737 0.594 -3.223 1.00 0.00 C ATOM 0 H ILE F 31 108.759 0.117 -0.985 1.00 0.00 H new ATOM 0 HA ILE F 31 109.473 2.832 -0.588 1.00 0.00 H new ATOM 0 HB ILE F 31 109.087 1.174 -3.116 1.00 0.00 H new ATOM 0 HG12 ILE F 31 111.601 1.887 -1.501 1.00 0.00 H new ATOM 0 HG13 ILE F 31 110.748 0.367 -1.319 1.00 0.00 H new ATOM 0 HG21 ILE F 31 110.591 2.829 -4.172 1.00 0.00 H new ATOM 0 HG22 ILE F 31 109.092 3.600 -3.600 1.00 0.00 H new ATOM 0 HG23 ILE F 31 110.599 3.786 -2.671 1.00 0.00 H new ATOM 0 HD11 ILE F 31 112.656 0.120 -2.877 1.00 0.00 H new ATOM 0 HD12 ILE F 31 111.117 -0.145 -3.731 1.00 0.00 H new ATOM 0 HD13 ILE F 31 111.983 1.399 -3.916 1.00 0.00 H new ATOM 1292 N HIS F 32 106.526 2.317 -1.937 1.00 0.00 N ATOM 1293 CA HIS F 32 105.264 2.979 -2.272 1.00 0.00 C ATOM 1294 C HIS F 32 104.753 3.777 -1.066 1.00 0.00 C ATOM 1295 O HIS F 32 104.314 4.919 -1.213 1.00 0.00 O ATOM 1296 CB HIS F 32 104.217 1.933 -2.695 1.00 0.00 C ATOM 1297 CG HIS F 32 102.961 2.619 -3.174 1.00 0.00 C ATOM 1298 ND1 HIS F 32 102.921 3.351 -4.350 1.00 0.00 N ATOM 1299 CD2 HIS F 32 101.696 2.691 -2.644 1.00 0.00 C ATOM 1300 CE1 HIS F 32 101.670 3.828 -4.488 1.00 0.00 C ATOM 1301 NE2 HIS F 32 100.883 3.455 -3.477 1.00 0.00 N ATOM 0 H HIS F 32 106.499 1.299 -2.001 1.00 0.00 H new ATOM 0 HA HIS F 32 105.434 3.665 -3.102 1.00 0.00 H new ATOM 0 HB2 HIS F 32 104.621 1.303 -3.487 1.00 0.00 H new ATOM 0 HB3 HIS F 32 103.985 1.279 -1.854 1.00 0.00 H new ATOM 0 HD2 HIS F 32 101.380 2.226 -1.722 1.00 0.00 H new ATOM 0 HE1 HIS F 32 101.343 4.439 -5.317 1.00 0.00 H new ATOM 0 HE2 HIS F 32 99.897 3.681 -3.343 1.00 0.00 H new ATOM 1310 N SER F 33 104.827 3.164 0.123 1.00 0.00 N ATOM 1311 CA SER F 33 104.377 3.824 1.348 1.00 0.00 C ATOM 1312 C SER F 33 105.296 5.002 1.712 1.00 0.00 C ATOM 1313 O SER F 33 104.811 6.039 2.176 1.00 0.00 O ATOM 1314 CB SER F 33 104.303 2.811 2.500 1.00 0.00 C ATOM 1315 OG SER F 33 105.610 2.416 2.891 1.00 0.00 O ATOM 0 H SER F 33 105.191 2.221 0.259 1.00 0.00 H new ATOM 0 HA SER F 33 103.379 4.226 1.174 1.00 0.00 H new ATOM 0 HB2 SER F 33 103.779 3.252 3.348 1.00 0.00 H new ATOM 0 HB3 SER F 33 103.729 1.938 2.190 1.00 0.00 H new ATOM 0 HG SER F 33 106.071 2.010 2.127 1.00 0.00 H new ATOM 1321 N LEU F 34 106.615 4.848 1.483 1.00 0.00 N ATOM 1322 CA LEU F 34 107.569 5.928 1.777 1.00 0.00 C ATOM 1323 C LEU F 34 107.228 7.163 0.941 1.00 0.00 C ATOM 1324 O LEU F 34 107.205 8.286 1.453 1.00 0.00 O ATOM 1325 CB LEU F 34 109.018 5.508 1.438 1.00 0.00 C ATOM 1326 CG LEU F 34 109.482 4.317 2.298 1.00 0.00 C ATOM 1327 CD1 LEU F 34 110.719 3.652 1.651 1.00 0.00 C ATOM 1328 CD2 LEU F 34 109.847 4.810 3.700 1.00 0.00 C ATOM 0 H LEU F 34 107.036 4.001 1.102 1.00 0.00 H new ATOM 0 HA LEU F 34 107.497 6.147 2.842 1.00 0.00 H new ATOM 0 HB2 LEU F 34 109.082 5.242 0.383 1.00 0.00 H new ATOM 0 HB3 LEU F 34 109.688 6.353 1.595 1.00 0.00 H new ATOM 0 HG LEU F 34 108.674 3.588 2.364 1.00 0.00 H new ATOM 0 HD11 LEU F 34 111.042 2.811 2.264 1.00 0.00 H new ATOM 0 HD12 LEU F 34 110.461 3.296 0.654 1.00 0.00 H new ATOM 0 HD13 LEU F 34 111.527 4.380 1.579 1.00 0.00 H new ATOM 0 HD21 LEU F 34 110.175 3.967 4.308 1.00 0.00 H new ATOM 0 HD22 LEU F 34 110.651 5.542 3.630 1.00 0.00 H new ATOM 0 HD23 LEU F 34 108.975 5.272 4.162 1.00 0.00 H new ATOM 1340 N HIS F 35 106.979 6.937 -0.355 1.00 0.00 N ATOM 1341 CA HIS F 35 106.653 8.024 -1.285 1.00 0.00 C ATOM 1342 C HIS F 35 105.252 8.592 -1.033 1.00 0.00 C ATOM 1343 O HIS F 35 105.073 9.812 -1.002 1.00 0.00 O ATOM 1344 CB HIS F 35 106.748 7.510 -2.730 1.00 0.00 C ATOM 1345 CG HIS F 35 106.631 8.663 -3.696 1.00 0.00 C ATOM 1346 ND1 HIS F 35 105.430 9.315 -3.928 1.00 0.00 N ATOM 1347 CD2 HIS F 35 107.556 9.289 -4.495 1.00 0.00 C ATOM 1348 CE1 HIS F 35 105.662 10.284 -4.834 1.00 0.00 C ATOM 1349 NE2 HIS F 35 106.942 10.311 -5.212 1.00 0.00 N ATOM 0 H HIS F 35 106.997 6.011 -0.783 1.00 0.00 H new ATOM 0 HA HIS F 35 107.371 8.828 -1.123 1.00 0.00 H new ATOM 0 HB2 HIS F 35 107.696 6.994 -2.880 1.00 0.00 H new ATOM 0 HB3 HIS F 35 105.957 6.784 -2.919 1.00 0.00 H new ATOM 0 HD2 HIS F 35 108.602 9.027 -4.557 1.00 0.00 H new ATOM 0 HE1 HIS F 35 104.905 10.957 -5.209 1.00 0.00 H new ATOM 0 HE2 HIS F 35 107.377 10.945 -5.883 1.00 0.00 H new ATOM 1358 N ASP F 36 104.264 7.701 -0.889 1.00 0.00 N ATOM 1359 CA ASP F 36 102.872 8.117 -0.676 1.00 0.00 C ATOM 1360 C ASP F 36 102.728 8.970 0.588 1.00 0.00 C ATOM 1361 O ASP F 36 102.003 9.969 0.583 1.00 0.00 O ATOM 1362 CB ASP F 36 101.971 6.877 -0.578 1.00 0.00 C ATOM 1363 CG ASP F 36 100.505 7.276 -0.749 1.00 0.00 C ATOM 1364 OD1 ASP F 36 99.994 7.955 0.121 1.00 0.00 O ATOM 1365 OD2 ASP F 36 99.917 6.896 -1.750 1.00 0.00 O ATOM 0 H ASP F 36 104.401 6.691 -0.916 1.00 0.00 H new ATOM 0 HA ASP F 36 102.566 8.727 -1.526 1.00 0.00 H new ATOM 0 HB2 ASP F 36 102.251 6.154 -1.344 1.00 0.00 H new ATOM 0 HB3 ASP F 36 102.113 6.390 0.387 1.00 0.00 H new ATOM 1370 N ASP F 37 103.414 8.566 1.665 1.00 0.00 N ATOM 1371 CA ASP F 37 103.348 9.295 2.939 1.00 0.00 C ATOM 1372 C ASP F 37 104.766 9.519 3.519 1.00 0.00 C ATOM 1373 O ASP F 37 105.223 8.721 4.348 1.00 0.00 O ATOM 1374 CB ASP F 37 102.477 8.518 3.937 1.00 0.00 C ATOM 1375 CG ASP F 37 101.055 8.361 3.392 1.00 0.00 C ATOM 1376 OD1 ASP F 37 100.377 9.368 3.266 1.00 0.00 O ATOM 1377 OD2 ASP F 37 100.665 7.238 3.108 1.00 0.00 O ATOM 0 H ASP F 37 104.017 7.744 1.681 1.00 0.00 H new ATOM 0 HA ASP F 37 102.899 10.272 2.760 1.00 0.00 H new ATOM 0 HB2 ASP F 37 102.913 7.536 4.123 1.00 0.00 H new ATOM 0 HB3 ASP F 37 102.452 9.042 4.893 1.00 0.00 H new ATOM 1382 N PRO F 38 105.480 10.578 3.113 1.00 0.00 N ATOM 1383 CA PRO F 38 106.861 10.856 3.636 1.00 0.00 C ATOM 1384 C PRO F 38 106.877 11.001 5.159 1.00 0.00 C ATOM 1385 O PRO F 38 107.838 10.604 5.818 1.00 0.00 O ATOM 1386 CB PRO F 38 107.272 12.173 2.957 1.00 0.00 C ATOM 1387 CG PRO F 38 106.376 12.314 1.770 1.00 0.00 C ATOM 1388 CD PRO F 38 105.070 11.616 2.133 1.00 0.00 C ATOM 0 HA PRO F 38 107.546 10.037 3.416 1.00 0.00 H new ATOM 0 HB2 PRO F 38 107.156 13.017 3.637 1.00 0.00 H new ATOM 0 HB3 PRO F 38 108.319 12.148 2.656 1.00 0.00 H new ATOM 0 HG2 PRO F 38 106.203 13.365 1.536 1.00 0.00 H new ATOM 0 HG3 PRO F 38 106.827 11.861 0.887 1.00 0.00 H new ATOM 0 HD2 PRO F 38 104.352 12.312 2.566 1.00 0.00 H new ATOM 0 HD3 PRO F 38 104.597 11.173 1.257 1.00 0.00 H new ATOM 1396 N SER F 39 105.797 11.565 5.701 1.00 0.00 N ATOM 1397 CA SER F 39 105.668 11.762 7.146 1.00 0.00 C ATOM 1398 C SER F 39 105.686 10.421 7.881 1.00 0.00 C ATOM 1399 O SER F 39 106.214 10.318 8.991 1.00 0.00 O ATOM 1400 CB SER F 39 104.357 12.496 7.453 1.00 0.00 C ATOM 1401 OG SER F 39 104.184 12.600 8.862 1.00 0.00 O ATOM 0 H SER F 39 104.997 11.894 5.160 1.00 0.00 H new ATOM 0 HA SER F 39 106.513 12.359 7.489 1.00 0.00 H new ATOM 0 HB2 SER F 39 104.371 13.489 7.004 1.00 0.00 H new ATOM 0 HB3 SER F 39 103.517 11.959 7.012 1.00 0.00 H new ATOM 0 HG SER F 39 103.734 11.796 9.197 1.00 0.00 H new ATOM 1407 N GLN F 40 105.083 9.407 7.255 1.00 0.00 N ATOM 1408 CA GLN F 40 105.000 8.068 7.844 1.00 0.00 C ATOM 1409 C GLN F 40 106.227 7.215 7.516 1.00 0.00 C ATOM 1410 O GLN F 40 106.337 6.093 8.011 1.00 0.00 O ATOM 1411 CB GLN F 40 103.740 7.356 7.318 1.00 0.00 C ATOM 1412 CG GLN F 40 102.531 7.675 8.206 1.00 0.00 C ATOM 1413 CD GLN F 40 102.235 9.177 8.202 1.00 0.00 C ATOM 1414 OE1 GLN F 40 102.866 9.941 8.935 1.00 0.00 O ATOM 1415 NE2 GLN F 40 101.307 9.649 7.415 1.00 0.00 N ATOM 0 H GLN F 40 104.644 9.488 6.338 1.00 0.00 H new ATOM 0 HA GLN F 40 104.954 8.188 8.926 1.00 0.00 H new ATOM 0 HB2 GLN F 40 103.539 7.670 6.294 1.00 0.00 H new ATOM 0 HB3 GLN F 40 103.907 6.279 7.294 1.00 0.00 H new ATOM 0 HG2 GLN F 40 101.658 7.127 7.851 1.00 0.00 H new ATOM 0 HG3 GLN F 40 102.724 7.341 9.225 1.00 0.00 H new ATOM 0 HE21 GLN F 40 100.784 9.018 6.808 1.00 0.00 H new ATOM 0 HE22 GLN F 40 101.105 10.649 7.407 1.00 0.00 H new ATOM 1424 N SER F 41 107.144 7.727 6.672 1.00 0.00 N ATOM 1425 CA SER F 41 108.347 6.961 6.274 1.00 0.00 C ATOM 1426 C SER F 41 109.123 6.432 7.486 1.00 0.00 C ATOM 1427 O SER F 41 109.581 5.289 7.488 1.00 0.00 O ATOM 1428 CB SER F 41 109.269 7.839 5.423 1.00 0.00 C ATOM 1429 OG SER F 41 109.890 8.815 6.252 1.00 0.00 O ATOM 0 H SER F 41 107.079 8.656 6.256 1.00 0.00 H new ATOM 0 HA SER F 41 108.007 6.103 5.694 1.00 0.00 H new ATOM 0 HB2 SER F 41 110.026 7.225 4.936 1.00 0.00 H new ATOM 0 HB3 SER F 41 108.698 8.327 4.633 1.00 0.00 H new ATOM 0 HG SER F 41 109.297 9.590 6.345 1.00 0.00 H new ATOM 1435 N ALA F 42 109.236 7.272 8.505 1.00 0.00 N ATOM 1436 CA ALA F 42 109.928 6.902 9.738 1.00 0.00 C ATOM 1437 C ALA F 42 109.217 5.724 10.410 1.00 0.00 C ATOM 1438 O ALA F 42 109.856 4.733 10.777 1.00 0.00 O ATOM 1439 CB ALA F 42 109.965 8.098 10.696 1.00 0.00 C ATOM 0 H ALA F 42 108.857 8.219 8.505 1.00 0.00 H new ATOM 0 HA ALA F 42 110.948 6.607 9.492 1.00 0.00 H new ATOM 0 HB1 ALA F 42 110.482 7.814 11.612 1.00 0.00 H new ATOM 0 HB2 ALA F 42 110.492 8.927 10.223 1.00 0.00 H new ATOM 0 HB3 ALA F 42 108.947 8.405 10.934 1.00 0.00 H new ATOM 1445 N ASN F 43 107.889 5.832 10.554 1.00 0.00 N ATOM 1446 CA ASN F 43 107.103 4.756 11.168 1.00 0.00 C ATOM 1447 C ASN F 43 107.173 3.502 10.302 1.00 0.00 C ATOM 1448 O ASN F 43 107.283 2.385 10.813 1.00 0.00 O ATOM 1449 CB ASN F 43 105.641 5.185 11.341 1.00 0.00 C ATOM 1450 CG ASN F 43 105.545 6.332 12.343 1.00 0.00 C ATOM 1451 OD1 ASN F 43 105.106 7.430 11.998 1.00 0.00 O ATOM 1452 ND2 ASN F 43 105.925 6.139 13.576 1.00 0.00 N ATOM 0 H ASN F 43 107.344 6.642 10.258 1.00 0.00 H new ATOM 0 HA ASN F 43 107.522 4.541 12.151 1.00 0.00 H new ATOM 0 HB2 ASN F 43 105.229 5.496 10.381 1.00 0.00 H new ATOM 0 HB3 ASN F 43 105.045 4.340 11.685 1.00 0.00 H new ATOM 0 HD21 ASN F 43 105.859 6.897 14.255 1.00 0.00 H new ATOM 0 HD22 ASN F 43 106.288 5.230 13.861 1.00 0.00 H new ATOM 1459 N LEU F 44 107.130 3.711 8.984 1.00 0.00 N ATOM 1460 CA LEU F 44 107.213 2.612 8.025 1.00 0.00 C ATOM 1461 C LEU F 44 108.563 1.928 8.160 1.00 0.00 C ATOM 1462 O LEU F 44 108.659 0.707 8.061 1.00 0.00 O ATOM 1463 CB LEU F 44 107.057 3.144 6.594 1.00 0.00 C ATOM 1464 CG LEU F 44 105.617 3.630 6.358 1.00 0.00 C ATOM 1465 CD1 LEU F 44 105.593 4.595 5.164 1.00 0.00 C ATOM 1466 CD2 LEU F 44 104.710 2.426 6.065 1.00 0.00 C ATOM 0 H LEU F 44 107.038 4.633 8.558 1.00 0.00 H new ATOM 0 HA LEU F 44 106.413 1.901 8.230 1.00 0.00 H new ATOM 0 HB2 LEU F 44 107.756 3.963 6.425 1.00 0.00 H new ATOM 0 HB3 LEU F 44 107.305 2.360 5.878 1.00 0.00 H new ATOM 0 HG LEU F 44 105.256 4.145 7.248 1.00 0.00 H new ATOM 0 HD11 LEU F 44 104.573 4.940 4.996 1.00 0.00 H new ATOM 0 HD12 LEU F 44 106.235 5.450 5.374 1.00 0.00 H new ATOM 0 HD13 LEU F 44 105.954 4.081 4.273 1.00 0.00 H new ATOM 0 HD21 LEU F 44 103.690 2.771 5.898 1.00 0.00 H new ATOM 0 HD22 LEU F 44 105.068 1.909 5.175 1.00 0.00 H new ATOM 0 HD23 LEU F 44 104.727 1.742 6.914 1.00 0.00 H new ATOM 1478 N LEU F 45 109.598 2.738 8.398 1.00 0.00 N ATOM 1479 CA LEU F 45 110.955 2.231 8.563 1.00 0.00 C ATOM 1480 C LEU F 45 111.020 1.278 9.754 1.00 0.00 C ATOM 1481 O LEU F 45 111.704 0.260 9.699 1.00 0.00 O ATOM 1482 CB LEU F 45 111.938 3.402 8.782 1.00 0.00 C ATOM 1483 CG LEU F 45 112.886 3.532 7.577 1.00 0.00 C ATOM 1484 CD1 LEU F 45 112.157 4.226 6.407 1.00 0.00 C ATOM 1485 CD2 LEU F 45 114.126 4.362 7.961 1.00 0.00 C ATOM 0 H LEU F 45 109.517 3.751 8.480 1.00 0.00 H new ATOM 0 HA LEU F 45 111.237 1.692 7.658 1.00 0.00 H new ATOM 0 HB2 LEU F 45 111.384 4.331 8.920 1.00 0.00 H new ATOM 0 HB3 LEU F 45 112.515 3.237 9.692 1.00 0.00 H new ATOM 0 HG LEU F 45 113.199 2.533 7.274 1.00 0.00 H new ATOM 0 HD11 LEU F 45 112.834 4.315 5.558 1.00 0.00 H new ATOM 0 HD12 LEU F 45 111.288 3.635 6.118 1.00 0.00 H new ATOM 0 HD13 LEU F 45 111.833 5.219 6.718 1.00 0.00 H new ATOM 0 HD21 LEU F 45 114.788 4.446 7.100 1.00 0.00 H new ATOM 0 HD22 LEU F 45 113.814 5.357 8.278 1.00 0.00 H new ATOM 0 HD23 LEU F 45 114.654 3.870 8.778 1.00 0.00 H new ATOM 1497 N ALA F 46 110.304 1.623 10.826 1.00 0.00 N ATOM 1498 CA ALA F 46 110.293 0.797 12.030 1.00 0.00 C ATOM 1499 C ALA F 46 109.694 -0.580 11.746 1.00 0.00 C ATOM 1500 O ALA F 46 110.327 -1.600 12.029 1.00 0.00 O ATOM 1501 CB ALA F 46 109.491 1.495 13.136 1.00 0.00 C ATOM 0 H ALA F 46 109.729 2.463 10.883 1.00 0.00 H new ATOM 0 HA ALA F 46 111.323 0.661 12.359 1.00 0.00 H new ATOM 0 HB1 ALA F 46 109.487 0.873 14.031 1.00 0.00 H new ATOM 0 HB2 ALA F 46 109.949 2.457 13.365 1.00 0.00 H new ATOM 0 HB3 ALA F 46 108.466 1.652 12.799 1.00 0.00 H new ATOM 1507 N GLU F 47 108.475 -0.611 11.190 1.00 0.00 N ATOM 1508 CA GLU F 47 107.827 -1.887 10.889 1.00 0.00 C ATOM 1509 C GLU F 47 108.548 -2.618 9.763 1.00 0.00 C ATOM 1510 O GLU F 47 108.664 -3.835 9.805 1.00 0.00 O ATOM 1511 CB GLU F 47 106.367 -1.700 10.490 1.00 0.00 C ATOM 1512 CG GLU F 47 105.550 -1.070 11.634 1.00 0.00 C ATOM 1513 CD GLU F 47 105.624 -1.908 12.924 1.00 0.00 C ATOM 1514 OE1 GLU F 47 105.281 -3.080 12.877 1.00 0.00 O ATOM 1515 OE2 GLU F 47 106.026 -1.364 13.941 1.00 0.00 O ATOM 0 H GLU F 47 107.930 0.216 10.945 1.00 0.00 H new ATOM 0 HA GLU F 47 107.874 -2.480 11.803 1.00 0.00 H new ATOM 0 HB2 GLU F 47 106.308 -1.065 9.606 1.00 0.00 H new ATOM 0 HB3 GLU F 47 105.935 -2.664 10.220 1.00 0.00 H new ATOM 0 HG2 GLU F 47 105.920 -0.064 11.833 1.00 0.00 H new ATOM 0 HG3 GLU F 47 104.509 -0.971 11.325 1.00 0.00 H new ATOM 1522 N ALA F 48 109.034 -1.871 8.756 1.00 0.00 N ATOM 1523 CA ALA F 48 109.756 -2.471 7.628 1.00 0.00 C ATOM 1524 C ALA F 48 111.017 -3.149 8.145 1.00 0.00 C ATOM 1525 O ALA F 48 111.314 -4.297 7.804 1.00 0.00 O ATOM 1526 CB ALA F 48 110.131 -1.387 6.610 1.00 0.00 C ATOM 0 H ALA F 48 108.939 -0.857 8.703 1.00 0.00 H new ATOM 0 HA ALA F 48 109.118 -3.207 7.140 1.00 0.00 H new ATOM 0 HB1 ALA F 48 110.667 -1.841 5.776 1.00 0.00 H new ATOM 0 HB2 ALA F 48 109.225 -0.906 6.241 1.00 0.00 H new ATOM 0 HB3 ALA F 48 110.768 -0.643 7.089 1.00 0.00 H new ATOM 1532 N LYS F 49 111.720 -2.434 9.019 1.00 0.00 N ATOM 1533 CA LYS F 49 112.916 -2.957 9.646 1.00 0.00 C ATOM 1534 C LYS F 49 112.541 -4.151 10.528 1.00 0.00 C ATOM 1535 O LYS F 49 113.250 -5.159 10.565 1.00 0.00 O ATOM 1536 CB LYS F 49 113.575 -1.862 10.491 1.00 0.00 C ATOM 1537 CG LYS F 49 114.962 -2.325 10.957 1.00 0.00 C ATOM 1538 CD LYS F 49 115.060 -2.239 12.486 1.00 0.00 C ATOM 1539 CE LYS F 49 115.126 -0.771 12.939 1.00 0.00 C ATOM 1540 NZ LYS F 49 116.489 -0.225 12.677 1.00 0.00 N ATOM 0 H LYS F 49 111.475 -1.486 9.306 1.00 0.00 H new ATOM 0 HA LYS F 49 113.621 -3.283 8.881 1.00 0.00 H new ATOM 0 HB2 LYS F 49 113.665 -0.945 9.908 1.00 0.00 H new ATOM 0 HB3 LYS F 49 112.950 -1.631 11.354 1.00 0.00 H new ATOM 0 HG2 LYS F 49 115.141 -3.349 10.630 1.00 0.00 H new ATOM 0 HG3 LYS F 49 115.733 -1.705 10.500 1.00 0.00 H new ATOM 0 HD2 LYS F 49 114.198 -2.727 12.940 1.00 0.00 H new ATOM 0 HD3 LYS F 49 115.946 -2.772 12.830 1.00 0.00 H new ATOM 0 HE2 LYS F 49 114.379 -0.182 12.406 1.00 0.00 H new ATOM 0 HE3 LYS F 49 114.892 -0.697 14.001 1.00 0.00 H new ATOM 0 HZ1 LYS F 49 116.556 0.739 13.061 1.00 0.00 H new ATOM 0 HZ2 LYS F 49 117.200 -0.831 13.135 1.00 0.00 H new ATOM 0 HZ3 LYS F 49 116.663 -0.202 11.652 1.00 0.00 H new ATOM 1554 N LYS F 50 111.390 -4.037 11.208 1.00 0.00 N ATOM 1555 CA LYS F 50 110.894 -5.115 12.058 1.00 0.00 C ATOM 1556 C LYS F 50 110.557 -6.303 11.181 1.00 0.00 C ATOM 1557 O LYS F 50 110.732 -7.457 11.569 1.00 0.00 O ATOM 1558 CB LYS F 50 109.646 -4.634 12.818 1.00 0.00 C ATOM 1559 CG LYS F 50 109.100 -5.736 13.741 1.00 0.00 C ATOM 1560 CD LYS F 50 107.690 -5.362 14.234 1.00 0.00 C ATOM 1561 CE LYS F 50 107.746 -4.127 15.145 1.00 0.00 C ATOM 1562 NZ LYS F 50 106.360 -3.751 15.545 1.00 0.00 N ATOM 0 H LYS F 50 110.792 -3.211 11.182 1.00 0.00 H new ATOM 0 HA LYS F 50 111.651 -5.406 12.786 1.00 0.00 H new ATOM 0 HB2 LYS F 50 109.893 -3.751 13.408 1.00 0.00 H new ATOM 0 HB3 LYS F 50 108.876 -4.337 12.107 1.00 0.00 H new ATOM 0 HG2 LYS F 50 109.067 -6.686 13.207 1.00 0.00 H new ATOM 0 HG3 LYS F 50 109.767 -5.872 14.592 1.00 0.00 H new ATOM 0 HD2 LYS F 50 107.042 -5.162 13.381 1.00 0.00 H new ATOM 0 HD3 LYS F 50 107.254 -6.201 14.776 1.00 0.00 H new ATOM 0 HE2 LYS F 50 108.348 -4.339 16.029 1.00 0.00 H new ATOM 0 HE3 LYS F 50 108.225 -3.298 14.625 1.00 0.00 H new ATOM 0 HZ1 LYS F 50 106.155 -2.785 15.220 1.00 0.00 H new ATOM 0 HZ2 LYS F 50 105.683 -4.412 15.114 1.00 0.00 H new ATOM 0 HZ3 LYS F 50 106.274 -3.793 16.581 1.00 0.00 H new ATOM 1576 N LEU F 51 110.067 -5.992 9.987 1.00 0.00 N ATOM 1577 CA LEU F 51 109.689 -6.999 9.017 1.00 0.00 C ATOM 1578 C LEU F 51 110.915 -7.799 8.604 1.00 0.00 C ATOM 1579 O LEU F 51 110.847 -9.018 8.463 1.00 0.00 O ATOM 1580 CB LEU F 51 109.062 -6.314 7.801 1.00 0.00 C ATOM 1581 CG LEU F 51 108.056 -7.246 7.124 1.00 0.00 C ATOM 1582 CD1 LEU F 51 106.888 -7.533 8.087 1.00 0.00 C ATOM 1583 CD2 LEU F 51 107.532 -6.562 5.859 1.00 0.00 C ATOM 0 H LEU F 51 109.923 -5.034 9.669 1.00 0.00 H new ATOM 0 HA LEU F 51 108.962 -7.682 9.456 1.00 0.00 H new ATOM 0 HB2 LEU F 51 108.565 -5.394 8.110 1.00 0.00 H new ATOM 0 HB3 LEU F 51 109.841 -6.033 7.092 1.00 0.00 H new ATOM 0 HG LEU F 51 108.536 -8.189 6.863 1.00 0.00 H new ATOM 0 HD11 LEU F 51 106.172 -8.197 7.603 1.00 0.00 H new ATOM 0 HD12 LEU F 51 107.270 -8.008 8.991 1.00 0.00 H new ATOM 0 HD13 LEU F 51 106.395 -6.597 8.350 1.00 0.00 H new ATOM 0 HD21 LEU F 51 106.813 -7.214 5.364 1.00 0.00 H new ATOM 0 HD22 LEU F 51 107.046 -5.624 6.127 1.00 0.00 H new ATOM 0 HD23 LEU F 51 108.363 -6.360 5.184 1.00 0.00 H new ATOM 1595 N ASN F 52 112.043 -7.098 8.455 1.00 0.00 N ATOM 1596 CA ASN F 52 113.307 -7.747 8.108 1.00 0.00 C ATOM 1597 C ASN F 52 113.637 -8.768 9.206 1.00 0.00 C ATOM 1598 O ASN F 52 114.111 -9.871 8.924 1.00 0.00 O ATOM 1599 CB ASN F 52 114.420 -6.674 7.945 1.00 0.00 C ATOM 1600 CG ASN F 52 115.613 -6.941 8.861 1.00 0.00 C ATOM 1601 OD1 ASN F 52 116.591 -7.571 8.457 1.00 0.00 O ATOM 1602 ND2 ASN F 52 115.576 -6.494 10.078 1.00 0.00 N ATOM 0 H ASN F 52 112.105 -6.086 8.569 1.00 0.00 H new ATOM 0 HA ASN F 52 113.232 -8.273 7.156 1.00 0.00 H new ATOM 0 HB2 ASN F 52 114.756 -6.655 6.908 1.00 0.00 H new ATOM 0 HB3 ASN F 52 114.008 -5.689 8.164 1.00 0.00 H new ATOM 0 HD21 ASN F 52 116.360 -6.663 10.708 1.00 0.00 H new ATOM 0 HD22 ASN F 52 114.763 -5.973 10.405 1.00 0.00 H new ATOM 1609 N ASP F 53 113.344 -8.377 10.454 1.00 0.00 N ATOM 1610 CA ASP F 53 113.565 -9.239 11.615 1.00 0.00 C ATOM 1611 C ASP F 53 112.501 -10.343 11.676 1.00 0.00 C ATOM 1612 O ASP F 53 112.767 -11.445 12.161 1.00 0.00 O ATOM 1613 CB ASP F 53 113.524 -8.409 12.909 1.00 0.00 C ATOM 1614 CG ASP F 53 114.649 -7.365 12.921 1.00 0.00 C ATOM 1615 OD1 ASP F 53 115.802 -7.750 12.781 1.00 0.00 O ATOM 1616 OD2 ASP F 53 114.344 -6.192 13.079 1.00 0.00 O ATOM 0 H ASP F 53 112.951 -7.464 10.682 1.00 0.00 H new ATOM 0 HA ASP F 53 114.547 -9.701 11.516 1.00 0.00 H new ATOM 0 HB2 ASP F 53 112.558 -7.911 12.997 1.00 0.00 H new ATOM 0 HB3 ASP F 53 113.623 -9.067 13.772 1.00 0.00 H new ATOM 1621 N ALA F 54 111.293 -10.021 11.193 1.00 0.00 N ATOM 1622 CA ALA F 54 110.167 -10.964 11.191 1.00 0.00 C ATOM 1623 C ALA F 54 110.316 -12.020 10.091 1.00 0.00 C ATOM 1624 O ALA F 54 109.917 -13.173 10.273 1.00 0.00 O ATOM 1625 CB ALA F 54 108.854 -10.201 10.986 1.00 0.00 C ATOM 0 H ALA F 54 111.070 -9.108 10.796 1.00 0.00 H new ATOM 0 HA ALA F 54 110.159 -11.474 12.154 1.00 0.00 H new ATOM 0 HB1 ALA F 54 108.021 -10.904 10.985 1.00 0.00 H new ATOM 0 HB2 ALA F 54 108.721 -9.482 11.794 1.00 0.00 H new ATOM 0 HB3 ALA F 54 108.885 -9.674 10.033 1.00 0.00 H new ATOM 1631 N GLN F 55 110.884 -11.609 8.952 1.00 0.00 N ATOM 1632 CA GLN F 55 111.080 -12.508 7.807 1.00 0.00 C ATOM 1633 C GLN F 55 112.470 -13.140 7.852 1.00 0.00 C ATOM 1634 O GLN F 55 112.790 -14.023 7.052 1.00 0.00 O ATOM 1635 CB GLN F 55 110.922 -11.730 6.493 1.00 0.00 C ATOM 1636 CG GLN F 55 109.488 -11.188 6.380 1.00 0.00 C ATOM 1637 CD GLN F 55 109.289 -10.439 5.057 1.00 0.00 C ATOM 1638 OE1 GLN F 55 110.168 -10.431 4.194 1.00 0.00 O ATOM 1639 NE2 GLN F 55 108.173 -9.802 4.843 1.00 0.00 N ATOM 0 H GLN F 55 111.217 -10.657 8.797 1.00 0.00 H new ATOM 0 HA GLN F 55 110.328 -13.295 7.859 1.00 0.00 H new ATOM 0 HB2 GLN F 55 111.636 -10.907 6.459 1.00 0.00 H new ATOM 0 HB3 GLN F 55 111.143 -12.379 5.646 1.00 0.00 H new ATOM 0 HG2 GLN F 55 108.777 -12.012 6.447 1.00 0.00 H new ATOM 0 HG3 GLN F 55 109.281 -10.520 7.216 1.00 0.00 H new ATOM 0 HE21 GLN F 55 107.440 -9.804 5.553 1.00 0.00 H new ATOM 0 HE22 GLN F 55 108.032 -9.301 3.966 1.00 0.00 H new ATOM 1648 N ALA F 56 113.284 -12.660 8.788 1.00 0.00 N ATOM 1649 CA ALA F 56 114.646 -13.131 8.961 1.00 0.00 C ATOM 1650 C ALA F 56 114.698 -14.629 9.273 1.00 0.00 C ATOM 1651 O ALA F 56 113.679 -15.250 9.592 1.00 0.00 O ATOM 1652 CB ALA F 56 115.305 -12.346 10.102 1.00 0.00 C ATOM 0 H ALA F 56 113.012 -11.931 9.448 1.00 0.00 H new ATOM 0 HA ALA F 56 115.182 -12.971 8.026 1.00 0.00 H new ATOM 0 HB1 ALA F 56 116.329 -12.694 10.239 1.00 0.00 H new ATOM 0 HB2 ALA F 56 115.312 -11.284 9.856 1.00 0.00 H new ATOM 0 HB3 ALA F 56 114.743 -12.502 11.023 1.00 0.00 H new TER 1658 ALA F 56