USER MOD reduce.3.24.130724 H: found=0, std=0, add=768, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 766 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 61 ASN : amide:sc= -1.4 K(o=-1.4,f=0.21) USER MOD Set 1.2: A 65 THR OG1 : rot 180:sc= 0 USER MOD Set 1.3: A 67 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 36 THR OG1 : rot -170:sc= 0.0433 USER MOD Set 2.2: A 66 CYS SG : rot 26:sc= 0.383 USER MOD Set 3.1: A 22 SER OG : rot -94:sc= 0.0838 USER MOD Set 3.2: A 23 HIS : no HD1:sc= 0.0814 K(o=0.17,f=-0.65) USER MOD Single : A 1 GLY N :NH3+ -125:sc= 0.0808 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.074 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc=-0.000806 X(o=-0.00081,f=0) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 13 HIS : no HD1:sc= -0.854 K(o=-0.85,f=-0.35) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot 180:sc= -0.0396 USER MOD Single : A 25 MET CE :methyl 174:sc= 0 (180deg=-0.0242) USER MOD Single : A 27 ASN : amide:sc= -1.46! K(o=-1.5!,f=-0.077) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 140:sc= -0.159 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 CYS SG : rot 36:sc= 0.16 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0392) USER MOD Single : A 69 SER OG : rot 180:sc= -0.465 USER MOD Single : A 70 TYR OH : rot -120:sc= -4.81! USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot 0:sc= 0.513 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 151:sc= -0.0508 (180deg=-1.15) USER MOD Single : A 88 HIS : no HE2:sc= -0.601 K(o=-0.6,f=-1.9) USER MOD Single : A 92 SER OG : rot -110:sc= -0.41 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= -0.0145 USER MOD Single : A 104 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 43:sc= 0.517 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 15.171 -30.233 3.434 1.00 0.00 N ATOM 2 CA GLY A 1 14.542 -29.116 4.114 1.00 0.00 C ATOM 3 C GLY A 1 13.229 -29.499 4.766 1.00 0.00 C ATOM 4 O GLY A 1 12.953 -30.681 4.973 1.00 0.00 O ATOM 0 H1 GLY A 1 16.139 -30.358 3.794 1.00 0.00 H new ATOM 0 H2 GLY A 1 14.622 -31.099 3.608 1.00 0.00 H new ATOM 0 H3 GLY A 1 15.203 -30.044 2.412 1.00 0.00 H new ATOM 0 HA2 GLY A 1 15.221 -28.728 4.873 1.00 0.00 H new ATOM 0 HA3 GLY A 1 14.368 -28.311 3.400 1.00 0.00 H new ATOM 8 N SER A 2 12.417 -28.498 5.091 1.00 0.00 N ATOM 9 CA SER A 2 11.127 -28.736 5.729 1.00 0.00 C ATOM 10 C SER A 2 10.008 -28.030 4.971 1.00 0.00 C ATOM 11 O SER A 2 10.248 -27.071 4.238 1.00 0.00 O ATOM 12 CB SER A 2 11.157 -28.256 7.182 1.00 0.00 C ATOM 13 OG SER A 2 9.858 -28.269 7.749 1.00 0.00 O ATOM 0 H SER A 2 12.629 -27.515 4.923 1.00 0.00 H new ATOM 0 HA SER A 2 10.933 -29.808 5.712 1.00 0.00 H new ATOM 0 HB2 SER A 2 11.819 -28.895 7.766 1.00 0.00 H new ATOM 0 HB3 SER A 2 11.567 -27.247 7.227 1.00 0.00 H new ATOM 0 HG SER A 2 9.903 -27.960 8.678 1.00 0.00 H new ATOM 19 N SER A 3 8.783 -28.513 5.153 1.00 0.00 N ATOM 20 CA SER A 3 7.625 -27.932 4.483 1.00 0.00 C ATOM 21 C SER A 3 6.330 -28.359 5.168 1.00 0.00 C ATOM 22 O SER A 3 6.241 -29.452 5.727 1.00 0.00 O ATOM 23 CB SER A 3 7.598 -28.348 3.011 1.00 0.00 C ATOM 24 OG SER A 3 7.572 -29.759 2.881 1.00 0.00 O ATOM 0 H SER A 3 8.567 -29.305 5.759 1.00 0.00 H new ATOM 0 HA SER A 3 7.708 -26.847 4.545 1.00 0.00 H new ATOM 0 HB2 SER A 3 6.722 -27.918 2.524 1.00 0.00 H new ATOM 0 HB3 SER A 3 8.474 -27.949 2.501 1.00 0.00 H new ATOM 0 HG SER A 3 7.553 -30.000 1.931 1.00 0.00 H new ATOM 30 N GLY A 4 5.327 -27.488 5.120 1.00 0.00 N ATOM 31 CA GLY A 4 4.050 -27.792 5.739 1.00 0.00 C ATOM 32 C GLY A 4 3.852 -27.058 7.050 1.00 0.00 C ATOM 33 O GLY A 4 4.756 -27.008 7.884 1.00 0.00 O ATOM 0 H GLY A 4 5.376 -26.577 4.663 1.00 0.00 H new ATOM 0 HA2 GLY A 4 3.245 -27.528 5.053 1.00 0.00 H new ATOM 0 HA3 GLY A 4 3.981 -28.866 5.913 1.00 0.00 H new ATOM 37 N SER A 5 2.666 -26.486 7.234 1.00 0.00 N ATOM 38 CA SER A 5 2.354 -25.747 8.451 1.00 0.00 C ATOM 39 C SER A 5 1.484 -26.581 9.386 1.00 0.00 C ATOM 40 O SER A 5 0.825 -27.529 8.958 1.00 0.00 O ATOM 41 CB SER A 5 1.643 -24.436 8.109 1.00 0.00 C ATOM 42 OG SER A 5 1.914 -23.440 9.080 1.00 0.00 O ATOM 0 H SER A 5 1.905 -26.521 6.555 1.00 0.00 H new ATOM 0 HA SER A 5 3.291 -25.522 8.960 1.00 0.00 H new ATOM 0 HB2 SER A 5 1.966 -24.089 7.128 1.00 0.00 H new ATOM 0 HB3 SER A 5 0.568 -24.607 8.049 1.00 0.00 H new ATOM 0 HG SER A 5 1.450 -22.612 8.838 1.00 0.00 H new ATOM 48 N SER A 6 1.489 -26.222 10.666 1.00 0.00 N ATOM 49 CA SER A 6 0.703 -26.940 11.663 1.00 0.00 C ATOM 50 C SER A 6 -0.573 -26.175 12.002 1.00 0.00 C ATOM 51 O SER A 6 -0.558 -24.954 12.147 1.00 0.00 O ATOM 52 CB SER A 6 1.530 -27.161 12.931 1.00 0.00 C ATOM 53 OG SER A 6 1.789 -25.935 13.593 1.00 0.00 O ATOM 0 H SER A 6 2.028 -25.439 11.037 1.00 0.00 H new ATOM 0 HA SER A 6 0.426 -27.908 11.244 1.00 0.00 H new ATOM 0 HB2 SER A 6 0.998 -27.835 13.603 1.00 0.00 H new ATOM 0 HB3 SER A 6 2.472 -27.645 12.674 1.00 0.00 H new ATOM 0 HG SER A 6 2.317 -26.105 14.401 1.00 0.00 H new ATOM 59 N GLY A 7 -1.677 -26.905 12.128 1.00 0.00 N ATOM 60 CA GLY A 7 -2.947 -26.281 12.448 1.00 0.00 C ATOM 61 C GLY A 7 -3.942 -26.371 11.308 1.00 0.00 C ATOM 62 O GLY A 7 -3.608 -26.837 10.220 1.00 0.00 O ATOM 0 H GLY A 7 -1.714 -27.918 12.014 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -3.369 -26.757 13.333 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -2.780 -25.233 12.699 1.00 0.00 H new ATOM 66 N ALA A 8 -5.168 -25.925 11.559 1.00 0.00 N ATOM 67 CA ALA A 8 -6.215 -25.957 10.544 1.00 0.00 C ATOM 68 C ALA A 8 -6.683 -24.548 10.194 1.00 0.00 C ATOM 69 O ALA A 8 -7.699 -24.077 10.705 1.00 0.00 O ATOM 70 CB ALA A 8 -7.387 -26.801 11.022 1.00 0.00 C ATOM 0 H ALA A 8 -5.461 -25.537 12.456 1.00 0.00 H new ATOM 0 HA ALA A 8 -5.800 -26.408 9.643 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -8.161 -26.816 10.255 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -7.048 -27.819 11.215 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -7.793 -26.374 11.939 1.00 0.00 H new ATOM 76 N ILE A 9 -5.936 -23.882 9.320 1.00 0.00 N ATOM 77 CA ILE A 9 -6.275 -22.528 8.901 1.00 0.00 C ATOM 78 C ILE A 9 -7.580 -22.507 8.112 1.00 0.00 C ATOM 79 O ILE A 9 -7.574 -22.546 6.882 1.00 0.00 O ATOM 80 CB ILE A 9 -5.158 -21.908 8.041 1.00 0.00 C ATOM 81 CG1 ILE A 9 -3.844 -21.870 8.824 1.00 0.00 C ATOM 82 CG2 ILE A 9 -5.552 -20.510 7.589 1.00 0.00 C ATOM 83 CD1 ILE A 9 -3.103 -23.189 8.825 1.00 0.00 C ATOM 0 H ILE A 9 -5.092 -24.258 8.888 1.00 0.00 H new ATOM 0 HA ILE A 9 -6.393 -21.937 9.809 1.00 0.00 H new ATOM 0 HB ILE A 9 -5.014 -22.528 7.156 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -3.199 -21.101 8.399 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -4.052 -21.579 9.853 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -4.752 -20.085 6.982 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -6.467 -20.563 6.999 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -5.720 -19.879 8.462 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -2.182 -23.088 9.398 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -3.729 -23.958 9.277 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -2.863 -23.472 7.800 1.00 0.00 H new ATOM 95 N ASN A 10 -8.698 -22.444 8.828 1.00 0.00 N ATOM 96 CA ASN A 10 -10.011 -22.417 8.194 1.00 0.00 C ATOM 97 C ASN A 10 -9.988 -21.559 6.933 1.00 0.00 C ATOM 98 O ASN A 10 -10.501 -21.960 5.888 1.00 0.00 O ATOM 99 CB ASN A 10 -11.060 -21.881 9.171 1.00 0.00 C ATOM 100 CG ASN A 10 -12.476 -22.192 8.725 1.00 0.00 C ATOM 101 OD1 ASN A 10 -13.234 -21.294 8.359 1.00 0.00 O ATOM 102 ND2 ASN A 10 -12.839 -23.469 8.756 1.00 0.00 N ATOM 0 H ASN A 10 -8.721 -22.411 9.847 1.00 0.00 H new ATOM 0 HA ASN A 10 -10.273 -23.437 7.913 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -10.889 -22.313 10.157 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -10.942 -20.802 9.271 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -13.780 -23.739 8.469 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -12.177 -24.180 9.067 1.00 0.00 H new ATOM 109 N SER A 11 -9.390 -20.377 7.038 1.00 0.00 N ATOM 110 CA SER A 11 -9.303 -19.461 5.907 1.00 0.00 C ATOM 111 C SER A 11 -8.199 -18.430 6.126 1.00 0.00 C ATOM 112 O SER A 11 -7.765 -18.201 7.255 1.00 0.00 O ATOM 113 CB SER A 11 -10.642 -18.753 5.693 1.00 0.00 C ATOM 114 OG SER A 11 -10.768 -18.293 4.359 1.00 0.00 O ATOM 0 H SER A 11 -8.958 -20.031 7.895 1.00 0.00 H new ATOM 0 HA SER A 11 -9.061 -20.043 5.018 1.00 0.00 H new ATOM 0 HB2 SER A 11 -11.459 -19.436 5.924 1.00 0.00 H new ATOM 0 HB3 SER A 11 -10.726 -17.911 6.381 1.00 0.00 H new ATOM 0 HG SER A 11 -11.633 -17.846 4.248 1.00 0.00 H new ATOM 120 N ARG A 12 -7.751 -17.812 5.038 1.00 0.00 N ATOM 121 CA ARG A 12 -6.697 -16.807 5.110 1.00 0.00 C ATOM 122 C ARG A 12 -7.198 -15.458 4.605 1.00 0.00 C ATOM 123 O ARG A 12 -7.939 -15.386 3.623 1.00 0.00 O ATOM 124 CB ARG A 12 -5.483 -17.251 4.293 1.00 0.00 C ATOM 125 CG ARG A 12 -5.759 -17.361 2.802 1.00 0.00 C ATOM 126 CD ARG A 12 -4.846 -18.381 2.140 1.00 0.00 C ATOM 127 NE ARG A 12 -5.218 -19.752 2.483 1.00 0.00 N ATOM 128 CZ ARG A 12 -4.434 -20.802 2.266 1.00 0.00 C ATOM 129 NH1 ARG A 12 -3.240 -20.639 1.711 1.00 0.00 N ATOM 130 NH2 ARG A 12 -4.842 -22.018 2.605 1.00 0.00 N ATOM 0 H ARG A 12 -8.101 -17.989 4.097 1.00 0.00 H new ATOM 0 HA ARG A 12 -6.403 -16.699 6.154 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -4.670 -16.543 4.452 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -5.141 -18.218 4.663 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -6.799 -17.645 2.643 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -5.620 -16.387 2.332 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -4.885 -18.255 1.058 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -3.816 -18.198 2.445 1.00 0.00 H new ATOM 0 HE ARG A 12 -6.129 -19.911 2.912 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -2.922 -19.706 1.450 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -2.640 -21.447 1.545 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -5.759 -22.148 3.033 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -4.239 -22.823 2.438 1.00 0.00 H new ATOM 144 N HIS A 13 -6.790 -14.389 5.282 1.00 0.00 N ATOM 145 CA HIS A 13 -7.197 -13.041 4.901 1.00 0.00 C ATOM 146 C HIS A 13 -6.083 -12.037 5.183 1.00 0.00 C ATOM 147 O HIS A 13 -5.195 -12.292 5.997 1.00 0.00 O ATOM 148 CB HIS A 13 -8.466 -12.637 5.653 1.00 0.00 C ATOM 149 CG HIS A 13 -9.649 -13.500 5.337 1.00 0.00 C ATOM 150 ND1 HIS A 13 -10.350 -14.197 6.299 1.00 0.00 N ATOM 151 CD2 HIS A 13 -10.255 -13.774 4.159 1.00 0.00 C ATOM 152 CE1 HIS A 13 -11.335 -14.864 5.725 1.00 0.00 C ATOM 153 NE2 HIS A 13 -11.300 -14.624 4.426 1.00 0.00 N ATOM 0 H HIS A 13 -6.178 -14.430 6.097 1.00 0.00 H new ATOM 0 HA HIS A 13 -7.402 -13.039 3.830 1.00 0.00 H new ATOM 0 HB2 HIS A 13 -8.272 -12.678 6.725 1.00 0.00 H new ATOM 0 HB3 HIS A 13 -8.707 -11.602 5.412 1.00 0.00 H new ATOM 0 HD2 HIS A 13 -9.970 -13.395 3.189 1.00 0.00 H new ATOM 0 HE1 HIS A 13 -12.048 -15.498 6.231 1.00 0.00 H new ATOM 0 HE2 HIS A 13 -11.944 -15.008 3.734 1.00 0.00 H new ATOM 162 N VAL A 14 -6.136 -10.896 4.504 1.00 0.00 N ATOM 163 CA VAL A 14 -5.132 -9.853 4.681 1.00 0.00 C ATOM 164 C VAL A 14 -5.777 -8.472 4.730 1.00 0.00 C ATOM 165 O VAL A 14 -6.705 -8.183 3.976 1.00 0.00 O ATOM 166 CB VAL A 14 -4.088 -9.881 3.549 1.00 0.00 C ATOM 167 CG1 VAL A 14 -3.126 -8.710 3.681 1.00 0.00 C ATOM 168 CG2 VAL A 14 -3.336 -11.203 3.552 1.00 0.00 C ATOM 0 H VAL A 14 -6.864 -10.670 3.826 1.00 0.00 H new ATOM 0 HA VAL A 14 -4.633 -10.051 5.630 1.00 0.00 H new ATOM 0 HB VAL A 14 -4.608 -9.787 2.596 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -2.396 -8.746 2.873 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -3.682 -7.774 3.626 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -2.610 -8.769 4.639 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -2.602 -11.206 2.746 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -2.826 -11.329 4.507 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -4.040 -12.022 3.405 1.00 0.00 H new ATOM 178 N SER A 15 -5.277 -7.623 5.622 1.00 0.00 N ATOM 179 CA SER A 15 -5.806 -6.272 5.771 1.00 0.00 C ATOM 180 C SER A 15 -4.678 -5.269 5.996 1.00 0.00 C ATOM 181 O SER A 15 -3.746 -5.527 6.757 1.00 0.00 O ATOM 182 CB SER A 15 -6.794 -6.216 6.937 1.00 0.00 C ATOM 183 OG SER A 15 -7.583 -5.040 6.880 1.00 0.00 O ATOM 0 H SER A 15 -4.507 -7.846 6.252 1.00 0.00 H new ATOM 0 HA SER A 15 -6.326 -6.007 4.850 1.00 0.00 H new ATOM 0 HB2 SER A 15 -7.441 -7.093 6.913 1.00 0.00 H new ATOM 0 HB3 SER A 15 -6.250 -6.247 7.881 1.00 0.00 H new ATOM 0 HG SER A 15 -8.208 -5.028 7.635 1.00 0.00 H new ATOM 189 N ALA A 16 -4.772 -4.124 5.328 1.00 0.00 N ATOM 190 CA ALA A 16 -3.762 -3.081 5.455 1.00 0.00 C ATOM 191 C ALA A 16 -4.256 -1.944 6.343 1.00 0.00 C ATOM 192 O ALA A 16 -5.449 -1.640 6.373 1.00 0.00 O ATOM 193 CB ALA A 16 -3.375 -2.551 4.082 1.00 0.00 C ATOM 0 H ALA A 16 -5.537 -3.895 4.694 1.00 0.00 H new ATOM 0 HA ALA A 16 -2.881 -3.518 5.925 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -2.620 -1.773 4.192 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -2.972 -3.364 3.478 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -4.255 -2.136 3.591 1.00 0.00 H new ATOM 199 N TYR A 17 -3.332 -1.320 7.066 1.00 0.00 N ATOM 200 CA TYR A 17 -3.675 -0.219 7.958 1.00 0.00 C ATOM 201 C TYR A 17 -2.468 0.681 8.201 1.00 0.00 C ATOM 202 O TYR A 17 -1.381 0.207 8.530 1.00 0.00 O ATOM 203 CB TYR A 17 -4.200 -0.758 9.289 1.00 0.00 C ATOM 204 CG TYR A 17 -3.112 -1.267 10.208 1.00 0.00 C ATOM 205 CD1 TYR A 17 -2.440 -0.404 11.065 1.00 0.00 C ATOM 206 CD2 TYR A 17 -2.755 -2.609 10.217 1.00 0.00 C ATOM 207 CE1 TYR A 17 -1.445 -0.865 11.906 1.00 0.00 C ATOM 208 CE2 TYR A 17 -1.762 -3.079 11.055 1.00 0.00 C ATOM 209 CZ TYR A 17 -1.110 -2.203 11.897 1.00 0.00 C ATOM 210 OH TYR A 17 -0.119 -2.666 12.732 1.00 0.00 O ATOM 0 H TYR A 17 -2.340 -1.558 7.052 1.00 0.00 H new ATOM 0 HA TYR A 17 -4.456 0.373 7.480 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -4.754 0.031 9.798 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -4.905 -1.566 9.092 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -2.700 0.644 11.074 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -3.262 -3.297 9.557 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -0.933 -0.181 12.567 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -1.498 -4.126 11.051 1.00 0.00 H new ATOM 0 HH TYR A 17 -0.007 -3.631 12.603 1.00 0.00 H new ATOM 220 N GLY A 18 -2.667 1.986 8.036 1.00 0.00 N ATOM 221 CA GLY A 18 -1.587 2.933 8.242 1.00 0.00 C ATOM 222 C GLY A 18 -1.925 4.318 7.729 1.00 0.00 C ATOM 223 O GLY A 18 -2.991 4.549 7.156 1.00 0.00 O ATOM 0 H GLY A 18 -3.557 2.404 7.763 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -1.355 2.989 9.306 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -0.690 2.572 7.739 1.00 0.00 H new ATOM 227 N PRO A 19 -1.004 5.271 7.934 1.00 0.00 N ATOM 228 CA PRO A 19 -1.188 6.658 7.496 1.00 0.00 C ATOM 229 C PRO A 19 -1.137 6.799 5.979 1.00 0.00 C ATOM 230 O PRO A 19 -1.957 7.494 5.382 1.00 0.00 O ATOM 231 CB PRO A 19 -0.011 7.393 8.142 1.00 0.00 C ATOM 232 CG PRO A 19 1.031 6.346 8.332 1.00 0.00 C ATOM 233 CD PRO A 19 0.289 5.068 8.610 1.00 0.00 C ATOM 0 HA PRO A 19 -2.163 7.050 7.784 1.00 0.00 H new ATOM 0 HB2 PRO A 19 0.350 8.200 7.504 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -0.299 7.842 9.092 1.00 0.00 H new ATOM 0 HG2 PRO A 19 1.654 6.250 7.443 1.00 0.00 H new ATOM 0 HG3 PRO A 19 1.693 6.600 9.159 1.00 0.00 H new ATOM 0 HD2 PRO A 19 0.818 4.202 8.213 1.00 0.00 H new ATOM 0 HD3 PRO A 19 0.162 4.902 9.680 1.00 0.00 H new ATOM 241 N GLY A 20 -0.166 6.133 5.360 1.00 0.00 N ATOM 242 CA GLY A 20 -0.027 6.197 3.917 1.00 0.00 C ATOM 243 C GLY A 20 -1.263 5.703 3.192 1.00 0.00 C ATOM 244 O GLY A 20 -1.622 6.224 2.135 1.00 0.00 O ATOM 0 H GLY A 20 0.526 5.551 5.832 1.00 0.00 H new ATOM 0 HA2 GLY A 20 0.177 7.226 3.620 1.00 0.00 H new ATOM 0 HA3 GLY A 20 0.832 5.600 3.611 1.00 0.00 H new ATOM 248 N LEU A 21 -1.916 4.695 3.759 1.00 0.00 N ATOM 249 CA LEU A 21 -3.120 4.130 3.160 1.00 0.00 C ATOM 250 C LEU A 21 -4.295 5.094 3.283 1.00 0.00 C ATOM 251 O LEU A 21 -5.055 5.288 2.334 1.00 0.00 O ATOM 252 CB LEU A 21 -3.467 2.797 3.825 1.00 0.00 C ATOM 253 CG LEU A 21 -2.456 1.666 3.631 1.00 0.00 C ATOM 254 CD1 LEU A 21 -2.765 0.507 4.566 1.00 0.00 C ATOM 255 CD2 LEU A 21 -2.450 1.199 2.183 1.00 0.00 C ATOM 0 H LEU A 21 -1.632 4.252 4.633 1.00 0.00 H new ATOM 0 HA LEU A 21 -2.923 3.961 2.101 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -3.589 2.968 4.894 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -4.432 2.464 3.443 1.00 0.00 H new ATOM 0 HG LEU A 21 -1.464 2.046 3.873 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -2.035 -0.288 4.413 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -2.717 0.850 5.599 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -3.765 0.127 4.356 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -1.725 0.394 2.063 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -3.442 0.837 1.913 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -2.179 2.031 1.533 1.00 0.00 H new ATOM 267 N SER A 22 -4.437 5.698 4.459 1.00 0.00 N ATOM 268 CA SER A 22 -5.521 6.642 4.708 1.00 0.00 C ATOM 269 C SER A 22 -5.336 7.911 3.882 1.00 0.00 C ATOM 270 O SER A 22 -6.295 8.454 3.334 1.00 0.00 O ATOM 271 CB SER A 22 -5.588 6.992 6.195 1.00 0.00 C ATOM 272 OG SER A 22 -6.647 7.897 6.458 1.00 0.00 O ATOM 0 H SER A 22 -3.815 5.551 5.254 1.00 0.00 H new ATOM 0 HA SER A 22 -6.457 6.170 4.411 1.00 0.00 H new ATOM 0 HB2 SER A 22 -5.728 6.083 6.780 1.00 0.00 H new ATOM 0 HB3 SER A 22 -4.642 7.432 6.511 1.00 0.00 H new ATOM 0 HG SER A 22 -6.305 8.815 6.441 1.00 0.00 H new ATOM 278 N HIS A 23 -4.094 8.379 3.799 1.00 0.00 N ATOM 279 CA HIS A 23 -3.782 9.585 3.040 1.00 0.00 C ATOM 280 C HIS A 23 -2.274 9.808 2.971 1.00 0.00 C ATOM 281 O HIS A 23 -1.498 9.057 3.559 1.00 0.00 O ATOM 282 CB HIS A 23 -4.461 10.801 3.671 1.00 0.00 C ATOM 283 CG HIS A 23 -4.020 11.071 5.077 1.00 0.00 C ATOM 284 ND1 HIS A 23 -4.522 10.392 6.166 1.00 0.00 N ATOM 285 CD2 HIS A 23 -3.116 11.951 5.567 1.00 0.00 C ATOM 286 CE1 HIS A 23 -3.948 10.844 7.267 1.00 0.00 C ATOM 287 NE2 HIS A 23 -3.090 11.790 6.931 1.00 0.00 N ATOM 0 H HIS A 23 -3.289 7.942 4.247 1.00 0.00 H new ATOM 0 HA HIS A 23 -4.159 9.454 2.026 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -4.256 11.680 3.059 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -5.540 10.650 3.660 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -2.525 12.649 4.993 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -4.147 10.499 8.271 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -2.503 12.316 7.579 1.00 0.00 H new ATOM 296 N GLY A 24 -1.866 10.847 2.248 1.00 0.00 N ATOM 297 CA GLY A 24 -0.453 11.150 2.115 1.00 0.00 C ATOM 298 C GLY A 24 -0.207 12.475 1.422 1.00 0.00 C ATOM 299 O GLY A 24 -1.112 13.301 1.308 1.00 0.00 O ATOM 0 H GLY A 24 -2.489 11.484 1.752 1.00 0.00 H new ATOM 0 HA2 GLY A 24 0.006 11.170 3.104 1.00 0.00 H new ATOM 0 HA3 GLY A 24 0.035 10.354 1.553 1.00 0.00 H new ATOM 303 N MET A 25 1.023 12.680 0.961 1.00 0.00 N ATOM 304 CA MET A 25 1.385 13.915 0.276 1.00 0.00 C ATOM 305 C MET A 25 2.397 13.645 -0.833 1.00 0.00 C ATOM 306 O MET A 25 3.096 12.632 -0.816 1.00 0.00 O ATOM 307 CB MET A 25 1.959 14.926 1.271 1.00 0.00 C ATOM 308 CG MET A 25 0.969 15.352 2.343 1.00 0.00 C ATOM 309 SD MET A 25 1.777 15.855 3.874 1.00 0.00 S ATOM 310 CE MET A 25 2.706 17.280 3.315 1.00 0.00 C ATOM 0 H MET A 25 1.785 12.007 1.049 1.00 0.00 H new ATOM 0 HA MET A 25 0.483 14.330 -0.173 1.00 0.00 H new ATOM 0 HB2 MET A 25 2.837 14.493 1.750 1.00 0.00 H new ATOM 0 HB3 MET A 25 2.295 15.809 0.727 1.00 0.00 H new ATOM 0 HG2 MET A 25 0.365 16.178 1.967 1.00 0.00 H new ATOM 0 HG3 MET A 25 0.287 14.527 2.551 1.00 0.00 H new ATOM 0 HE1 MET A 25 3.175 17.767 4.170 1.00 0.00 H new ATOM 0 HE2 MET A 25 3.475 16.960 2.612 1.00 0.00 H new ATOM 0 HE3 MET A 25 2.034 17.982 2.822 1.00 0.00 H new ATOM 320 N VAL A 26 2.471 14.559 -1.796 1.00 0.00 N ATOM 321 CA VAL A 26 3.399 14.419 -2.912 1.00 0.00 C ATOM 322 C VAL A 26 4.845 14.439 -2.431 1.00 0.00 C ATOM 323 O VAL A 26 5.184 15.143 -1.481 1.00 0.00 O ATOM 324 CB VAL A 26 3.200 15.539 -3.951 1.00 0.00 C ATOM 325 CG1 VAL A 26 4.174 15.374 -5.107 1.00 0.00 C ATOM 326 CG2 VAL A 26 1.763 15.553 -4.450 1.00 0.00 C ATOM 0 H VAL A 26 1.900 15.404 -1.826 1.00 0.00 H new ATOM 0 HA VAL A 26 3.188 13.457 -3.380 1.00 0.00 H new ATOM 0 HB VAL A 26 3.403 16.497 -3.471 1.00 0.00 H new ATOM 0 HG11 VAL A 26 4.019 16.174 -5.831 1.00 0.00 H new ATOM 0 HG12 VAL A 26 5.196 15.419 -4.731 1.00 0.00 H new ATOM 0 HG13 VAL A 26 4.007 14.411 -5.589 1.00 0.00 H new ATOM 0 HG21 VAL A 26 1.640 16.350 -5.183 1.00 0.00 H new ATOM 0 HG22 VAL A 26 1.529 14.595 -4.914 1.00 0.00 H new ATOM 0 HG23 VAL A 26 1.088 15.724 -3.611 1.00 0.00 H new ATOM 336 N ASN A 27 5.694 13.660 -3.094 1.00 0.00 N ATOM 337 CA ASN A 27 7.106 13.588 -2.733 1.00 0.00 C ATOM 338 C ASN A 27 7.277 13.082 -1.304 1.00 0.00 C ATOM 339 O ASN A 27 8.195 13.493 -0.594 1.00 0.00 O ATOM 340 CB ASN A 27 7.762 14.962 -2.882 1.00 0.00 C ATOM 341 CG ASN A 27 8.332 15.183 -4.270 1.00 0.00 C ATOM 342 OD1 ASN A 27 9.419 14.701 -4.591 1.00 0.00 O ATOM 343 ND2 ASN A 27 7.599 15.915 -5.100 1.00 0.00 N ATOM 0 H ASN A 27 5.429 13.070 -3.883 1.00 0.00 H new ATOM 0 HA ASN A 27 7.593 12.885 -3.409 1.00 0.00 H new ATOM 0 HB2 ASN A 27 7.027 15.738 -2.666 1.00 0.00 H new ATOM 0 HB3 ASN A 27 8.558 15.063 -2.145 1.00 0.00 H new ATOM 0 HD21 ASN A 27 7.931 16.098 -6.047 1.00 0.00 H new ATOM 0 HD22 ASN A 27 6.704 16.294 -4.791 1.00 0.00 H new ATOM 350 N LYS A 28 6.387 12.187 -0.889 1.00 0.00 N ATOM 351 CA LYS A 28 6.439 11.622 0.455 1.00 0.00 C ATOM 352 C LYS A 28 6.163 10.122 0.425 1.00 0.00 C ATOM 353 O LYS A 28 5.154 9.663 -0.111 1.00 0.00 O ATOM 354 CB LYS A 28 5.425 12.320 1.363 1.00 0.00 C ATOM 355 CG LYS A 28 5.742 13.784 1.616 1.00 0.00 C ATOM 356 CD LYS A 28 6.633 13.960 2.834 1.00 0.00 C ATOM 357 CE LYS A 28 8.106 13.917 2.457 1.00 0.00 C ATOM 358 NZ LYS A 28 8.976 14.411 3.560 1.00 0.00 N ATOM 0 H LYS A 28 5.621 11.837 -1.464 1.00 0.00 H new ATOM 0 HA LYS A 28 7.442 11.781 0.851 1.00 0.00 H new ATOM 0 HB2 LYS A 28 4.435 12.244 0.914 1.00 0.00 H new ATOM 0 HB3 LYS A 28 5.383 11.796 2.318 1.00 0.00 H new ATOM 0 HG2 LYS A 28 6.234 14.207 0.740 1.00 0.00 H new ATOM 0 HG3 LYS A 28 4.815 14.338 1.760 1.00 0.00 H new ATOM 0 HD2 LYS A 28 6.407 14.911 3.317 1.00 0.00 H new ATOM 0 HD3 LYS A 28 6.419 13.175 3.559 1.00 0.00 H new ATOM 0 HE2 LYS A 28 8.386 12.895 2.204 1.00 0.00 H new ATOM 0 HE3 LYS A 28 8.271 14.523 1.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 9.972 14.366 3.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 8.726 15.395 3.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 8.838 13.818 4.403 1.00 0.00 H new ATOM 372 N PRO A 29 7.078 9.339 1.016 1.00 0.00 N ATOM 373 CA PRO A 29 6.953 7.880 1.072 1.00 0.00 C ATOM 374 C PRO A 29 5.827 7.429 1.997 1.00 0.00 C ATOM 375 O PRO A 29 5.996 7.375 3.215 1.00 0.00 O ATOM 376 CB PRO A 29 8.309 7.429 1.622 1.00 0.00 C ATOM 377 CG PRO A 29 8.813 8.599 2.393 1.00 0.00 C ATOM 378 CD PRO A 29 8.304 9.819 1.675 1.00 0.00 C ATOM 0 HA PRO A 29 6.709 7.454 0.099 1.00 0.00 H new ATOM 0 HB2 PRO A 29 8.206 6.550 2.259 1.00 0.00 H new ATOM 0 HB3 PRO A 29 8.993 7.161 0.817 1.00 0.00 H new ATOM 0 HG2 PRO A 29 8.453 8.573 3.421 1.00 0.00 H new ATOM 0 HG3 PRO A 29 9.902 8.598 2.436 1.00 0.00 H new ATOM 0 HD2 PRO A 29 8.095 10.635 2.367 1.00 0.00 H new ATOM 0 HD3 PRO A 29 9.029 10.192 0.952 1.00 0.00 H new ATOM 386 N ALA A 30 4.679 7.107 1.410 1.00 0.00 N ATOM 387 CA ALA A 30 3.526 6.659 2.182 1.00 0.00 C ATOM 388 C ALA A 30 3.783 5.293 2.808 1.00 0.00 C ATOM 389 O ALA A 30 3.688 4.263 2.140 1.00 0.00 O ATOM 390 CB ALA A 30 2.287 6.614 1.301 1.00 0.00 C ATOM 0 H ALA A 30 4.522 7.148 0.403 1.00 0.00 H new ATOM 0 HA ALA A 30 3.359 7.373 2.988 1.00 0.00 H new ATOM 0 HB1 ALA A 30 1.434 6.278 1.890 1.00 0.00 H new ATOM 0 HB2 ALA A 30 2.085 7.610 0.906 1.00 0.00 H new ATOM 0 HB3 ALA A 30 2.453 5.922 0.475 1.00 0.00 H new ATOM 396 N THR A 31 4.109 5.290 4.097 1.00 0.00 N ATOM 397 CA THR A 31 4.381 4.050 4.814 1.00 0.00 C ATOM 398 C THR A 31 3.111 3.489 5.443 1.00 0.00 C ATOM 399 O THR A 31 2.294 4.233 5.986 1.00 0.00 O ATOM 400 CB THR A 31 5.438 4.258 5.915 1.00 0.00 C ATOM 401 OG1 THR A 31 4.897 5.068 6.966 1.00 0.00 O ATOM 402 CG2 THR A 31 6.686 4.920 5.350 1.00 0.00 C ATOM 0 H THR A 31 4.191 6.133 4.666 1.00 0.00 H new ATOM 0 HA THR A 31 4.765 3.339 4.082 1.00 0.00 H new ATOM 0 HB THR A 31 5.713 3.281 6.313 1.00 0.00 H new ATOM 0 HG1 THR A 31 5.574 5.194 7.663 1.00 0.00 H new ATOM 0 HG21 THR A 31 7.418 5.056 6.146 1.00 0.00 H new ATOM 0 HG22 THR A 31 7.112 4.288 4.570 1.00 0.00 H new ATOM 0 HG23 THR A 31 6.424 5.890 4.928 1.00 0.00 H new ATOM 410 N PHE A 32 2.952 2.172 5.368 1.00 0.00 N ATOM 411 CA PHE A 32 1.780 1.510 5.931 1.00 0.00 C ATOM 412 C PHE A 32 2.105 0.072 6.325 1.00 0.00 C ATOM 413 O PHE A 32 3.128 -0.480 5.919 1.00 0.00 O ATOM 414 CB PHE A 32 0.627 1.528 4.926 1.00 0.00 C ATOM 415 CG PHE A 32 0.945 0.826 3.636 1.00 0.00 C ATOM 416 CD1 PHE A 32 1.618 1.486 2.621 1.00 0.00 C ATOM 417 CD2 PHE A 32 0.571 -0.493 3.439 1.00 0.00 C ATOM 418 CE1 PHE A 32 1.912 0.844 1.433 1.00 0.00 C ATOM 419 CE2 PHE A 32 0.862 -1.141 2.253 1.00 0.00 C ATOM 420 CZ PHE A 32 1.534 -0.472 1.250 1.00 0.00 C ATOM 0 H PHE A 32 3.619 1.542 4.923 1.00 0.00 H new ATOM 0 HA PHE A 32 1.480 2.054 6.827 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -0.247 1.060 5.379 1.00 0.00 H new ATOM 0 HB3 PHE A 32 0.359 2.562 4.711 1.00 0.00 H new ATOM 0 HD1 PHE A 32 1.917 2.515 2.760 1.00 0.00 H new ATOM 0 HD2 PHE A 32 0.046 -1.021 4.221 1.00 0.00 H new ATOM 0 HE1 PHE A 32 2.436 1.370 0.649 1.00 0.00 H new ATOM 0 HE2 PHE A 32 0.564 -2.169 2.111 1.00 0.00 H new ATOM 0 HZ PHE A 32 1.764 -0.977 0.323 1.00 0.00 H new ATOM 430 N THR A 33 1.226 -0.529 7.121 1.00 0.00 N ATOM 431 CA THR A 33 1.418 -1.902 7.572 1.00 0.00 C ATOM 432 C THR A 33 0.389 -2.836 6.946 1.00 0.00 C ATOM 433 O THR A 33 -0.780 -2.478 6.800 1.00 0.00 O ATOM 434 CB THR A 33 1.324 -2.007 9.106 1.00 0.00 C ATOM 435 OG1 THR A 33 2.555 -1.584 9.703 1.00 0.00 O ATOM 436 CG2 THR A 33 1.011 -3.433 9.533 1.00 0.00 C ATOM 0 H THR A 33 0.374 -0.087 7.467 1.00 0.00 H new ATOM 0 HA THR A 33 2.417 -2.202 7.255 1.00 0.00 H new ATOM 0 HB THR A 33 0.516 -1.358 9.443 1.00 0.00 H new ATOM 0 HG1 THR A 33 2.486 -1.652 10.678 1.00 0.00 H new ATOM 0 HG21 THR A 33 0.950 -3.482 10.620 1.00 0.00 H new ATOM 0 HG22 THR A 33 0.059 -3.741 9.101 1.00 0.00 H new ATOM 0 HG23 THR A 33 1.800 -4.099 9.184 1.00 0.00 H new ATOM 444 N ILE A 34 0.830 -4.034 6.579 1.00 0.00 N ATOM 445 CA ILE A 34 -0.054 -5.020 5.970 1.00 0.00 C ATOM 446 C ILE A 34 -0.109 -6.297 6.802 1.00 0.00 C ATOM 447 O ILE A 34 0.898 -6.985 6.971 1.00 0.00 O ATOM 448 CB ILE A 34 0.395 -5.372 4.539 1.00 0.00 C ATOM 449 CG1 ILE A 34 0.780 -4.103 3.776 1.00 0.00 C ATOM 450 CG2 ILE A 34 -0.707 -6.123 3.808 1.00 0.00 C ATOM 451 CD1 ILE A 34 1.455 -4.377 2.450 1.00 0.00 C ATOM 0 H ILE A 34 1.795 -4.346 6.693 1.00 0.00 H new ATOM 0 HA ILE A 34 -1.047 -4.572 5.930 1.00 0.00 H new ATOM 0 HB ILE A 34 1.271 -6.018 4.597 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -0.116 -3.507 3.602 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.446 -3.503 4.397 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -0.375 -6.365 2.798 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -0.937 -7.044 4.344 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -1.600 -5.500 3.757 1.00 0.00 H new ATOM 0 HD11 ILE A 34 1.700 -3.432 1.964 1.00 0.00 H new ATOM 0 HD12 ILE A 34 2.369 -4.946 2.618 1.00 0.00 H new ATOM 0 HD13 ILE A 34 0.783 -4.950 1.811 1.00 0.00 H new ATOM 463 N VAL A 35 -1.294 -6.609 7.318 1.00 0.00 N ATOM 464 CA VAL A 35 -1.482 -7.805 8.130 1.00 0.00 C ATOM 465 C VAL A 35 -1.335 -9.069 7.290 1.00 0.00 C ATOM 466 O VAL A 35 -2.268 -9.483 6.602 1.00 0.00 O ATOM 467 CB VAL A 35 -2.865 -7.811 8.808 1.00 0.00 C ATOM 468 CG1 VAL A 35 -3.057 -9.084 9.618 1.00 0.00 C ATOM 469 CG2 VAL A 35 -3.033 -6.580 9.686 1.00 0.00 C ATOM 0 H VAL A 35 -2.137 -6.050 7.188 1.00 0.00 H new ATOM 0 HA VAL A 35 -0.709 -7.791 8.898 1.00 0.00 H new ATOM 0 HB VAL A 35 -3.631 -7.783 8.033 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -4.040 -9.070 10.090 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -2.983 -9.949 8.959 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -2.286 -9.146 10.386 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -4.016 -6.601 10.157 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -2.261 -6.574 10.456 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -2.942 -5.682 9.075 1.00 0.00 H new ATOM 479 N THR A 36 -0.155 -9.679 7.351 1.00 0.00 N ATOM 480 CA THR A 36 0.116 -10.895 6.595 1.00 0.00 C ATOM 481 C THR A 36 0.632 -12.004 7.505 1.00 0.00 C ATOM 482 O THR A 36 1.362 -12.893 7.066 1.00 0.00 O ATOM 483 CB THR A 36 1.145 -10.645 5.477 1.00 0.00 C ATOM 484 OG1 THR A 36 2.333 -10.062 6.025 1.00 0.00 O ATOM 485 CG2 THR A 36 0.571 -9.726 4.409 1.00 0.00 C ATOM 0 H THR A 36 0.628 -9.350 7.916 1.00 0.00 H new ATOM 0 HA THR A 36 -0.828 -11.205 6.147 1.00 0.00 H new ATOM 0 HB THR A 36 1.389 -11.603 5.018 1.00 0.00 H new ATOM 0 HG1 THR A 36 2.915 -9.759 5.297 1.00 0.00 H new ATOM 0 HG21 THR A 36 1.316 -9.564 3.630 1.00 0.00 H new ATOM 0 HG22 THR A 36 -0.316 -10.185 3.973 1.00 0.00 H new ATOM 0 HG23 THR A 36 0.302 -8.770 4.858 1.00 0.00 H new ATOM 493 N LYS A 37 0.247 -11.947 8.776 1.00 0.00 N ATOM 494 CA LYS A 37 0.669 -12.948 9.749 1.00 0.00 C ATOM 495 C LYS A 37 -0.081 -14.260 9.539 1.00 0.00 C ATOM 496 O LYS A 37 0.531 -15.314 9.366 1.00 0.00 O ATOM 497 CB LYS A 37 0.434 -12.436 11.172 1.00 0.00 C ATOM 498 CG LYS A 37 0.597 -13.506 12.238 1.00 0.00 C ATOM 499 CD LYS A 37 2.061 -13.748 12.566 1.00 0.00 C ATOM 500 CE LYS A 37 2.260 -15.074 13.284 1.00 0.00 C ATOM 501 NZ LYS A 37 1.812 -15.009 14.702 1.00 0.00 N ATOM 0 H LYS A 37 -0.357 -11.218 9.156 1.00 0.00 H new ATOM 0 HA LYS A 37 1.734 -13.132 9.607 1.00 0.00 H new ATOM 0 HB2 LYS A 37 1.130 -11.623 11.376 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -0.571 -12.019 11.238 1.00 0.00 H new ATOM 0 HG2 LYS A 37 0.066 -13.205 13.141 1.00 0.00 H new ATOM 0 HG3 LYS A 37 0.142 -14.435 11.895 1.00 0.00 H new ATOM 0 HD2 LYS A 37 2.647 -13.739 11.647 1.00 0.00 H new ATOM 0 HD3 LYS A 37 2.434 -12.936 13.190 1.00 0.00 H new ATOM 0 HE2 LYS A 37 1.706 -15.855 12.764 1.00 0.00 H new ATOM 0 HE3 LYS A 37 3.313 -15.352 13.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 1.964 -15.932 15.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 2.358 -14.281 15.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 0.801 -14.769 14.736 1.00 0.00 H new ATOM 515 N ASP A 38 -1.407 -14.188 9.555 1.00 0.00 N ATOM 516 CA ASP A 38 -2.239 -15.370 9.364 1.00 0.00 C ATOM 517 C ASP A 38 -2.132 -15.884 7.932 1.00 0.00 C ATOM 518 O ASP A 38 -1.975 -17.083 7.703 1.00 0.00 O ATOM 519 CB ASP A 38 -3.698 -15.051 9.696 1.00 0.00 C ATOM 520 CG ASP A 38 -3.842 -14.293 11.001 1.00 0.00 C ATOM 521 OD1 ASP A 38 -3.619 -14.902 12.068 1.00 0.00 O ATOM 522 OD2 ASP A 38 -4.180 -13.092 10.955 1.00 0.00 O ATOM 0 H ASP A 38 -1.929 -13.323 9.698 1.00 0.00 H new ATOM 0 HA ASP A 38 -1.882 -16.148 10.038 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -4.131 -14.462 8.887 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -4.266 -15.980 9.754 1.00 0.00 H new ATOM 527 N ALA A 39 -2.218 -14.970 6.971 1.00 0.00 N ATOM 528 CA ALA A 39 -2.129 -15.331 5.562 1.00 0.00 C ATOM 529 C ALA A 39 -0.862 -16.130 5.279 1.00 0.00 C ATOM 530 O ALA A 39 -0.891 -17.123 4.554 1.00 0.00 O ATOM 531 CB ALA A 39 -2.174 -14.083 4.693 1.00 0.00 C ATOM 0 H ALA A 39 -2.349 -13.973 7.143 1.00 0.00 H new ATOM 0 HA ALA A 39 -2.985 -15.960 5.319 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -2.107 -14.368 3.643 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -3.111 -13.553 4.866 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -1.337 -13.433 4.947 1.00 0.00 H new ATOM 537 N GLY A 40 0.252 -15.688 5.855 1.00 0.00 N ATOM 538 CA GLY A 40 1.515 -16.373 5.652 1.00 0.00 C ATOM 539 C GLY A 40 2.085 -16.140 4.267 1.00 0.00 C ATOM 540 O GLY A 40 1.390 -16.314 3.266 1.00 0.00 O ATOM 0 H GLY A 40 0.302 -14.867 6.459 1.00 0.00 H new ATOM 0 HA2 GLY A 40 2.233 -16.034 6.399 1.00 0.00 H new ATOM 0 HA3 GLY A 40 1.374 -17.442 5.808 1.00 0.00 H new ATOM 544 N GLU A 41 3.352 -15.742 4.209 1.00 0.00 N ATOM 545 CA GLU A 41 4.013 -15.482 2.935 1.00 0.00 C ATOM 546 C GLU A 41 3.511 -16.437 1.857 1.00 0.00 C ATOM 547 O GLU A 41 3.434 -17.646 2.070 1.00 0.00 O ATOM 548 CB GLU A 41 5.530 -15.617 3.086 1.00 0.00 C ATOM 549 CG GLU A 41 5.970 -16.968 3.623 1.00 0.00 C ATOM 550 CD GLU A 41 6.001 -17.011 5.139 1.00 0.00 C ATOM 551 OE1 GLU A 41 5.457 -16.080 5.769 1.00 0.00 O ATOM 552 OE2 GLU A 41 6.568 -17.975 5.694 1.00 0.00 O ATOM 0 H GLU A 41 3.941 -15.593 5.028 1.00 0.00 H new ATOM 0 HA GLU A 41 3.774 -14.463 2.632 1.00 0.00 H new ATOM 0 HB2 GLU A 41 5.999 -15.450 2.116 1.00 0.00 H new ATOM 0 HB3 GLU A 41 5.891 -14.835 3.754 1.00 0.00 H new ATOM 0 HG2 GLU A 41 5.293 -17.739 3.255 1.00 0.00 H new ATOM 0 HG3 GLU A 41 6.962 -17.203 3.236 1.00 0.00 H new ATOM 559 N GLY A 42 3.169 -15.884 0.697 1.00 0.00 N ATOM 560 CA GLY A 42 2.677 -16.700 -0.398 1.00 0.00 C ATOM 561 C GLY A 42 2.792 -16.001 -1.739 1.00 0.00 C ATOM 562 O GLY A 42 3.878 -15.579 -2.136 1.00 0.00 O ATOM 0 H GLY A 42 3.224 -14.885 0.496 1.00 0.00 H new ATOM 0 HA2 GLY A 42 3.236 -17.635 -0.430 1.00 0.00 H new ATOM 0 HA3 GLY A 42 1.634 -16.958 -0.215 1.00 0.00 H new ATOM 566 N GLY A 43 1.669 -15.880 -2.440 1.00 0.00 N ATOM 567 CA GLY A 43 1.670 -15.229 -3.737 1.00 0.00 C ATOM 568 C GLY A 43 1.074 -13.837 -3.687 1.00 0.00 C ATOM 569 O GLY A 43 0.302 -13.452 -4.566 1.00 0.00 O ATOM 0 H GLY A 43 0.758 -16.221 -2.133 1.00 0.00 H new ATOM 0 HA2 GLY A 43 2.693 -15.170 -4.110 1.00 0.00 H new ATOM 0 HA3 GLY A 43 1.107 -15.837 -4.446 1.00 0.00 H new ATOM 573 N LEU A 44 1.431 -13.078 -2.656 1.00 0.00 N ATOM 574 CA LEU A 44 0.925 -11.720 -2.494 1.00 0.00 C ATOM 575 C LEU A 44 1.363 -10.833 -3.655 1.00 0.00 C ATOM 576 O LEU A 44 2.431 -11.034 -4.234 1.00 0.00 O ATOM 577 CB LEU A 44 1.413 -11.127 -1.171 1.00 0.00 C ATOM 578 CG LEU A 44 0.765 -9.809 -0.746 1.00 0.00 C ATOM 579 CD1 LEU A 44 -0.577 -10.065 -0.078 1.00 0.00 C ATOM 580 CD2 LEU A 44 1.688 -9.037 0.185 1.00 0.00 C ATOM 0 H LEU A 44 2.069 -13.381 -1.920 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.164 -11.763 -2.486 1.00 0.00 H new ATOM 0 HB2 LEU A 44 1.246 -11.861 -0.383 1.00 0.00 H new ATOM 0 HB3 LEU A 44 2.490 -10.973 -1.240 1.00 0.00 H new ATOM 0 HG LEU A 44 0.594 -9.206 -1.638 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -1.023 -9.116 0.218 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -1.240 -10.575 -0.777 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.431 -10.688 0.805 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.211 -8.102 0.477 1.00 0.00 H new ATOM 0 HD22 LEU A 44 1.891 -9.634 1.074 1.00 0.00 H new ATOM 0 HD23 LEU A 44 2.625 -8.821 -0.328 1.00 0.00 H new ATOM 592 N SER A 45 0.533 -9.850 -3.988 1.00 0.00 N ATOM 593 CA SER A 45 0.834 -8.933 -5.081 1.00 0.00 C ATOM 594 C SER A 45 0.648 -7.484 -4.641 1.00 0.00 C ATOM 595 O SER A 45 -0.370 -7.130 -4.043 1.00 0.00 O ATOM 596 CB SER A 45 -0.060 -9.231 -6.286 1.00 0.00 C ATOM 597 OG SER A 45 0.450 -10.315 -7.043 1.00 0.00 O ATOM 0 H SER A 45 -0.353 -9.668 -3.517 1.00 0.00 H new ATOM 0 HA SER A 45 1.876 -9.077 -5.367 1.00 0.00 H new ATOM 0 HB2 SER A 45 -1.069 -9.464 -5.946 1.00 0.00 H new ATOM 0 HB3 SER A 45 -0.133 -8.345 -6.917 1.00 0.00 H new ATOM 0 HG SER A 45 -0.140 -10.487 -7.806 1.00 0.00 H new ATOM 603 N LEU A 46 1.637 -6.649 -4.941 1.00 0.00 N ATOM 604 CA LEU A 46 1.584 -5.238 -4.577 1.00 0.00 C ATOM 605 C LEU A 46 1.716 -4.352 -5.812 1.00 0.00 C ATOM 606 O LEU A 46 2.629 -4.527 -6.618 1.00 0.00 O ATOM 607 CB LEU A 46 2.692 -4.906 -3.576 1.00 0.00 C ATOM 608 CG LEU A 46 2.471 -5.393 -2.144 1.00 0.00 C ATOM 609 CD1 LEU A 46 3.802 -5.670 -1.462 1.00 0.00 C ATOM 610 CD2 LEU A 46 1.666 -4.373 -1.352 1.00 0.00 C ATOM 0 H LEU A 46 2.485 -6.925 -5.435 1.00 0.00 H new ATOM 0 HA LEU A 46 0.616 -5.044 -4.115 1.00 0.00 H new ATOM 0 HB2 LEU A 46 3.626 -5.332 -3.943 1.00 0.00 H new ATOM 0 HB3 LEU A 46 2.822 -3.824 -3.554 1.00 0.00 H new ATOM 0 HG LEU A 46 1.905 -6.324 -2.181 1.00 0.00 H new ATOM 0 HD11 LEU A 46 3.624 -6.016 -0.444 1.00 0.00 H new ATOM 0 HD12 LEU A 46 4.342 -6.437 -2.016 1.00 0.00 H new ATOM 0 HD13 LEU A 46 4.395 -4.756 -1.436 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.518 -4.736 -0.335 1.00 0.00 H new ATOM 0 HD22 LEU A 46 2.205 -3.426 -1.324 1.00 0.00 H new ATOM 0 HD23 LEU A 46 0.697 -4.225 -1.829 1.00 0.00 H new ATOM 622 N ALA A 47 0.800 -3.399 -5.951 1.00 0.00 N ATOM 623 CA ALA A 47 0.817 -2.483 -7.085 1.00 0.00 C ATOM 624 C ALA A 47 -0.102 -1.291 -6.841 1.00 0.00 C ATOM 625 O ALA A 47 -1.217 -1.446 -6.342 1.00 0.00 O ATOM 626 CB ALA A 47 0.415 -3.212 -8.358 1.00 0.00 C ATOM 0 H ALA A 47 0.037 -3.241 -5.293 1.00 0.00 H new ATOM 0 HA ALA A 47 1.833 -2.106 -7.202 1.00 0.00 H new ATOM 0 HB1 ALA A 47 0.432 -2.516 -9.197 1.00 0.00 H new ATOM 0 HB2 ALA A 47 1.115 -4.026 -8.548 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -0.590 -3.617 -8.243 1.00 0.00 H new ATOM 632 N VAL A 48 0.372 -0.101 -7.196 1.00 0.00 N ATOM 633 CA VAL A 48 -0.409 1.117 -7.017 1.00 0.00 C ATOM 634 C VAL A 48 -0.822 1.708 -8.360 1.00 0.00 C ATOM 635 O VAL A 48 -0.026 1.762 -9.297 1.00 0.00 O ATOM 636 CB VAL A 48 0.380 2.177 -6.224 1.00 0.00 C ATOM 637 CG1 VAL A 48 -0.420 3.467 -6.116 1.00 0.00 C ATOM 638 CG2 VAL A 48 0.743 1.648 -4.845 1.00 0.00 C ATOM 0 H VAL A 48 1.293 0.045 -7.609 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.301 0.841 -6.455 1.00 0.00 H new ATOM 0 HB VAL A 48 1.304 2.394 -6.760 1.00 0.00 H new ATOM 0 HG11 VAL A 48 0.152 4.204 -5.553 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.625 3.853 -7.115 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -1.361 3.270 -5.603 1.00 0.00 H new ATOM 0 HG21 VAL A 48 1.300 2.409 -4.298 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -0.167 1.402 -4.298 1.00 0.00 H new ATOM 0 HG23 VAL A 48 1.357 0.753 -4.949 1.00 0.00 H new ATOM 648 N GLU A 49 -2.073 2.149 -8.446 1.00 0.00 N ATOM 649 CA GLU A 49 -2.593 2.736 -9.676 1.00 0.00 C ATOM 650 C GLU A 49 -3.276 4.071 -9.396 1.00 0.00 C ATOM 651 O GLU A 49 -4.385 4.114 -8.863 1.00 0.00 O ATOM 652 CB GLU A 49 -3.578 1.777 -10.348 1.00 0.00 C ATOM 653 CG GLU A 49 -2.907 0.709 -11.195 1.00 0.00 C ATOM 654 CD GLU A 49 -2.559 1.202 -12.586 1.00 0.00 C ATOM 655 OE1 GLU A 49 -3.339 2.000 -13.146 1.00 0.00 O ATOM 656 OE2 GLU A 49 -1.505 0.789 -13.115 1.00 0.00 O ATOM 0 H GLU A 49 -2.745 2.111 -7.679 1.00 0.00 H new ATOM 0 HA GLU A 49 -1.753 2.912 -10.348 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -4.182 1.293 -9.580 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -4.260 2.351 -10.975 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -1.999 0.371 -10.695 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -3.567 -0.155 -11.274 1.00 0.00 H new ATOM 663 N GLY A 50 -2.606 5.160 -9.758 1.00 0.00 N ATOM 664 CA GLY A 50 -3.163 6.482 -9.537 1.00 0.00 C ATOM 665 C GLY A 50 -2.789 7.459 -10.634 1.00 0.00 C ATOM 666 O GLY A 50 -2.590 7.083 -11.789 1.00 0.00 O ATOM 0 H GLY A 50 -1.687 5.151 -10.201 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -4.249 6.410 -9.474 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -2.813 6.865 -8.579 1.00 0.00 H new ATOM 670 N PRO A 51 -2.691 8.748 -10.275 1.00 0.00 N ATOM 671 CA PRO A 51 -2.339 9.809 -11.224 1.00 0.00 C ATOM 672 C PRO A 51 -0.886 9.723 -11.678 1.00 0.00 C ATOM 673 O PRO A 51 -0.430 10.530 -12.487 1.00 0.00 O ATOM 674 CB PRO A 51 -2.574 11.093 -10.423 1.00 0.00 C ATOM 675 CG PRO A 51 -2.417 10.685 -8.999 1.00 0.00 C ATOM 676 CD PRO A 51 -2.915 9.269 -8.916 1.00 0.00 C ATOM 0 HA PRO A 51 -2.926 9.748 -12.140 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -1.855 11.866 -10.695 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -3.567 11.501 -10.611 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -1.375 10.751 -8.687 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -2.989 11.339 -8.341 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -2.367 8.694 -8.170 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -3.968 9.229 -8.639 1.00 0.00 H new ATOM 684 N SER A 52 -0.164 8.740 -11.151 1.00 0.00 N ATOM 685 CA SER A 52 1.240 8.550 -11.499 1.00 0.00 C ATOM 686 C SER A 52 1.786 7.269 -10.877 1.00 0.00 C ATOM 687 O SER A 52 1.418 6.901 -9.761 1.00 0.00 O ATOM 688 CB SER A 52 2.068 9.750 -11.036 1.00 0.00 C ATOM 689 OG SER A 52 3.240 9.893 -11.820 1.00 0.00 O ATOM 0 H SER A 52 -0.528 8.062 -10.481 1.00 0.00 H new ATOM 0 HA SER A 52 1.312 8.465 -12.583 1.00 0.00 H new ATOM 0 HB2 SER A 52 1.468 10.658 -11.104 1.00 0.00 H new ATOM 0 HB3 SER A 52 2.341 9.625 -9.988 1.00 0.00 H new ATOM 0 HG SER A 52 3.399 10.843 -12.000 1.00 0.00 H new ATOM 695 N LYS A 53 2.667 6.593 -11.606 1.00 0.00 N ATOM 696 CA LYS A 53 3.267 5.354 -11.128 1.00 0.00 C ATOM 697 C LYS A 53 4.313 5.634 -10.053 1.00 0.00 C ATOM 698 O LYS A 53 5.319 6.294 -10.311 1.00 0.00 O ATOM 699 CB LYS A 53 3.907 4.591 -12.290 1.00 0.00 C ATOM 700 CG LYS A 53 4.188 3.131 -11.978 1.00 0.00 C ATOM 701 CD LYS A 53 4.847 2.427 -13.152 1.00 0.00 C ATOM 702 CE LYS A 53 6.295 2.862 -13.322 1.00 0.00 C ATOM 703 NZ LYS A 53 6.928 2.233 -14.514 1.00 0.00 N ATOM 0 H LYS A 53 2.982 6.883 -12.532 1.00 0.00 H new ATOM 0 HA LYS A 53 2.477 4.743 -10.691 1.00 0.00 H new ATOM 0 HB2 LYS A 53 3.249 4.648 -13.157 1.00 0.00 H new ATOM 0 HB3 LYS A 53 4.841 5.081 -12.565 1.00 0.00 H new ATOM 0 HG2 LYS A 53 4.834 3.063 -11.103 1.00 0.00 H new ATOM 0 HG3 LYS A 53 3.256 2.626 -11.726 1.00 0.00 H new ATOM 0 HD2 LYS A 53 4.805 1.348 -13.001 1.00 0.00 H new ATOM 0 HD3 LYS A 53 4.292 2.642 -14.065 1.00 0.00 H new ATOM 0 HE2 LYS A 53 6.339 3.947 -13.418 1.00 0.00 H new ATOM 0 HE3 LYS A 53 6.861 2.597 -12.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 7.914 2.555 -14.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 6.909 1.198 -14.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 6.404 2.506 -15.370 1.00 0.00 H new ATOM 717 N ALA A 54 4.067 5.129 -8.849 1.00 0.00 N ATOM 718 CA ALA A 54 4.989 5.322 -7.737 1.00 0.00 C ATOM 719 C ALA A 54 5.715 4.026 -7.394 1.00 0.00 C ATOM 720 O ALA A 54 5.128 2.946 -7.434 1.00 0.00 O ATOM 721 CB ALA A 54 4.244 5.850 -6.520 1.00 0.00 C ATOM 0 H ALA A 54 3.237 4.583 -8.619 1.00 0.00 H new ATOM 0 HA ALA A 54 5.736 6.056 -8.040 1.00 0.00 H new ATOM 0 HB1 ALA A 54 4.945 5.990 -5.697 1.00 0.00 H new ATOM 0 HB2 ALA A 54 3.777 6.804 -6.765 1.00 0.00 H new ATOM 0 HB3 ALA A 54 3.476 5.135 -6.225 1.00 0.00 H new ATOM 727 N GLU A 55 6.996 4.142 -7.057 1.00 0.00 N ATOM 728 CA GLU A 55 7.802 2.978 -6.708 1.00 0.00 C ATOM 729 C GLU A 55 7.414 2.439 -5.334 1.00 0.00 C ATOM 730 O GLU A 55 7.459 3.161 -4.338 1.00 0.00 O ATOM 731 CB GLU A 55 9.290 3.336 -6.727 1.00 0.00 C ATOM 732 CG GLU A 55 9.862 3.487 -8.126 1.00 0.00 C ATOM 733 CD GLU A 55 11.106 4.353 -8.157 1.00 0.00 C ATOM 734 OE1 GLU A 55 12.141 3.927 -7.603 1.00 0.00 O ATOM 735 OE2 GLU A 55 11.045 5.458 -8.736 1.00 0.00 O ATOM 0 H GLU A 55 7.497 5.029 -7.018 1.00 0.00 H new ATOM 0 HA GLU A 55 7.613 2.202 -7.450 1.00 0.00 H new ATOM 0 HB2 GLU A 55 9.438 4.268 -6.181 1.00 0.00 H new ATOM 0 HB3 GLU A 55 9.848 2.564 -6.197 1.00 0.00 H new ATOM 0 HG2 GLU A 55 10.100 2.501 -8.526 1.00 0.00 H new ATOM 0 HG3 GLU A 55 9.105 3.921 -8.779 1.00 0.00 H new ATOM 742 N ILE A 56 7.033 1.167 -5.290 1.00 0.00 N ATOM 743 CA ILE A 56 6.638 0.531 -4.040 1.00 0.00 C ATOM 744 C ILE A 56 7.742 -0.380 -3.513 1.00 0.00 C ATOM 745 O ILE A 56 8.181 -1.303 -4.199 1.00 0.00 O ATOM 746 CB ILE A 56 5.347 -0.291 -4.210 1.00 0.00 C ATOM 747 CG1 ILE A 56 4.297 0.519 -4.973 1.00 0.00 C ATOM 748 CG2 ILE A 56 4.809 -0.719 -2.852 1.00 0.00 C ATOM 749 CD1 ILE A 56 3.279 -0.337 -5.694 1.00 0.00 C ATOM 0 H ILE A 56 6.990 0.557 -6.106 1.00 0.00 H new ATOM 0 HA ILE A 56 6.458 1.331 -3.322 1.00 0.00 H new ATOM 0 HB ILE A 56 5.578 -1.187 -4.787 1.00 0.00 H new ATOM 0 HG12 ILE A 56 3.778 1.175 -4.274 1.00 0.00 H new ATOM 0 HG13 ILE A 56 4.800 1.159 -5.698 1.00 0.00 H new ATOM 0 HG21 ILE A 56 3.896 -1.299 -2.989 1.00 0.00 H new ATOM 0 HG22 ILE A 56 5.554 -1.329 -2.341 1.00 0.00 H new ATOM 0 HG23 ILE A 56 4.591 0.165 -2.252 1.00 0.00 H new ATOM 0 HD11 ILE A 56 2.566 0.304 -6.213 1.00 0.00 H new ATOM 0 HD12 ILE A 56 3.787 -0.975 -6.417 1.00 0.00 H new ATOM 0 HD13 ILE A 56 2.749 -0.958 -4.972 1.00 0.00 H new ATOM 761 N THR A 57 8.186 -0.115 -2.288 1.00 0.00 N ATOM 762 CA THR A 57 9.238 -0.910 -1.668 1.00 0.00 C ATOM 763 C THR A 57 8.653 -1.957 -0.727 1.00 0.00 C ATOM 764 O THR A 57 7.673 -1.699 -0.028 1.00 0.00 O ATOM 765 CB THR A 57 10.224 -0.024 -0.883 1.00 0.00 C ATOM 766 OG1 THR A 57 11.501 -0.666 -0.802 1.00 0.00 O ATOM 767 CG2 THR A 57 9.701 0.256 0.517 1.00 0.00 C ATOM 0 H THR A 57 7.833 0.644 -1.706 1.00 0.00 H new ATOM 0 HA THR A 57 9.774 -1.409 -2.475 1.00 0.00 H new ATOM 0 HB THR A 57 10.328 0.924 -1.411 1.00 0.00 H new ATOM 0 HG1 THR A 57 12.123 -0.096 -0.303 1.00 0.00 H new ATOM 0 HG21 THR A 57 10.413 0.883 1.053 1.00 0.00 H new ATOM 0 HG22 THR A 57 8.742 0.771 0.451 1.00 0.00 H new ATOM 0 HG23 THR A 57 9.572 -0.685 1.052 1.00 0.00 H new ATOM 775 N CYS A 58 9.260 -3.139 -0.714 1.00 0.00 N ATOM 776 CA CYS A 58 8.799 -4.226 0.142 1.00 0.00 C ATOM 777 C CYS A 58 9.888 -4.642 1.126 1.00 0.00 C ATOM 778 O CYS A 58 11.035 -4.867 0.740 1.00 0.00 O ATOM 779 CB CYS A 58 8.375 -5.426 -0.706 1.00 0.00 C ATOM 780 SG CYS A 58 9.701 -6.118 -1.722 1.00 0.00 S ATOM 0 H CYS A 58 10.072 -3.369 -1.287 1.00 0.00 H new ATOM 0 HA CYS A 58 7.939 -3.870 0.709 1.00 0.00 H new ATOM 0 HB2 CYS A 58 7.992 -6.206 -0.047 1.00 0.00 H new ATOM 0 HB3 CYS A 58 7.553 -5.126 -1.356 1.00 0.00 H new ATOM 0 HG CYS A 58 10.828 -6.034 -1.080 1.00 0.00 H new ATOM 786 N LYS A 59 9.521 -4.742 2.399 1.00 0.00 N ATOM 787 CA LYS A 59 10.465 -5.131 3.440 1.00 0.00 C ATOM 788 C LYS A 59 10.048 -6.448 4.088 1.00 0.00 C ATOM 789 O LYS A 59 8.866 -6.791 4.113 1.00 0.00 O ATOM 790 CB LYS A 59 10.563 -4.035 4.503 1.00 0.00 C ATOM 791 CG LYS A 59 11.823 -4.119 5.348 1.00 0.00 C ATOM 792 CD LYS A 59 12.935 -3.255 4.778 1.00 0.00 C ATOM 793 CE LYS A 59 13.865 -4.062 3.885 1.00 0.00 C ATOM 794 NZ LYS A 59 14.445 -3.231 2.794 1.00 0.00 N ATOM 0 H LYS A 59 8.575 -4.559 2.735 1.00 0.00 H new ATOM 0 HA LYS A 59 11.442 -5.268 2.977 1.00 0.00 H new ATOM 0 HB2 LYS A 59 10.528 -3.062 4.014 1.00 0.00 H new ATOM 0 HB3 LYS A 59 9.693 -4.095 5.156 1.00 0.00 H new ATOM 0 HG2 LYS A 59 11.601 -3.802 6.367 1.00 0.00 H new ATOM 0 HG3 LYS A 59 12.157 -5.155 5.402 1.00 0.00 H new ATOM 0 HD2 LYS A 59 12.503 -2.433 4.207 1.00 0.00 H new ATOM 0 HD3 LYS A 59 13.506 -2.811 5.593 1.00 0.00 H new ATOM 0 HE2 LYS A 59 14.670 -4.485 4.486 1.00 0.00 H new ATOM 0 HE3 LYS A 59 13.317 -4.899 3.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 15.073 -3.817 2.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 13.679 -2.848 2.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 14.989 -2.447 3.207 1.00 0.00 H new ATOM 808 N ASP A 60 11.025 -7.179 4.612 1.00 0.00 N ATOM 809 CA ASP A 60 10.759 -8.456 5.263 1.00 0.00 C ATOM 810 C ASP A 60 10.951 -8.348 6.773 1.00 0.00 C ATOM 811 O ASP A 60 12.074 -8.211 7.257 1.00 0.00 O ATOM 812 CB ASP A 60 11.676 -9.542 4.697 1.00 0.00 C ATOM 813 CG ASP A 60 13.047 -9.010 4.331 1.00 0.00 C ATOM 814 OD1 ASP A 60 13.875 -8.825 5.248 1.00 0.00 O ATOM 815 OD2 ASP A 60 13.292 -8.777 3.129 1.00 0.00 O ATOM 0 H ASP A 60 12.009 -6.909 4.599 1.00 0.00 H new ATOM 0 HA ASP A 60 9.722 -8.727 5.065 1.00 0.00 H new ATOM 0 HB2 ASP A 60 11.784 -10.341 5.431 1.00 0.00 H new ATOM 0 HB3 ASP A 60 11.212 -9.981 3.814 1.00 0.00 H new ATOM 820 N ASN A 61 9.848 -8.408 7.511 1.00 0.00 N ATOM 821 CA ASN A 61 9.895 -8.314 8.965 1.00 0.00 C ATOM 822 C ASN A 61 10.189 -9.676 9.589 1.00 0.00 C ATOM 823 O ASN A 61 10.878 -9.770 10.604 1.00 0.00 O ATOM 824 CB ASN A 61 8.571 -7.769 9.505 1.00 0.00 C ATOM 825 CG ASN A 61 8.254 -6.386 8.969 1.00 0.00 C ATOM 826 OD1 ASN A 61 8.958 -5.419 9.261 1.00 0.00 O ATOM 827 ND2 ASN A 61 7.190 -6.287 8.182 1.00 0.00 N ATOM 0 H ASN A 61 8.910 -8.521 7.126 1.00 0.00 H new ATOM 0 HA ASN A 61 10.699 -7.629 9.234 1.00 0.00 H new ATOM 0 HB2 ASN A 61 7.764 -8.452 9.239 1.00 0.00 H new ATOM 0 HB3 ASN A 61 8.613 -7.733 10.594 1.00 0.00 H new ATOM 0 HD21 ASN A 61 6.927 -5.382 7.792 1.00 0.00 H new ATOM 0 HD22 ASN A 61 6.636 -7.116 7.967 1.00 0.00 H new ATOM 834 N LYS A 62 9.662 -10.728 8.973 1.00 0.00 N ATOM 835 CA LYS A 62 9.868 -12.085 9.465 1.00 0.00 C ATOM 836 C LYS A 62 9.238 -12.267 10.842 1.00 0.00 C ATOM 837 O LYS A 62 9.747 -13.019 11.674 1.00 0.00 O ATOM 838 CB LYS A 62 11.363 -12.405 9.530 1.00 0.00 C ATOM 839 CG LYS A 62 11.902 -13.055 8.267 1.00 0.00 C ATOM 840 CD LYS A 62 12.174 -12.027 7.182 1.00 0.00 C ATOM 841 CE LYS A 62 12.977 -12.624 6.037 1.00 0.00 C ATOM 842 NZ LYS A 62 14.410 -12.803 6.399 1.00 0.00 N ATOM 0 H LYS A 62 9.089 -10.667 8.132 1.00 0.00 H new ATOM 0 HA LYS A 62 9.385 -12.773 8.771 1.00 0.00 H new ATOM 0 HB2 LYS A 62 11.915 -11.484 9.719 1.00 0.00 H new ATOM 0 HB3 LYS A 62 11.548 -13.067 10.376 1.00 0.00 H new ATOM 0 HG2 LYS A 62 12.821 -13.593 8.498 1.00 0.00 H new ATOM 0 HG3 LYS A 62 11.185 -13.790 7.901 1.00 0.00 H new ATOM 0 HD2 LYS A 62 11.229 -11.639 6.802 1.00 0.00 H new ATOM 0 HD3 LYS A 62 12.717 -11.183 7.607 1.00 0.00 H new ATOM 0 HE2 LYS A 62 12.550 -13.587 5.757 1.00 0.00 H new ATOM 0 HE3 LYS A 62 12.901 -11.976 5.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 14.943 -13.116 5.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 14.798 -11.900 6.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 14.492 -13.519 7.149 1.00 0.00 H new ATOM 856 N ASP A 63 8.129 -11.574 11.077 1.00 0.00 N ATOM 857 CA ASP A 63 7.429 -11.661 12.353 1.00 0.00 C ATOM 858 C ASP A 63 5.942 -11.930 12.140 1.00 0.00 C ATOM 859 O ASP A 63 5.350 -12.769 12.816 1.00 0.00 O ATOM 860 CB ASP A 63 7.617 -10.370 13.151 1.00 0.00 C ATOM 861 CG ASP A 63 8.943 -10.331 13.885 1.00 0.00 C ATOM 862 OD1 ASP A 63 9.212 -11.263 14.672 1.00 0.00 O ATOM 863 OD2 ASP A 63 9.710 -9.369 13.675 1.00 0.00 O ATOM 0 H ASP A 63 7.696 -10.946 10.400 1.00 0.00 H new ATOM 0 HA ASP A 63 7.853 -12.492 12.916 1.00 0.00 H new ATOM 0 HB2 ASP A 63 7.553 -9.517 12.476 1.00 0.00 H new ATOM 0 HB3 ASP A 63 6.804 -10.269 13.870 1.00 0.00 H new ATOM 868 N GLY A 64 5.345 -11.209 11.195 1.00 0.00 N ATOM 869 CA GLY A 64 3.933 -11.384 10.911 1.00 0.00 C ATOM 870 C GLY A 64 3.320 -10.166 10.248 1.00 0.00 C ATOM 871 O GLY A 64 2.145 -9.861 10.456 1.00 0.00 O ATOM 0 H GLY A 64 5.814 -10.508 10.622 1.00 0.00 H new ATOM 0 HA2 GLY A 64 3.800 -12.251 10.264 1.00 0.00 H new ATOM 0 HA3 GLY A 64 3.402 -11.594 11.839 1.00 0.00 H new ATOM 875 N THR A 65 4.118 -9.466 9.447 1.00 0.00 N ATOM 876 CA THR A 65 3.648 -8.273 8.754 1.00 0.00 C ATOM 877 C THR A 65 4.541 -7.941 7.564 1.00 0.00 C ATOM 878 O THR A 65 5.462 -8.692 7.238 1.00 0.00 O ATOM 879 CB THR A 65 3.598 -7.057 9.698 1.00 0.00 C ATOM 880 OG1 THR A 65 4.906 -6.781 10.211 1.00 0.00 O ATOM 881 CG2 THR A 65 2.638 -7.307 10.851 1.00 0.00 C ATOM 0 H THR A 65 5.092 -9.705 9.262 1.00 0.00 H new ATOM 0 HA THR A 65 2.640 -8.490 8.400 1.00 0.00 H new ATOM 0 HB THR A 65 3.243 -6.198 9.130 1.00 0.00 H new ATOM 0 HG1 THR A 65 4.866 -6.006 10.809 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.619 -6.435 11.504 1.00 0.00 H new ATOM 0 HG22 THR A 65 1.637 -7.488 10.459 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.969 -8.178 11.417 1.00 0.00 H new ATOM 889 N CYS A 66 4.265 -6.813 6.919 1.00 0.00 N ATOM 890 CA CYS A 66 5.045 -6.382 5.764 1.00 0.00 C ATOM 891 C CYS A 66 5.063 -4.860 5.658 1.00 0.00 C ATOM 892 O CYS A 66 4.020 -4.225 5.502 1.00 0.00 O ATOM 893 CB CYS A 66 4.473 -6.988 4.482 1.00 0.00 C ATOM 894 SG CYS A 66 5.070 -8.657 4.124 1.00 0.00 S ATOM 0 H CYS A 66 3.507 -6.180 7.176 1.00 0.00 H new ATOM 0 HA CYS A 66 6.069 -6.731 5.897 1.00 0.00 H new ATOM 0 HB2 CYS A 66 3.386 -7.011 4.557 1.00 0.00 H new ATOM 0 HB3 CYS A 66 4.721 -6.337 3.643 1.00 0.00 H new ATOM 0 HG CYS A 66 5.429 -9.236 5.231 1.00 0.00 H new ATOM 900 N THR A 67 6.256 -4.280 5.744 1.00 0.00 N ATOM 901 CA THR A 67 6.411 -2.834 5.661 1.00 0.00 C ATOM 902 C THR A 67 6.589 -2.382 4.215 1.00 0.00 C ATOM 903 O THR A 67 7.572 -2.731 3.562 1.00 0.00 O ATOM 904 CB THR A 67 7.614 -2.348 6.490 1.00 0.00 C ATOM 905 OG1 THR A 67 7.423 -2.678 7.870 1.00 0.00 O ATOM 906 CG2 THR A 67 7.802 -0.846 6.343 1.00 0.00 C ATOM 0 H THR A 67 7.130 -4.791 5.871 1.00 0.00 H new ATOM 0 HA THR A 67 5.499 -2.396 6.067 1.00 0.00 H new ATOM 0 HB THR A 67 8.509 -2.847 6.118 1.00 0.00 H new ATOM 0 HG1 THR A 67 8.193 -2.367 8.390 1.00 0.00 H new ATOM 0 HG21 THR A 67 8.658 -0.526 6.938 1.00 0.00 H new ATOM 0 HG22 THR A 67 7.977 -0.602 5.295 1.00 0.00 H new ATOM 0 HG23 THR A 67 6.906 -0.331 6.691 1.00 0.00 H new ATOM 914 N VAL A 68 5.631 -1.603 3.721 1.00 0.00 N ATOM 915 CA VAL A 68 5.684 -1.102 2.353 1.00 0.00 C ATOM 916 C VAL A 68 5.590 0.419 2.321 1.00 0.00 C ATOM 917 O VAL A 68 4.939 1.029 3.169 1.00 0.00 O ATOM 918 CB VAL A 68 4.549 -1.693 1.495 1.00 0.00 C ATOM 919 CG1 VAL A 68 4.646 -1.193 0.062 1.00 0.00 C ATOM 920 CG2 VAL A 68 4.583 -3.213 1.541 1.00 0.00 C ATOM 0 H VAL A 68 4.810 -1.306 4.248 1.00 0.00 H new ATOM 0 HA VAL A 68 6.643 -1.413 1.939 1.00 0.00 H new ATOM 0 HB VAL A 68 3.596 -1.361 1.906 1.00 0.00 H new ATOM 0 HG11 VAL A 68 3.836 -1.621 -0.528 1.00 0.00 H new ATOM 0 HG12 VAL A 68 4.568 -0.106 0.050 1.00 0.00 H new ATOM 0 HG13 VAL A 68 5.603 -1.493 -0.364 1.00 0.00 H new ATOM 0 HG21 VAL A 68 3.774 -3.614 0.930 1.00 0.00 H new ATOM 0 HG22 VAL A 68 5.539 -3.567 1.156 1.00 0.00 H new ATOM 0 HG23 VAL A 68 4.460 -3.549 2.571 1.00 0.00 H new ATOM 930 N SER A 69 6.246 1.026 1.337 1.00 0.00 N ATOM 931 CA SER A 69 6.240 2.477 1.196 1.00 0.00 C ATOM 932 C SER A 69 6.234 2.880 -0.276 1.00 0.00 C ATOM 933 O SER A 69 7.030 2.380 -1.071 1.00 0.00 O ATOM 934 CB SER A 69 7.457 3.084 1.897 1.00 0.00 C ATOM 935 OG SER A 69 7.663 2.490 3.167 1.00 0.00 O ATOM 0 H SER A 69 6.788 0.535 0.626 1.00 0.00 H new ATOM 0 HA SER A 69 5.332 2.859 1.663 1.00 0.00 H new ATOM 0 HB2 SER A 69 8.344 2.945 1.279 1.00 0.00 H new ATOM 0 HB3 SER A 69 7.315 4.158 2.013 1.00 0.00 H new ATOM 0 HG SER A 69 8.447 2.894 3.594 1.00 0.00 H new ATOM 941 N TYR A 70 5.330 3.786 -0.630 1.00 0.00 N ATOM 942 CA TYR A 70 5.217 4.255 -2.006 1.00 0.00 C ATOM 943 C TYR A 70 5.378 5.771 -2.080 1.00 0.00 C ATOM 944 O TYR A 70 4.822 6.506 -1.263 1.00 0.00 O ATOM 945 CB TYR A 70 3.868 3.844 -2.598 1.00 0.00 C ATOM 946 CG TYR A 70 2.723 4.735 -2.171 1.00 0.00 C ATOM 947 CD1 TYR A 70 2.623 6.041 -2.633 1.00 0.00 C ATOM 948 CD2 TYR A 70 1.742 4.270 -1.304 1.00 0.00 C ATOM 949 CE1 TYR A 70 1.579 6.858 -2.245 1.00 0.00 C ATOM 950 CE2 TYR A 70 0.694 5.079 -0.911 1.00 0.00 C ATOM 951 CZ TYR A 70 0.617 6.373 -1.384 1.00 0.00 C ATOM 952 OH TYR A 70 -0.425 7.183 -0.994 1.00 0.00 O ATOM 0 H TYR A 70 4.665 4.210 0.016 1.00 0.00 H new ATOM 0 HA TYR A 70 6.016 3.794 -2.587 1.00 0.00 H new ATOM 0 HB2 TYR A 70 3.940 3.855 -3.686 1.00 0.00 H new ATOM 0 HB3 TYR A 70 3.649 2.818 -2.303 1.00 0.00 H new ATOM 0 HD1 TYR A 70 3.375 6.424 -3.307 1.00 0.00 H new ATOM 0 HD2 TYR A 70 1.800 3.258 -0.931 1.00 0.00 H new ATOM 0 HE1 TYR A 70 1.516 7.871 -2.614 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -0.061 4.701 -0.237 1.00 0.00 H new ATOM 0 HH TYR A 70 -0.413 7.285 -0.019 1.00 0.00 H new ATOM 962 N LEU A 71 6.141 6.231 -3.066 1.00 0.00 N ATOM 963 CA LEU A 71 6.375 7.659 -3.249 1.00 0.00 C ATOM 964 C LEU A 71 5.636 8.178 -4.478 1.00 0.00 C ATOM 965 O LEU A 71 6.062 7.983 -5.617 1.00 0.00 O ATOM 966 CB LEU A 71 7.873 7.936 -3.385 1.00 0.00 C ATOM 967 CG LEU A 71 8.256 9.341 -3.853 1.00 0.00 C ATOM 968 CD1 LEU A 71 8.310 10.300 -2.674 1.00 0.00 C ATOM 969 CD2 LEU A 71 9.590 9.315 -4.584 1.00 0.00 C ATOM 0 H LEU A 71 6.608 5.636 -3.750 1.00 0.00 H new ATOM 0 HA LEU A 71 5.994 8.181 -2.371 1.00 0.00 H new ATOM 0 HB2 LEU A 71 8.345 7.755 -2.419 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.294 7.214 -4.085 1.00 0.00 H new ATOM 0 HG LEU A 71 7.492 9.693 -4.546 1.00 0.00 H new ATOM 0 HD11 LEU A 71 8.584 11.294 -3.026 1.00 0.00 H new ATOM 0 HD12 LEU A 71 7.332 10.342 -2.194 1.00 0.00 H new ATOM 0 HD13 LEU A 71 9.052 9.952 -1.956 1.00 0.00 H new ATOM 0 HD21 LEU A 71 9.846 10.323 -4.910 1.00 0.00 H new ATOM 0 HD22 LEU A 71 10.365 8.942 -3.914 1.00 0.00 H new ATOM 0 HD23 LEU A 71 9.516 8.661 -5.453 1.00 0.00 H new ATOM 981 N PRO A 72 4.504 8.859 -4.245 1.00 0.00 N ATOM 982 CA PRO A 72 3.684 9.423 -5.321 1.00 0.00 C ATOM 983 C PRO A 72 4.364 10.600 -6.012 1.00 0.00 C ATOM 984 O PRO A 72 5.225 11.262 -5.431 1.00 0.00 O ATOM 985 CB PRO A 72 2.419 9.888 -4.596 1.00 0.00 C ATOM 986 CG PRO A 72 2.855 10.135 -3.193 1.00 0.00 C ATOM 987 CD PRO A 72 3.938 9.130 -2.913 1.00 0.00 C ATOM 0 HA PRO A 72 3.496 8.698 -6.113 1.00 0.00 H new ATOM 0 HB2 PRO A 72 2.013 10.792 -5.049 1.00 0.00 H new ATOM 0 HB3 PRO A 72 1.637 9.130 -4.640 1.00 0.00 H new ATOM 0 HG2 PRO A 72 3.227 11.153 -3.073 1.00 0.00 H new ATOM 0 HG3 PRO A 72 2.023 10.016 -2.499 1.00 0.00 H new ATOM 0 HD2 PRO A 72 4.689 9.528 -2.231 1.00 0.00 H new ATOM 0 HD3 PRO A 72 3.538 8.226 -2.455 1.00 0.00 H new ATOM 995 N THR A 73 3.973 10.856 -7.257 1.00 0.00 N ATOM 996 CA THR A 73 4.546 11.953 -8.027 1.00 0.00 C ATOM 997 C THR A 73 3.520 13.056 -8.259 1.00 0.00 C ATOM 998 O THR A 73 3.878 14.207 -8.508 1.00 0.00 O ATOM 999 CB THR A 73 5.075 11.466 -9.389 1.00 0.00 C ATOM 1000 OG1 THR A 73 5.905 10.313 -9.208 1.00 0.00 O ATOM 1001 CG2 THR A 73 5.868 12.562 -10.085 1.00 0.00 C ATOM 0 H THR A 73 3.262 10.319 -7.753 1.00 0.00 H new ATOM 0 HA THR A 73 5.377 12.350 -7.443 1.00 0.00 H new ATOM 0 HB THR A 73 4.220 11.205 -10.013 1.00 0.00 H new ATOM 0 HG1 THR A 73 6.236 10.008 -10.079 1.00 0.00 H new ATOM 0 HG21 THR A 73 6.231 12.195 -11.045 1.00 0.00 H new ATOM 0 HG22 THR A 73 5.226 13.428 -10.247 1.00 0.00 H new ATOM 0 HG23 THR A 73 6.715 12.850 -9.462 1.00 0.00 H new ATOM 1009 N ALA A 74 2.243 12.698 -8.175 1.00 0.00 N ATOM 1010 CA ALA A 74 1.165 13.659 -8.373 1.00 0.00 C ATOM 1011 C ALA A 74 0.041 13.438 -7.367 1.00 0.00 C ATOM 1012 O ALA A 74 -0.242 12.314 -6.952 1.00 0.00 O ATOM 1013 CB ALA A 74 0.630 13.566 -9.794 1.00 0.00 C ATOM 0 H ALA A 74 1.930 11.749 -7.971 1.00 0.00 H new ATOM 0 HA ALA A 74 1.569 14.659 -8.213 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -0.175 14.289 -9.928 1.00 0.00 H new ATOM 0 HB2 ALA A 74 1.432 13.781 -10.500 1.00 0.00 H new ATOM 0 HB3 ALA A 74 0.248 12.561 -9.974 1.00 0.00 H new ATOM 1019 N PRO A 75 -0.617 14.535 -6.963 1.00 0.00 N ATOM 1020 CA PRO A 75 -1.721 14.486 -6.000 1.00 0.00 C ATOM 1021 C PRO A 75 -2.969 13.833 -6.582 1.00 0.00 C ATOM 1022 O PRO A 75 -3.328 14.074 -7.734 1.00 0.00 O ATOM 1023 CB PRO A 75 -1.985 15.962 -5.688 1.00 0.00 C ATOM 1024 CG PRO A 75 -1.502 16.695 -6.892 1.00 0.00 C ATOM 1025 CD PRO A 75 -0.333 15.907 -7.416 1.00 0.00 C ATOM 0 HA PRO A 75 -1.471 13.889 -5.123 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -3.045 16.146 -5.511 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -1.452 16.279 -4.791 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -2.288 16.773 -7.643 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -1.204 17.712 -6.636 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -0.263 15.965 -8.502 1.00 0.00 H new ATOM 0 HD3 PRO A 75 0.612 16.275 -7.016 1.00 0.00 H new ATOM 1033 N GLY A 76 -3.629 13.005 -5.777 1.00 0.00 N ATOM 1034 CA GLY A 76 -4.831 12.330 -6.230 1.00 0.00 C ATOM 1035 C GLY A 76 -5.139 11.088 -5.418 1.00 0.00 C ATOM 1036 O GLY A 76 -4.544 10.863 -4.365 1.00 0.00 O ATOM 0 H GLY A 76 -3.352 12.790 -4.819 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -5.675 13.018 -6.171 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -4.717 12.056 -7.279 1.00 0.00 H new ATOM 1040 N ASP A 77 -6.073 10.280 -5.908 1.00 0.00 N ATOM 1041 CA ASP A 77 -6.461 9.054 -5.220 1.00 0.00 C ATOM 1042 C ASP A 77 -5.691 7.856 -5.769 1.00 0.00 C ATOM 1043 O ASP A 77 -5.916 7.426 -6.900 1.00 0.00 O ATOM 1044 CB ASP A 77 -7.965 8.817 -5.363 1.00 0.00 C ATOM 1045 CG ASP A 77 -8.774 10.079 -5.138 1.00 0.00 C ATOM 1046 OD1 ASP A 77 -8.496 10.794 -4.152 1.00 0.00 O ATOM 1047 OD2 ASP A 77 -9.684 10.353 -5.948 1.00 0.00 O ATOM 0 H ASP A 77 -6.575 10.452 -6.779 1.00 0.00 H new ATOM 0 HA ASP A 77 -6.218 9.167 -4.164 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -8.175 8.427 -6.359 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -8.279 8.055 -4.649 1.00 0.00 H new ATOM 1052 N TYR A 78 -4.781 7.324 -4.960 1.00 0.00 N ATOM 1053 CA TYR A 78 -3.975 6.179 -5.365 1.00 0.00 C ATOM 1054 C TYR A 78 -4.671 4.869 -5.008 1.00 0.00 C ATOM 1055 O TYR A 78 -5.199 4.714 -3.907 1.00 0.00 O ATOM 1056 CB TYR A 78 -2.599 6.236 -4.700 1.00 0.00 C ATOM 1057 CG TYR A 78 -1.672 7.262 -5.313 1.00 0.00 C ATOM 1058 CD1 TYR A 78 -1.786 8.609 -4.994 1.00 0.00 C ATOM 1059 CD2 TYR A 78 -0.681 6.883 -6.210 1.00 0.00 C ATOM 1060 CE1 TYR A 78 -0.942 9.549 -5.552 1.00 0.00 C ATOM 1061 CE2 TYR A 78 0.169 7.816 -6.772 1.00 0.00 C ATOM 1062 CZ TYR A 78 0.034 9.148 -6.440 1.00 0.00 C ATOM 1063 OH TYR A 78 0.878 10.081 -6.998 1.00 0.00 O ATOM 0 H TYR A 78 -4.583 7.668 -4.020 1.00 0.00 H new ATOM 0 HA TYR A 78 -3.850 6.220 -6.447 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -2.726 6.460 -3.641 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -2.133 5.253 -4.764 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -2.548 8.927 -4.298 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -0.573 5.841 -6.473 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -1.046 10.593 -5.294 1.00 0.00 H new ATOM 0 HE2 TYR A 78 0.935 7.504 -7.467 1.00 0.00 H new ATOM 0 HH TYR A 78 0.650 10.972 -6.660 1.00 0.00 H new ATOM 1073 N SER A 79 -4.666 3.929 -5.948 1.00 0.00 N ATOM 1074 CA SER A 79 -5.299 2.633 -5.735 1.00 0.00 C ATOM 1075 C SER A 79 -4.256 1.562 -5.429 1.00 0.00 C ATOM 1076 O SER A 79 -3.481 1.168 -6.301 1.00 0.00 O ATOM 1077 CB SER A 79 -6.113 2.230 -6.967 1.00 0.00 C ATOM 1078 OG SER A 79 -7.225 3.089 -7.146 1.00 0.00 O ATOM 0 H SER A 79 -4.231 4.041 -6.864 1.00 0.00 H new ATOM 0 HA SER A 79 -5.968 2.720 -4.879 1.00 0.00 H new ATOM 0 HB2 SER A 79 -5.478 2.262 -7.853 1.00 0.00 H new ATOM 0 HB3 SER A 79 -6.458 1.202 -6.859 1.00 0.00 H new ATOM 0 HG SER A 79 -7.728 2.812 -7.940 1.00 0.00 H new ATOM 1084 N ILE A 80 -4.243 1.097 -4.184 1.00 0.00 N ATOM 1085 CA ILE A 80 -3.296 0.072 -3.762 1.00 0.00 C ATOM 1086 C ILE A 80 -3.907 -1.321 -3.877 1.00 0.00 C ATOM 1087 O ILE A 80 -4.651 -1.757 -2.999 1.00 0.00 O ATOM 1088 CB ILE A 80 -2.831 0.298 -2.312 1.00 0.00 C ATOM 1089 CG1 ILE A 80 -2.146 1.660 -2.180 1.00 0.00 C ATOM 1090 CG2 ILE A 80 -1.892 -0.817 -1.877 1.00 0.00 C ATOM 1091 CD1 ILE A 80 -2.282 2.274 -0.804 1.00 0.00 C ATOM 0 H ILE A 80 -4.877 1.414 -3.450 1.00 0.00 H new ATOM 0 HA ILE A 80 -2.435 0.145 -4.426 1.00 0.00 H new ATOM 0 HB ILE A 80 -3.704 0.286 -1.660 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -1.088 1.550 -2.417 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -2.568 2.343 -2.917 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -1.572 -0.643 -0.850 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -2.410 -1.774 -1.938 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -1.020 -0.834 -2.531 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -1.773 3.238 -0.784 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -3.337 2.416 -0.572 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -1.834 1.611 -0.064 1.00 0.00 H new ATOM 1103 N ILE A 81 -3.586 -2.014 -4.964 1.00 0.00 N ATOM 1104 CA ILE A 81 -4.100 -3.358 -5.192 1.00 0.00 C ATOM 1105 C ILE A 81 -3.269 -4.398 -4.448 1.00 0.00 C ATOM 1106 O ILE A 81 -2.057 -4.492 -4.639 1.00 0.00 O ATOM 1107 CB ILE A 81 -4.117 -3.708 -6.692 1.00 0.00 C ATOM 1108 CG1 ILE A 81 -4.996 -2.718 -7.459 1.00 0.00 C ATOM 1109 CG2 ILE A 81 -4.610 -5.132 -6.898 1.00 0.00 C ATOM 1110 CD1 ILE A 81 -4.605 -2.563 -8.912 1.00 0.00 C ATOM 0 H ILE A 81 -2.972 -1.667 -5.701 1.00 0.00 H new ATOM 0 HA ILE A 81 -5.122 -3.373 -4.812 1.00 0.00 H new ATOM 0 HB ILE A 81 -3.100 -3.637 -7.078 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -6.034 -3.047 -7.403 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -4.944 -1.745 -6.971 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -4.616 -5.364 -7.963 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -3.948 -5.825 -6.379 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.620 -5.229 -6.500 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -5.270 -1.846 -9.393 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -3.578 -2.204 -8.976 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -4.685 -3.527 -9.415 1.00 0.00 H new ATOM 1122 N VAL A 82 -3.931 -5.180 -3.601 1.00 0.00 N ATOM 1123 CA VAL A 82 -3.254 -6.216 -2.830 1.00 0.00 C ATOM 1124 C VAL A 82 -3.986 -7.549 -2.939 1.00 0.00 C ATOM 1125 O VAL A 82 -4.996 -7.771 -2.271 1.00 0.00 O ATOM 1126 CB VAL A 82 -3.140 -5.826 -1.344 1.00 0.00 C ATOM 1127 CG1 VAL A 82 -2.478 -6.941 -0.548 1.00 0.00 C ATOM 1128 CG2 VAL A 82 -2.370 -4.523 -1.193 1.00 0.00 C ATOM 0 H VAL A 82 -4.935 -5.116 -3.431 1.00 0.00 H new ATOM 0 HA VAL A 82 -2.253 -6.319 -3.249 1.00 0.00 H new ATOM 0 HB VAL A 82 -4.144 -5.676 -0.948 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -2.406 -6.647 0.499 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -3.074 -7.850 -0.630 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -1.479 -7.126 -0.942 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -2.299 -4.263 -0.137 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -1.368 -4.643 -1.605 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -2.890 -3.729 -1.728 1.00 0.00 H new ATOM 1138 N ARG A 83 -3.470 -8.433 -3.786 1.00 0.00 N ATOM 1139 CA ARG A 83 -4.075 -9.745 -3.984 1.00 0.00 C ATOM 1140 C ARG A 83 -3.200 -10.843 -3.387 1.00 0.00 C ATOM 1141 O ARG A 83 -1.995 -10.664 -3.211 1.00 0.00 O ATOM 1142 CB ARG A 83 -4.296 -10.008 -5.475 1.00 0.00 C ATOM 1143 CG ARG A 83 -5.155 -8.957 -6.159 1.00 0.00 C ATOM 1144 CD ARG A 83 -5.404 -9.304 -7.618 1.00 0.00 C ATOM 1145 NE ARG A 83 -5.579 -8.111 -8.442 1.00 0.00 N ATOM 1146 CZ ARG A 83 -5.779 -8.147 -9.755 1.00 0.00 C ATOM 1147 NH1 ARG A 83 -5.828 -9.310 -10.389 1.00 0.00 N ATOM 1148 NH2 ARG A 83 -5.930 -7.018 -10.435 1.00 0.00 N ATOM 0 H ARG A 83 -2.634 -8.265 -4.346 1.00 0.00 H new ATOM 0 HA ARG A 83 -5.038 -9.754 -3.473 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -3.328 -10.055 -5.974 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -4.765 -10.984 -5.597 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -6.108 -8.869 -5.637 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -4.664 -7.986 -6.094 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -4.567 -9.889 -8.000 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -6.292 -9.931 -7.695 1.00 0.00 H new ATOM 0 HE ARG A 83 -5.546 -7.200 -7.984 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -5.712 -10.180 -9.869 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -5.982 -9.335 -11.397 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -5.893 -6.122 -9.950 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -6.083 -7.046 -11.443 1.00 0.00 H new ATOM 1162 N PHE A 84 -3.815 -11.979 -3.077 1.00 0.00 N ATOM 1163 CA PHE A 84 -3.093 -13.106 -2.498 1.00 0.00 C ATOM 1164 C PHE A 84 -3.490 -14.414 -3.176 1.00 0.00 C ATOM 1165 O PHE A 84 -4.519 -15.007 -2.851 1.00 0.00 O ATOM 1166 CB PHE A 84 -3.365 -13.195 -0.995 1.00 0.00 C ATOM 1167 CG PHE A 84 -2.490 -14.189 -0.285 1.00 0.00 C ATOM 1168 CD1 PHE A 84 -1.226 -13.829 0.154 1.00 0.00 C ATOM 1169 CD2 PHE A 84 -2.931 -15.482 -0.057 1.00 0.00 C ATOM 1170 CE1 PHE A 84 -0.418 -14.741 0.807 1.00 0.00 C ATOM 1171 CE2 PHE A 84 -2.128 -16.398 0.597 1.00 0.00 C ATOM 1172 CZ PHE A 84 -0.870 -16.027 1.028 1.00 0.00 C ATOM 0 H PHE A 84 -4.812 -12.144 -3.217 1.00 0.00 H new ATOM 0 HA PHE A 84 -2.027 -12.943 -2.659 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -3.220 -12.211 -0.549 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -4.409 -13.465 -0.838 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -0.868 -12.824 -0.016 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -3.913 -15.778 -0.394 1.00 0.00 H new ATOM 0 HE1 PHE A 84 0.565 -14.448 1.144 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -2.484 -17.403 0.771 1.00 0.00 H new ATOM 0 HZ PHE A 84 -0.240 -16.742 1.537 1.00 0.00 H new ATOM 1182 N ASP A 85 -2.669 -14.856 -4.122 1.00 0.00 N ATOM 1183 CA ASP A 85 -2.933 -16.093 -4.847 1.00 0.00 C ATOM 1184 C ASP A 85 -4.185 -15.961 -5.709 1.00 0.00 C ATOM 1185 O ASP A 85 -5.053 -16.834 -5.698 1.00 0.00 O ATOM 1186 CB ASP A 85 -3.092 -17.258 -3.870 1.00 0.00 C ATOM 1187 CG ASP A 85 -2.802 -18.599 -4.515 1.00 0.00 C ATOM 1188 OD1 ASP A 85 -2.961 -18.710 -5.748 1.00 0.00 O ATOM 1189 OD2 ASP A 85 -2.416 -19.537 -3.786 1.00 0.00 O ATOM 0 H ASP A 85 -1.815 -14.376 -4.405 1.00 0.00 H new ATOM 0 HA ASP A 85 -2.083 -16.291 -5.500 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -2.421 -17.113 -3.024 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -4.108 -17.261 -3.475 1.00 0.00 H new ATOM 1194 N ASP A 86 -4.272 -14.864 -6.453 1.00 0.00 N ATOM 1195 CA ASP A 86 -5.417 -14.617 -7.321 1.00 0.00 C ATOM 1196 C ASP A 86 -6.684 -14.399 -6.499 1.00 0.00 C ATOM 1197 O ASP A 86 -7.742 -14.946 -6.811 1.00 0.00 O ATOM 1198 CB ASP A 86 -5.616 -15.788 -8.285 1.00 0.00 C ATOM 1199 CG ASP A 86 -4.358 -16.112 -9.068 1.00 0.00 C ATOM 1200 OD1 ASP A 86 -3.499 -16.844 -8.533 1.00 0.00 O ATOM 1201 OD2 ASP A 86 -4.233 -15.633 -10.215 1.00 0.00 O ATOM 0 H ASP A 86 -3.563 -14.131 -6.472 1.00 0.00 H new ATOM 0 HA ASP A 86 -5.217 -13.713 -7.896 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -5.928 -16.668 -7.723 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -6.422 -15.551 -8.979 1.00 0.00 H new ATOM 1206 N LYS A 87 -6.569 -13.596 -5.446 1.00 0.00 N ATOM 1207 CA LYS A 87 -7.704 -13.304 -4.579 1.00 0.00 C ATOM 1208 C LYS A 87 -7.597 -11.898 -3.997 1.00 0.00 C ATOM 1209 O LYS A 87 -6.578 -11.534 -3.410 1.00 0.00 O ATOM 1210 CB LYS A 87 -7.784 -14.331 -3.447 1.00 0.00 C ATOM 1211 CG LYS A 87 -7.018 -13.923 -2.200 1.00 0.00 C ATOM 1212 CD LYS A 87 -6.755 -15.113 -1.293 1.00 0.00 C ATOM 1213 CE LYS A 87 -7.883 -15.311 -0.292 1.00 0.00 C ATOM 1214 NZ LYS A 87 -9.107 -15.863 -0.937 1.00 0.00 N ATOM 0 H LYS A 87 -5.701 -13.136 -5.173 1.00 0.00 H new ATOM 0 HA LYS A 87 -8.612 -13.361 -5.179 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -8.830 -14.490 -3.185 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -7.397 -15.285 -3.805 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -6.071 -13.467 -2.487 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -7.584 -13.167 -1.655 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -6.640 -16.013 -1.896 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -5.816 -14.965 -0.760 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -7.553 -15.986 0.498 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -8.120 -14.358 0.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -9.641 -16.426 -0.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -9.701 -15.081 -1.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -8.835 -16.468 -1.738 1.00 0.00 H new ATOM 1228 N HIS A 88 -8.656 -11.112 -4.163 1.00 0.00 N ATOM 1229 CA HIS A 88 -8.681 -9.746 -3.653 1.00 0.00 C ATOM 1230 C HIS A 88 -9.041 -9.726 -2.170 1.00 0.00 C ATOM 1231 O HIS A 88 -10.016 -10.351 -1.751 1.00 0.00 O ATOM 1232 CB HIS A 88 -9.681 -8.902 -4.444 1.00 0.00 C ATOM 1233 CG HIS A 88 -9.055 -8.118 -5.556 1.00 0.00 C ATOM 1234 ND1 HIS A 88 -8.719 -6.785 -5.442 1.00 0.00 N ATOM 1235 CD2 HIS A 88 -8.703 -8.487 -6.810 1.00 0.00 C ATOM 1236 CE1 HIS A 88 -8.189 -6.368 -6.577 1.00 0.00 C ATOM 1237 NE2 HIS A 88 -8.167 -7.382 -7.424 1.00 0.00 N ATOM 0 H HIS A 88 -9.508 -11.398 -4.646 1.00 0.00 H new ATOM 0 HA HIS A 88 -7.684 -9.322 -3.773 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -10.448 -9.556 -4.859 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -10.182 -8.214 -3.763 1.00 0.00 H new ATOM 0 HD1 HIS A 88 -8.858 -6.211 -4.610 1.00 0.00 H new ATOM 0 HD2 HIS A 88 -8.822 -9.468 -7.246 1.00 0.00 H new ATOM 0 HE1 HIS A 88 -7.834 -5.368 -6.779 1.00 0.00 H new ATOM 1246 N ILE A 89 -8.249 -9.007 -1.383 1.00 0.00 N ATOM 1247 CA ILE A 89 -8.485 -8.907 0.052 1.00 0.00 C ATOM 1248 C ILE A 89 -9.631 -7.946 0.354 1.00 0.00 C ATOM 1249 O ILE A 89 -9.915 -7.020 -0.406 1.00 0.00 O ATOM 1250 CB ILE A 89 -7.224 -8.435 0.798 1.00 0.00 C ATOM 1251 CG1 ILE A 89 -6.863 -7.007 0.384 1.00 0.00 C ATOM 1252 CG2 ILE A 89 -6.063 -9.380 0.527 1.00 0.00 C ATOM 1253 CD1 ILE A 89 -5.913 -6.321 1.340 1.00 0.00 C ATOM 0 H ILE A 89 -7.438 -8.485 -1.715 1.00 0.00 H new ATOM 0 HA ILE A 89 -8.750 -9.906 0.399 1.00 0.00 H new ATOM 0 HB ILE A 89 -7.430 -8.441 1.868 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -6.414 -7.028 -0.609 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -7.777 -6.418 0.308 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -5.179 -9.033 1.061 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -6.323 -10.382 0.868 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -5.855 -9.403 -0.543 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -5.702 -5.313 0.983 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -6.368 -6.268 2.329 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -4.983 -6.887 1.398 1.00 0.00 H new ATOM 1265 N PRO A 90 -10.304 -8.169 1.493 1.00 0.00 N ATOM 1266 CA PRO A 90 -11.428 -7.333 1.924 1.00 0.00 C ATOM 1267 C PRO A 90 -10.984 -5.937 2.345 1.00 0.00 C ATOM 1268 O PRO A 90 -10.803 -5.664 3.531 1.00 0.00 O ATOM 1269 CB PRO A 90 -12.000 -8.096 3.121 1.00 0.00 C ATOM 1270 CG PRO A 90 -10.855 -8.893 3.644 1.00 0.00 C ATOM 1271 CD PRO A 90 -10.020 -9.255 2.446 1.00 0.00 C ATOM 0 HA PRO A 90 -12.147 -7.172 1.121 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -12.386 -7.413 3.878 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -12.827 -8.740 2.822 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -10.275 -8.316 4.364 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -11.205 -9.787 4.160 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -8.960 -9.304 2.695 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -10.298 -10.228 2.041 1.00 0.00 H new ATOM 1279 N GLY A 91 -10.809 -5.055 1.366 1.00 0.00 N ATOM 1280 CA GLY A 91 -10.387 -3.697 1.656 1.00 0.00 C ATOM 1281 C GLY A 91 -9.562 -3.094 0.537 1.00 0.00 C ATOM 1282 O GLY A 91 -9.287 -1.894 0.536 1.00 0.00 O ATOM 0 H GLY A 91 -10.952 -5.257 0.376 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -11.266 -3.076 1.830 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -9.804 -3.690 2.577 1.00 0.00 H new ATOM 1286 N SER A 92 -9.165 -3.928 -0.419 1.00 0.00 N ATOM 1287 CA SER A 92 -8.362 -3.472 -1.547 1.00 0.00 C ATOM 1288 C SER A 92 -9.158 -3.543 -2.846 1.00 0.00 C ATOM 1289 O SER A 92 -10.097 -4.328 -2.986 1.00 0.00 O ATOM 1290 CB SER A 92 -7.090 -4.313 -1.668 1.00 0.00 C ATOM 1291 OG SER A 92 -6.704 -4.462 -3.023 1.00 0.00 O ATOM 0 H SER A 92 -9.387 -4.923 -0.435 1.00 0.00 H new ATOM 0 HA SER A 92 -8.086 -2.433 -1.367 1.00 0.00 H new ATOM 0 HB2 SER A 92 -6.284 -3.841 -1.107 1.00 0.00 H new ATOM 0 HB3 SER A 92 -7.256 -5.294 -1.224 1.00 0.00 H new ATOM 0 HG SER A 92 -6.847 -5.390 -3.304 1.00 0.00 H new ATOM 1297 N PRO A 93 -8.776 -2.705 -3.821 1.00 0.00 N ATOM 1298 CA PRO A 93 -7.661 -1.766 -3.665 1.00 0.00 C ATOM 1299 C PRO A 93 -7.983 -0.640 -2.688 1.00 0.00 C ATOM 1300 O PRO A 93 -9.095 -0.112 -2.678 1.00 0.00 O ATOM 1301 CB PRO A 93 -7.467 -1.209 -5.078 1.00 0.00 C ATOM 1302 CG PRO A 93 -8.797 -1.361 -5.731 1.00 0.00 C ATOM 1303 CD PRO A 93 -9.404 -2.608 -5.149 1.00 0.00 C ATOM 0 HA PRO A 93 -6.774 -2.251 -3.257 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -7.156 -0.165 -5.053 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -6.696 -1.759 -5.618 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -9.428 -0.493 -5.538 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -8.693 -1.446 -6.813 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -10.489 -2.531 -5.076 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -9.188 -3.484 -5.761 1.00 0.00 H new ATOM 1311 N PHE A 94 -7.003 -0.278 -1.867 1.00 0.00 N ATOM 1312 CA PHE A 94 -7.182 0.786 -0.885 1.00 0.00 C ATOM 1313 C PHE A 94 -6.977 2.156 -1.524 1.00 0.00 C ATOM 1314 O PHE A 94 -5.875 2.494 -1.958 1.00 0.00 O ATOM 1315 CB PHE A 94 -6.208 0.603 0.280 1.00 0.00 C ATOM 1316 CG PHE A 94 -6.435 -0.662 1.059 1.00 0.00 C ATOM 1317 CD1 PHE A 94 -5.886 -1.861 0.634 1.00 0.00 C ATOM 1318 CD2 PHE A 94 -7.199 -0.651 2.215 1.00 0.00 C ATOM 1319 CE1 PHE A 94 -6.092 -3.026 1.349 1.00 0.00 C ATOM 1320 CE2 PHE A 94 -7.409 -1.812 2.933 1.00 0.00 C ATOM 1321 CZ PHE A 94 -6.856 -3.002 2.499 1.00 0.00 C ATOM 0 H PHE A 94 -6.077 -0.705 -1.862 1.00 0.00 H new ATOM 0 HA PHE A 94 -8.203 0.730 -0.508 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -5.189 0.605 -0.106 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -6.295 1.456 0.953 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -5.290 -1.886 -0.266 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -7.635 0.276 2.558 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -5.656 -3.954 1.009 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -8.005 -1.790 3.833 1.00 0.00 H new ATOM 0 HZ PHE A 94 -7.021 -3.911 3.058 1.00 0.00 H new ATOM 1331 N THR A 95 -8.047 2.943 -1.579 1.00 0.00 N ATOM 1332 CA THR A 95 -7.987 4.276 -2.166 1.00 0.00 C ATOM 1333 C THR A 95 -7.349 5.272 -1.204 1.00 0.00 C ATOM 1334 O THR A 95 -7.998 5.755 -0.277 1.00 0.00 O ATOM 1335 CB THR A 95 -9.388 4.782 -2.557 1.00 0.00 C ATOM 1336 OG1 THR A 95 -10.029 3.833 -3.418 1.00 0.00 O ATOM 1337 CG2 THR A 95 -9.301 6.130 -3.256 1.00 0.00 C ATOM 0 H THR A 95 -8.966 2.680 -1.224 1.00 0.00 H new ATOM 0 HA THR A 95 -7.374 4.198 -3.064 1.00 0.00 H new ATOM 0 HB THR A 95 -9.975 4.900 -1.646 1.00 0.00 H new ATOM 0 HG1 THR A 95 -10.920 4.161 -3.661 1.00 0.00 H new ATOM 0 HG21 THR A 95 -10.303 6.467 -3.523 1.00 0.00 H new ATOM 0 HG22 THR A 95 -8.839 6.857 -2.588 1.00 0.00 H new ATOM 0 HG23 THR A 95 -8.698 6.033 -4.159 1.00 0.00 H new ATOM 1345 N ALA A 96 -6.076 5.574 -1.431 1.00 0.00 N ATOM 1346 CA ALA A 96 -5.352 6.516 -0.585 1.00 0.00 C ATOM 1347 C ALA A 96 -5.365 7.917 -1.187 1.00 0.00 C ATOM 1348 O ALA A 96 -5.172 8.089 -2.390 1.00 0.00 O ATOM 1349 CB ALA A 96 -3.921 6.043 -0.374 1.00 0.00 C ATOM 0 H ALA A 96 -5.524 5.181 -2.193 1.00 0.00 H new ATOM 0 HA ALA A 96 -5.855 6.560 0.381 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -3.392 6.755 0.259 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -3.928 5.065 0.107 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -3.416 5.969 -1.337 1.00 0.00 H new ATOM 1355 N LYS A 97 -5.594 8.916 -0.342 1.00 0.00 N ATOM 1356 CA LYS A 97 -5.632 10.303 -0.789 1.00 0.00 C ATOM 1357 C LYS A 97 -4.247 10.937 -0.714 1.00 0.00 C ATOM 1358 O LYS A 97 -3.561 10.833 0.303 1.00 0.00 O ATOM 1359 CB LYS A 97 -6.620 11.108 0.059 1.00 0.00 C ATOM 1360 CG LYS A 97 -7.253 12.271 -0.684 1.00 0.00 C ATOM 1361 CD LYS A 97 -7.700 13.366 0.271 1.00 0.00 C ATOM 1362 CE LYS A 97 -8.553 14.408 -0.435 1.00 0.00 C ATOM 1363 NZ LYS A 97 -7.733 15.308 -1.292 1.00 0.00 N ATOM 0 H LYS A 97 -5.756 8.791 0.657 1.00 0.00 H new ATOM 0 HA LYS A 97 -5.962 10.314 -1.828 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -7.407 10.443 0.414 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -6.103 11.489 0.940 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -6.538 12.680 -1.399 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -8.109 11.915 -1.257 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -8.267 12.926 1.091 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -6.826 13.847 0.710 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -9.304 13.908 -1.047 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -9.089 15.001 0.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -8.351 16.004 -1.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -7.033 15.804 -0.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -7.241 14.745 -2.015 1.00 0.00 H new ATOM 1377 N ILE A 98 -3.843 11.596 -1.795 1.00 0.00 N ATOM 1378 CA ILE A 98 -2.541 12.248 -1.849 1.00 0.00 C ATOM 1379 C ILE A 98 -2.676 13.713 -2.253 1.00 0.00 C ATOM 1380 O ILE A 98 -3.161 14.027 -3.341 1.00 0.00 O ATOM 1381 CB ILE A 98 -1.596 11.540 -2.839 1.00 0.00 C ATOM 1382 CG1 ILE A 98 -1.358 10.093 -2.403 1.00 0.00 C ATOM 1383 CG2 ILE A 98 -0.278 12.292 -2.943 1.00 0.00 C ATOM 1384 CD1 ILE A 98 -0.746 9.970 -1.024 1.00 0.00 C ATOM 0 H ILE A 98 -4.399 11.692 -2.645 1.00 0.00 H new ATOM 0 HA ILE A 98 -2.116 12.187 -0.847 1.00 0.00 H new ATOM 0 HB ILE A 98 -2.064 11.531 -3.823 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -2.307 9.556 -2.420 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -0.704 9.607 -3.127 1.00 0.00 H new ATOM 0 HG21 ILE A 98 0.379 11.780 -3.646 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -0.465 13.307 -3.295 1.00 0.00 H new ATOM 0 HG23 ILE A 98 0.198 12.329 -1.963 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -0.606 8.917 -0.781 1.00 0.00 H new ATOM 0 HD12 ILE A 98 0.218 10.478 -1.007 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -1.409 10.427 -0.289 1.00 0.00 H new ATOM 1396 N THR A 99 -2.243 14.607 -1.370 1.00 0.00 N ATOM 1397 CA THR A 99 -2.315 16.038 -1.634 1.00 0.00 C ATOM 1398 C THR A 99 -0.939 16.607 -1.961 1.00 0.00 C ATOM 1399 O THR A 99 0.081 15.953 -1.746 1.00 0.00 O ATOM 1400 CB THR A 99 -2.901 16.802 -0.431 1.00 0.00 C ATOM 1401 OG1 THR A 99 -2.178 16.470 0.759 1.00 0.00 O ATOM 1402 CG2 THR A 99 -4.374 16.472 -0.246 1.00 0.00 C ATOM 0 H THR A 99 -1.839 14.365 -0.465 1.00 0.00 H new ATOM 0 HA THR A 99 -2.972 16.168 -2.494 1.00 0.00 H new ATOM 0 HB THR A 99 -2.807 17.870 -0.626 1.00 0.00 H new ATOM 0 HG1 THR A 99 -2.555 16.961 1.519 1.00 0.00 H new ATOM 0 HG21 THR A 99 -4.766 17.023 0.609 1.00 0.00 H new ATOM 0 HG22 THR A 99 -4.925 16.754 -1.143 1.00 0.00 H new ATOM 0 HG23 THR A 99 -4.488 15.402 -0.071 1.00 0.00 H new ATOM 1410 N GLY A 100 -0.917 17.830 -2.482 1.00 0.00 N ATOM 1411 CA GLY A 100 0.340 18.466 -2.830 1.00 0.00 C ATOM 1412 C GLY A 100 0.233 19.318 -4.079 1.00 0.00 C ATOM 1413 O GLY A 100 -0.679 19.135 -4.887 1.00 0.00 O ATOM 0 H GLY A 100 -1.748 18.392 -2.669 1.00 0.00 H new ATOM 0 HA2 GLY A 100 0.672 19.087 -1.998 1.00 0.00 H new ATOM 0 HA3 GLY A 100 1.101 17.701 -2.980 1.00 0.00 H new ATOM 1417 N ASP A 101 1.164 20.251 -4.239 1.00 0.00 N ATOM 1418 CA ASP A 101 1.170 21.135 -5.399 1.00 0.00 C ATOM 1419 C ASP A 101 2.589 21.589 -5.729 1.00 0.00 C ATOM 1420 O ASP A 101 3.384 21.875 -4.833 1.00 0.00 O ATOM 1421 CB ASP A 101 0.278 22.351 -5.145 1.00 0.00 C ATOM 1422 CG ASP A 101 0.521 22.974 -3.784 1.00 0.00 C ATOM 1423 OD1 ASP A 101 0.015 22.426 -2.782 1.00 0.00 O ATOM 1424 OD2 ASP A 101 1.219 24.007 -3.721 1.00 0.00 O ATOM 0 H ASP A 101 1.925 20.415 -3.580 1.00 0.00 H new ATOM 0 HA ASP A 101 0.778 20.579 -6.251 1.00 0.00 H new ATOM 0 HB2 ASP A 101 0.456 23.097 -5.920 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -0.768 22.054 -5.224 1.00 0.00 H new ATOM 1429 N ASP A 102 2.899 21.652 -7.019 1.00 0.00 N ATOM 1430 CA ASP A 102 4.222 22.071 -7.467 1.00 0.00 C ATOM 1431 C ASP A 102 4.603 23.415 -6.855 1.00 0.00 C ATOM 1432 O ASP A 102 3.894 24.407 -7.021 1.00 0.00 O ATOM 1433 CB ASP A 102 4.261 22.163 -8.994 1.00 0.00 C ATOM 1434 CG ASP A 102 5.677 22.169 -9.537 1.00 0.00 C ATOM 1435 OD1 ASP A 102 6.470 23.037 -9.116 1.00 0.00 O ATOM 1436 OD2 ASP A 102 5.991 21.306 -10.382 1.00 0.00 O ATOM 0 H ASP A 102 2.253 21.418 -7.773 1.00 0.00 H new ATOM 0 HA ASP A 102 4.944 21.324 -7.136 1.00 0.00 H new ATOM 0 HB2 ASP A 102 3.715 21.321 -9.420 1.00 0.00 H new ATOM 0 HB3 ASP A 102 3.748 23.070 -9.314 1.00 0.00 H new ATOM 1441 N SER A 103 5.727 23.439 -6.145 1.00 0.00 N ATOM 1442 CA SER A 103 6.200 24.660 -5.503 1.00 0.00 C ATOM 1443 C SER A 103 6.640 25.685 -6.543 1.00 0.00 C ATOM 1444 O SER A 103 7.691 25.541 -7.166 1.00 0.00 O ATOM 1445 CB SER A 103 7.360 24.347 -4.556 1.00 0.00 C ATOM 1446 OG SER A 103 7.598 25.425 -3.668 1.00 0.00 O ATOM 0 H SER A 103 6.327 22.627 -6.000 1.00 0.00 H new ATOM 0 HA SER A 103 5.375 25.082 -4.929 1.00 0.00 H new ATOM 0 HB2 SER A 103 7.135 23.445 -3.986 1.00 0.00 H new ATOM 0 HB3 SER A 103 8.261 24.142 -5.134 1.00 0.00 H new ATOM 0 HG SER A 103 8.343 25.200 -3.072 1.00 0.00 H new ATOM 1452 N MET A 104 5.826 26.720 -6.726 1.00 0.00 N ATOM 1453 CA MET A 104 6.132 27.771 -7.690 1.00 0.00 C ATOM 1454 C MET A 104 7.406 28.513 -7.299 1.00 0.00 C ATOM 1455 O MET A 104 8.350 28.599 -8.084 1.00 0.00 O ATOM 1456 CB MET A 104 4.965 28.755 -7.790 1.00 0.00 C ATOM 1457 CG MET A 104 5.067 29.701 -8.976 1.00 0.00 C ATOM 1458 SD MET A 104 4.487 28.955 -10.511 1.00 0.00 S ATOM 1459 CE MET A 104 5.427 29.888 -11.717 1.00 0.00 C ATOM 0 H MET A 104 4.950 26.853 -6.220 1.00 0.00 H new ATOM 0 HA MET A 104 6.289 27.304 -8.662 1.00 0.00 H new ATOM 0 HB2 MET A 104 4.033 28.194 -7.862 1.00 0.00 H new ATOM 0 HB3 MET A 104 4.915 29.341 -6.872 1.00 0.00 H new ATOM 0 HG2 MET A 104 4.485 30.599 -8.770 1.00 0.00 H new ATOM 0 HG3 MET A 104 6.104 30.014 -9.098 1.00 0.00 H new ATOM 0 HE1 MET A 104 5.178 29.542 -12.720 1.00 0.00 H new ATOM 0 HE2 MET A 104 5.184 30.947 -11.628 1.00 0.00 H new ATOM 0 HE3 MET A 104 6.493 29.744 -11.538 1.00 0.00 H new ATOM 1469 N ARG A 105 7.425 29.048 -6.083 1.00 0.00 N ATOM 1470 CA ARG A 105 8.583 29.784 -5.590 1.00 0.00 C ATOM 1471 C ARG A 105 9.080 30.779 -6.635 1.00 0.00 C ATOM 1472 O ARG A 105 10.284 30.918 -6.851 1.00 0.00 O ATOM 1473 CB ARG A 105 9.707 28.817 -5.216 1.00 0.00 C ATOM 1474 CG ARG A 105 9.517 28.157 -3.860 1.00 0.00 C ATOM 1475 CD ARG A 105 9.813 29.123 -2.724 1.00 0.00 C ATOM 1476 NE ARG A 105 10.051 28.428 -1.462 1.00 0.00 N ATOM 1477 CZ ARG A 105 11.142 27.714 -1.210 1.00 0.00 C ATOM 1478 NH1 ARG A 105 12.092 27.603 -2.129 1.00 0.00 N ATOM 1479 NH2 ARG A 105 11.286 27.110 -0.038 1.00 0.00 N ATOM 0 H ARG A 105 6.652 28.986 -5.421 1.00 0.00 H new ATOM 0 HA ARG A 105 8.279 30.338 -4.702 1.00 0.00 H new ATOM 0 HB2 ARG A 105 9.778 28.043 -5.980 1.00 0.00 H new ATOM 0 HB3 ARG A 105 10.654 29.356 -5.219 1.00 0.00 H new ATOM 0 HG2 ARG A 105 8.494 27.793 -3.772 1.00 0.00 H new ATOM 0 HG3 ARG A 105 10.172 27.289 -3.781 1.00 0.00 H new ATOM 0 HD2 ARG A 105 10.687 29.724 -2.977 1.00 0.00 H new ATOM 0 HD3 ARG A 105 8.976 29.811 -2.606 1.00 0.00 H new ATOM 0 HE ARG A 105 9.340 28.495 -0.734 1.00 0.00 H new ATOM 0 HH11 ARG A 105 11.985 28.067 -3.031 1.00 0.00 H new ATOM 0 HH12 ARG A 105 12.929 27.054 -1.933 1.00 0.00 H new ATOM 0 HH21 ARG A 105 10.558 27.193 0.672 1.00 0.00 H new ATOM 0 HH22 ARG A 105 12.125 26.562 0.154 1.00 0.00 H new ATOM 1493 N SER A 106 8.144 31.468 -7.281 1.00 0.00 N ATOM 1494 CA SER A 106 8.487 32.446 -8.307 1.00 0.00 C ATOM 1495 C SER A 106 8.869 33.782 -7.677 1.00 0.00 C ATOM 1496 O SER A 106 8.008 34.538 -7.228 1.00 0.00 O ATOM 1497 CB SER A 106 7.313 32.640 -9.269 1.00 0.00 C ATOM 1498 OG SER A 106 7.669 33.495 -10.342 1.00 0.00 O ATOM 0 H SER A 106 7.143 31.367 -7.112 1.00 0.00 H new ATOM 0 HA SER A 106 9.345 32.068 -8.863 1.00 0.00 H new ATOM 0 HB2 SER A 106 6.996 31.673 -9.660 1.00 0.00 H new ATOM 0 HB3 SER A 106 6.464 33.061 -8.731 1.00 0.00 H new ATOM 0 HG SER A 106 6.903 33.602 -10.943 1.00 0.00 H new ATOM 1504 N GLY A 107 10.167 34.066 -7.648 1.00 0.00 N ATOM 1505 CA GLY A 107 10.642 35.310 -7.071 1.00 0.00 C ATOM 1506 C GLY A 107 11.999 35.163 -6.411 1.00 0.00 C ATOM 1507 O GLY A 107 12.132 35.255 -5.191 1.00 0.00 O ATOM 0 H GLY A 107 10.899 33.457 -8.014 1.00 0.00 H new ATOM 0 HA2 GLY A 107 10.701 36.069 -7.851 1.00 0.00 H new ATOM 0 HA3 GLY A 107 9.920 35.664 -6.335 1.00 0.00 H new ATOM 1511 N PRO A 108 13.036 34.927 -7.228 1.00 0.00 N ATOM 1512 CA PRO A 108 14.408 34.761 -6.738 1.00 0.00 C ATOM 1513 C PRO A 108 14.996 36.064 -6.208 1.00 0.00 C ATOM 1514 O PRO A 108 15.786 36.060 -5.264 1.00 0.00 O ATOM 1515 CB PRO A 108 15.173 34.295 -7.979 1.00 0.00 C ATOM 1516 CG PRO A 108 14.389 34.824 -9.130 1.00 0.00 C ATOM 1517 CD PRO A 108 12.950 34.805 -8.693 1.00 0.00 C ATOM 0 HA PRO A 108 14.461 34.065 -5.901 1.00 0.00 H new ATOM 0 HB2 PRO A 108 16.192 34.681 -7.984 1.00 0.00 H new ATOM 0 HB3 PRO A 108 15.244 33.208 -8.015 1.00 0.00 H new ATOM 0 HG2 PRO A 108 14.706 35.835 -9.387 1.00 0.00 H new ATOM 0 HG3 PRO A 108 14.536 34.209 -10.018 1.00 0.00 H new ATOM 0 HD2 PRO A 108 12.386 35.628 -9.132 1.00 0.00 H new ATOM 0 HD3 PRO A 108 12.452 33.882 -8.991 1.00 0.00 H new ATOM 1525 N SER A 109 14.605 37.177 -6.820 1.00 0.00 N ATOM 1526 CA SER A 109 15.097 38.487 -6.411 1.00 0.00 C ATOM 1527 C SER A 109 14.045 39.231 -5.593 1.00 0.00 C ATOM 1528 O SER A 109 13.077 39.759 -6.140 1.00 0.00 O ATOM 1529 CB SER A 109 15.485 39.315 -7.637 1.00 0.00 C ATOM 1530 OG SER A 109 14.411 39.397 -8.558 1.00 0.00 O ATOM 0 H SER A 109 13.949 37.198 -7.601 1.00 0.00 H new ATOM 0 HA SER A 109 15.979 38.338 -5.788 1.00 0.00 H new ATOM 0 HB2 SER A 109 15.778 40.317 -7.325 1.00 0.00 H new ATOM 0 HB3 SER A 109 16.352 38.867 -8.123 1.00 0.00 H new ATOM 0 HG SER A 109 13.576 39.563 -8.073 1.00 0.00 H new ATOM 1536 N SER A 110 14.243 39.268 -4.279 1.00 0.00 N ATOM 1537 CA SER A 110 13.311 39.943 -3.384 1.00 0.00 C ATOM 1538 C SER A 110 13.183 41.420 -3.746 1.00 0.00 C ATOM 1539 O SER A 110 14.182 42.126 -3.882 1.00 0.00 O ATOM 1540 CB SER A 110 13.771 39.800 -1.932 1.00 0.00 C ATOM 1541 OG SER A 110 12.916 40.510 -1.054 1.00 0.00 O ATOM 0 H SER A 110 15.041 38.838 -3.811 1.00 0.00 H new ATOM 0 HA SER A 110 12.334 39.473 -3.496 1.00 0.00 H new ATOM 0 HB2 SER A 110 13.788 38.746 -1.655 1.00 0.00 H new ATOM 0 HB3 SER A 110 14.791 40.172 -1.832 1.00 0.00 H new ATOM 0 HG SER A 110 13.230 40.401 -0.132 1.00 0.00 H new ATOM 1547 N GLY A 111 11.946 41.880 -3.901 1.00 0.00 N ATOM 1548 CA GLY A 111 11.708 43.269 -4.246 1.00 0.00 C ATOM 1549 C GLY A 111 10.435 43.811 -3.628 1.00 0.00 C ATOM 1550 O GLY A 111 10.439 44.881 -3.019 1.00 0.00 O ATOM 0 H GLY A 111 11.104 41.315 -3.794 1.00 0.00 H new ATOM 0 HA2 GLY A 111 12.554 43.872 -3.916 1.00 0.00 H new ATOM 0 HA3 GLY A 111 11.652 43.366 -5.330 1.00 0.00 H new TER 1554 GLY A 111