USER MOD reduce.3.24.130724 H: found=0, std=0, add=783, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 783 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 60 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 104 ASN : amide:sc= -0.435 X(o=-0.43,f=-0.87) USER MOD Set 2.1: A 62 ASN : amide:sc= 0.347 K(o=0.66,f=0.08) USER MOD Set 2.2: A 65 SER OG : rot -178:sc= 0.313 USER MOD Set 3.1: A 36 ASN : amide:sc= -3.09! C(o=-2.4!,f=-9.7!) USER MOD Set 3.2: A 41 THR OG1 : rot -160:sc= 0.712 USER MOD Single : A 1 SER N :NH3+ 148:sc= 0.0772 (180deg=0) USER MOD Single : A 1 SER OG : rot -120:sc= 0.0385 USER MOD Single : A 5 SER OG : rot 180:sc= 0.111 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 ASN : amide:sc= 0.863 K(o=0.86,f=-0.0088) USER MOD Single : A 11 LYS NZ :NH3+ 142:sc= 0.00367 (180deg=0) USER MOD Single : A 14 THR OG1 : rot -150:sc= 0.0742 USER MOD Single : A 15 SER OG : rot -153:sc= 0.992 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 GLN : amide:sc= 0.135 K(o=0.13,f=-1.5!) USER MOD Single : A 25 THR OG1 : rot -137:sc= -0.429 USER MOD Single : A 26 THR OG1 : rot -73:sc= 0.163 USER MOD Single : A 28 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 SER OG : rot 175:sc= -2.11! USER MOD Single : A 37 SER OG : rot 180:sc= 0.162 USER MOD Single : A 42 ASN : amide:sc= -1.83! K(o=-1.8!,f=-0.043) USER MOD Single : A 43 ASN : amide:sc= 0.942 K(o=0.94,f=0) USER MOD Single : A 45 SER OG : rot 92:sc= 0.052 USER MOD Single : A 48 SER OG : rot 83:sc= 0.314 USER MOD Single : A 57 ASN : amide:sc= 0.326 K(o=0.33,f=-4.4!) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0.147 USER MOD Single : A 69 LYS NZ :NH3+ -166:sc= 0.798 (180deg=-0.439) USER MOD Single : A 71 SER OG : rot 94:sc= 1.3 USER MOD Single : A 75 GLN : amide:sc= -7.59! C(o=-7.6!,f=-4.1!) USER MOD Single : A 84 HIS : no HE2:sc= -1.5! C(o=-1.5!,f=-4.3!) USER MOD Single : A 85 THR OG1 : rot 110:sc= -1.04 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 THR OG1 : rot 77:sc= 1.37 USER MOD Single : A 103 THR OG1 : rot 180:sc= -0.703 USER MOD Single : A 110 ASN : amide:sc= 0.00755 X(o=0.0075,f=0) USER MOD Single : A 115 THR OG1 : rot -119:sc= 0.138 USER MOD Single : A 116 LYS NZ :NH3+ 169:sc= 1.78 (180deg=1.51) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 20.348 -10.544 1.420 1.00 0.00 N ATOM 2 CA SER A 1 18.978 -10.736 0.904 1.00 0.00 C ATOM 3 C SER A 1 18.630 -12.218 0.863 1.00 0.00 C ATOM 4 O SER A 1 19.459 -13.049 0.485 1.00 0.00 O ATOM 5 CB SER A 1 18.863 -10.132 -0.498 1.00 0.00 C ATOM 6 OG SER A 1 19.385 -8.812 -0.534 1.00 0.00 O ATOM 0 H1 SER A 1 20.773 -9.706 0.973 1.00 0.00 H new ATOM 0 H2 SER A 1 20.315 -10.408 2.451 1.00 0.00 H new ATOM 0 H3 SER A 1 20.923 -11.383 1.200 1.00 0.00 H new ATOM 0 HA SER A 1 18.277 -10.232 1.570 1.00 0.00 H new ATOM 0 HB2 SER A 1 19.400 -10.758 -1.211 1.00 0.00 H new ATOM 0 HB3 SER A 1 17.818 -10.121 -0.807 1.00 0.00 H new ATOM 0 HG SER A 1 18.680 -8.189 -0.809 1.00 0.00 H new ATOM 14 N LEU A 2 17.411 -12.547 1.270 1.00 0.00 N ATOM 15 CA LEU A 2 16.947 -13.927 1.257 1.00 0.00 C ATOM 16 C LEU A 2 16.664 -14.386 -0.168 1.00 0.00 C ATOM 17 O LEU A 2 16.142 -13.619 -0.982 1.00 0.00 O ATOM 18 CB LEU A 2 15.684 -14.073 2.111 1.00 0.00 C ATOM 19 CG LEU A 2 15.685 -15.263 3.075 1.00 0.00 C ATOM 20 CD1 LEU A 2 15.597 -14.784 4.514 1.00 0.00 C ATOM 21 CD2 LEU A 2 14.540 -16.215 2.757 1.00 0.00 C ATOM 0 H LEU A 2 16.725 -11.875 1.614 1.00 0.00 H new ATOM 0 HA LEU A 2 17.734 -14.554 1.676 1.00 0.00 H new ATOM 0 HB2 LEU A 2 15.547 -13.158 2.688 1.00 0.00 H new ATOM 0 HB3 LEU A 2 14.824 -14.164 1.447 1.00 0.00 H new ATOM 0 HG LEU A 2 16.623 -15.804 2.949 1.00 0.00 H new ATOM 0 HD11 LEU A 2 15.599 -15.644 5.184 1.00 0.00 H new ATOM 0 HD12 LEU A 2 16.452 -14.147 4.738 1.00 0.00 H new ATOM 0 HD13 LEU A 2 14.676 -14.217 4.653 1.00 0.00 H new ATOM 0 HD21 LEU A 2 14.559 -17.053 3.454 1.00 0.00 H new ATOM 0 HD22 LEU A 2 13.591 -15.687 2.851 1.00 0.00 H new ATOM 0 HD23 LEU A 2 14.649 -16.587 1.738 1.00 0.00 H new ATOM 33 N PRO A 3 17.021 -15.637 -0.492 1.00 0.00 N ATOM 34 CA PRO A 3 16.784 -16.220 -1.814 1.00 0.00 C ATOM 35 C PRO A 3 15.318 -16.595 -2.028 1.00 0.00 C ATOM 36 O PRO A 3 14.484 -16.394 -1.139 1.00 0.00 O ATOM 37 CB PRO A 3 17.667 -17.482 -1.818 1.00 0.00 C ATOM 38 CG PRO A 3 18.512 -17.384 -0.588 1.00 0.00 C ATOM 39 CD PRO A 3 17.706 -16.586 0.389 1.00 0.00 C ATOM 0 HA PRO A 3 17.020 -15.518 -2.614 1.00 0.00 H new ATOM 0 HB2 PRO A 3 17.059 -18.386 -1.805 1.00 0.00 H new ATOM 0 HB3 PRO A 3 18.284 -17.526 -2.715 1.00 0.00 H new ATOM 0 HG2 PRO A 3 18.743 -18.372 -0.191 1.00 0.00 H new ATOM 0 HG3 PRO A 3 19.463 -16.896 -0.803 1.00 0.00 H new ATOM 0 HD2 PRO A 3 17.004 -17.208 0.944 1.00 0.00 H new ATOM 0 HD3 PRO A 3 18.335 -16.082 1.123 1.00 0.00 H new ATOM 47 N ALA A 4 15.024 -17.147 -3.210 1.00 0.00 N ATOM 48 CA ALA A 4 13.669 -17.554 -3.600 1.00 0.00 C ATOM 49 C ALA A 4 12.732 -16.354 -3.756 1.00 0.00 C ATOM 50 O ALA A 4 12.326 -16.013 -4.869 1.00 0.00 O ATOM 51 CB ALA A 4 13.089 -18.565 -2.614 1.00 0.00 C ATOM 0 H ALA A 4 15.725 -17.325 -3.929 1.00 0.00 H new ATOM 0 HA ALA A 4 13.752 -18.035 -4.575 1.00 0.00 H new ATOM 0 HB1 ALA A 4 12.085 -18.847 -2.930 1.00 0.00 H new ATOM 0 HB2 ALA A 4 13.723 -19.451 -2.587 1.00 0.00 H new ATOM 0 HB3 ALA A 4 13.045 -18.120 -1.620 1.00 0.00 H new ATOM 57 N SER A 5 12.388 -15.727 -2.641 1.00 0.00 N ATOM 58 CA SER A 5 11.487 -14.583 -2.633 1.00 0.00 C ATOM 59 C SER A 5 12.171 -13.328 -3.179 1.00 0.00 C ATOM 60 O SER A 5 13.367 -13.114 -2.960 1.00 0.00 O ATOM 61 CB SER A 5 11.001 -14.343 -1.204 1.00 0.00 C ATOM 62 OG SER A 5 11.691 -15.188 -0.294 1.00 0.00 O ATOM 0 H SER A 5 12.725 -15.996 -1.717 1.00 0.00 H new ATOM 0 HA SER A 5 10.639 -14.800 -3.282 1.00 0.00 H new ATOM 0 HB2 SER A 5 11.158 -13.300 -0.931 1.00 0.00 H new ATOM 0 HB3 SER A 5 9.929 -14.531 -1.142 1.00 0.00 H new ATOM 0 HG SER A 5 11.369 -15.020 0.616 1.00 0.00 H new ATOM 68 N ALA A 6 11.411 -12.500 -3.888 1.00 0.00 N ATOM 69 CA ALA A 6 11.936 -11.253 -4.432 1.00 0.00 C ATOM 70 C ALA A 6 12.023 -10.185 -3.342 1.00 0.00 C ATOM 71 O ALA A 6 11.336 -9.161 -3.390 1.00 0.00 O ATOM 72 CB ALA A 6 11.070 -10.776 -5.593 1.00 0.00 C ATOM 0 H ALA A 6 10.428 -12.670 -4.100 1.00 0.00 H new ATOM 0 HA ALA A 6 12.943 -11.434 -4.808 1.00 0.00 H new ATOM 0 HB1 ALA A 6 11.474 -9.844 -5.989 1.00 0.00 H new ATOM 0 HB2 ALA A 6 11.065 -11.532 -6.378 1.00 0.00 H new ATOM 0 HB3 ALA A 6 10.051 -10.610 -5.243 1.00 0.00 H new ATOM 78 N ALA A 7 12.891 -10.426 -2.365 1.00 0.00 N ATOM 79 CA ALA A 7 13.035 -9.542 -1.214 1.00 0.00 C ATOM 80 C ALA A 7 13.808 -8.272 -1.565 1.00 0.00 C ATOM 81 O ALA A 7 14.013 -7.408 -0.717 1.00 0.00 O ATOM 82 CB ALA A 7 13.727 -10.282 -0.077 1.00 0.00 C ATOM 0 H ALA A 7 13.512 -11.235 -2.348 1.00 0.00 H new ATOM 0 HA ALA A 7 12.036 -9.240 -0.898 1.00 0.00 H new ATOM 0 HB1 ALA A 7 13.832 -9.616 0.780 1.00 0.00 H new ATOM 0 HB2 ALA A 7 13.132 -11.150 0.208 1.00 0.00 H new ATOM 0 HB3 ALA A 7 14.714 -10.610 -0.404 1.00 0.00 H new ATOM 88 N LYS A 8 14.235 -8.160 -2.818 1.00 0.00 N ATOM 89 CA LYS A 8 14.964 -6.978 -3.267 1.00 0.00 C ATOM 90 C LYS A 8 13.992 -5.878 -3.674 1.00 0.00 C ATOM 91 O LYS A 8 14.395 -4.782 -4.064 1.00 0.00 O ATOM 92 CB LYS A 8 15.894 -7.322 -4.434 1.00 0.00 C ATOM 93 CG LYS A 8 17.306 -7.687 -4.004 1.00 0.00 C ATOM 94 CD LYS A 8 18.053 -6.478 -3.465 1.00 0.00 C ATOM 95 CE LYS A 8 19.557 -6.715 -3.447 1.00 0.00 C ATOM 96 NZ LYS A 8 20.320 -5.453 -3.242 1.00 0.00 N ATOM 0 H LYS A 8 14.090 -8.868 -3.538 1.00 0.00 H new ATOM 0 HA LYS A 8 15.573 -6.619 -2.438 1.00 0.00 H new ATOM 0 HB2 LYS A 8 15.468 -8.155 -4.993 1.00 0.00 H new ATOM 0 HB3 LYS A 8 15.939 -6.471 -5.114 1.00 0.00 H new ATOM 0 HG2 LYS A 8 17.266 -8.462 -3.239 1.00 0.00 H new ATOM 0 HG3 LYS A 8 17.850 -8.104 -4.852 1.00 0.00 H new ATOM 0 HD2 LYS A 8 17.828 -5.606 -4.079 1.00 0.00 H new ATOM 0 HD3 LYS A 8 17.706 -6.255 -2.456 1.00 0.00 H new ATOM 0 HE2 LYS A 8 19.803 -7.420 -2.653 1.00 0.00 H new ATOM 0 HE3 LYS A 8 19.863 -7.174 -4.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 21.339 -5.660 -3.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 20.106 -4.789 -4.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 20.049 -5.027 -2.333 1.00 0.00 H new ATOM 110 N ASN A 9 12.706 -6.183 -3.577 1.00 0.00 N ATOM 111 CA ASN A 9 11.657 -5.222 -3.901 1.00 0.00 C ATOM 112 C ASN A 9 11.238 -4.451 -2.649 1.00 0.00 C ATOM 113 O ASN A 9 10.719 -3.335 -2.735 1.00 0.00 O ATOM 114 CB ASN A 9 10.452 -5.942 -4.535 1.00 0.00 C ATOM 115 CG ASN A 9 9.273 -6.113 -3.586 1.00 0.00 C ATOM 116 OD1 ASN A 9 8.378 -5.272 -3.531 1.00 0.00 O ATOM 117 ND2 ASN A 9 9.260 -7.214 -2.849 1.00 0.00 N ATOM 0 H ASN A 9 12.361 -7.094 -3.275 1.00 0.00 H new ATOM 0 HA ASN A 9 12.045 -4.506 -4.625 1.00 0.00 H new ATOM 0 HB2 ASN A 9 10.124 -5.381 -5.410 1.00 0.00 H new ATOM 0 HB3 ASN A 9 10.770 -6.924 -4.886 1.00 0.00 H new ATOM 0 HD21 ASN A 9 8.487 -7.388 -2.206 1.00 0.00 H new ATOM 0 HD22 ASN A 9 10.023 -7.887 -2.924 1.00 0.00 H new ATOM 124 N ALA A 10 11.505 -5.043 -1.488 1.00 0.00 N ATOM 125 CA ALA A 10 11.114 -4.461 -0.212 1.00 0.00 C ATOM 126 C ALA A 10 11.939 -3.217 0.102 1.00 0.00 C ATOM 127 O ALA A 10 13.052 -3.310 0.623 1.00 0.00 O ATOM 128 CB ALA A 10 11.263 -5.489 0.897 1.00 0.00 C ATOM 0 H ALA A 10 11.995 -5.934 -1.407 1.00 0.00 H new ATOM 0 HA ALA A 10 10.068 -4.161 -0.280 1.00 0.00 H new ATOM 0 HB1 ALA A 10 10.968 -5.044 1.847 1.00 0.00 H new ATOM 0 HB2 ALA A 10 10.626 -6.348 0.685 1.00 0.00 H new ATOM 0 HB3 ALA A 10 12.302 -5.814 0.955 1.00 0.00 H new ATOM 134 N LYS A 11 11.402 -2.053 -0.232 1.00 0.00 N ATOM 135 CA LYS A 11 12.088 -0.801 0.036 1.00 0.00 C ATOM 136 C LYS A 11 11.345 0.017 1.086 1.00 0.00 C ATOM 137 O LYS A 11 11.567 -0.161 2.283 1.00 0.00 O ATOM 138 CB LYS A 11 12.248 0.012 -1.248 1.00 0.00 C ATOM 139 CG LYS A 11 13.378 -0.483 -2.136 1.00 0.00 C ATOM 140 CD LYS A 11 13.028 -0.363 -3.609 1.00 0.00 C ATOM 141 CE LYS A 11 13.226 -1.681 -4.339 1.00 0.00 C ATOM 142 NZ LYS A 11 14.527 -1.717 -5.059 1.00 0.00 N ATOM 0 H LYS A 11 10.495 -1.951 -0.688 1.00 0.00 H new ATOM 0 HA LYS A 11 13.078 -1.040 0.425 1.00 0.00 H new ATOM 0 HB2 LYS A 11 11.314 -0.020 -1.809 1.00 0.00 H new ATOM 0 HB3 LYS A 11 12.429 1.055 -0.989 1.00 0.00 H new ATOM 0 HG2 LYS A 11 14.282 0.090 -1.929 1.00 0.00 H new ATOM 0 HG3 LYS A 11 13.599 -1.523 -1.898 1.00 0.00 H new ATOM 0 HD2 LYS A 11 11.992 -0.041 -3.713 1.00 0.00 H new ATOM 0 HD3 LYS A 11 13.648 0.406 -4.070 1.00 0.00 H new ATOM 0 HE2 LYS A 11 13.182 -2.503 -3.625 1.00 0.00 H new ATOM 0 HE3 LYS A 11 12.412 -1.831 -5.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 14.937 -2.670 -4.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 14.376 -1.478 -6.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 15.179 -1.027 -4.633 1.00 0.00 H new ATOM 156 N LEU A 12 10.472 0.916 0.619 1.00 0.00 N ATOM 157 CA LEU A 12 9.728 1.837 1.489 1.00 0.00 C ATOM 158 C LEU A 12 10.680 2.813 2.191 1.00 0.00 C ATOM 159 O LEU A 12 10.274 3.586 3.054 1.00 0.00 O ATOM 160 CB LEU A 12 8.891 1.065 2.521 1.00 0.00 C ATOM 161 CG LEU A 12 7.403 1.446 2.601 1.00 0.00 C ATOM 162 CD1 LEU A 12 7.232 2.789 3.285 1.00 0.00 C ATOM 163 CD2 LEU A 12 6.768 1.479 1.220 1.00 0.00 C ATOM 0 H LEU A 12 10.260 1.027 -0.373 1.00 0.00 H new ATOM 0 HA LEU A 12 9.048 2.413 0.862 1.00 0.00 H new ATOM 0 HB2 LEU A 12 8.962 0.001 2.295 1.00 0.00 H new ATOM 0 HB3 LEU A 12 9.337 1.212 3.505 1.00 0.00 H new ATOM 0 HG LEU A 12 6.897 0.682 3.191 1.00 0.00 H new ATOM 0 HD11 LEU A 12 6.173 3.041 3.332 1.00 0.00 H new ATOM 0 HD12 LEU A 12 7.638 2.737 4.295 1.00 0.00 H new ATOM 0 HD13 LEU A 12 7.763 3.555 2.720 1.00 0.00 H new ATOM 0 HD21 LEU A 12 5.716 1.751 1.310 1.00 0.00 H new ATOM 0 HD22 LEU A 12 7.282 2.214 0.601 1.00 0.00 H new ATOM 0 HD23 LEU A 12 6.850 0.495 0.758 1.00 0.00 H new ATOM 175 N ALA A 13 11.950 2.771 1.808 1.00 0.00 N ATOM 176 CA ALA A 13 12.954 3.659 2.375 1.00 0.00 C ATOM 177 C ALA A 13 13.491 4.598 1.304 1.00 0.00 C ATOM 178 O ALA A 13 13.848 5.742 1.578 1.00 0.00 O ATOM 179 CB ALA A 13 14.090 2.852 2.994 1.00 0.00 C ATOM 0 H ALA A 13 12.309 2.127 1.103 1.00 0.00 H new ATOM 0 HA ALA A 13 12.488 4.256 3.159 1.00 0.00 H new ATOM 0 HB1 ALA A 13 14.832 3.531 3.413 1.00 0.00 H new ATOM 0 HB2 ALA A 13 13.694 2.214 3.784 1.00 0.00 H new ATOM 0 HB3 ALA A 13 14.557 2.233 2.227 1.00 0.00 H new ATOM 185 N THR A 14 13.549 4.098 0.080 1.00 0.00 N ATOM 186 CA THR A 14 14.004 4.884 -1.053 1.00 0.00 C ATOM 187 C THR A 14 12.898 5.809 -1.553 1.00 0.00 C ATOM 188 O THR A 14 13.162 6.819 -2.207 1.00 0.00 O ATOM 189 CB THR A 14 14.450 3.962 -2.195 1.00 0.00 C ATOM 190 OG1 THR A 14 14.479 2.604 -1.724 1.00 0.00 O ATOM 191 CG2 THR A 14 15.825 4.359 -2.712 1.00 0.00 C ATOM 0 H THR A 14 13.283 3.141 -0.154 1.00 0.00 H new ATOM 0 HA THR A 14 14.848 5.490 -0.723 1.00 0.00 H new ATOM 0 HB THR A 14 13.740 4.055 -3.017 1.00 0.00 H new ATOM 0 HG1 THR A 14 15.166 2.103 -2.212 1.00 0.00 H new ATOM 0 HG21 THR A 14 16.117 3.689 -3.521 1.00 0.00 H new ATOM 0 HG22 THR A 14 15.792 5.383 -3.083 1.00 0.00 H new ATOM 0 HG23 THR A 14 16.552 4.289 -1.903 1.00 0.00 H new ATOM 199 N SER A 15 11.659 5.460 -1.239 1.00 0.00 N ATOM 200 CA SER A 15 10.519 6.254 -1.647 1.00 0.00 C ATOM 201 C SER A 15 10.339 7.451 -0.719 1.00 0.00 C ATOM 202 O SER A 15 9.457 7.456 0.139 1.00 0.00 O ATOM 203 CB SER A 15 9.259 5.391 -1.642 1.00 0.00 C ATOM 204 OG SER A 15 9.579 4.010 -1.550 1.00 0.00 O ATOM 0 H SER A 15 11.421 4.627 -0.700 1.00 0.00 H new ATOM 0 HA SER A 15 10.695 6.625 -2.657 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.624 5.676 -0.803 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.687 5.574 -2.552 1.00 0.00 H new ATOM 0 HG SER A 15 8.865 3.481 -1.962 1.00 0.00 H new ATOM 210 N ALA A 16 11.182 8.464 -0.895 1.00 0.00 N ATOM 211 CA ALA A 16 11.061 9.699 -0.133 1.00 0.00 C ATOM 212 C ALA A 16 9.694 10.327 -0.369 1.00 0.00 C ATOM 213 O ALA A 16 9.149 11.015 0.493 1.00 0.00 O ATOM 214 CB ALA A 16 12.167 10.670 -0.516 1.00 0.00 C ATOM 0 H ALA A 16 11.956 8.452 -1.559 1.00 0.00 H new ATOM 0 HA ALA A 16 11.161 9.468 0.928 1.00 0.00 H new ATOM 0 HB1 ALA A 16 12.062 11.588 0.063 1.00 0.00 H new ATOM 0 HB2 ALA A 16 13.137 10.218 -0.307 1.00 0.00 H new ATOM 0 HB3 ALA A 16 12.096 10.901 -1.579 1.00 0.00 H new ATOM 220 N ALA A 17 9.141 10.060 -1.547 1.00 0.00 N ATOM 221 CA ALA A 17 7.812 10.530 -1.905 1.00 0.00 C ATOM 222 C ALA A 17 6.740 9.903 -1.014 1.00 0.00 C ATOM 223 O ALA A 17 5.744 10.543 -0.692 1.00 0.00 O ATOM 224 CB ALA A 17 7.528 10.219 -3.362 1.00 0.00 C ATOM 0 H ALA A 17 9.600 9.514 -2.276 1.00 0.00 H new ATOM 0 HA ALA A 17 7.783 11.609 -1.754 1.00 0.00 H new ATOM 0 HB1 ALA A 17 6.531 10.574 -3.622 1.00 0.00 H new ATOM 0 HB2 ALA A 17 8.266 10.717 -3.991 1.00 0.00 H new ATOM 0 HB3 ALA A 17 7.583 9.142 -3.522 1.00 0.00 H new ATOM 230 N PHE A 18 6.960 8.656 -0.599 1.00 0.00 N ATOM 231 CA PHE A 18 6.003 7.951 0.251 1.00 0.00 C ATOM 232 C PHE A 18 6.046 8.528 1.657 1.00 0.00 C ATOM 233 O PHE A 18 5.045 8.542 2.368 1.00 0.00 O ATOM 234 CB PHE A 18 6.298 6.446 0.285 1.00 0.00 C ATOM 235 CG PHE A 18 5.099 5.609 0.638 1.00 0.00 C ATOM 236 CD1 PHE A 18 4.250 5.146 -0.354 1.00 0.00 C ATOM 237 CD2 PHE A 18 4.822 5.283 1.956 1.00 0.00 C ATOM 238 CE1 PHE A 18 3.145 4.381 -0.040 1.00 0.00 C ATOM 239 CE2 PHE A 18 3.717 4.517 2.278 1.00 0.00 C ATOM 240 CZ PHE A 18 2.879 4.061 1.276 1.00 0.00 C ATOM 0 H PHE A 18 7.791 8.115 -0.837 1.00 0.00 H new ATOM 0 HA PHE A 18 5.005 8.087 -0.165 1.00 0.00 H new ATOM 0 HB2 PHE A 18 6.674 6.135 -0.690 1.00 0.00 H new ATOM 0 HB3 PHE A 18 7.091 6.255 1.008 1.00 0.00 H new ATOM 0 HD1 PHE A 18 4.456 5.387 -1.387 1.00 0.00 H new ATOM 0 HD2 PHE A 18 5.477 5.631 2.741 1.00 0.00 H new ATOM 0 HE1 PHE A 18 2.489 4.033 -0.824 1.00 0.00 H new ATOM 0 HE2 PHE A 18 3.508 4.275 3.310 1.00 0.00 H new ATOM 0 HZ PHE A 18 2.019 3.456 1.523 1.00 0.00 H new ATOM 250 N ALA A 19 7.220 9.005 2.046 1.00 0.00 N ATOM 251 CA ALA A 19 7.382 9.690 3.321 1.00 0.00 C ATOM 252 C ALA A 19 6.619 11.011 3.331 1.00 0.00 C ATOM 253 O ALA A 19 6.030 11.388 4.346 1.00 0.00 O ATOM 254 CB ALA A 19 8.852 9.930 3.608 1.00 0.00 C ATOM 0 H ALA A 19 8.076 8.930 1.496 1.00 0.00 H new ATOM 0 HA ALA A 19 6.970 9.053 4.103 1.00 0.00 H new ATOM 0 HB1 ALA A 19 8.957 10.443 4.564 1.00 0.00 H new ATOM 0 HB2 ALA A 19 9.375 8.975 3.649 1.00 0.00 H new ATOM 0 HB3 ALA A 19 9.281 10.545 2.817 1.00 0.00 H new ATOM 260 N LYS A 20 6.626 11.715 2.198 1.00 0.00 N ATOM 261 CA LYS A 20 5.857 12.948 2.063 1.00 0.00 C ATOM 262 C LYS A 20 4.373 12.608 2.032 1.00 0.00 C ATOM 263 O LYS A 20 3.534 13.318 2.591 1.00 0.00 O ATOM 264 CB LYS A 20 6.255 13.695 0.786 1.00 0.00 C ATOM 265 CG LYS A 20 7.724 14.092 0.735 1.00 0.00 C ATOM 266 CD LYS A 20 8.290 13.956 -0.668 1.00 0.00 C ATOM 267 CE LYS A 20 8.605 15.311 -1.274 1.00 0.00 C ATOM 268 NZ LYS A 20 10.051 15.632 -1.201 1.00 0.00 N ATOM 0 H LYS A 20 7.154 11.452 1.366 1.00 0.00 H new ATOM 0 HA LYS A 20 6.067 13.597 2.914 1.00 0.00 H new ATOM 0 HB2 LYS A 20 6.028 13.067 -0.076 1.00 0.00 H new ATOM 0 HB3 LYS A 20 5.643 14.593 0.696 1.00 0.00 H new ATOM 0 HG2 LYS A 20 7.836 15.122 1.075 1.00 0.00 H new ATOM 0 HG3 LYS A 20 8.295 13.466 1.421 1.00 0.00 H new ATOM 0 HD2 LYS A 20 9.195 13.350 -0.639 1.00 0.00 H new ATOM 0 HD3 LYS A 20 7.575 13.431 -1.301 1.00 0.00 H new ATOM 0 HE2 LYS A 20 8.283 15.326 -2.315 1.00 0.00 H new ATOM 0 HE3 LYS A 20 8.036 16.082 -0.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 10.221 16.566 -1.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 10.354 15.644 -0.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 10.593 14.912 -1.719 1.00 0.00 H new ATOM 282 N GLN A 21 4.079 11.488 1.388 1.00 0.00 N ATOM 283 CA GLN A 21 2.728 10.949 1.311 1.00 0.00 C ATOM 284 C GLN A 21 2.220 10.559 2.698 1.00 0.00 C ATOM 285 O GLN A 21 1.016 10.547 2.952 1.00 0.00 O ATOM 286 CB GLN A 21 2.727 9.728 0.387 1.00 0.00 C ATOM 287 CG GLN A 21 1.712 9.808 -0.737 1.00 0.00 C ATOM 288 CD GLN A 21 2.053 8.898 -1.904 1.00 0.00 C ATOM 289 OE1 GLN A 21 2.669 7.845 -1.734 1.00 0.00 O ATOM 290 NE2 GLN A 21 1.659 9.300 -3.104 1.00 0.00 N ATOM 0 H GLN A 21 4.775 10.924 0.901 1.00 0.00 H new ATOM 0 HA GLN A 21 2.062 11.714 0.911 1.00 0.00 H new ATOM 0 HB2 GLN A 21 3.722 9.609 -0.043 1.00 0.00 H new ATOM 0 HB3 GLN A 21 2.528 8.836 0.981 1.00 0.00 H new ATOM 0 HG2 GLN A 21 0.728 9.543 -0.351 1.00 0.00 H new ATOM 0 HG3 GLN A 21 1.649 10.837 -1.091 1.00 0.00 H new ATOM 0 HE21 GLN A 21 1.151 10.178 -3.206 1.00 0.00 H new ATOM 0 HE22 GLN A 21 1.864 8.731 -3.925 1.00 0.00 H new ATOM 299 N ALA A 22 3.149 10.264 3.602 1.00 0.00 N ATOM 300 CA ALA A 22 2.809 9.840 4.954 1.00 0.00 C ATOM 301 C ALA A 22 2.186 10.971 5.769 1.00 0.00 C ATOM 302 O ALA A 22 1.605 10.733 6.826 1.00 0.00 O ATOM 303 CB ALA A 22 4.038 9.300 5.663 1.00 0.00 C ATOM 0 H ALA A 22 4.151 10.312 3.419 1.00 0.00 H new ATOM 0 HA ALA A 22 2.065 9.048 4.869 1.00 0.00 H new ATOM 0 HB1 ALA A 22 3.768 8.987 6.672 1.00 0.00 H new ATOM 0 HB2 ALA A 22 4.431 8.446 5.111 1.00 0.00 H new ATOM 0 HB3 ALA A 22 4.799 10.079 5.716 1.00 0.00 H new ATOM 309 N GLU A 23 2.316 12.202 5.291 1.00 0.00 N ATOM 310 CA GLU A 23 1.673 13.328 5.950 1.00 0.00 C ATOM 311 C GLU A 23 0.540 13.871 5.088 1.00 0.00 C ATOM 312 O GLU A 23 -0.026 14.926 5.373 1.00 0.00 O ATOM 313 CB GLU A 23 2.681 14.427 6.279 1.00 0.00 C ATOM 314 CG GLU A 23 2.352 15.168 7.568 1.00 0.00 C ATOM 315 CD GLU A 23 3.557 15.366 8.462 1.00 0.00 C ATOM 316 OE1 GLU A 23 4.324 16.321 8.221 1.00 0.00 O ATOM 317 OE2 GLU A 23 3.739 14.578 9.415 1.00 0.00 O ATOM 0 H GLU A 23 2.855 12.443 4.459 1.00 0.00 H new ATOM 0 HA GLU A 23 1.253 12.974 6.891 1.00 0.00 H new ATOM 0 HB2 GLU A 23 3.675 13.988 6.362 1.00 0.00 H new ATOM 0 HB3 GLU A 23 2.715 15.140 5.455 1.00 0.00 H new ATOM 0 HG2 GLU A 23 1.925 16.140 7.322 1.00 0.00 H new ATOM 0 HG3 GLU A 23 1.589 14.614 8.114 1.00 0.00 H new ATOM 324 N GLY A 24 0.214 13.140 4.031 1.00 0.00 N ATOM 325 CA GLY A 24 -0.918 13.506 3.203 1.00 0.00 C ATOM 326 C GLY A 24 -2.203 12.945 3.770 1.00 0.00 C ATOM 327 O GLY A 24 -3.299 13.307 3.349 1.00 0.00 O ATOM 0 H GLY A 24 0.712 12.301 3.732 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -0.989 14.592 3.135 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -0.769 13.133 2.190 1.00 0.00 H new ATOM 331 N THR A 25 -2.050 12.039 4.723 1.00 0.00 N ATOM 332 CA THR A 25 -3.166 11.442 5.432 1.00 0.00 C ATOM 333 C THR A 25 -2.707 11.035 6.829 1.00 0.00 C ATOM 334 O THR A 25 -1.583 10.559 6.995 1.00 0.00 O ATOM 335 CB THR A 25 -3.714 10.206 4.690 1.00 0.00 C ATOM 336 OG1 THR A 25 -3.688 10.430 3.276 1.00 0.00 O ATOM 337 CG2 THR A 25 -5.139 9.894 5.125 1.00 0.00 C ATOM 0 H THR A 25 -1.139 11.696 5.027 1.00 0.00 H new ATOM 0 HA THR A 25 -3.967 12.178 5.493 1.00 0.00 H new ATOM 0 HB THR A 25 -3.079 9.356 4.939 1.00 0.00 H new ATOM 0 HG1 THR A 25 -4.523 10.106 2.878 1.00 0.00 H new ATOM 0 HG21 THR A 25 -5.500 9.018 4.586 1.00 0.00 H new ATOM 0 HG22 THR A 25 -5.157 9.694 6.196 1.00 0.00 H new ATOM 0 HG23 THR A 25 -5.782 10.746 4.904 1.00 0.00 H new ATOM 345 N THR A 26 -3.547 11.245 7.828 1.00 0.00 N ATOM 346 CA THR A 26 -3.193 10.909 9.193 1.00 0.00 C ATOM 347 C THR A 26 -3.127 9.393 9.384 1.00 0.00 C ATOM 348 O THR A 26 -4.152 8.741 9.594 1.00 0.00 O ATOM 349 CB THR A 26 -4.212 11.510 10.169 1.00 0.00 C ATOM 350 OG1 THR A 26 -5.272 12.137 9.431 1.00 0.00 O ATOM 351 CG2 THR A 26 -3.548 12.529 11.081 1.00 0.00 C ATOM 0 H THR A 26 -4.478 11.647 7.718 1.00 0.00 H new ATOM 0 HA THR A 26 -2.208 11.327 9.398 1.00 0.00 H new ATOM 0 HB THR A 26 -4.619 10.709 10.786 1.00 0.00 H new ATOM 0 HG1 THR A 26 -4.945 12.971 9.033 1.00 0.00 H new ATOM 0 HG21 THR A 26 -4.289 12.943 11.765 1.00 0.00 H new ATOM 0 HG22 THR A 26 -2.757 12.044 11.653 1.00 0.00 H new ATOM 0 HG23 THR A 26 -3.121 13.332 10.480 1.00 0.00 H new ATOM 359 N CYS A 27 -1.920 8.843 9.309 1.00 0.00 N ATOM 360 CA CYS A 27 -1.726 7.404 9.413 1.00 0.00 C ATOM 361 C CYS A 27 -0.377 7.076 10.038 1.00 0.00 C ATOM 362 O CYS A 27 0.499 7.935 10.135 1.00 0.00 O ATOM 363 CB CYS A 27 -1.810 6.761 8.031 1.00 0.00 C ATOM 364 SG CYS A 27 -3.470 6.791 7.290 1.00 0.00 S ATOM 0 H CYS A 27 -1.060 9.375 9.176 1.00 0.00 H new ATOM 0 HA CYS A 27 -2.514 7.007 10.053 1.00 0.00 H new ATOM 0 HB2 CYS A 27 -1.117 7.273 7.363 1.00 0.00 H new ATOM 0 HB3 CYS A 27 -1.476 5.726 8.104 1.00 0.00 H new ATOM 369 N ASN A 28 -0.216 5.828 10.451 1.00 0.00 N ATOM 370 CA ASN A 28 1.031 5.367 11.040 1.00 0.00 C ATOM 371 C ASN A 28 1.651 4.304 10.146 1.00 0.00 C ATOM 372 O ASN A 28 1.037 3.889 9.169 1.00 0.00 O ATOM 373 CB ASN A 28 0.787 4.795 12.438 1.00 0.00 C ATOM 374 CG ASN A 28 0.426 5.859 13.451 1.00 0.00 C ATOM 375 OD1 ASN A 28 -0.749 6.114 13.706 1.00 0.00 O ATOM 376 ND2 ASN A 28 1.432 6.488 14.029 1.00 0.00 N ATOM 0 H ASN A 28 -0.940 5.112 10.388 1.00 0.00 H new ATOM 0 HA ASN A 28 1.713 6.213 11.129 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -0.015 4.059 12.390 1.00 0.00 H new ATOM 0 HB3 ASN A 28 1.682 4.270 12.772 1.00 0.00 H new ATOM 0 HD21 ASN A 28 1.249 7.218 14.717 1.00 0.00 H new ATOM 0 HD22 ASN A 28 2.392 6.244 13.787 1.00 0.00 H new ATOM 383 N VAL A 29 2.851 3.857 10.489 1.00 0.00 N ATOM 384 CA VAL A 29 3.564 2.856 9.695 1.00 0.00 C ATOM 385 C VAL A 29 2.727 1.583 9.497 1.00 0.00 C ATOM 386 O VAL A 29 2.655 1.045 8.391 1.00 0.00 O ATOM 387 CB VAL A 29 4.925 2.510 10.352 1.00 0.00 C ATOM 388 CG1 VAL A 29 5.304 1.047 10.151 1.00 0.00 C ATOM 389 CG2 VAL A 29 6.020 3.423 9.822 1.00 0.00 C ATOM 0 H VAL A 29 3.357 4.172 11.317 1.00 0.00 H new ATOM 0 HA VAL A 29 3.745 3.288 8.711 1.00 0.00 H new ATOM 0 HB VAL A 29 4.817 2.672 11.425 1.00 0.00 H new ATOM 0 HG11 VAL A 29 6.264 0.851 10.628 1.00 0.00 H new ATOM 0 HG12 VAL A 29 4.541 0.409 10.596 1.00 0.00 H new ATOM 0 HG13 VAL A 29 5.378 0.834 9.085 1.00 0.00 H new ATOM 0 HG21 VAL A 29 6.968 3.166 10.294 1.00 0.00 H new ATOM 0 HG22 VAL A 29 6.107 3.299 8.743 1.00 0.00 H new ATOM 0 HG23 VAL A 29 5.771 4.460 10.049 1.00 0.00 H new ATOM 399 N GLY A 30 2.070 1.124 10.557 1.00 0.00 N ATOM 400 CA GLY A 30 1.309 -0.111 10.473 1.00 0.00 C ATOM 401 C GLY A 30 -0.158 0.113 10.151 1.00 0.00 C ATOM 402 O GLY A 30 -0.966 -0.815 10.222 1.00 0.00 O ATOM 0 H GLY A 30 2.050 1.581 11.468 1.00 0.00 H new ATOM 0 HA2 GLY A 30 1.749 -0.750 9.708 1.00 0.00 H new ATOM 0 HA3 GLY A 30 1.389 -0.645 11.420 1.00 0.00 H new ATOM 406 N SER A 31 -0.505 1.346 9.803 1.00 0.00 N ATOM 407 CA SER A 31 -1.882 1.690 9.474 1.00 0.00 C ATOM 408 C SER A 31 -1.951 2.477 8.168 1.00 0.00 C ATOM 409 O SER A 31 -3.024 2.892 7.731 1.00 0.00 O ATOM 410 CB SER A 31 -2.496 2.502 10.614 1.00 0.00 C ATOM 411 OG SER A 31 -1.499 2.895 11.547 1.00 0.00 O ATOM 0 H SER A 31 0.150 2.126 9.741 1.00 0.00 H new ATOM 0 HA SER A 31 -2.448 0.768 9.342 1.00 0.00 H new ATOM 0 HB2 SER A 31 -2.992 3.385 10.211 1.00 0.00 H new ATOM 0 HB3 SER A 31 -3.259 1.910 11.118 1.00 0.00 H new ATOM 0 HG SER A 31 -1.897 3.481 12.224 1.00 0.00 H new ATOM 417 N ILE A 32 -0.801 2.661 7.543 1.00 0.00 N ATOM 418 CA ILE A 32 -0.720 3.401 6.297 1.00 0.00 C ATOM 419 C ILE A 32 -0.901 2.450 5.128 1.00 0.00 C ATOM 420 O ILE A 32 -0.310 1.370 5.094 1.00 0.00 O ATOM 421 CB ILE A 32 0.616 4.193 6.183 1.00 0.00 C ATOM 422 CG1 ILE A 32 0.365 5.558 5.545 1.00 0.00 C ATOM 423 CG2 ILE A 32 1.682 3.427 5.403 1.00 0.00 C ATOM 424 CD1 ILE A 32 1.355 6.613 5.983 1.00 0.00 C ATOM 0 H ILE A 32 0.094 2.306 7.881 1.00 0.00 H new ATOM 0 HA ILE A 32 -1.522 4.139 6.279 1.00 0.00 H new ATOM 0 HB ILE A 32 0.999 4.331 7.194 1.00 0.00 H new ATOM 0 HG12 ILE A 32 0.407 5.458 4.460 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -0.643 5.889 5.796 1.00 0.00 H new ATOM 0 HG21 ILE A 32 2.594 4.022 5.352 1.00 0.00 H new ATOM 0 HG22 ILE A 32 1.893 2.483 5.906 1.00 0.00 H new ATOM 0 HG23 ILE A 32 1.322 3.228 4.394 1.00 0.00 H new ATOM 0 HD11 ILE A 32 1.120 7.558 5.493 1.00 0.00 H new ATOM 0 HD12 ILE A 32 1.297 6.740 7.064 1.00 0.00 H new ATOM 0 HD13 ILE A 32 2.363 6.303 5.708 1.00 0.00 H new ATOM 436 N ALA A 33 -1.745 2.827 4.191 1.00 0.00 N ATOM 437 CA ALA A 33 -2.060 1.953 3.082 1.00 0.00 C ATOM 438 C ALA A 33 -2.284 2.727 1.804 1.00 0.00 C ATOM 439 O ALA A 33 -2.618 3.911 1.820 1.00 0.00 O ATOM 440 CB ALA A 33 -3.286 1.108 3.395 1.00 0.00 C ATOM 0 H ALA A 33 -2.223 3.728 4.175 1.00 0.00 H new ATOM 0 HA ALA A 33 -1.201 1.298 2.935 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -3.506 0.458 2.548 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -3.093 0.500 4.279 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -4.139 1.760 3.583 1.00 0.00 H new ATOM 446 N CYS A 34 -2.089 2.044 0.696 1.00 0.00 N ATOM 447 CA CYS A 34 -2.425 2.592 -0.592 1.00 0.00 C ATOM 448 C CYS A 34 -3.648 1.862 -1.123 1.00 0.00 C ATOM 449 O CYS A 34 -3.704 0.635 -1.092 1.00 0.00 O ATOM 450 CB CYS A 34 -1.249 2.458 -1.558 1.00 0.00 C ATOM 451 SG CYS A 34 -1.541 3.204 -3.193 1.00 0.00 S ATOM 0 H CYS A 34 -1.697 1.103 0.666 1.00 0.00 H new ATOM 0 HA CYS A 34 -2.647 3.655 -0.495 1.00 0.00 H new ATOM 0 HB2 CYS A 34 -0.370 2.922 -1.110 1.00 0.00 H new ATOM 0 HB3 CYS A 34 -1.019 1.401 -1.689 1.00 0.00 H new ATOM 456 N CYS A 35 -4.634 2.606 -1.573 1.00 0.00 N ATOM 457 CA CYS A 35 -5.860 2.012 -2.066 1.00 0.00 C ATOM 458 C CYS A 35 -6.032 2.332 -3.534 1.00 0.00 C ATOM 459 O CYS A 35 -5.495 3.325 -4.026 1.00 0.00 O ATOM 460 CB CYS A 35 -7.061 2.528 -1.276 1.00 0.00 C ATOM 461 SG CYS A 35 -6.936 2.280 0.523 1.00 0.00 S ATOM 0 H CYS A 35 -4.612 3.625 -1.608 1.00 0.00 H new ATOM 0 HA CYS A 35 -5.799 0.931 -1.938 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -7.183 3.592 -1.477 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -7.960 2.030 -1.638 1.00 0.00 H new ATOM 466 N ASN A 36 -6.758 1.488 -4.240 1.00 0.00 N ATOM 467 CA ASN A 36 -7.030 1.730 -5.647 1.00 0.00 C ATOM 468 C ASN A 36 -8.342 1.087 -6.053 1.00 0.00 C ATOM 469 O ASN A 36 -8.847 0.199 -5.362 1.00 0.00 O ATOM 470 CB ASN A 36 -5.876 1.217 -6.522 1.00 0.00 C ATOM 471 CG ASN A 36 -5.758 -0.296 -6.519 1.00 0.00 C ATOM 472 OD1 ASN A 36 -6.483 -0.988 -7.226 1.00 0.00 O ATOM 473 ND2 ASN A 36 -4.837 -0.815 -5.723 1.00 0.00 N ATOM 0 H ASN A 36 -7.169 0.632 -3.867 1.00 0.00 H new ATOM 0 HA ASN A 36 -7.115 2.806 -5.799 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -6.022 1.563 -7.545 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -4.940 1.650 -6.170 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -4.710 -1.826 -5.682 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -4.254 -0.204 -5.151 1.00 0.00 H new ATOM 480 N SER A 37 -8.911 1.572 -7.147 1.00 0.00 N ATOM 481 CA SER A 37 -10.133 1.012 -7.702 1.00 0.00 C ATOM 482 C SER A 37 -9.974 -0.486 -7.958 1.00 0.00 C ATOM 483 O SER A 37 -8.975 -0.921 -8.530 1.00 0.00 O ATOM 484 CB SER A 37 -10.482 1.754 -8.991 1.00 0.00 C ATOM 485 OG SER A 37 -9.869 3.036 -9.001 1.00 0.00 O ATOM 0 H SER A 37 -8.539 2.363 -7.673 1.00 0.00 H new ATOM 0 HA SER A 37 -10.946 1.136 -6.987 1.00 0.00 H new ATOM 0 HB2 SER A 37 -10.148 1.177 -9.853 1.00 0.00 H new ATOM 0 HB3 SER A 37 -11.563 1.859 -9.077 1.00 0.00 H new ATOM 0 HG SER A 37 -10.098 3.502 -9.832 1.00 0.00 H new ATOM 491 N PRO A 38 -10.970 -1.288 -7.541 1.00 0.00 N ATOM 492 CA PRO A 38 -10.899 -2.758 -7.574 1.00 0.00 C ATOM 493 C PRO A 38 -10.455 -3.317 -8.919 1.00 0.00 C ATOM 494 O PRO A 38 -9.792 -4.347 -8.973 1.00 0.00 O ATOM 495 CB PRO A 38 -12.335 -3.192 -7.282 1.00 0.00 C ATOM 496 CG PRO A 38 -12.928 -2.065 -6.513 1.00 0.00 C ATOM 497 CD PRO A 38 -12.258 -0.814 -7.004 1.00 0.00 C ATOM 0 HA PRO A 38 -10.160 -3.127 -6.863 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -12.887 -3.375 -8.204 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -12.359 -4.118 -6.707 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -14.006 -2.014 -6.668 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -12.766 -2.198 -5.443 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -12.852 -0.318 -7.771 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -12.114 -0.095 -6.197 1.00 0.00 H new ATOM 505 N ALA A 39 -10.793 -2.623 -9.996 1.00 0.00 N ATOM 506 CA ALA A 39 -10.482 -3.087 -11.347 1.00 0.00 C ATOM 507 C ALA A 39 -8.982 -3.276 -11.566 1.00 0.00 C ATOM 508 O ALA A 39 -8.569 -3.997 -12.473 1.00 0.00 O ATOM 509 CB ALA A 39 -11.037 -2.113 -12.371 1.00 0.00 C ATOM 0 H ALA A 39 -11.286 -1.731 -9.963 1.00 0.00 H new ATOM 0 HA ALA A 39 -10.953 -4.062 -11.471 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -10.801 -2.466 -13.375 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -12.119 -2.042 -12.257 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -10.591 -1.130 -12.218 1.00 0.00 H new ATOM 515 N GLU A 40 -8.174 -2.640 -10.727 1.00 0.00 N ATOM 516 CA GLU A 40 -6.728 -2.699 -10.869 1.00 0.00 C ATOM 517 C GLU A 40 -6.123 -3.678 -9.860 1.00 0.00 C ATOM 518 O GLU A 40 -5.395 -4.597 -10.237 1.00 0.00 O ATOM 519 CB GLU A 40 -6.139 -1.293 -10.701 1.00 0.00 C ATOM 520 CG GLU A 40 -4.687 -1.272 -10.262 1.00 0.00 C ATOM 521 CD GLU A 40 -3.817 -0.412 -11.158 1.00 0.00 C ATOM 522 OE1 GLU A 40 -3.970 0.826 -11.125 1.00 0.00 O ATOM 523 OE2 GLU A 40 -2.980 -0.975 -11.900 1.00 0.00 O ATOM 0 H GLU A 40 -8.498 -2.077 -9.941 1.00 0.00 H new ATOM 0 HA GLU A 40 -6.481 -3.064 -11.866 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.228 -0.759 -11.647 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -6.735 -0.747 -9.970 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -4.626 -0.901 -9.239 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -4.299 -2.291 -10.255 1.00 0.00 H new ATOM 530 N THR A 41 -6.445 -3.497 -8.588 1.00 0.00 N ATOM 531 CA THR A 41 -5.890 -4.332 -7.530 1.00 0.00 C ATOM 532 C THR A 41 -6.428 -5.766 -7.592 1.00 0.00 C ATOM 533 O THR A 41 -5.768 -6.706 -7.150 1.00 0.00 O ATOM 534 CB THR A 41 -6.153 -3.699 -6.138 1.00 0.00 C ATOM 535 OG1 THR A 41 -4.942 -3.677 -5.372 1.00 0.00 O ATOM 536 CG2 THR A 41 -7.236 -4.428 -5.354 1.00 0.00 C ATOM 0 H THR A 41 -7.090 -2.777 -8.261 1.00 0.00 H new ATOM 0 HA THR A 41 -4.813 -4.386 -7.686 1.00 0.00 H new ATOM 0 HB THR A 41 -6.507 -2.683 -6.315 1.00 0.00 H new ATOM 0 HG1 THR A 41 -5.158 -3.584 -4.421 1.00 0.00 H new ATOM 0 HG21 THR A 41 -7.377 -3.941 -4.389 1.00 0.00 H new ATOM 0 HG22 THR A 41 -8.171 -4.401 -5.914 1.00 0.00 H new ATOM 0 HG23 THR A 41 -6.937 -5.464 -5.197 1.00 0.00 H new ATOM 544 N ASN A 42 -7.609 -5.932 -8.172 1.00 0.00 N ATOM 545 CA ASN A 42 -8.252 -7.242 -8.250 1.00 0.00 C ATOM 546 C ASN A 42 -7.887 -7.953 -9.543 1.00 0.00 C ATOM 547 O ASN A 42 -8.555 -8.905 -9.942 1.00 0.00 O ATOM 548 CB ASN A 42 -9.771 -7.112 -8.150 1.00 0.00 C ATOM 549 CG ASN A 42 -10.290 -7.313 -6.741 1.00 0.00 C ATOM 550 OD1 ASN A 42 -11.170 -8.135 -6.501 1.00 0.00 O ATOM 551 ND2 ASN A 42 -9.749 -6.554 -5.802 1.00 0.00 N ATOM 0 H ASN A 42 -8.145 -5.175 -8.597 1.00 0.00 H new ATOM 0 HA ASN A 42 -7.891 -7.833 -7.408 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -10.070 -6.125 -8.504 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -10.237 -7.843 -8.811 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -10.061 -6.639 -4.835 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -9.020 -5.883 -6.045 1.00 0.00 H new ATOM 558 N ASN A 43 -6.840 -7.457 -10.198 1.00 0.00 N ATOM 559 CA ASN A 43 -6.367 -8.015 -11.471 1.00 0.00 C ATOM 560 C ASN A 43 -6.203 -9.533 -11.402 1.00 0.00 C ATOM 561 O ASN A 43 -6.414 -10.236 -12.390 1.00 0.00 O ATOM 562 CB ASN A 43 -5.029 -7.384 -11.866 1.00 0.00 C ATOM 563 CG ASN A 43 -5.130 -6.549 -13.130 1.00 0.00 C ATOM 564 OD1 ASN A 43 -5.220 -7.083 -14.236 1.00 0.00 O ATOM 565 ND2 ASN A 43 -5.101 -5.235 -12.980 1.00 0.00 N ATOM 0 H ASN A 43 -6.295 -6.661 -9.867 1.00 0.00 H new ATOM 0 HA ASN A 43 -7.123 -7.784 -12.222 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -4.671 -6.758 -11.049 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -4.289 -8.171 -12.013 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -5.154 -4.627 -13.797 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -5.026 -4.830 -12.047 1.00 0.00 H new ATOM 572 N ASP A 44 -5.816 -10.031 -10.236 1.00 0.00 N ATOM 573 CA ASP A 44 -5.672 -11.465 -10.028 1.00 0.00 C ATOM 574 C ASP A 44 -6.618 -11.927 -8.921 1.00 0.00 C ATOM 575 O ASP A 44 -6.960 -11.153 -8.023 1.00 0.00 O ATOM 576 CB ASP A 44 -4.222 -11.817 -9.678 1.00 0.00 C ATOM 577 CG ASP A 44 -4.080 -13.222 -9.124 1.00 0.00 C ATOM 578 OD1 ASP A 44 -4.564 -14.174 -9.770 1.00 0.00 O ATOM 579 OD2 ASP A 44 -3.515 -13.372 -8.030 1.00 0.00 O ATOM 0 H ASP A 44 -5.596 -9.462 -9.418 1.00 0.00 H new ATOM 0 HA ASP A 44 -5.932 -11.981 -10.952 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -3.603 -11.718 -10.569 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -3.845 -11.102 -8.947 1.00 0.00 H new ATOM 584 N SER A 45 -7.029 -13.190 -8.988 1.00 0.00 N ATOM 585 CA SER A 45 -8.009 -13.740 -8.059 1.00 0.00 C ATOM 586 C SER A 45 -7.364 -14.114 -6.725 1.00 0.00 C ATOM 587 O SER A 45 -8.036 -14.178 -5.695 1.00 0.00 O ATOM 588 CB SER A 45 -8.670 -14.963 -8.683 1.00 0.00 C ATOM 589 OG SER A 45 -8.451 -14.988 -10.088 1.00 0.00 O ATOM 0 H SER A 45 -6.694 -13.857 -9.683 1.00 0.00 H new ATOM 0 HA SER A 45 -8.761 -12.977 -7.861 1.00 0.00 H new ATOM 0 HB2 SER A 45 -8.269 -15.870 -8.231 1.00 0.00 H new ATOM 0 HB3 SER A 45 -9.740 -14.950 -8.476 1.00 0.00 H new ATOM 0 HG SER A 45 -7.642 -15.505 -10.284 1.00 0.00 H new ATOM 595 N LEU A 46 -6.062 -14.374 -6.748 1.00 0.00 N ATOM 596 CA LEU A 46 -5.322 -14.654 -5.524 1.00 0.00 C ATOM 597 C LEU A 46 -4.883 -13.338 -4.891 1.00 0.00 C ATOM 598 O LEU A 46 -4.867 -13.195 -3.667 1.00 0.00 O ATOM 599 CB LEU A 46 -4.111 -15.549 -5.819 1.00 0.00 C ATOM 600 CG LEU A 46 -3.053 -15.613 -4.713 1.00 0.00 C ATOM 601 CD1 LEU A 46 -3.392 -16.697 -3.705 1.00 0.00 C ATOM 602 CD2 LEU A 46 -1.680 -15.862 -5.310 1.00 0.00 C ATOM 0 H LEU A 46 -5.499 -14.397 -7.598 1.00 0.00 H new ATOM 0 HA LEU A 46 -5.966 -15.188 -4.826 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -4.468 -16.560 -6.015 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -3.634 -15.196 -6.734 1.00 0.00 H new ATOM 0 HG LEU A 46 -3.042 -14.654 -4.195 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -2.627 -16.724 -2.929 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -4.360 -16.483 -3.253 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -3.432 -17.663 -4.209 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -0.939 -15.905 -4.512 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -1.685 -16.808 -5.852 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -1.429 -15.052 -5.995 1.00 0.00 H new ATOM 614 N LEU A 47 -4.537 -12.382 -5.750 1.00 0.00 N ATOM 615 CA LEU A 47 -4.172 -11.031 -5.336 1.00 0.00 C ATOM 616 C LEU A 47 -5.232 -10.418 -4.431 1.00 0.00 C ATOM 617 O LEU A 47 -4.907 -9.754 -3.451 1.00 0.00 O ATOM 618 CB LEU A 47 -3.985 -10.144 -6.566 1.00 0.00 C ATOM 619 CG LEU A 47 -2.660 -9.385 -6.628 1.00 0.00 C ATOM 620 CD1 LEU A 47 -2.396 -8.910 -8.044 1.00 0.00 C ATOM 621 CD2 LEU A 47 -2.667 -8.210 -5.664 1.00 0.00 C ATOM 0 H LEU A 47 -4.502 -12.525 -6.759 1.00 0.00 H new ATOM 0 HA LEU A 47 -3.239 -11.096 -4.776 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -4.071 -10.765 -7.458 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.801 -9.422 -6.600 1.00 0.00 H new ATOM 0 HG LEU A 47 -1.859 -10.062 -6.331 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -1.449 -8.371 -8.076 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -2.347 -9.769 -8.713 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -3.202 -8.248 -8.362 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -1.714 -7.684 -5.725 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.475 -7.528 -5.927 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -2.816 -8.574 -4.648 1.00 0.00 H new ATOM 633 N SER A 48 -6.497 -10.661 -4.757 1.00 0.00 N ATOM 634 CA SER A 48 -7.606 -10.084 -4.009 1.00 0.00 C ATOM 635 C SER A 48 -7.641 -10.618 -2.571 1.00 0.00 C ATOM 636 O SER A 48 -8.260 -10.020 -1.691 1.00 0.00 O ATOM 637 CB SER A 48 -8.923 -10.384 -4.730 1.00 0.00 C ATOM 638 OG SER A 48 -8.694 -11.188 -5.876 1.00 0.00 O ATOM 0 H SER A 48 -6.779 -11.255 -5.536 1.00 0.00 H new ATOM 0 HA SER A 48 -7.466 -9.004 -3.955 1.00 0.00 H new ATOM 0 HB2 SER A 48 -9.607 -10.895 -4.052 1.00 0.00 H new ATOM 0 HB3 SER A 48 -9.403 -9.451 -5.024 1.00 0.00 H new ATOM 0 HG SER A 48 -8.642 -12.130 -5.610 1.00 0.00 H new ATOM 644 N GLY A 49 -6.959 -11.739 -2.342 1.00 0.00 N ATOM 645 CA GLY A 49 -6.865 -12.298 -1.008 1.00 0.00 C ATOM 646 C GLY A 49 -5.573 -11.900 -0.319 1.00 0.00 C ATOM 647 O GLY A 49 -5.509 -11.830 0.908 1.00 0.00 O ATOM 0 H GLY A 49 -6.469 -12.270 -3.062 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -7.713 -11.961 -0.412 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -6.927 -13.385 -1.064 1.00 0.00 H new ATOM 651 N LEU A 50 -4.547 -11.610 -1.116 1.00 0.00 N ATOM 652 CA LEU A 50 -3.248 -11.196 -0.586 1.00 0.00 C ATOM 653 C LEU A 50 -3.297 -9.752 -0.102 1.00 0.00 C ATOM 654 O LEU A 50 -2.360 -9.268 0.525 1.00 0.00 O ATOM 655 CB LEU A 50 -2.159 -11.339 -1.652 1.00 0.00 C ATOM 656 CG LEU A 50 -1.862 -12.771 -2.094 1.00 0.00 C ATOM 657 CD1 LEU A 50 -0.925 -12.776 -3.289 1.00 0.00 C ATOM 658 CD2 LEU A 50 -1.270 -13.570 -0.944 1.00 0.00 C ATOM 0 H LEU A 50 -4.590 -11.654 -2.134 1.00 0.00 H new ATOM 0 HA LEU A 50 -3.011 -11.845 0.257 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -2.452 -10.760 -2.527 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -1.239 -10.896 -1.270 1.00 0.00 H new ATOM 0 HG LEU A 50 -2.799 -13.242 -2.392 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -0.725 -13.804 -3.590 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -1.388 -12.239 -4.117 1.00 0.00 H new ATOM 0 HD13 LEU A 50 0.011 -12.288 -3.019 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -1.064 -14.588 -1.276 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -0.343 -13.101 -0.615 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -1.978 -13.595 -0.116 1.00 0.00 H new ATOM 670 N LEU A 51 -4.400 -9.074 -0.403 1.00 0.00 N ATOM 671 CA LEU A 51 -4.592 -7.685 0.004 1.00 0.00 C ATOM 672 C LEU A 51 -4.689 -7.568 1.526 1.00 0.00 C ATOM 673 O LEU A 51 -4.610 -6.474 2.085 1.00 0.00 O ATOM 674 CB LEU A 51 -5.856 -7.121 -0.646 1.00 0.00 C ATOM 675 CG LEU A 51 -5.636 -6.114 -1.784 1.00 0.00 C ATOM 676 CD1 LEU A 51 -4.237 -5.514 -1.738 1.00 0.00 C ATOM 677 CD2 LEU A 51 -5.884 -6.775 -3.126 1.00 0.00 C ATOM 0 H LEU A 51 -5.180 -9.467 -0.931 1.00 0.00 H new ATOM 0 HA LEU A 51 -3.728 -7.109 -0.328 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -6.444 -7.953 -1.033 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -6.455 -6.640 0.127 1.00 0.00 H new ATOM 0 HG LEU A 51 -6.349 -5.300 -1.652 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -4.118 -4.806 -2.558 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -4.094 -4.997 -0.789 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -3.497 -6.309 -1.834 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -5.724 -6.050 -3.924 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -5.196 -7.611 -3.253 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -6.910 -7.140 -3.168 1.00 0.00 H new ATOM 689 N GLY A 52 -4.867 -8.703 2.186 1.00 0.00 N ATOM 690 CA GLY A 52 -4.903 -8.734 3.629 1.00 0.00 C ATOM 691 C GLY A 52 -4.368 -10.044 4.162 1.00 0.00 C ATOM 692 O GLY A 52 -5.116 -11.015 4.301 1.00 0.00 O ATOM 0 H GLY A 52 -4.988 -9.612 1.739 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -4.314 -7.908 4.028 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -5.927 -8.590 3.973 1.00 0.00 H new ATOM 696 N ALA A 53 -3.081 -10.072 4.487 1.00 0.00 N ATOM 697 CA ALA A 53 -2.414 -11.319 4.839 1.00 0.00 C ATOM 698 C ALA A 53 -2.676 -11.701 6.292 1.00 0.00 C ATOM 699 O ALA A 53 -1.755 -11.761 7.109 1.00 0.00 O ATOM 700 CB ALA A 53 -0.923 -11.210 4.566 1.00 0.00 C ATOM 0 H ALA A 53 -2.480 -9.248 4.514 1.00 0.00 H new ATOM 0 HA ALA A 53 -2.826 -12.113 4.216 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -0.435 -12.147 4.833 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -0.761 -11.005 3.508 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -0.502 -10.400 5.161 1.00 0.00 H new ATOM 706 N GLY A 54 -3.939 -11.956 6.605 1.00 0.00 N ATOM 707 CA GLY A 54 -4.309 -12.356 7.946 1.00 0.00 C ATOM 708 C GLY A 54 -5.746 -12.012 8.279 1.00 0.00 C ATOM 709 O GLY A 54 -6.007 -11.373 9.294 1.00 0.00 O ATOM 0 H GLY A 54 -4.717 -11.892 5.949 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -4.162 -13.431 8.055 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -3.647 -11.869 8.662 1.00 0.00 H new ATOM 713 N LEU A 55 -6.674 -12.444 7.421 1.00 0.00 N ATOM 714 CA LEU A 55 -8.109 -12.209 7.623 1.00 0.00 C ATOM 715 C LEU A 55 -8.435 -10.717 7.662 1.00 0.00 C ATOM 716 O LEU A 55 -9.215 -10.261 8.500 1.00 0.00 O ATOM 717 CB LEU A 55 -8.585 -12.880 8.915 1.00 0.00 C ATOM 718 CG LEU A 55 -9.245 -14.249 8.736 1.00 0.00 C ATOM 719 CD1 LEU A 55 -8.395 -15.342 9.370 1.00 0.00 C ATOM 720 CD2 LEU A 55 -10.643 -14.245 9.335 1.00 0.00 C ATOM 0 H LEU A 55 -6.455 -12.964 6.571 1.00 0.00 H new ATOM 0 HA LEU A 55 -8.635 -12.648 6.775 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -7.731 -12.991 9.583 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -9.293 -12.216 9.411 1.00 0.00 H new ATOM 0 HG LEU A 55 -9.326 -14.456 7.669 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -8.882 -16.308 9.232 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.413 -15.360 8.897 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -8.281 -15.142 10.435 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -11.100 -15.226 9.200 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -10.582 -14.017 10.399 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -11.251 -13.490 8.836 1.00 0.00 H new ATOM 732 N LEU A 56 -7.846 -9.961 6.747 1.00 0.00 N ATOM 733 CA LEU A 56 -8.088 -8.527 6.686 1.00 0.00 C ATOM 734 C LEU A 56 -9.330 -8.215 5.858 1.00 0.00 C ATOM 735 O LEU A 56 -10.041 -9.119 5.418 1.00 0.00 O ATOM 736 CB LEU A 56 -6.884 -7.800 6.092 1.00 0.00 C ATOM 737 CG LEU A 56 -6.262 -6.732 6.991 1.00 0.00 C ATOM 738 CD1 LEU A 56 -4.745 -6.844 6.975 1.00 0.00 C ATOM 739 CD2 LEU A 56 -6.700 -5.342 6.552 1.00 0.00 C ATOM 0 H LEU A 56 -7.201 -10.314 6.040 1.00 0.00 H new ATOM 0 HA LEU A 56 -8.249 -8.178 7.706 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -6.119 -8.537 5.847 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -7.188 -7.332 5.155 1.00 0.00 H new ATOM 0 HG LEU A 56 -6.610 -6.894 8.011 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -4.317 -6.077 7.620 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -4.449 -7.829 7.337 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -4.381 -6.707 5.957 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -6.247 -4.595 7.204 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -6.381 -5.168 5.524 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -7.786 -5.266 6.613 1.00 0.00 H new ATOM 751 N ASN A 57 -9.575 -6.933 5.642 1.00 0.00 N ATOM 752 CA ASN A 57 -10.733 -6.483 4.902 1.00 0.00 C ATOM 753 C ASN A 57 -10.325 -5.441 3.870 1.00 0.00 C ATOM 754 O ASN A 57 -9.143 -5.120 3.732 1.00 0.00 O ATOM 755 CB ASN A 57 -11.770 -5.906 5.860 1.00 0.00 C ATOM 756 CG ASN A 57 -13.191 -6.113 5.385 1.00 0.00 C ATOM 757 OD1 ASN A 57 -13.436 -6.424 4.219 1.00 0.00 O ATOM 758 ND2 ASN A 57 -14.139 -5.937 6.283 1.00 0.00 N ATOM 0 H ASN A 57 -8.975 -6.179 5.976 1.00 0.00 H new ATOM 0 HA ASN A 57 -11.173 -7.333 4.380 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -11.649 -6.368 6.840 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -11.586 -4.839 5.986 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -15.118 -6.058 6.022 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -13.894 -5.680 7.239 1.00 0.00 H new ATOM 765 N GLY A 58 -11.307 -4.929 3.155 1.00 0.00 N ATOM 766 CA GLY A 58 -11.046 -3.972 2.101 1.00 0.00 C ATOM 767 C GLY A 58 -11.472 -2.573 2.483 1.00 0.00 C ATOM 768 O GLY A 58 -11.402 -2.194 3.649 1.00 0.00 O ATOM 0 H GLY A 58 -12.292 -5.160 3.285 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -9.982 -3.975 1.865 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -11.573 -4.277 1.197 1.00 0.00 H new ATOM 772 N LEU A 59 -11.930 -1.808 1.506 1.00 0.00 N ATOM 773 CA LEU A 59 -12.407 -0.458 1.757 1.00 0.00 C ATOM 774 C LEU A 59 -13.661 -0.492 2.622 1.00 0.00 C ATOM 775 O LEU A 59 -14.454 -1.432 2.539 1.00 0.00 O ATOM 776 CB LEU A 59 -12.697 0.257 0.434 1.00 0.00 C ATOM 777 CG LEU A 59 -12.898 1.771 0.527 1.00 0.00 C ATOM 778 CD1 LEU A 59 -11.796 2.410 1.359 1.00 0.00 C ATOM 779 CD2 LEU A 59 -12.935 2.377 -0.866 1.00 0.00 C ATOM 0 H LEU A 59 -11.982 -2.099 0.530 1.00 0.00 H new ATOM 0 HA LEU A 59 -11.630 0.092 2.289 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -11.873 0.060 -0.252 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -13.591 -0.183 -0.007 1.00 0.00 H new ATOM 0 HG LEU A 59 -13.850 1.966 1.020 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -11.958 3.487 1.412 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -11.810 1.991 2.365 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -10.829 2.211 0.897 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -13.078 3.455 -0.790 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -11.995 2.171 -1.377 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -13.758 1.940 -1.431 1.00 0.00 H new ATOM 791 N SER A 60 -13.801 0.516 3.474 1.00 0.00 N ATOM 792 CA SER A 60 -14.960 0.647 4.343 1.00 0.00 C ATOM 793 C SER A 60 -16.250 0.601 3.536 1.00 0.00 C ATOM 794 O SER A 60 -16.544 1.514 2.763 1.00 0.00 O ATOM 795 CB SER A 60 -14.883 1.957 5.138 1.00 0.00 C ATOM 796 OG SER A 60 -15.925 2.041 6.092 1.00 0.00 O ATOM 0 H SER A 60 -13.115 1.263 3.581 1.00 0.00 H new ATOM 0 HA SER A 60 -14.960 -0.191 5.040 1.00 0.00 H new ATOM 0 HB2 SER A 60 -13.919 2.023 5.642 1.00 0.00 H new ATOM 0 HB3 SER A 60 -14.944 2.804 4.454 1.00 0.00 H new ATOM 0 HG SER A 60 -15.850 2.885 6.585 1.00 0.00 H new ATOM 802 N GLY A 61 -16.993 -0.488 3.687 1.00 0.00 N ATOM 803 CA GLY A 61 -18.268 -0.617 3.013 1.00 0.00 C ATOM 804 C GLY A 61 -18.129 -1.083 1.575 1.00 0.00 C ATOM 805 O GLY A 61 -18.779 -2.045 1.166 1.00 0.00 O ATOM 0 H GLY A 61 -16.733 -1.286 4.267 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -18.893 -1.323 3.560 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -18.782 0.344 3.031 1.00 0.00 H new ATOM 809 N ASN A 62 -17.276 -0.411 0.816 1.00 0.00 N ATOM 810 CA ASN A 62 -17.106 -0.715 -0.597 1.00 0.00 C ATOM 811 C ASN A 62 -16.181 -1.903 -0.795 1.00 0.00 C ATOM 812 O ASN A 62 -14.956 -1.762 -0.835 1.00 0.00 O ATOM 813 CB ASN A 62 -16.563 0.498 -1.341 1.00 0.00 C ATOM 814 CG ASN A 62 -16.619 0.323 -2.845 1.00 0.00 C ATOM 815 OD1 ASN A 62 -17.691 0.371 -3.445 1.00 0.00 O ATOM 816 ND2 ASN A 62 -15.472 0.122 -3.468 1.00 0.00 N ATOM 0 H ASN A 62 -16.689 0.351 1.156 1.00 0.00 H new ATOM 0 HA ASN A 62 -18.084 -0.972 -1.003 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -17.136 1.381 -1.059 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -15.532 0.677 -1.036 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -15.456 0.000 -4.481 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -14.602 0.088 -2.937 1.00 0.00 H new ATOM 823 N THR A 63 -16.779 -3.067 -0.912 1.00 0.00 N ATOM 824 CA THR A 63 -16.039 -4.297 -1.119 1.00 0.00 C ATOM 825 C THR A 63 -15.352 -4.309 -2.483 1.00 0.00 C ATOM 826 O THR A 63 -15.974 -4.039 -3.511 1.00 0.00 O ATOM 827 CB THR A 63 -16.975 -5.510 -1.003 1.00 0.00 C ATOM 828 OG1 THR A 63 -18.284 -5.071 -0.611 1.00 0.00 O ATOM 829 CG2 THR A 63 -16.447 -6.510 0.012 1.00 0.00 C ATOM 0 H THR A 63 -17.790 -3.191 -0.867 1.00 0.00 H new ATOM 0 HA THR A 63 -15.272 -4.355 -0.346 1.00 0.00 H new ATOM 0 HB THR A 63 -17.025 -6.001 -1.975 1.00 0.00 H new ATOM 0 HG1 THR A 63 -18.881 -5.845 -0.539 1.00 0.00 H new ATOM 0 HG21 THR A 63 -17.128 -7.359 0.075 1.00 0.00 H new ATOM 0 HG22 THR A 63 -15.462 -6.858 -0.298 1.00 0.00 H new ATOM 0 HG23 THR A 63 -16.372 -6.032 0.989 1.00 0.00 H new ATOM 837 N GLY A 64 -14.062 -4.606 -2.480 1.00 0.00 N ATOM 838 CA GLY A 64 -13.313 -4.669 -3.714 1.00 0.00 C ATOM 839 C GLY A 64 -12.013 -3.900 -3.622 1.00 0.00 C ATOM 840 O GLY A 64 -10.948 -4.430 -3.930 1.00 0.00 O ATOM 0 H GLY A 64 -13.519 -4.805 -1.640 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -13.103 -5.710 -3.959 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -13.917 -4.266 -4.527 1.00 0.00 H new ATOM 844 N SER A 65 -12.099 -2.650 -3.182 1.00 0.00 N ATOM 845 CA SER A 65 -10.920 -1.806 -3.044 1.00 0.00 C ATOM 846 C SER A 65 -10.179 -2.112 -1.746 1.00 0.00 C ATOM 847 O SER A 65 -10.175 -1.307 -0.817 1.00 0.00 O ATOM 848 CB SER A 65 -11.325 -0.333 -3.088 1.00 0.00 C ATOM 849 OG SER A 65 -12.652 -0.187 -3.568 1.00 0.00 O ATOM 0 H SER A 65 -12.974 -2.199 -2.915 1.00 0.00 H new ATOM 0 HA SER A 65 -10.247 -2.016 -3.875 1.00 0.00 H new ATOM 0 HB2 SER A 65 -11.245 0.100 -2.091 1.00 0.00 H new ATOM 0 HB3 SER A 65 -10.639 0.218 -3.731 1.00 0.00 H new ATOM 0 HG SER A 65 -12.879 0.765 -3.616 1.00 0.00 H new ATOM 855 N ALA A 66 -9.580 -3.292 -1.680 1.00 0.00 N ATOM 856 CA ALA A 66 -8.786 -3.680 -0.526 1.00 0.00 C ATOM 857 C ALA A 66 -7.406 -3.048 -0.616 1.00 0.00 C ATOM 858 O ALA A 66 -6.806 -3.001 -1.690 1.00 0.00 O ATOM 859 CB ALA A 66 -8.687 -5.194 -0.435 1.00 0.00 C ATOM 0 H ALA A 66 -9.630 -3.998 -2.414 1.00 0.00 H new ATOM 0 HA ALA A 66 -9.273 -3.322 0.381 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -8.089 -5.468 0.434 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -9.686 -5.619 -0.337 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -8.215 -5.583 -1.337 1.00 0.00 H new ATOM 865 N CYS A 67 -6.917 -2.548 0.502 1.00 0.00 N ATOM 866 CA CYS A 67 -5.659 -1.825 0.518 1.00 0.00 C ATOM 867 C CYS A 67 -4.570 -2.603 1.242 1.00 0.00 C ATOM 868 O CYS A 67 -4.817 -3.238 2.274 1.00 0.00 O ATOM 869 CB CYS A 67 -5.850 -0.461 1.178 1.00 0.00 C ATOM 870 SG CYS A 67 -7.440 0.334 0.794 1.00 0.00 S ATOM 0 H CYS A 67 -7.371 -2.629 1.412 1.00 0.00 H new ATOM 0 HA CYS A 67 -5.341 -1.691 -0.516 1.00 0.00 H new ATOM 0 HB2 CYS A 67 -5.766 -0.577 2.259 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -5.041 0.199 0.864 1.00 0.00 H new ATOM 875 N ALA A 68 -3.358 -2.530 0.711 1.00 0.00 N ATOM 876 CA ALA A 68 -2.216 -3.191 1.320 1.00 0.00 C ATOM 877 C ALA A 68 -1.335 -2.165 2.018 1.00 0.00 C ATOM 878 O ALA A 68 -1.359 -0.982 1.682 1.00 0.00 O ATOM 879 CB ALA A 68 -1.426 -3.972 0.279 1.00 0.00 C ATOM 0 H ALA A 68 -3.141 -2.017 -0.144 1.00 0.00 H new ATOM 0 HA ALA A 68 -2.576 -3.902 2.064 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -0.576 -4.459 0.757 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -2.068 -4.727 -0.174 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -1.067 -3.290 -0.492 1.00 0.00 H new ATOM 885 N LYS A 69 -0.567 -2.622 2.995 1.00 0.00 N ATOM 886 CA LYS A 69 0.209 -1.723 3.843 1.00 0.00 C ATOM 887 C LYS A 69 1.696 -1.900 3.574 1.00 0.00 C ATOM 888 O LYS A 69 2.079 -2.708 2.730 1.00 0.00 O ATOM 889 CB LYS A 69 -0.093 -1.999 5.320 1.00 0.00 C ATOM 890 CG LYS A 69 -1.391 -1.380 5.838 1.00 0.00 C ATOM 891 CD LYS A 69 -2.616 -1.872 5.077 1.00 0.00 C ATOM 892 CE LYS A 69 -3.419 -2.890 5.870 1.00 0.00 C ATOM 893 NZ LYS A 69 -3.690 -4.125 5.084 1.00 0.00 N ATOM 0 H LYS A 69 -0.463 -3.611 3.222 1.00 0.00 H new ATOM 0 HA LYS A 69 -0.071 -0.695 3.611 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -0.136 -3.078 5.472 1.00 0.00 H new ATOM 0 HB3 LYS A 69 0.736 -1.625 5.921 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -1.505 -1.616 6.896 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -1.329 -0.295 5.758 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -3.253 -1.023 4.831 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -2.300 -2.317 4.134 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -2.876 -3.151 6.779 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -4.364 -2.444 6.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -4.427 -4.684 5.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -4.014 -3.866 4.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -2.819 -4.689 5.012 1.00 0.00 H new ATOM 907 N ALA A 70 2.531 -1.165 4.301 1.00 0.00 N ATOM 908 CA ALA A 70 3.976 -1.216 4.094 1.00 0.00 C ATOM 909 C ALA A 70 4.522 -2.620 4.334 1.00 0.00 C ATOM 910 O ALA A 70 5.409 -3.079 3.618 1.00 0.00 O ATOM 911 CB ALA A 70 4.678 -0.212 4.995 1.00 0.00 C ATOM 0 H ALA A 70 2.233 -0.527 5.039 1.00 0.00 H new ATOM 0 HA ALA A 70 4.174 -0.953 3.055 1.00 0.00 H new ATOM 0 HB1 ALA A 70 5.754 -0.263 4.828 1.00 0.00 H new ATOM 0 HB2 ALA A 70 4.323 0.793 4.766 1.00 0.00 H new ATOM 0 HB3 ALA A 70 4.461 -0.445 6.038 1.00 0.00 H new ATOM 917 N SER A 71 3.976 -3.302 5.331 1.00 0.00 N ATOM 918 CA SER A 71 4.375 -4.670 5.626 1.00 0.00 C ATOM 919 C SER A 71 3.993 -5.587 4.472 1.00 0.00 C ATOM 920 O SER A 71 4.764 -6.452 4.056 1.00 0.00 O ATOM 921 CB SER A 71 3.695 -5.134 6.911 1.00 0.00 C ATOM 922 OG SER A 71 2.638 -4.256 7.260 1.00 0.00 O ATOM 0 H SER A 71 3.255 -2.930 5.949 1.00 0.00 H new ATOM 0 HA SER A 71 5.456 -4.708 5.758 1.00 0.00 H new ATOM 0 HB2 SER A 71 3.308 -6.144 6.780 1.00 0.00 H new ATOM 0 HB3 SER A 71 4.424 -5.175 7.721 1.00 0.00 H new ATOM 0 HG SER A 71 1.794 -4.602 6.903 1.00 0.00 H new ATOM 928 N LEU A 72 2.803 -5.364 3.933 1.00 0.00 N ATOM 929 CA LEU A 72 2.298 -6.152 2.819 1.00 0.00 C ATOM 930 C LEU A 72 3.026 -5.804 1.523 1.00 0.00 C ATOM 931 O LEU A 72 2.978 -6.554 0.545 1.00 0.00 O ATOM 932 CB LEU A 72 0.792 -5.951 2.663 1.00 0.00 C ATOM 933 CG LEU A 72 -0.041 -7.207 2.915 1.00 0.00 C ATOM 934 CD1 LEU A 72 0.261 -7.780 4.290 1.00 0.00 C ATOM 935 CD2 LEU A 72 -1.518 -6.900 2.779 1.00 0.00 C ATOM 0 H LEU A 72 2.164 -4.636 4.253 1.00 0.00 H new ATOM 0 HA LEU A 72 2.487 -7.203 3.035 1.00 0.00 H new ATOM 0 HB2 LEU A 72 0.468 -5.171 3.352 1.00 0.00 H new ATOM 0 HB3 LEU A 72 0.588 -5.591 1.655 1.00 0.00 H new ATOM 0 HG LEU A 72 0.225 -7.953 2.166 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -0.341 -8.674 4.452 1.00 0.00 H new ATOM 0 HD12 LEU A 72 1.318 -8.038 4.352 1.00 0.00 H new ATOM 0 HD13 LEU A 72 0.023 -7.039 5.053 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.096 -7.806 2.962 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -1.799 -6.137 3.505 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -1.723 -6.536 1.772 1.00 0.00 H new ATOM 947 N ILE A 73 3.698 -4.669 1.516 1.00 0.00 N ATOM 948 CA ILE A 73 4.538 -4.303 0.392 1.00 0.00 C ATOM 949 C ILE A 73 5.716 -5.277 0.294 1.00 0.00 C ATOM 950 O ILE A 73 6.151 -5.638 -0.797 1.00 0.00 O ATOM 951 CB ILE A 73 5.029 -2.830 0.510 1.00 0.00 C ATOM 952 CG1 ILE A 73 4.348 -1.954 -0.546 1.00 0.00 C ATOM 953 CG2 ILE A 73 6.543 -2.715 0.382 1.00 0.00 C ATOM 954 CD1 ILE A 73 3.133 -1.210 -0.033 1.00 0.00 C ATOM 0 H ILE A 73 3.679 -3.986 2.274 1.00 0.00 H new ATOM 0 HA ILE A 73 3.950 -4.370 -0.524 1.00 0.00 H new ATOM 0 HB ILE A 73 4.755 -2.480 1.505 1.00 0.00 H new ATOM 0 HG12 ILE A 73 5.071 -1.232 -0.926 1.00 0.00 H new ATOM 0 HG13 ILE A 73 4.050 -2.580 -1.387 1.00 0.00 H new ATOM 0 HG21 ILE A 73 6.837 -1.669 0.471 1.00 0.00 H new ATOM 0 HG22 ILE A 73 7.020 -3.295 1.172 1.00 0.00 H new ATOM 0 HG23 ILE A 73 6.856 -3.099 -0.589 1.00 0.00 H new ATOM 0 HD11 ILE A 73 2.706 -0.612 -0.838 1.00 0.00 H new ATOM 0 HD12 ILE A 73 2.391 -1.926 0.321 1.00 0.00 H new ATOM 0 HD13 ILE A 73 3.427 -0.556 0.788 1.00 0.00 H new ATOM 966 N ASP A 74 6.187 -5.738 1.449 1.00 0.00 N ATOM 967 CA ASP A 74 7.377 -6.582 1.509 1.00 0.00 C ATOM 968 C ASP A 74 7.037 -8.065 1.675 1.00 0.00 C ATOM 969 O ASP A 74 7.666 -8.919 1.049 1.00 0.00 O ATOM 970 CB ASP A 74 8.289 -6.098 2.645 1.00 0.00 C ATOM 971 CG ASP A 74 8.924 -7.226 3.444 1.00 0.00 C ATOM 972 OD1 ASP A 74 9.954 -7.773 2.996 1.00 0.00 O ATOM 973 OD2 ASP A 74 8.394 -7.560 4.527 1.00 0.00 O ATOM 0 H ASP A 74 5.763 -5.542 2.356 1.00 0.00 H new ATOM 0 HA ASP A 74 7.900 -6.493 0.557 1.00 0.00 H new ATOM 0 HB2 ASP A 74 9.078 -5.474 2.225 1.00 0.00 H new ATOM 0 HB3 ASP A 74 7.710 -5.468 3.320 1.00 0.00 H new ATOM 978 N GLN A 75 6.025 -8.355 2.491 1.00 0.00 N ATOM 979 CA GLN A 75 5.656 -9.734 2.835 1.00 0.00 C ATOM 980 C GLN A 75 5.464 -10.621 1.593 1.00 0.00 C ATOM 981 O GLN A 75 5.704 -11.827 1.646 1.00 0.00 O ATOM 982 CB GLN A 75 4.390 -9.726 3.722 1.00 0.00 C ATOM 983 CG GLN A 75 3.276 -10.683 3.292 1.00 0.00 C ATOM 984 CD GLN A 75 2.314 -10.059 2.302 1.00 0.00 C ATOM 985 OE1 GLN A 75 1.234 -10.579 2.045 1.00 0.00 O ATOM 986 NE2 GLN A 75 2.709 -8.930 1.746 1.00 0.00 N ATOM 0 H GLN A 75 5.438 -7.647 2.932 1.00 0.00 H new ATOM 0 HA GLN A 75 6.483 -10.173 3.394 1.00 0.00 H new ATOM 0 HB2 GLN A 75 4.682 -9.972 4.743 1.00 0.00 H new ATOM 0 HB3 GLN A 75 3.987 -8.713 3.741 1.00 0.00 H new ATOM 0 HG2 GLN A 75 3.720 -11.574 2.848 1.00 0.00 H new ATOM 0 HG3 GLN A 75 2.723 -11.008 4.173 1.00 0.00 H new ATOM 0 HE21 GLN A 75 3.616 -8.532 1.989 1.00 0.00 H new ATOM 0 HE22 GLN A 75 2.107 -8.455 1.073 1.00 0.00 H new ATOM 995 N LEU A 76 5.047 -10.024 0.477 1.00 0.00 N ATOM 996 CA LEU A 76 4.806 -10.791 -0.740 1.00 0.00 C ATOM 997 C LEU A 76 5.126 -9.982 -1.995 1.00 0.00 C ATOM 998 O LEU A 76 5.293 -10.552 -3.072 1.00 0.00 O ATOM 999 CB LEU A 76 3.356 -11.287 -0.791 1.00 0.00 C ATOM 1000 CG LEU A 76 3.167 -12.807 -0.955 1.00 0.00 C ATOM 1001 CD1 LEU A 76 4.500 -13.512 -1.175 1.00 0.00 C ATOM 1002 CD2 LEU A 76 2.460 -13.384 0.263 1.00 0.00 C ATOM 0 H LEU A 76 4.871 -9.023 0.392 1.00 0.00 H new ATOM 0 HA LEU A 76 5.476 -11.650 -0.716 1.00 0.00 H new ATOM 0 HB2 LEU A 76 2.854 -10.975 0.125 1.00 0.00 H new ATOM 0 HB3 LEU A 76 2.851 -10.787 -1.617 1.00 0.00 H new ATOM 0 HG LEU A 76 2.550 -12.975 -1.838 1.00 0.00 H new ATOM 0 HD11 LEU A 76 4.331 -14.583 -1.287 1.00 0.00 H new ATOM 0 HD12 LEU A 76 4.973 -13.123 -2.077 1.00 0.00 H new ATOM 0 HD13 LEU A 76 5.151 -13.335 -0.319 1.00 0.00 H new ATOM 0 HD21 LEU A 76 2.333 -14.459 0.134 1.00 0.00 H new ATOM 0 HD22 LEU A 76 3.057 -13.193 1.155 1.00 0.00 H new ATOM 0 HD23 LEU A 76 1.483 -12.913 0.373 1.00 0.00 H new ATOM 1014 N GLY A 77 5.208 -8.662 -1.865 1.00 0.00 N ATOM 1015 CA GLY A 77 5.547 -7.840 -3.014 1.00 0.00 C ATOM 1016 C GLY A 77 4.359 -7.610 -3.932 1.00 0.00 C ATOM 1017 O GLY A 77 4.431 -7.885 -5.133 1.00 0.00 O ATOM 0 H GLY A 77 5.048 -8.151 -0.997 1.00 0.00 H new ATOM 0 HA2 GLY A 77 5.928 -6.879 -2.670 1.00 0.00 H new ATOM 0 HA3 GLY A 77 6.349 -8.318 -3.576 1.00 0.00 H new ATOM 1021 N LEU A 78 3.250 -7.153 -3.358 1.00 0.00 N ATOM 1022 CA LEU A 78 2.024 -6.911 -4.120 1.00 0.00 C ATOM 1023 C LEU A 78 2.201 -5.739 -5.086 1.00 0.00 C ATOM 1024 O LEU A 78 1.827 -4.606 -4.786 1.00 0.00 O ATOM 1025 CB LEU A 78 0.853 -6.627 -3.174 1.00 0.00 C ATOM 1026 CG LEU A 78 0.096 -7.861 -2.689 1.00 0.00 C ATOM 1027 CD1 LEU A 78 0.962 -8.676 -1.740 1.00 0.00 C ATOM 1028 CD2 LEU A 78 -1.198 -7.452 -2.009 1.00 0.00 C ATOM 0 H LEU A 78 3.173 -6.941 -2.363 1.00 0.00 H new ATOM 0 HA LEU A 78 1.808 -7.809 -4.698 1.00 0.00 H new ATOM 0 HB2 LEU A 78 1.231 -6.087 -2.306 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.150 -5.965 -3.680 1.00 0.00 H new ATOM 0 HG LEU A 78 -0.147 -8.481 -3.552 1.00 0.00 H new ATOM 0 HD11 LEU A 78 0.408 -9.552 -1.403 1.00 0.00 H new ATOM 0 HD12 LEU A 78 1.867 -8.996 -2.257 1.00 0.00 H new ATOM 0 HD13 LEU A 78 1.233 -8.065 -0.879 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -1.727 -8.342 -1.668 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.974 -6.814 -1.154 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -1.823 -6.906 -2.715 1.00 0.00 H new ATOM 1040 N LEU A 79 2.749 -6.032 -6.260 1.00 0.00 N ATOM 1041 CA LEU A 79 3.085 -5.003 -7.239 1.00 0.00 C ATOM 1042 C LEU A 79 1.845 -4.356 -7.860 1.00 0.00 C ATOM 1043 O LEU A 79 1.954 -3.391 -8.615 1.00 0.00 O ATOM 1044 CB LEU A 79 3.972 -5.590 -8.342 1.00 0.00 C ATOM 1045 CG LEU A 79 3.673 -7.043 -8.722 1.00 0.00 C ATOM 1046 CD1 LEU A 79 2.919 -7.108 -10.045 1.00 0.00 C ATOM 1047 CD2 LEU A 79 4.963 -7.851 -8.800 1.00 0.00 C ATOM 0 H LEU A 79 2.972 -6.981 -6.559 1.00 0.00 H new ATOM 0 HA LEU A 79 3.627 -4.222 -6.705 1.00 0.00 H new ATOM 0 HB2 LEU A 79 3.871 -4.971 -9.234 1.00 0.00 H new ATOM 0 HB3 LEU A 79 5.012 -5.522 -8.023 1.00 0.00 H new ATOM 0 HG LEU A 79 3.041 -7.477 -7.947 1.00 0.00 H new ATOM 0 HD11 LEU A 79 2.716 -8.149 -10.297 1.00 0.00 H new ATOM 0 HD12 LEU A 79 1.977 -6.566 -9.954 1.00 0.00 H new ATOM 0 HD13 LEU A 79 3.524 -6.655 -10.831 1.00 0.00 H new ATOM 0 HD21 LEU A 79 4.731 -8.881 -9.071 1.00 0.00 H new ATOM 0 HD22 LEU A 79 5.620 -7.416 -9.554 1.00 0.00 H new ATOM 0 HD23 LEU A 79 5.462 -7.834 -7.831 1.00 0.00 H new ATOM 1059 N ALA A 80 0.672 -4.883 -7.540 1.00 0.00 N ATOM 1060 CA ALA A 80 -0.574 -4.317 -8.042 1.00 0.00 C ATOM 1061 C ALA A 80 -0.949 -3.062 -7.263 1.00 0.00 C ATOM 1062 O ALA A 80 -1.769 -2.266 -7.710 1.00 0.00 O ATOM 1063 CB ALA A 80 -1.699 -5.340 -7.961 1.00 0.00 C ATOM 0 H ALA A 80 0.556 -5.698 -6.938 1.00 0.00 H new ATOM 0 HA ALA A 80 -0.424 -4.045 -9.087 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -2.620 -4.898 -8.340 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -1.441 -6.213 -8.561 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -1.842 -5.642 -6.924 1.00 0.00 H new ATOM 1069 N LEU A 81 -0.332 -2.885 -6.104 1.00 0.00 N ATOM 1070 CA LEU A 81 -0.667 -1.776 -5.231 1.00 0.00 C ATOM 1071 C LEU A 81 0.405 -0.696 -5.264 1.00 0.00 C ATOM 1072 O LEU A 81 0.131 0.470 -4.985 1.00 0.00 O ATOM 1073 CB LEU A 81 -0.853 -2.278 -3.802 1.00 0.00 C ATOM 1074 CG LEU A 81 -1.752 -1.416 -2.928 1.00 0.00 C ATOM 1075 CD1 LEU A 81 -3.074 -2.119 -2.678 1.00 0.00 C ATOM 1076 CD2 LEU A 81 -1.059 -1.096 -1.617 1.00 0.00 C ATOM 0 H LEU A 81 0.403 -3.497 -5.749 1.00 0.00 H new ATOM 0 HA LEU A 81 -1.598 -1.337 -5.589 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -1.266 -3.286 -3.838 1.00 0.00 H new ATOM 0 HB3 LEU A 81 0.126 -2.351 -3.329 1.00 0.00 H new ATOM 0 HG LEU A 81 -1.954 -0.480 -3.448 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -3.707 -1.491 -2.051 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -3.574 -2.304 -3.629 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -2.892 -3.068 -2.174 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -1.713 -0.479 -1.001 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -0.832 -2.023 -1.090 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -0.133 -0.556 -1.817 1.00 0.00 H new ATOM 1088 N VAL A 82 1.627 -1.083 -5.601 1.00 0.00 N ATOM 1089 CA VAL A 82 2.730 -0.137 -5.617 1.00 0.00 C ATOM 1090 C VAL A 82 3.045 0.309 -7.036 1.00 0.00 C ATOM 1091 O VAL A 82 3.034 -0.494 -7.971 1.00 0.00 O ATOM 1092 CB VAL A 82 4.018 -0.716 -4.984 1.00 0.00 C ATOM 1093 CG1 VAL A 82 4.518 0.194 -3.874 1.00 0.00 C ATOM 1094 CG2 VAL A 82 3.791 -2.124 -4.457 1.00 0.00 C ATOM 0 H VAL A 82 1.877 -2.036 -5.864 1.00 0.00 H new ATOM 0 HA VAL A 82 2.404 0.714 -5.020 1.00 0.00 H new ATOM 0 HB VAL A 82 4.779 -0.771 -5.763 1.00 0.00 H new ATOM 0 HG11 VAL A 82 5.424 -0.227 -3.439 1.00 0.00 H new ATOM 0 HG12 VAL A 82 4.736 1.181 -4.283 1.00 0.00 H new ATOM 0 HG13 VAL A 82 3.752 0.282 -3.103 1.00 0.00 H new ATOM 0 HG21 VAL A 82 4.715 -2.502 -4.019 1.00 0.00 H new ATOM 0 HG22 VAL A 82 3.010 -2.107 -3.697 1.00 0.00 H new ATOM 0 HG23 VAL A 82 3.486 -2.774 -5.277 1.00 0.00 H new ATOM 1104 N ASP A 83 3.314 1.592 -7.188 1.00 0.00 N ATOM 1105 CA ASP A 83 3.753 2.139 -8.463 1.00 0.00 C ATOM 1106 C ASP A 83 5.146 2.720 -8.294 1.00 0.00 C ATOM 1107 O ASP A 83 5.563 3.017 -7.176 1.00 0.00 O ATOM 1108 CB ASP A 83 2.786 3.220 -8.959 1.00 0.00 C ATOM 1109 CG ASP A 83 2.851 3.422 -10.462 1.00 0.00 C ATOM 1110 OD1 ASP A 83 3.864 3.956 -10.958 1.00 0.00 O ATOM 1111 OD2 ASP A 83 1.889 3.045 -11.162 1.00 0.00 O ATOM 0 H ASP A 83 3.236 2.281 -6.440 1.00 0.00 H new ATOM 0 HA ASP A 83 3.770 1.342 -9.206 1.00 0.00 H new ATOM 0 HB2 ASP A 83 1.769 2.948 -8.677 1.00 0.00 H new ATOM 0 HB3 ASP A 83 3.014 4.162 -8.460 1.00 0.00 H new ATOM 1116 N HIS A 84 5.869 2.875 -9.385 1.00 0.00 N ATOM 1117 CA HIS A 84 7.213 3.404 -9.315 1.00 0.00 C ATOM 1118 C HIS A 84 7.285 4.781 -9.947 1.00 0.00 C ATOM 1119 O HIS A 84 7.172 4.931 -11.163 1.00 0.00 O ATOM 1120 CB HIS A 84 8.217 2.472 -9.986 1.00 0.00 C ATOM 1121 CG HIS A 84 9.617 2.679 -9.505 1.00 0.00 C ATOM 1122 ND1 HIS A 84 10.287 3.875 -9.626 1.00 0.00 N ATOM 1123 CD2 HIS A 84 10.458 1.845 -8.858 1.00 0.00 C ATOM 1124 CE1 HIS A 84 11.483 3.762 -9.090 1.00 0.00 C ATOM 1125 NE2 HIS A 84 11.620 2.537 -8.615 1.00 0.00 N ATOM 0 H HIS A 84 5.549 2.643 -10.325 1.00 0.00 H new ATOM 0 HA HIS A 84 7.474 3.484 -8.260 1.00 0.00 H new ATOM 0 HB2 HIS A 84 7.924 1.438 -9.802 1.00 0.00 H new ATOM 0 HB3 HIS A 84 8.183 2.626 -11.065 1.00 0.00 H new ATOM 0 HD1 HIS A 84 9.914 4.718 -10.063 1.00 0.00 H new ATOM 0 HD2 HIS A 84 10.255 0.821 -8.582 1.00 0.00 H new ATOM 0 HE1 HIS A 84 12.229 4.542 -9.046 1.00 0.00 H new ATOM 1134 N THR A 85 7.493 5.777 -9.110 1.00 0.00 N ATOM 1135 CA THR A 85 7.637 7.143 -9.563 1.00 0.00 C ATOM 1136 C THR A 85 9.111 7.501 -9.684 1.00 0.00 C ATOM 1137 O THR A 85 9.972 6.619 -9.651 1.00 0.00 O ATOM 1138 CB THR A 85 6.954 8.115 -8.593 1.00 0.00 C ATOM 1139 OG1 THR A 85 7.345 7.806 -7.251 1.00 0.00 O ATOM 1140 CG2 THR A 85 5.440 8.026 -8.716 1.00 0.00 C ATOM 0 H THR A 85 7.567 5.662 -8.099 1.00 0.00 H new ATOM 0 HA THR A 85 7.159 7.228 -10.539 1.00 0.00 H new ATOM 0 HB THR A 85 7.263 9.130 -8.843 1.00 0.00 H new ATOM 0 HG1 THR A 85 7.929 8.515 -6.909 1.00 0.00 H new ATOM 0 HG21 THR A 85 4.977 8.724 -8.019 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.142 8.278 -9.734 1.00 0.00 H new ATOM 0 HG23 THR A 85 5.115 7.012 -8.484 1.00 0.00 H new ATOM 1148 N GLU A 86 9.387 8.788 -9.846 1.00 0.00 N ATOM 1149 CA GLU A 86 10.755 9.289 -9.927 1.00 0.00 C ATOM 1150 C GLU A 86 11.609 8.784 -8.759 1.00 0.00 C ATOM 1151 O GLU A 86 12.749 8.356 -8.956 1.00 0.00 O ATOM 1152 CB GLU A 86 10.740 10.819 -9.963 1.00 0.00 C ATOM 1153 CG GLU A 86 9.662 11.378 -10.883 1.00 0.00 C ATOM 1154 CD GLU A 86 9.420 12.858 -10.687 1.00 0.00 C ATOM 1155 OE1 GLU A 86 9.177 13.286 -9.540 1.00 0.00 O ATOM 1156 OE2 GLU A 86 9.470 13.603 -11.688 1.00 0.00 O ATOM 0 H GLU A 86 8.673 9.512 -9.925 1.00 0.00 H new ATOM 0 HA GLU A 86 11.206 8.911 -10.845 1.00 0.00 H new ATOM 0 HB2 GLU A 86 10.583 11.200 -8.954 1.00 0.00 H new ATOM 0 HB3 GLU A 86 11.715 11.180 -10.292 1.00 0.00 H new ATOM 0 HG2 GLU A 86 9.948 11.197 -11.919 1.00 0.00 H new ATOM 0 HG3 GLU A 86 8.731 10.838 -10.711 1.00 0.00 H new ATOM 1163 N GLU A 87 11.051 8.824 -7.552 1.00 0.00 N ATOM 1164 CA GLU A 87 11.749 8.353 -6.359 1.00 0.00 C ATOM 1165 C GLU A 87 11.837 6.829 -6.338 1.00 0.00 C ATOM 1166 O GLU A 87 12.893 6.253 -6.609 1.00 0.00 O ATOM 1167 CB GLU A 87 11.043 8.845 -5.092 1.00 0.00 C ATOM 1168 CG GLU A 87 11.128 10.350 -4.895 1.00 0.00 C ATOM 1169 CD GLU A 87 9.981 11.085 -5.555 1.00 0.00 C ATOM 1170 OE1 GLU A 87 9.254 10.467 -6.359 1.00 0.00 O ATOM 1171 OE2 GLU A 87 9.787 12.280 -5.263 1.00 0.00 O ATOM 0 H GLU A 87 10.112 9.180 -7.374 1.00 0.00 H new ATOM 0 HA GLU A 87 12.760 8.760 -6.387 1.00 0.00 H new ATOM 0 HB2 GLU A 87 9.994 8.551 -5.133 1.00 0.00 H new ATOM 0 HB3 GLU A 87 11.480 8.348 -4.226 1.00 0.00 H new ATOM 0 HG2 GLU A 87 11.134 10.574 -3.828 1.00 0.00 H new ATOM 0 HG3 GLU A 87 12.071 10.714 -5.302 1.00 0.00 H new ATOM 1178 N GLY A 88 10.725 6.173 -6.025 1.00 0.00 N ATOM 1179 CA GLY A 88 10.739 4.729 -5.900 1.00 0.00 C ATOM 1180 C GLY A 88 9.346 4.138 -5.812 1.00 0.00 C ATOM 1181 O GLY A 88 8.399 4.703 -6.357 1.00 0.00 O ATOM 0 H GLY A 88 9.820 6.613 -5.857 1.00 0.00 H new ATOM 0 HA2 GLY A 88 11.259 4.299 -6.756 1.00 0.00 H new ATOM 0 HA3 GLY A 88 11.305 4.450 -5.011 1.00 0.00 H new ATOM 1185 N PRO A 89 9.199 2.983 -5.136 1.00 0.00 N ATOM 1186 CA PRO A 89 7.904 2.319 -4.956 1.00 0.00 C ATOM 1187 C PRO A 89 6.994 3.103 -4.016 1.00 0.00 C ATOM 1188 O PRO A 89 7.231 3.156 -2.805 1.00 0.00 O ATOM 1189 CB PRO A 89 8.264 0.960 -4.336 1.00 0.00 C ATOM 1190 CG PRO A 89 9.743 0.830 -4.480 1.00 0.00 C ATOM 1191 CD PRO A 89 10.281 2.230 -4.493 1.00 0.00 C ATOM 0 HA PRO A 89 7.358 2.233 -5.896 1.00 0.00 H new ATOM 0 HB2 PRO A 89 7.967 0.917 -3.288 1.00 0.00 H new ATOM 0 HB3 PRO A 89 7.748 0.147 -4.847 1.00 0.00 H new ATOM 0 HG2 PRO A 89 10.167 0.257 -3.655 1.00 0.00 H new ATOM 0 HG3 PRO A 89 10.001 0.304 -5.399 1.00 0.00 H new ATOM 0 HD2 PRO A 89 10.486 2.595 -3.487 1.00 0.00 H new ATOM 0 HD3 PRO A 89 11.213 2.301 -5.054 1.00 0.00 H new ATOM 1199 N VAL A 90 5.973 3.720 -4.584 1.00 0.00 N ATOM 1200 CA VAL A 90 5.054 4.565 -3.837 1.00 0.00 C ATOM 1201 C VAL A 90 3.610 4.116 -4.040 1.00 0.00 C ATOM 1202 O VAL A 90 3.353 3.088 -4.667 1.00 0.00 O ATOM 1203 CB VAL A 90 5.185 6.021 -4.297 1.00 0.00 C ATOM 1204 CG1 VAL A 90 6.340 6.706 -3.585 1.00 0.00 C ATOM 1205 CG2 VAL A 90 5.374 6.070 -5.805 1.00 0.00 C ATOM 0 H VAL A 90 5.756 3.650 -5.578 1.00 0.00 H new ATOM 0 HA VAL A 90 5.310 4.481 -2.781 1.00 0.00 H new ATOM 0 HB VAL A 90 4.270 6.556 -4.041 1.00 0.00 H new ATOM 0 HG11 VAL A 90 6.416 7.739 -3.925 1.00 0.00 H new ATOM 0 HG12 VAL A 90 6.165 6.691 -2.509 1.00 0.00 H new ATOM 0 HG13 VAL A 90 7.268 6.181 -3.809 1.00 0.00 H new ATOM 0 HG21 VAL A 90 5.467 7.107 -6.127 1.00 0.00 H new ATOM 0 HG22 VAL A 90 6.277 5.524 -6.076 1.00 0.00 H new ATOM 0 HG23 VAL A 90 4.514 5.614 -6.295 1.00 0.00 H new ATOM 1215 N CYS A 91 2.672 4.897 -3.517 1.00 0.00 N ATOM 1216 CA CYS A 91 1.255 4.602 -3.685 1.00 0.00 C ATOM 1217 C CYS A 91 0.845 4.774 -5.145 1.00 0.00 C ATOM 1218 O CYS A 91 1.214 5.754 -5.793 1.00 0.00 O ATOM 1219 CB CYS A 91 0.412 5.513 -2.787 1.00 0.00 C ATOM 1220 SG CYS A 91 -1.386 5.201 -2.860 1.00 0.00 S ATOM 0 H CYS A 91 2.867 5.738 -2.974 1.00 0.00 H new ATOM 0 HA CYS A 91 1.080 3.566 -3.394 1.00 0.00 H new ATOM 0 HB2 CYS A 91 0.746 5.395 -1.756 1.00 0.00 H new ATOM 0 HB3 CYS A 91 0.599 6.550 -3.066 1.00 0.00 H new ATOM 1225 N LYS A 92 0.099 3.802 -5.654 1.00 0.00 N ATOM 1226 CA LYS A 92 -0.337 3.801 -7.041 1.00 0.00 C ATOM 1227 C LYS A 92 -1.440 4.823 -7.288 1.00 0.00 C ATOM 1228 O LYS A 92 -1.492 5.447 -8.349 1.00 0.00 O ATOM 1229 CB LYS A 92 -0.843 2.408 -7.421 1.00 0.00 C ATOM 1230 CG LYS A 92 -0.631 2.050 -8.880 1.00 0.00 C ATOM 1231 CD LYS A 92 -0.059 0.648 -9.027 1.00 0.00 C ATOM 1232 CE LYS A 92 -0.189 0.144 -10.453 1.00 0.00 C ATOM 1233 NZ LYS A 92 0.853 -0.865 -10.786 1.00 0.00 N ATOM 0 H LYS A 92 -0.219 2.995 -5.117 1.00 0.00 H new ATOM 0 HA LYS A 92 0.520 4.072 -7.658 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -0.339 1.668 -6.799 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -1.907 2.345 -7.193 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -1.579 2.116 -9.414 1.00 0.00 H new ATOM 0 HG3 LYS A 92 0.045 2.771 -9.339 1.00 0.00 H new ATOM 0 HD2 LYS A 92 0.991 0.649 -8.734 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -0.578 -0.031 -8.351 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -1.177 -0.295 -10.593 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -0.113 0.985 -11.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 0.728 -1.182 -11.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 1.796 -0.439 -10.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 0.765 -1.679 -10.145 1.00 0.00 H new ATOM 1247 N ASN A 93 -2.321 4.999 -6.310 1.00 0.00 N ATOM 1248 CA ASN A 93 -3.515 5.808 -6.530 1.00 0.00 C ATOM 1249 C ASN A 93 -3.951 6.563 -5.275 1.00 0.00 C ATOM 1250 O ASN A 93 -3.446 7.644 -4.984 1.00 0.00 O ATOM 1251 CB ASN A 93 -4.662 4.919 -7.026 1.00 0.00 C ATOM 1252 CG ASN A 93 -4.881 5.012 -8.526 1.00 0.00 C ATOM 1253 OD1 ASN A 93 -5.288 6.051 -9.042 1.00 0.00 O ATOM 1254 ND2 ASN A 93 -4.618 3.919 -9.231 1.00 0.00 N ATOM 0 H ASN A 93 -2.235 4.602 -5.375 1.00 0.00 H new ATOM 0 HA ASN A 93 -3.265 6.553 -7.285 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -4.453 3.883 -6.759 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -5.581 5.201 -6.512 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -4.752 3.920 -10.242 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -4.282 3.078 -8.762 1.00 0.00 H new ATOM 1261 N ILE A 94 -4.884 5.974 -4.532 1.00 0.00 N ATOM 1262 CA ILE A 94 -5.573 6.669 -3.447 1.00 0.00 C ATOM 1263 C ILE A 94 -4.893 6.436 -2.099 1.00 0.00 C ATOM 1264 O ILE A 94 -4.562 5.304 -1.746 1.00 0.00 O ATOM 1265 CB ILE A 94 -7.046 6.201 -3.357 1.00 0.00 C ATOM 1266 CG1 ILE A 94 -7.662 6.097 -4.755 1.00 0.00 C ATOM 1267 CG2 ILE A 94 -7.868 7.139 -2.486 1.00 0.00 C ATOM 1268 CD1 ILE A 94 -8.677 4.983 -4.882 1.00 0.00 C ATOM 0 H ILE A 94 -5.183 5.008 -4.663 1.00 0.00 H new ATOM 0 HA ILE A 94 -5.533 7.734 -3.674 1.00 0.00 H new ATOM 0 HB ILE A 94 -7.056 5.214 -2.895 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -8.140 7.044 -5.005 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -6.867 5.939 -5.484 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -8.898 6.785 -2.441 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -7.449 7.163 -1.480 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -7.847 8.142 -2.911 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -9.074 4.966 -5.897 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -8.199 4.028 -4.663 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -9.491 5.151 -4.177 1.00 0.00 H new ATOM 1280 N VAL A 95 -4.687 7.513 -1.352 1.00 0.00 N ATOM 1281 CA VAL A 95 -4.105 7.428 -0.015 1.00 0.00 C ATOM 1282 C VAL A 95 -5.195 7.196 1.029 1.00 0.00 C ATOM 1283 O VAL A 95 -6.215 7.893 1.039 1.00 0.00 O ATOM 1284 CB VAL A 95 -3.319 8.707 0.356 1.00 0.00 C ATOM 1285 CG1 VAL A 95 -1.820 8.444 0.322 1.00 0.00 C ATOM 1286 CG2 VAL A 95 -3.679 9.867 -0.566 1.00 0.00 C ATOM 0 H VAL A 95 -4.915 8.461 -1.650 1.00 0.00 H new ATOM 0 HA VAL A 95 -3.412 6.587 -0.024 1.00 0.00 H new ATOM 0 HB VAL A 95 -3.600 8.987 1.371 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -1.285 9.356 0.586 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -1.572 7.658 1.036 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -1.528 8.129 -0.680 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -3.109 10.751 -0.278 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -3.441 9.601 -1.596 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -4.745 10.080 -0.484 1.00 0.00 H new ATOM 1296 N ALA A 96 -4.991 6.214 1.900 1.00 0.00 N ATOM 1297 CA ALA A 96 -5.979 5.889 2.914 1.00 0.00 C ATOM 1298 C ALA A 96 -5.337 5.226 4.126 1.00 0.00 C ATOM 1299 O ALA A 96 -4.138 4.946 4.136 1.00 0.00 O ATOM 1300 CB ALA A 96 -7.051 4.992 2.325 1.00 0.00 C ATOM 0 H ALA A 96 -4.153 5.633 1.922 1.00 0.00 H new ATOM 0 HA ALA A 96 -6.436 6.819 3.251 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -7.788 4.753 3.092 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -7.542 5.506 1.498 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -6.595 4.071 1.961 1.00 0.00 H new ATOM 1306 N CYS A 97 -6.148 4.971 5.141 1.00 0.00 N ATOM 1307 CA CYS A 97 -5.674 4.349 6.365 1.00 0.00 C ATOM 1308 C CYS A 97 -6.270 2.959 6.523 1.00 0.00 C ATOM 1309 O CYS A 97 -7.487 2.790 6.485 1.00 0.00 O ATOM 1310 CB CYS A 97 -6.028 5.215 7.573 1.00 0.00 C ATOM 1311 SG CYS A 97 -4.590 5.693 8.577 1.00 0.00 S ATOM 0 H CYS A 97 -7.145 5.188 5.139 1.00 0.00 H new ATOM 0 HA CYS A 97 -4.590 4.257 6.306 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -6.534 6.116 7.227 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -6.735 4.674 8.202 1.00 0.00 H new ATOM 1316 N CYS A 98 -5.412 1.970 6.700 1.00 0.00 N ATOM 1317 CA CYS A 98 -5.848 0.585 6.792 1.00 0.00 C ATOM 1318 C CYS A 98 -4.983 -0.173 7.791 1.00 0.00 C ATOM 1319 O CYS A 98 -3.756 -0.124 7.717 1.00 0.00 O ATOM 1320 CB CYS A 98 -5.777 -0.082 5.417 1.00 0.00 C ATOM 1321 SG CYS A 98 -6.640 -1.683 5.312 1.00 0.00 S ATOM 0 H CYS A 98 -4.404 2.100 6.783 1.00 0.00 H new ATOM 0 HA CYS A 98 -6.881 0.564 7.138 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -6.202 0.595 4.676 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -4.730 -0.229 5.152 1.00 0.00 H new ATOM 1326 N PRO A 99 -5.610 -0.873 8.744 1.00 0.00 N ATOM 1327 CA PRO A 99 -4.900 -1.588 9.802 1.00 0.00 C ATOM 1328 C PRO A 99 -4.514 -3.016 9.399 1.00 0.00 C ATOM 1329 O PRO A 99 -5.347 -3.780 8.913 1.00 0.00 O ATOM 1330 CB PRO A 99 -5.941 -1.604 10.918 1.00 0.00 C ATOM 1331 CG PRO A 99 -7.252 -1.706 10.213 1.00 0.00 C ATOM 1332 CD PRO A 99 -7.075 -1.024 8.877 1.00 0.00 C ATOM 0 HA PRO A 99 -3.952 -1.120 10.067 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -5.787 -2.447 11.591 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -5.886 -0.699 11.523 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -7.541 -2.749 10.081 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -8.042 -1.227 10.792 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -7.490 -1.622 8.066 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -7.580 -0.058 8.852 1.00 0.00 H new ATOM 1340 N GLU A 100 -3.250 -3.378 9.595 1.00 0.00 N ATOM 1341 CA GLU A 100 -2.805 -4.737 9.314 1.00 0.00 C ATOM 1342 C GLU A 100 -3.238 -5.684 10.422 1.00 0.00 C ATOM 1343 O GLU A 100 -2.594 -5.778 11.465 1.00 0.00 O ATOM 1344 CB GLU A 100 -1.288 -4.798 9.139 1.00 0.00 C ATOM 1345 CG GLU A 100 -0.803 -4.123 7.871 1.00 0.00 C ATOM 1346 CD GLU A 100 -0.675 -5.068 6.698 1.00 0.00 C ATOM 1347 OE1 GLU A 100 -1.719 -5.505 6.168 1.00 0.00 O ATOM 1348 OE2 GLU A 100 0.470 -5.339 6.282 1.00 0.00 O ATOM 0 H GLU A 100 -2.522 -2.755 9.944 1.00 0.00 H new ATOM 0 HA GLU A 100 -3.271 -5.049 8.380 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -0.811 -4.327 9.998 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -0.972 -5.841 9.131 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -1.493 -3.321 7.608 1.00 0.00 H new ATOM 0 HG3 GLU A 100 0.165 -3.660 8.062 1.00 0.00 H new ATOM 1355 N GLY A 101 -4.344 -6.365 10.189 1.00 0.00 N ATOM 1356 CA GLY A 101 -4.844 -7.339 11.135 1.00 0.00 C ATOM 1357 C GLY A 101 -6.234 -7.794 10.767 1.00 0.00 C ATOM 1358 O GLY A 101 -6.492 -8.988 10.655 1.00 0.00 O ATOM 0 H GLY A 101 -4.913 -6.260 9.349 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -4.174 -8.198 11.165 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -4.853 -6.907 12.135 1.00 0.00 H new ATOM 1362 N THR A 102 -7.124 -6.831 10.583 1.00 0.00 N ATOM 1363 CA THR A 102 -8.483 -7.088 10.135 1.00 0.00 C ATOM 1364 C THR A 102 -9.252 -5.774 10.100 1.00 0.00 C ATOM 1365 O THR A 102 -8.677 -4.715 10.368 1.00 0.00 O ATOM 1366 CB THR A 102 -9.213 -8.126 11.029 1.00 0.00 C ATOM 1367 OG1 THR A 102 -10.374 -8.624 10.351 1.00 0.00 O ATOM 1368 CG2 THR A 102 -9.618 -7.535 12.374 1.00 0.00 C ATOM 0 H THR A 102 -6.922 -5.844 10.741 1.00 0.00 H new ATOM 0 HA THR A 102 -8.436 -7.519 9.135 1.00 0.00 H new ATOM 0 HB THR A 102 -8.516 -8.942 11.220 1.00 0.00 H new ATOM 0 HG1 THR A 102 -10.102 -9.276 9.672 1.00 0.00 H new ATOM 0 HG21 THR A 102 -10.126 -8.295 12.968 1.00 0.00 H new ATOM 0 HG22 THR A 102 -8.729 -7.194 12.904 1.00 0.00 H new ATOM 0 HG23 THR A 102 -10.290 -6.692 12.213 1.00 0.00 H new ATOM 1376 N THR A 103 -10.540 -5.848 9.781 1.00 0.00 N ATOM 1377 CA THR A 103 -11.384 -4.663 9.635 1.00 0.00 C ATOM 1378 C THR A 103 -11.035 -3.893 8.364 1.00 0.00 C ATOM 1379 O THR A 103 -9.952 -4.049 7.797 1.00 0.00 O ATOM 1380 CB THR A 103 -11.293 -3.722 10.865 1.00 0.00 C ATOM 1381 OG1 THR A 103 -10.983 -4.474 12.047 1.00 0.00 O ATOM 1382 CG2 THR A 103 -12.594 -2.964 11.078 1.00 0.00 C ATOM 0 H THR A 103 -11.029 -6.728 9.616 1.00 0.00 H new ATOM 0 HA THR A 103 -12.411 -5.020 9.564 1.00 0.00 H new ATOM 0 HB THR A 103 -10.498 -3.002 10.670 1.00 0.00 H new ATOM 0 HG1 THR A 103 -10.927 -3.868 12.815 1.00 0.00 H new ATOM 0 HG21 THR A 103 -12.498 -2.313 11.947 1.00 0.00 H new ATOM 0 HG22 THR A 103 -12.813 -2.362 10.196 1.00 0.00 H new ATOM 0 HG23 THR A 103 -13.405 -3.673 11.243 1.00 0.00 H new ATOM 1390 N ASN A 104 -11.982 -3.087 7.913 1.00 0.00 N ATOM 1391 CA ASN A 104 -11.852 -2.349 6.668 1.00 0.00 C ATOM 1392 C ASN A 104 -10.926 -1.150 6.824 1.00 0.00 C ATOM 1393 O ASN A 104 -10.505 -0.811 7.928 1.00 0.00 O ATOM 1394 CB ASN A 104 -13.231 -1.879 6.197 1.00 0.00 C ATOM 1395 CG ASN A 104 -14.105 -1.398 7.343 1.00 0.00 C ATOM 1396 OD1 ASN A 104 -14.874 -2.171 7.919 1.00 0.00 O ATOM 1397 ND2 ASN A 104 -13.983 -0.129 7.696 1.00 0.00 N ATOM 0 H ASN A 104 -12.863 -2.926 8.400 1.00 0.00 H new ATOM 0 HA ASN A 104 -11.416 -3.017 5.925 1.00 0.00 H new ATOM 0 HB2 ASN A 104 -13.109 -1.072 5.474 1.00 0.00 H new ATOM 0 HB3 ASN A 104 -13.733 -2.697 5.680 1.00 0.00 H new ATOM 0 HD21 ASN A 104 -14.536 0.241 8.469 1.00 0.00 H new ATOM 0 HD22 ASN A 104 -13.336 0.480 7.195 1.00 0.00 H new ATOM 1404 N CYS A 105 -10.650 -0.494 5.710 1.00 0.00 N ATOM 1405 CA CYS A 105 -9.774 0.663 5.694 1.00 0.00 C ATOM 1406 C CYS A 105 -10.579 1.920 5.385 1.00 0.00 C ATOM 1407 O CYS A 105 -11.603 1.861 4.700 1.00 0.00 O ATOM 1408 CB CYS A 105 -8.676 0.477 4.640 1.00 0.00 C ATOM 1409 SG CYS A 105 -8.308 -1.267 4.234 1.00 0.00 S ATOM 0 H CYS A 105 -11.025 -0.747 4.796 1.00 0.00 H new ATOM 0 HA CYS A 105 -9.310 0.768 6.675 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -8.973 0.995 3.728 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -7.763 0.955 4.995 1.00 0.00 H new ATOM 1414 N VAL A 106 -10.122 3.053 5.898 1.00 0.00 N ATOM 1415 CA VAL A 106 -10.827 4.310 5.714 1.00 0.00 C ATOM 1416 C VAL A 106 -10.089 5.200 4.717 1.00 0.00 C ATOM 1417 O VAL A 106 -8.868 5.346 4.783 1.00 0.00 O ATOM 1418 CB VAL A 106 -11.022 5.060 7.059 1.00 0.00 C ATOM 1419 CG1 VAL A 106 -11.610 4.129 8.106 1.00 0.00 C ATOM 1420 CG2 VAL A 106 -9.718 5.661 7.565 1.00 0.00 C ATOM 0 H VAL A 106 -9.265 3.126 6.446 1.00 0.00 H new ATOM 0 HA VAL A 106 -11.814 4.075 5.316 1.00 0.00 H new ATOM 0 HB VAL A 106 -11.718 5.879 6.878 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -11.740 4.671 9.043 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -12.577 3.760 7.763 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -10.936 3.287 8.264 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -9.897 6.177 8.508 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -8.987 4.867 7.719 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -9.335 6.370 6.831 1.00 0.00 H new ATOM 1430 N ALA A 107 -10.829 5.770 3.779 1.00 0.00 N ATOM 1431 CA ALA A 107 -10.245 6.648 2.777 1.00 0.00 C ATOM 1432 C ALA A 107 -10.679 8.085 3.017 1.00 0.00 C ATOM 1433 O ALA A 107 -11.869 8.391 2.998 1.00 0.00 O ATOM 1434 CB ALA A 107 -10.635 6.199 1.379 1.00 0.00 C ATOM 0 H ALA A 107 -11.837 5.640 3.691 1.00 0.00 H new ATOM 0 HA ALA A 107 -9.160 6.595 2.862 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -10.188 6.869 0.644 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -10.277 5.184 1.210 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -11.720 6.222 1.279 1.00 0.00 H new ATOM 1440 N VAL A 108 -9.714 8.959 3.253 1.00 0.00 N ATOM 1441 CA VAL A 108 -10.010 10.352 3.534 1.00 0.00 C ATOM 1442 C VAL A 108 -9.483 11.249 2.426 1.00 0.00 C ATOM 1443 O VAL A 108 -9.430 12.472 2.569 1.00 0.00 O ATOM 1444 CB VAL A 108 -9.423 10.812 4.892 1.00 0.00 C ATOM 1445 CG1 VAL A 108 -10.471 11.571 5.689 1.00 0.00 C ATOM 1446 CG2 VAL A 108 -8.892 9.629 5.697 1.00 0.00 C ATOM 0 H VAL A 108 -8.721 8.728 3.255 1.00 0.00 H new ATOM 0 HA VAL A 108 -11.095 10.437 3.588 1.00 0.00 H new ATOM 0 HB VAL A 108 -8.585 11.478 4.688 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -10.045 11.888 6.641 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -10.793 12.447 5.126 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -11.328 10.923 5.873 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -8.487 9.986 6.644 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -9.703 8.927 5.891 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -8.106 9.128 5.132 1.00 0.00 H new ATOM 1456 N ASP A 109 -9.119 10.635 1.311 1.00 0.00 N ATOM 1457 CA ASP A 109 -8.598 11.376 0.169 1.00 0.00 C ATOM 1458 C ASP A 109 -9.709 12.173 -0.494 1.00 0.00 C ATOM 1459 O ASP A 109 -10.733 11.620 -0.906 1.00 0.00 O ATOM 1460 CB ASP A 109 -7.943 10.442 -0.855 1.00 0.00 C ATOM 1461 CG ASP A 109 -7.966 11.017 -2.267 1.00 0.00 C ATOM 1462 OD1 ASP A 109 -7.369 12.094 -2.491 1.00 0.00 O ATOM 1463 OD2 ASP A 109 -8.599 10.406 -3.147 1.00 0.00 O ATOM 0 H ASP A 109 -9.174 9.626 1.171 1.00 0.00 H new ATOM 0 HA ASP A 109 -7.835 12.061 0.539 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -6.911 10.251 -0.560 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -8.459 9.482 -0.849 1.00 0.00 H new ATOM 1468 N ASN A 110 -9.506 13.472 -0.570 1.00 0.00 N ATOM 1469 CA ASN A 110 -10.451 14.361 -1.212 1.00 0.00 C ATOM 1470 C ASN A 110 -9.710 15.260 -2.185 1.00 0.00 C ATOM 1471 O ASN A 110 -9.370 16.399 -1.854 1.00 0.00 O ATOM 1472 CB ASN A 110 -11.201 15.195 -0.169 1.00 0.00 C ATOM 1473 CG ASN A 110 -12.462 14.506 0.321 1.00 0.00 C ATOM 1474 OD1 ASN A 110 -13.559 14.766 -0.171 1.00 0.00 O ATOM 1475 ND2 ASN A 110 -12.315 13.617 1.294 1.00 0.00 N ATOM 0 H ASN A 110 -8.683 13.940 -0.189 1.00 0.00 H new ATOM 0 HA ASN A 110 -11.187 13.771 -1.758 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -10.544 15.390 0.678 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -11.462 16.162 -0.599 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -13.128 13.122 1.660 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -11.389 13.428 1.677 1.00 0.00 H new ATOM 1482 N ALA A 111 -9.442 14.717 -3.373 1.00 0.00 N ATOM 1483 CA ALA A 111 -8.684 15.410 -4.414 1.00 0.00 C ATOM 1484 C ALA A 111 -7.235 15.632 -3.991 1.00 0.00 C ATOM 1485 O ALA A 111 -6.653 16.691 -4.236 1.00 0.00 O ATOM 1486 CB ALA A 111 -9.346 16.728 -4.789 1.00 0.00 C ATOM 0 H ALA A 111 -9.746 13.781 -3.641 1.00 0.00 H new ATOM 0 HA ALA A 111 -8.680 14.771 -5.297 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -8.761 17.221 -5.565 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -10.353 16.537 -5.160 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -9.399 17.371 -3.911 1.00 0.00 H new ATOM 1492 N GLY A 112 -6.662 14.629 -3.346 1.00 0.00 N ATOM 1493 CA GLY A 112 -5.267 14.694 -2.954 1.00 0.00 C ATOM 1494 C GLY A 112 -4.435 13.636 -3.647 1.00 0.00 C ATOM 1495 O GLY A 112 -3.235 13.812 -3.863 1.00 0.00 O ATOM 0 H GLY A 112 -7.139 13.766 -3.085 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -4.869 15.681 -3.191 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -5.187 14.569 -1.874 1.00 0.00 H new ATOM 1499 N ALA A 113 -5.075 12.525 -3.985 1.00 0.00 N ATOM 1500 CA ALA A 113 -4.416 11.440 -4.692 1.00 0.00 C ATOM 1501 C ALA A 113 -4.051 11.846 -6.118 1.00 0.00 C ATOM 1502 O ALA A 113 -4.717 12.682 -6.731 1.00 0.00 O ATOM 1503 CB ALA A 113 -5.310 10.214 -4.706 1.00 0.00 C ATOM 0 H ALA A 113 -6.059 12.353 -3.778 1.00 0.00 H new ATOM 0 HA ALA A 113 -3.491 11.204 -4.166 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -4.809 9.405 -5.238 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -5.516 9.902 -3.682 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -6.247 10.453 -5.208 1.00 0.00 H new ATOM 1509 N GLY A 114 -2.993 11.244 -6.647 1.00 0.00 N ATOM 1510 CA GLY A 114 -2.551 11.565 -7.989 1.00 0.00 C ATOM 1511 C GLY A 114 -1.140 12.111 -8.014 1.00 0.00 C ATOM 1512 O GLY A 114 -0.515 12.185 -9.069 1.00 0.00 O ATOM 0 H GLY A 114 -2.433 10.538 -6.169 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -2.603 10.671 -8.610 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -3.229 12.297 -8.427 1.00 0.00 H new ATOM 1516 N THR A 115 -0.635 12.488 -6.850 1.00 0.00 N ATOM 1517 CA THR A 115 0.719 12.998 -6.740 1.00 0.00 C ATOM 1518 C THR A 115 1.411 12.421 -5.508 1.00 0.00 C ATOM 1519 O THR A 115 0.779 11.768 -4.674 1.00 0.00 O ATOM 1520 CB THR A 115 0.746 14.545 -6.696 1.00 0.00 C ATOM 1521 OG1 THR A 115 2.069 15.023 -6.987 1.00 0.00 O ATOM 1522 CG2 THR A 115 0.297 15.079 -5.338 1.00 0.00 C ATOM 0 H THR A 115 -1.145 12.450 -5.967 1.00 0.00 H new ATOM 0 HA THR A 115 1.261 12.681 -7.631 1.00 0.00 H new ATOM 0 HB THR A 115 0.048 14.908 -7.450 1.00 0.00 H new ATOM 0 HG1 THR A 115 2.407 15.535 -6.223 1.00 0.00 H new ATOM 0 HG21 THR A 115 0.330 16.168 -5.347 1.00 0.00 H new ATOM 0 HG22 THR A 115 -0.722 14.748 -5.136 1.00 0.00 H new ATOM 0 HG23 THR A 115 0.962 14.702 -4.561 1.00 0.00 H new ATOM 1530 N LYS A 116 2.712 12.649 -5.410 1.00 0.00 N ATOM 1531 CA LYS A 116 3.495 12.160 -4.285 1.00 0.00 C ATOM 1532 C LYS A 116 4.306 13.295 -3.677 1.00 0.00 C ATOM 1533 O LYS A 116 4.552 13.330 -2.475 1.00 0.00 O ATOM 1534 CB LYS A 116 4.429 11.027 -4.729 1.00 0.00 C ATOM 1535 CG LYS A 116 4.651 10.961 -6.235 1.00 0.00 C ATOM 1536 CD LYS A 116 6.130 10.889 -6.580 1.00 0.00 C ATOM 1537 CE LYS A 116 6.519 11.936 -7.619 1.00 0.00 C ATOM 1538 NZ LYS A 116 7.893 12.457 -7.399 1.00 0.00 N ATOM 0 H LYS A 116 3.250 13.173 -6.100 1.00 0.00 H new ATOM 0 HA LYS A 116 2.810 11.770 -3.532 1.00 0.00 H new ATOM 0 HB2 LYS A 116 5.393 11.150 -4.235 1.00 0.00 H new ATOM 0 HB3 LYS A 116 4.017 10.076 -4.391 1.00 0.00 H new ATOM 0 HG2 LYS A 116 4.139 10.088 -6.641 1.00 0.00 H new ATOM 0 HG3 LYS A 116 4.209 11.838 -6.707 1.00 0.00 H new ATOM 0 HD2 LYS A 116 6.722 11.036 -5.677 1.00 0.00 H new ATOM 0 HD3 LYS A 116 6.367 9.895 -6.959 1.00 0.00 H new ATOM 0 HE2 LYS A 116 6.452 11.500 -8.616 1.00 0.00 H new ATOM 0 HE3 LYS A 116 5.809 12.762 -7.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 8.187 13.020 -8.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 7.905 13.055 -6.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 8.550 11.661 -7.272 1.00 0.00 H new ATOM 1552 N ALA A 117 4.722 14.222 -4.524 1.00 0.00 N ATOM 1553 CA ALA A 117 5.460 15.390 -4.084 1.00 0.00 C ATOM 1554 C ALA A 117 4.705 16.654 -4.467 1.00 0.00 C ATOM 1555 O ALA A 117 4.125 16.728 -5.553 1.00 0.00 O ATOM 1556 CB ALA A 117 6.855 15.391 -4.690 1.00 0.00 C ATOM 0 H ALA A 117 4.558 14.185 -5.530 1.00 0.00 H new ATOM 0 HA ALA A 117 5.560 15.360 -2.999 1.00 0.00 H new ATOM 0 HB1 ALA A 117 7.398 16.273 -4.351 1.00 0.00 H new ATOM 0 HB2 ALA A 117 7.389 14.494 -4.376 1.00 0.00 H new ATOM 0 HB3 ALA A 117 6.779 15.407 -5.777 1.00 0.00 H new ATOM 1562 N GLU A 118 4.693 17.632 -3.575 1.00 0.00 N ATOM 1563 CA GLU A 118 4.039 18.899 -3.850 1.00 0.00 C ATOM 1564 C GLU A 118 4.781 20.031 -3.149 1.00 0.00 C ATOM 1565 O GLU A 118 4.684 21.184 -3.616 1.00 0.00 O ATOM 1566 CB GLU A 118 2.566 18.860 -3.421 1.00 0.00 C ATOM 1567 CG GLU A 118 2.346 18.981 -1.917 1.00 0.00 C ATOM 1568 CD GLU A 118 1.551 20.217 -1.531 1.00 0.00 C ATOM 1569 OE1 GLU A 118 0.788 20.735 -2.375 1.00 0.00 O ATOM 1570 OE2 GLU A 118 1.686 20.675 -0.378 1.00 0.00 O ATOM 1571 OXT GLU A 118 5.482 19.752 -2.151 1.00 0.00 O ATOM 0 H GLU A 118 5.129 17.572 -2.655 1.00 0.00 H new ATOM 0 HA GLU A 118 4.065 19.079 -4.925 1.00 0.00 H new ATOM 0 HB2 GLU A 118 2.033 19.669 -3.920 1.00 0.00 H new ATOM 0 HB3 GLU A 118 2.124 17.926 -3.767 1.00 0.00 H new ATOM 0 HG2 GLU A 118 1.824 18.094 -1.559 1.00 0.00 H new ATOM 0 HG3 GLU A 118 3.313 19.006 -1.415 1.00 0.00 H new TER 1578 GLU A 118