USER MOD reduce.3.24.130724 H: found=0, std=0, add=903, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 897 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 65 ASN : amide:sc= -0.452 X(o=-3.9,f=-4!) USER MOD Set 1.2: A 95 HIS : no HD1:sc= -3.48 K(o=-3.9,f=-8.2!) USER MOD Set 2.1: A 45 THR OG1 : rot -82:sc= 0.25 USER MOD Set 2.2: A 84 GLN : amide:sc= -0.0314 K(o=0.22,f=-0.6) USER MOD Set 3.1: A 83 TYR OH : rot -143:sc= 1.01 USER MOD Set 3.2: A 101 TYR OH : rot 110:sc= -0.226 USER MOD Single : A 1 GLY N :NH3+ 132:sc= 0.0303 (180deg=0) USER MOD Single : A 2 SER OG : rot 26:sc= 0.149 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 8 HIS :FLIP no HE2:sc= -1.2 F(o=-2.4,f=-1.2) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 THR OG1 : rot 62:sc= 1.15 USER MOD Single : A 22 SER OG : rot 180:sc= -0.585 USER MOD Single : A 25 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000191) USER MOD Single : A 34 LYS NZ :NH3+ 153:sc=-0.00765 (180deg=-0.767) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 78:sc= -0.965 USER MOD Single : A 48 SER OG : rot 26:sc= -1.69! USER MOD Single : A 52 THR OG1 : rot 179:sc= 0.208 USER MOD Single : A 53 GLN : amide:sc= -1.61! X(o=-1.6!,f=-2) USER MOD Single : A 58 HIS : no HE2:sc= 0.577 K(o=0.58,f=-1.9!) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 HIS : no HD1:sc= -0.0987 X(o=-0.099,f=0) USER MOD Single : A 67 SER OG : rot 126:sc= 1.33 USER MOD Single : A 70 SER OG : rot 23:sc= 0.153 USER MOD Single : A 71 THR OG1 : rot 160:sc= 0 USER MOD Single : A 73 CYS SG : rot -134:sc= 0.781 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= -0.148 X(o=-0.15,f=0) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot -171:sc= 0.918 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.443) USER MOD Single : A 100 THR OG1 : rot 43:sc= 0.114 USER MOD Single : A 108 ASN : amide:sc= -1.42 X(o=-1.4,f=-1.8!) USER MOD Single : A 109 SER OG : rot 23:sc= 1.34 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 CYS SG : rot 3:sc= 0.243 USER MOD Single : A 120 GLN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 41:sc= 1.05 USER MOD Single : A 127 SER OG : rot 78:sc= 0.0474 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -17.461 16.456 34.158 1.00 0.00 N ATOM 2 CA GLY A 1 -16.346 15.667 34.647 1.00 0.00 C ATOM 3 C GLY A 1 -15.006 16.313 34.354 1.00 0.00 C ATOM 4 O GLY A 1 -14.861 17.038 33.370 1.00 0.00 O ATOM 0 H1 GLY A 1 -18.116 15.843 33.633 1.00 0.00 H new ATOM 0 H2 GLY A 1 -17.960 16.887 34.962 1.00 0.00 H new ATOM 0 H3 GLY A 1 -17.107 17.204 33.528 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -16.450 15.525 35.723 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -16.377 14.678 34.190 1.00 0.00 H new ATOM 8 N SER A 2 -14.025 16.050 35.211 1.00 0.00 N ATOM 9 CA SER A 2 -12.691 16.616 35.042 1.00 0.00 C ATOM 10 C SER A 2 -11.624 15.650 35.546 1.00 0.00 C ATOM 11 O SER A 2 -11.675 15.190 36.687 1.00 0.00 O ATOM 12 CB SER A 2 -12.581 17.948 35.786 1.00 0.00 C ATOM 13 OG SER A 2 -12.783 17.774 37.178 1.00 0.00 O ATOM 0 H SER A 2 -14.128 15.449 36.029 1.00 0.00 H new ATOM 0 HA SER A 2 -12.528 16.788 33.978 1.00 0.00 H new ATOM 0 HB2 SER A 2 -11.599 18.386 35.610 1.00 0.00 H new ATOM 0 HB3 SER A 2 -13.318 18.649 35.393 1.00 0.00 H new ATOM 0 HG SER A 2 -12.545 16.858 37.431 1.00 0.00 H new ATOM 19 N SER A 3 -10.656 15.346 34.687 1.00 0.00 N ATOM 20 CA SER A 3 -9.577 14.431 35.043 1.00 0.00 C ATOM 21 C SER A 3 -8.335 14.703 34.200 1.00 0.00 C ATOM 22 O SER A 3 -8.421 14.885 32.987 1.00 0.00 O ATOM 23 CB SER A 3 -10.027 12.981 34.855 1.00 0.00 C ATOM 24 OG SER A 3 -8.965 12.080 35.117 1.00 0.00 O ATOM 0 H SER A 3 -10.597 15.720 33.740 1.00 0.00 H new ATOM 0 HA SER A 3 -9.327 14.593 36.091 1.00 0.00 H new ATOM 0 HB2 SER A 3 -10.863 12.767 35.521 1.00 0.00 H new ATOM 0 HB3 SER A 3 -10.387 12.838 33.836 1.00 0.00 H new ATOM 0 HG SER A 3 -9.278 11.160 34.992 1.00 0.00 H new ATOM 30 N GLY A 4 -7.178 14.730 34.855 1.00 0.00 N ATOM 31 CA GLY A 4 -5.933 14.980 34.152 1.00 0.00 C ATOM 32 C GLY A 4 -5.170 16.159 34.725 1.00 0.00 C ATOM 33 O GLY A 4 -5.336 16.504 35.894 1.00 0.00 O ATOM 0 H GLY A 4 -7.081 14.583 35.860 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -5.307 14.089 34.199 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -6.145 15.165 33.099 1.00 0.00 H new ATOM 37 N SER A 5 -4.331 16.776 33.900 1.00 0.00 N ATOM 38 CA SER A 5 -3.535 17.919 34.333 1.00 0.00 C ATOM 39 C SER A 5 -3.693 19.088 33.366 1.00 0.00 C ATOM 40 O SER A 5 -4.262 18.941 32.284 1.00 0.00 O ATOM 41 CB SER A 5 -2.060 17.528 34.442 1.00 0.00 C ATOM 42 OG SER A 5 -1.814 16.790 35.626 1.00 0.00 O ATOM 0 H SER A 5 -4.184 16.504 32.928 1.00 0.00 H new ATOM 0 HA SER A 5 -3.894 18.230 35.314 1.00 0.00 H new ATOM 0 HB2 SER A 5 -1.773 16.935 33.574 1.00 0.00 H new ATOM 0 HB3 SER A 5 -1.441 18.425 34.434 1.00 0.00 H new ATOM 0 HG SER A 5 -0.865 16.551 35.671 1.00 0.00 H new ATOM 48 N SER A 6 -3.185 20.250 33.764 1.00 0.00 N ATOM 49 CA SER A 6 -3.272 21.447 32.936 1.00 0.00 C ATOM 50 C SER A 6 -2.203 21.433 31.847 1.00 0.00 C ATOM 51 O SER A 6 -1.036 21.146 32.111 1.00 0.00 O ATOM 52 CB SER A 6 -3.122 22.701 33.798 1.00 0.00 C ATOM 53 OG SER A 6 -1.805 22.816 34.307 1.00 0.00 O ATOM 0 H SER A 6 -2.709 20.388 34.655 1.00 0.00 H new ATOM 0 HA SER A 6 -4.252 21.458 32.459 1.00 0.00 H new ATOM 0 HB2 SER A 6 -3.365 23.584 33.206 1.00 0.00 H new ATOM 0 HB3 SER A 6 -3.832 22.665 34.624 1.00 0.00 H new ATOM 0 HG SER A 6 -1.735 23.627 34.853 1.00 0.00 H new ATOM 59 N GLY A 7 -2.612 21.745 30.621 1.00 0.00 N ATOM 60 CA GLY A 7 -1.679 21.763 29.510 1.00 0.00 C ATOM 61 C GLY A 7 -2.195 20.999 28.307 1.00 0.00 C ATOM 62 O GLY A 7 -2.472 21.587 27.261 1.00 0.00 O ATOM 0 H GLY A 7 -3.573 21.986 30.378 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -1.481 22.796 29.223 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.730 21.333 29.830 1.00 0.00 H new ATOM 66 N HIS A 8 -2.322 19.684 28.453 1.00 0.00 N ATOM 67 CA HIS A 8 -2.808 18.837 27.369 1.00 0.00 C ATOM 68 C HIS A 8 -4.110 19.386 26.793 1.00 0.00 C ATOM 69 O HIS A 8 -4.960 19.892 27.526 1.00 0.00 O ATOM 70 CB HIS A 8 -3.018 17.407 27.865 1.00 0.00 C ATOM 71 CG HIS A 8 -3.968 16.614 27.021 1.00 0.00 C ATOM 72 ND1 HIS A 8 -3.910 16.262 25.716 1.00 0.00 N flip ATOM 73 CD2 HIS A 8 -5.145 16.085 27.508 1.00 0.00 C flip ATOM 74 CE1 HIS A 8 -5.041 15.533 25.440 1.00 0.00 C flip ATOM 75 NE2 HIS A 8 -5.770 15.441 26.538 1.00 0.00 N flip ATOM 0 H HIS A 8 -2.095 19.182 29.311 1.00 0.00 H new ATOM 0 HA HIS A 8 -2.056 18.832 26.580 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -2.056 16.896 27.893 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -3.392 17.437 28.888 1.00 0.00 H new ATOM 0 HD1 HIS A 8 -3.165 16.495 25.059 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -5.500 16.182 28.523 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -5.293 15.105 24.481 1.00 0.00 H new ATOM 83 N PHE A 9 -4.260 19.281 25.477 1.00 0.00 N ATOM 84 CA PHE A 9 -5.457 19.768 24.802 1.00 0.00 C ATOM 85 C PHE A 9 -6.045 18.692 23.894 1.00 0.00 C ATOM 86 O PHE A 9 -5.641 18.527 22.743 1.00 0.00 O ATOM 87 CB PHE A 9 -5.135 21.021 23.986 1.00 0.00 C ATOM 88 CG PHE A 9 -4.191 20.767 22.845 1.00 0.00 C ATOM 89 CD1 PHE A 9 -2.857 20.478 23.084 1.00 0.00 C ATOM 90 CD2 PHE A 9 -4.638 20.817 21.535 1.00 0.00 C ATOM 91 CE1 PHE A 9 -1.986 20.244 22.036 1.00 0.00 C ATOM 92 CE2 PHE A 9 -3.772 20.583 20.483 1.00 0.00 C ATOM 93 CZ PHE A 9 -2.444 20.297 20.735 1.00 0.00 C ATOM 0 H PHE A 9 -3.567 18.863 24.856 1.00 0.00 H new ATOM 0 HA PHE A 9 -6.196 20.020 25.563 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -6.063 21.438 23.594 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -4.701 21.773 24.645 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -2.494 20.435 24.100 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -5.675 21.041 21.333 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -0.948 20.020 22.235 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -4.133 20.624 19.466 1.00 0.00 H new ATOM 0 HZ PHE A 9 -1.765 20.115 19.915 1.00 0.00 H new ATOM 103 N PRO A 10 -7.023 17.942 24.422 1.00 0.00 N ATOM 104 CA PRO A 10 -7.688 16.869 23.677 1.00 0.00 C ATOM 105 C PRO A 10 -8.571 17.403 22.554 1.00 0.00 C ATOM 106 O PRO A 10 -9.253 16.640 21.871 1.00 0.00 O ATOM 107 CB PRO A 10 -8.539 16.172 24.741 1.00 0.00 C ATOM 108 CG PRO A 10 -8.785 17.218 25.773 1.00 0.00 C ATOM 109 CD PRO A 10 -7.555 18.083 25.788 1.00 0.00 C ATOM 0 HA PRO A 10 -6.972 16.210 23.186 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -9.474 15.803 24.321 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -8.019 15.313 25.164 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -9.671 17.804 25.531 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -8.958 16.768 26.751 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -7.796 19.120 26.020 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -6.837 17.747 26.536 1.00 0.00 H new ATOM 117 N ALA A 11 -8.553 18.719 22.370 1.00 0.00 N ATOM 118 CA ALA A 11 -9.351 19.355 21.329 1.00 0.00 C ATOM 119 C ALA A 11 -8.508 19.643 20.091 1.00 0.00 C ATOM 120 O ALA A 11 -7.774 20.630 20.043 1.00 0.00 O ATOM 121 CB ALA A 11 -9.977 20.639 21.853 1.00 0.00 C ATOM 0 H ALA A 11 -7.995 19.365 22.928 1.00 0.00 H new ATOM 0 HA ALA A 11 -10.146 18.666 21.044 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -10.570 21.103 21.065 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -10.620 20.410 22.703 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -9.191 21.325 22.167 1.00 0.00 H new ATOM 127 N ARG A 12 -8.618 18.774 19.091 1.00 0.00 N ATOM 128 CA ARG A 12 -7.865 18.934 17.853 1.00 0.00 C ATOM 129 C ARG A 12 -8.487 20.015 16.974 1.00 0.00 C ATOM 130 O ARG A 12 -9.692 20.007 16.721 1.00 0.00 O ATOM 131 CB ARG A 12 -7.809 17.610 17.090 1.00 0.00 C ATOM 132 CG ARG A 12 -9.171 17.111 16.635 1.00 0.00 C ATOM 133 CD ARG A 12 -9.103 15.674 16.145 1.00 0.00 C ATOM 134 NE ARG A 12 -9.162 14.716 17.246 1.00 0.00 N ATOM 135 CZ ARG A 12 -9.247 13.402 17.074 1.00 0.00 C ATOM 136 NH1 ARG A 12 -9.281 12.891 15.851 1.00 0.00 N ATOM 137 NH2 ARG A 12 -9.296 12.595 18.126 1.00 0.00 N ATOM 0 H ARG A 12 -9.221 17.952 19.114 1.00 0.00 H new ATOM 0 HA ARG A 12 -6.851 19.239 18.111 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -7.166 17.730 16.218 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -7.348 16.854 17.725 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -9.880 17.182 17.460 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -9.546 17.751 15.837 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -9.927 15.486 15.457 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -8.180 15.526 15.585 1.00 0.00 H new ATOM 0 HE ARG A 12 -9.136 15.076 18.200 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -9.242 13.508 15.039 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -9.346 11.881 15.722 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -9.268 12.984 19.069 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -9.361 11.586 17.992 1.00 0.00 H new ATOM 151 N VAL A 13 -7.657 20.945 16.511 1.00 0.00 N ATOM 152 CA VAL A 13 -8.125 22.032 15.659 1.00 0.00 C ATOM 153 C VAL A 13 -8.027 21.656 14.185 1.00 0.00 C ATOM 154 O VAL A 13 -7.450 20.628 13.832 1.00 0.00 O ATOM 155 CB VAL A 13 -7.321 23.322 15.904 1.00 0.00 C ATOM 156 CG1 VAL A 13 -7.481 23.787 17.343 1.00 0.00 C ATOM 157 CG2 VAL A 13 -5.854 23.108 15.564 1.00 0.00 C ATOM 0 H VAL A 13 -6.657 20.967 16.712 1.00 0.00 H new ATOM 0 HA VAL A 13 -9.169 22.209 15.916 1.00 0.00 H new ATOM 0 HB VAL A 13 -7.712 24.102 15.251 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -6.905 24.700 17.497 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -8.534 23.983 17.547 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -7.119 23.012 18.018 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -5.301 24.030 15.743 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -5.448 22.314 16.190 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -5.761 22.827 14.515 1.00 0.00 H new ATOM 167 N LYS A 14 -8.595 22.497 13.327 1.00 0.00 N ATOM 168 CA LYS A 14 -8.571 22.256 11.889 1.00 0.00 C ATOM 169 C LYS A 14 -7.240 22.695 11.286 1.00 0.00 C ATOM 170 O LYS A 14 -6.878 23.870 11.343 1.00 0.00 O ATOM 171 CB LYS A 14 -9.721 23.000 11.207 1.00 0.00 C ATOM 172 CG LYS A 14 -11.093 22.608 11.730 1.00 0.00 C ATOM 173 CD LYS A 14 -11.550 21.278 11.156 1.00 0.00 C ATOM 174 CE LYS A 14 -12.089 21.436 9.743 1.00 0.00 C ATOM 175 NZ LYS A 14 -11.984 20.171 8.964 1.00 0.00 N ATOM 0 H LYS A 14 -9.078 23.352 13.603 1.00 0.00 H new ATOM 0 HA LYS A 14 -8.690 21.185 11.724 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -9.581 24.072 11.345 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -9.682 22.808 10.135 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -11.064 22.545 12.818 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -11.816 23.383 11.475 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -10.716 20.577 11.152 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -12.322 20.851 11.795 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -13.132 21.751 9.785 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -11.538 22.225 9.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -12.362 20.320 8.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -10.986 19.884 8.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -12.530 19.424 9.439 1.00 0.00 H new ATOM 189 N VAL A 15 -6.515 21.743 10.707 1.00 0.00 N ATOM 190 CA VAL A 15 -5.226 22.032 10.091 1.00 0.00 C ATOM 191 C VAL A 15 -5.200 21.583 8.634 1.00 0.00 C ATOM 192 O VAL A 15 -5.088 20.393 8.343 1.00 0.00 O ATOM 193 CB VAL A 15 -4.075 21.343 10.849 1.00 0.00 C ATOM 194 CG1 VAL A 15 -2.746 21.611 10.160 1.00 0.00 C ATOM 195 CG2 VAL A 15 -4.038 21.808 12.297 1.00 0.00 C ATOM 0 H VAL A 15 -6.799 20.765 10.652 1.00 0.00 H new ATOM 0 HA VAL A 15 -5.088 23.112 10.138 1.00 0.00 H new ATOM 0 HB VAL A 15 -4.250 20.267 10.841 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -1.945 21.117 10.710 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -2.780 21.224 9.141 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -2.559 22.685 10.134 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -3.219 21.312 12.818 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -3.887 22.887 12.329 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -4.981 21.559 12.783 1.00 0.00 H new ATOM 205 N GLU A 16 -5.305 22.546 7.723 1.00 0.00 N ATOM 206 CA GLU A 16 -5.294 22.249 6.295 1.00 0.00 C ATOM 207 C GLU A 16 -3.894 21.857 5.832 1.00 0.00 C ATOM 208 O GLU A 16 -2.885 22.344 6.342 1.00 0.00 O ATOM 209 CB GLU A 16 -5.788 23.458 5.497 1.00 0.00 C ATOM 210 CG GLU A 16 -7.292 23.659 5.566 1.00 0.00 C ATOM 211 CD GLU A 16 -8.062 22.359 5.431 1.00 0.00 C ATOM 212 OE1 GLU A 16 -8.301 21.927 4.285 1.00 0.00 O ATOM 213 OE2 GLU A 16 -8.423 21.775 6.474 1.00 0.00 O ATOM 0 H GLU A 16 -5.398 23.537 7.948 1.00 0.00 H new ATOM 0 HA GLU A 16 -5.965 21.408 6.119 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -5.293 24.355 5.869 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -5.493 23.340 4.454 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -7.548 24.132 6.514 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -7.600 24.343 4.775 1.00 0.00 H new ATOM 220 N PRO A 17 -3.830 20.955 4.841 1.00 0.00 N ATOM 221 CA PRO A 17 -2.561 20.477 4.286 1.00 0.00 C ATOM 222 C PRO A 17 -1.836 21.554 3.485 1.00 0.00 C ATOM 223 O PRO A 17 -2.400 22.138 2.561 1.00 0.00 O ATOM 224 CB PRO A 17 -2.984 19.325 3.372 1.00 0.00 C ATOM 225 CG PRO A 17 -4.391 19.637 2.996 1.00 0.00 C ATOM 226 CD PRO A 17 -4.993 20.333 4.185 1.00 0.00 C ATOM 0 HA PRO A 17 -1.860 20.183 5.067 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -2.344 19.262 2.492 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -2.915 18.366 3.886 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -4.427 20.274 2.112 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -4.942 18.727 2.756 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -5.730 21.077 3.884 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -5.500 19.631 4.847 1.00 0.00 H new ATOM 234 N ALA A 18 -0.583 21.810 3.845 1.00 0.00 N ATOM 235 CA ALA A 18 0.219 22.815 3.158 1.00 0.00 C ATOM 236 C ALA A 18 1.105 22.176 2.093 1.00 0.00 C ATOM 237 O ALA A 18 2.071 22.782 1.630 1.00 0.00 O ATOM 238 CB ALA A 18 1.067 23.587 4.158 1.00 0.00 C ATOM 0 H ALA A 18 -0.101 21.335 4.608 1.00 0.00 H new ATOM 0 HA ALA A 18 -0.460 23.508 2.661 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.661 24.334 3.631 1.00 0.00 H new ATOM 0 HB2 ALA A 18 0.418 24.082 4.880 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.731 22.898 4.680 1.00 0.00 H new ATOM 244 N VAL A 19 0.769 20.948 1.710 1.00 0.00 N ATOM 245 CA VAL A 19 1.534 20.227 0.699 1.00 0.00 C ATOM 246 C VAL A 19 0.611 19.537 -0.299 1.00 0.00 C ATOM 247 O VAL A 19 -0.545 19.246 0.007 1.00 0.00 O ATOM 248 CB VAL A 19 2.458 19.174 1.340 1.00 0.00 C ATOM 249 CG1 VAL A 19 1.639 18.078 2.005 1.00 0.00 C ATOM 250 CG2 VAL A 19 3.401 18.590 0.299 1.00 0.00 C ATOM 0 H VAL A 19 -0.027 20.432 2.084 1.00 0.00 H new ATOM 0 HA VAL A 19 2.143 20.965 0.177 1.00 0.00 H new ATOM 0 HB VAL A 19 3.058 19.661 2.108 1.00 0.00 H new ATOM 0 HG11 VAL A 19 2.309 17.344 2.452 1.00 0.00 H new ATOM 0 HG12 VAL A 19 1.009 18.514 2.780 1.00 0.00 H new ATOM 0 HG13 VAL A 19 1.011 17.590 1.260 1.00 0.00 H new ATOM 0 HG21 VAL A 19 4.047 17.848 0.769 1.00 0.00 H new ATOM 0 HG22 VAL A 19 2.821 18.117 -0.493 1.00 0.00 H new ATOM 0 HG23 VAL A 19 4.012 19.386 -0.126 1.00 0.00 H new ATOM 260 N ASP A 20 1.130 19.278 -1.494 1.00 0.00 N ATOM 261 CA ASP A 20 0.353 18.621 -2.539 1.00 0.00 C ATOM 262 C ASP A 20 0.680 17.132 -2.603 1.00 0.00 C ATOM 263 O ASP A 20 1.784 16.743 -2.989 1.00 0.00 O ATOM 264 CB ASP A 20 0.625 19.274 -3.894 1.00 0.00 C ATOM 265 CG ASP A 20 0.945 20.751 -3.771 1.00 0.00 C ATOM 266 OD1 ASP A 20 0.310 21.428 -2.936 1.00 0.00 O ATOM 267 OD2 ASP A 20 1.831 21.230 -4.510 1.00 0.00 O ATOM 0 H ASP A 20 2.085 19.513 -1.763 1.00 0.00 H new ATOM 0 HA ASP A 20 -0.704 18.733 -2.297 1.00 0.00 H new ATOM 0 HB2 ASP A 20 1.457 18.764 -4.379 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -0.246 19.146 -4.537 1.00 0.00 H new ATOM 272 N THR A 21 -0.286 16.302 -2.222 1.00 0.00 N ATOM 273 CA THR A 21 -0.100 14.856 -2.235 1.00 0.00 C ATOM 274 C THR A 21 -1.268 14.158 -2.922 1.00 0.00 C ATOM 275 O THR A 21 -2.008 13.401 -2.293 1.00 0.00 O ATOM 276 CB THR A 21 0.050 14.297 -0.807 1.00 0.00 C ATOM 277 OG1 THR A 21 -1.207 14.354 -0.124 1.00 0.00 O ATOM 278 CG2 THR A 21 1.093 15.081 -0.026 1.00 0.00 C ATOM 0 H THR A 21 -1.205 16.606 -1.901 1.00 0.00 H new ATOM 0 HA THR A 21 0.816 14.659 -2.793 1.00 0.00 H new ATOM 0 HB THR A 21 0.377 13.260 -0.879 1.00 0.00 H new ATOM 0 HG1 THR A 21 -1.861 13.796 -0.595 1.00 0.00 H new ATOM 0 HG21 THR A 21 1.181 14.668 0.979 1.00 0.00 H new ATOM 0 HG22 THR A 21 2.055 15.011 -0.533 1.00 0.00 H new ATOM 0 HG23 THR A 21 0.791 16.126 0.037 1.00 0.00 H new ATOM 286 N SER A 22 -1.428 14.416 -4.216 1.00 0.00 N ATOM 287 CA SER A 22 -2.508 13.814 -4.988 1.00 0.00 C ATOM 288 C SER A 22 -1.963 13.098 -6.220 1.00 0.00 C ATOM 289 O SER A 22 -2.600 12.193 -6.759 1.00 0.00 O ATOM 290 CB SER A 22 -3.518 14.882 -5.410 1.00 0.00 C ATOM 291 OG SER A 22 -4.799 14.316 -5.626 1.00 0.00 O ATOM 0 H SER A 22 -0.823 15.038 -4.752 1.00 0.00 H new ATOM 0 HA SER A 22 -3.008 13.081 -4.355 1.00 0.00 H new ATOM 0 HB2 SER A 22 -3.582 15.651 -4.640 1.00 0.00 H new ATOM 0 HB3 SER A 22 -3.175 15.371 -6.322 1.00 0.00 H new ATOM 0 HG SER A 22 -5.427 15.020 -5.893 1.00 0.00 H new ATOM 297 N ARG A 23 -0.779 13.511 -6.660 1.00 0.00 N ATOM 298 CA ARG A 23 -0.147 12.912 -7.829 1.00 0.00 C ATOM 299 C ARG A 23 0.841 11.825 -7.416 1.00 0.00 C ATOM 300 O ARG A 23 1.549 11.265 -8.254 1.00 0.00 O ATOM 301 CB ARG A 23 0.572 13.983 -8.653 1.00 0.00 C ATOM 302 CG ARG A 23 -0.275 15.216 -8.919 1.00 0.00 C ATOM 303 CD ARG A 23 0.590 16.433 -9.211 1.00 0.00 C ATOM 304 NE ARG A 23 1.055 16.454 -10.596 1.00 0.00 N ATOM 305 CZ ARG A 23 0.309 16.864 -11.615 1.00 0.00 C ATOM 306 NH1 ARG A 23 -0.931 17.285 -11.407 1.00 0.00 N ATOM 307 NH2 ARG A 23 0.803 16.854 -12.847 1.00 0.00 N ATOM 0 H ARG A 23 -0.238 14.258 -6.224 1.00 0.00 H new ATOM 0 HA ARG A 23 -0.928 12.457 -8.439 1.00 0.00 H new ATOM 0 HB2 ARG A 23 1.481 14.282 -8.131 1.00 0.00 H new ATOM 0 HB3 ARG A 23 0.879 13.551 -9.605 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -0.938 15.028 -9.764 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -0.908 15.417 -8.055 1.00 0.00 H new ATOM 0 HD2 ARG A 23 0.021 17.340 -9.006 1.00 0.00 H new ATOM 0 HD3 ARG A 23 1.449 16.437 -8.540 1.00 0.00 H new ATOM 0 HE ARG A 23 2.005 16.136 -10.791 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -1.315 17.295 -10.462 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -1.501 17.599 -12.192 1.00 0.00 H new ATOM 0 HH21 ARG A 23 1.756 16.531 -13.012 1.00 0.00 H new ATOM 0 HH22 ARG A 23 0.229 17.169 -13.629 1.00 0.00 H new ATOM 321 N ILE A 24 0.883 11.532 -6.121 1.00 0.00 N ATOM 322 CA ILE A 24 1.783 10.512 -5.597 1.00 0.00 C ATOM 323 C ILE A 24 1.417 9.131 -6.129 1.00 0.00 C ATOM 324 O ILE A 24 0.291 8.664 -5.954 1.00 0.00 O ATOM 325 CB ILE A 24 1.762 10.480 -4.057 1.00 0.00 C ATOM 326 CG1 ILE A 24 2.475 11.708 -3.490 1.00 0.00 C ATOM 327 CG2 ILE A 24 2.409 9.201 -3.546 1.00 0.00 C ATOM 328 CD1 ILE A 24 2.530 11.731 -1.978 1.00 0.00 C ATOM 0 H ILE A 24 0.304 11.987 -5.415 1.00 0.00 H new ATOM 0 HA ILE A 24 2.787 10.773 -5.933 1.00 0.00 H new ATOM 0 HB ILE A 24 0.725 10.499 -3.721 1.00 0.00 H new ATOM 0 HG12 ILE A 24 3.491 11.742 -3.883 1.00 0.00 H new ATOM 0 HG13 ILE A 24 1.968 12.607 -3.841 1.00 0.00 H new ATOM 0 HG21 ILE A 24 2.387 9.192 -2.456 1.00 0.00 H new ATOM 0 HG22 ILE A 24 1.861 8.339 -3.927 1.00 0.00 H new ATOM 0 HG23 ILE A 24 3.443 9.154 -3.888 1.00 0.00 H new ATOM 0 HD11 ILE A 24 3.050 12.630 -1.646 1.00 0.00 H new ATOM 0 HD12 ILE A 24 1.516 11.729 -1.577 1.00 0.00 H new ATOM 0 HD13 ILE A 24 3.064 10.851 -1.620 1.00 0.00 H new ATOM 340 N LYS A 25 2.376 8.479 -6.777 1.00 0.00 N ATOM 341 CA LYS A 25 2.157 7.149 -7.332 1.00 0.00 C ATOM 342 C LYS A 25 3.014 6.112 -6.614 1.00 0.00 C ATOM 343 O LYS A 25 3.962 6.456 -5.907 1.00 0.00 O ATOM 344 CB LYS A 25 2.475 7.140 -8.829 1.00 0.00 C ATOM 345 CG LYS A 25 1.290 7.506 -9.705 1.00 0.00 C ATOM 346 CD LYS A 25 0.303 6.356 -9.817 1.00 0.00 C ATOM 347 CE LYS A 25 -1.000 6.801 -10.465 1.00 0.00 C ATOM 348 NZ LYS A 25 -0.801 7.217 -11.880 1.00 0.00 N ATOM 0 H LYS A 25 3.313 8.851 -6.931 1.00 0.00 H new ATOM 0 HA LYS A 25 1.108 6.891 -7.188 1.00 0.00 H new ATOM 0 HB2 LYS A 25 3.289 7.839 -9.023 1.00 0.00 H new ATOM 0 HB3 LYS A 25 2.832 6.149 -9.110 1.00 0.00 H new ATOM 0 HG2 LYS A 25 0.787 8.380 -9.291 1.00 0.00 H new ATOM 0 HG3 LYS A 25 1.643 7.782 -10.699 1.00 0.00 H new ATOM 0 HD2 LYS A 25 0.746 5.551 -10.403 1.00 0.00 H new ATOM 0 HD3 LYS A 25 0.098 5.953 -8.825 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -1.723 5.986 -10.424 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -1.423 7.631 -9.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -1.714 7.497 -12.291 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -0.144 8.022 -11.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -0.406 6.423 -12.423 1.00 0.00 H new ATOM 362 N VAL A 26 2.677 4.839 -6.800 1.00 0.00 N ATOM 363 CA VAL A 26 3.417 3.752 -6.171 1.00 0.00 C ATOM 364 C VAL A 26 3.396 2.499 -7.040 1.00 0.00 C ATOM 365 O VAL A 26 2.346 2.094 -7.539 1.00 0.00 O ATOM 366 CB VAL A 26 2.843 3.411 -4.783 1.00 0.00 C ATOM 367 CG1 VAL A 26 3.234 4.474 -3.768 1.00 0.00 C ATOM 368 CG2 VAL A 26 1.331 3.260 -4.855 1.00 0.00 C ATOM 0 H VAL A 26 1.896 4.536 -7.382 1.00 0.00 H new ATOM 0 HA VAL A 26 4.446 4.094 -6.056 1.00 0.00 H new ATOM 0 HB VAL A 26 3.265 2.460 -4.457 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.820 4.216 -2.793 1.00 0.00 H new ATOM 0 HG12 VAL A 26 4.320 4.528 -3.698 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.843 5.441 -4.085 1.00 0.00 H new ATOM 0 HG21 VAL A 26 0.942 3.019 -3.866 1.00 0.00 H new ATOM 0 HG22 VAL A 26 0.888 4.194 -5.202 1.00 0.00 H new ATOM 0 HG23 VAL A 26 1.078 2.459 -5.549 1.00 0.00 H new ATOM 378 N PHE A 27 4.563 1.888 -7.216 1.00 0.00 N ATOM 379 CA PHE A 27 4.680 0.681 -8.025 1.00 0.00 C ATOM 380 C PHE A 27 5.516 -0.375 -7.308 1.00 0.00 C ATOM 381 O PHE A 27 6.573 -0.076 -6.755 1.00 0.00 O ATOM 382 CB PHE A 27 5.306 1.009 -9.382 1.00 0.00 C ATOM 383 CG PHE A 27 6.448 1.980 -9.296 1.00 0.00 C ATOM 384 CD1 PHE A 27 7.725 1.543 -8.981 1.00 0.00 C ATOM 385 CD2 PHE A 27 6.246 3.331 -9.530 1.00 0.00 C ATOM 386 CE1 PHE A 27 8.777 2.435 -8.900 1.00 0.00 C ATOM 387 CE2 PHE A 27 7.294 4.228 -9.451 1.00 0.00 C ATOM 388 CZ PHE A 27 8.562 3.779 -9.137 1.00 0.00 C ATOM 0 H PHE A 27 5.441 2.209 -6.809 1.00 0.00 H new ATOM 0 HA PHE A 27 3.678 0.281 -8.183 1.00 0.00 H new ATOM 0 HB2 PHE A 27 5.658 0.086 -9.843 1.00 0.00 H new ATOM 0 HB3 PHE A 27 4.538 1.420 -10.037 1.00 0.00 H new ATOM 0 HD1 PHE A 27 7.900 0.493 -8.797 1.00 0.00 H new ATOM 0 HD2 PHE A 27 5.257 3.687 -9.777 1.00 0.00 H new ATOM 0 HE1 PHE A 27 9.767 2.082 -8.652 1.00 0.00 H new ATOM 0 HE2 PHE A 27 7.122 5.278 -9.634 1.00 0.00 H new ATOM 0 HZ PHE A 27 9.384 4.477 -9.077 1.00 0.00 H new ATOM 398 N GLY A 28 5.033 -1.614 -7.322 1.00 0.00 N ATOM 399 CA GLY A 28 5.747 -2.696 -6.670 1.00 0.00 C ATOM 400 C GLY A 28 4.817 -3.773 -6.147 1.00 0.00 C ATOM 401 O GLY A 28 3.610 -3.569 -6.012 1.00 0.00 O ATOM 0 H GLY A 28 4.160 -1.887 -7.773 1.00 0.00 H new ATOM 0 HA2 GLY A 28 6.451 -3.139 -7.375 1.00 0.00 H new ATOM 0 HA3 GLY A 28 6.333 -2.294 -5.844 1.00 0.00 H new ATOM 405 N PRO A 29 5.380 -4.952 -5.846 1.00 0.00 N ATOM 406 CA PRO A 29 4.611 -6.089 -5.332 1.00 0.00 C ATOM 407 C PRO A 29 4.109 -5.854 -3.911 1.00 0.00 C ATOM 408 O PRO A 29 3.031 -6.315 -3.539 1.00 0.00 O ATOM 409 CB PRO A 29 5.618 -7.241 -5.360 1.00 0.00 C ATOM 410 CG PRO A 29 6.951 -6.582 -5.267 1.00 0.00 C ATOM 411 CD PRO A 29 6.812 -5.266 -5.983 1.00 0.00 C ATOM 0 HA PRO A 29 3.714 -6.275 -5.923 1.00 0.00 H new ATOM 0 HB2 PRO A 29 5.457 -7.928 -4.529 1.00 0.00 H new ATOM 0 HB3 PRO A 29 5.528 -7.824 -6.277 1.00 0.00 H new ATOM 0 HG2 PRO A 29 7.241 -6.432 -4.227 1.00 0.00 H new ATOM 0 HG3 PRO A 29 7.724 -7.197 -5.728 1.00 0.00 H new ATOM 0 HD2 PRO A 29 7.437 -4.495 -5.532 1.00 0.00 H new ATOM 0 HD3 PRO A 29 7.108 -5.345 -7.029 1.00 0.00 H new ATOM 419 N GLY A 30 4.899 -5.133 -3.121 1.00 0.00 N ATOM 420 CA GLY A 30 4.517 -4.850 -1.750 1.00 0.00 C ATOM 421 C GLY A 30 3.220 -4.071 -1.658 1.00 0.00 C ATOM 422 O GLY A 30 2.549 -4.088 -0.626 1.00 0.00 O ATOM 0 H GLY A 30 5.796 -4.740 -3.406 1.00 0.00 H new ATOM 0 HA2 GLY A 30 4.413 -5.788 -1.204 1.00 0.00 H new ATOM 0 HA3 GLY A 30 5.312 -4.284 -1.264 1.00 0.00 H new ATOM 426 N ILE A 31 2.866 -3.384 -2.740 1.00 0.00 N ATOM 427 CA ILE A 31 1.642 -2.595 -2.776 1.00 0.00 C ATOM 428 C ILE A 31 0.642 -3.177 -3.769 1.00 0.00 C ATOM 429 O ILE A 31 -0.552 -2.886 -3.706 1.00 0.00 O ATOM 430 CB ILE A 31 1.927 -1.129 -3.153 1.00 0.00 C ATOM 431 CG1 ILE A 31 0.750 -0.238 -2.753 1.00 0.00 C ATOM 432 CG2 ILE A 31 2.206 -1.010 -4.644 1.00 0.00 C ATOM 433 CD1 ILE A 31 0.694 0.060 -1.271 1.00 0.00 C ATOM 0 H ILE A 31 3.410 -3.359 -3.602 1.00 0.00 H new ATOM 0 HA ILE A 31 1.217 -2.628 -1.773 1.00 0.00 H new ATOM 0 HB ILE A 31 2.811 -0.795 -2.610 1.00 0.00 H new ATOM 0 HG12 ILE A 31 0.813 0.701 -3.302 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -0.180 -0.721 -3.054 1.00 0.00 H new ATOM 0 HG21 ILE A 31 2.406 0.032 -4.895 1.00 0.00 H new ATOM 0 HG22 ILE A 31 3.073 -1.618 -4.901 1.00 0.00 H new ATOM 0 HG23 ILE A 31 1.339 -1.359 -5.205 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -0.165 0.696 -1.060 1.00 0.00 H new ATOM 0 HD12 ILE A 31 0.600 -0.873 -0.716 1.00 0.00 H new ATOM 0 HD13 ILE A 31 1.607 0.572 -0.968 1.00 0.00 H new ATOM 445 N GLU A 32 1.138 -4.004 -4.685 1.00 0.00 N ATOM 446 CA GLU A 32 0.287 -4.628 -5.691 1.00 0.00 C ATOM 447 C GLU A 32 -0.271 -5.955 -5.184 1.00 0.00 C ATOM 448 O GLU A 32 -1.466 -6.223 -5.298 1.00 0.00 O ATOM 449 CB GLU A 32 1.070 -4.853 -6.986 1.00 0.00 C ATOM 450 CG GLU A 32 1.424 -3.567 -7.714 1.00 0.00 C ATOM 451 CD GLU A 32 0.308 -3.082 -8.618 1.00 0.00 C ATOM 452 OE1 GLU A 32 -0.822 -2.899 -8.120 1.00 0.00 O ATOM 453 OE2 GLU A 32 0.565 -2.886 -9.824 1.00 0.00 O ATOM 0 H GLU A 32 2.124 -4.257 -4.751 1.00 0.00 H new ATOM 0 HA GLU A 32 -0.547 -3.956 -5.892 1.00 0.00 H new ATOM 0 HB2 GLU A 32 1.987 -5.395 -6.757 1.00 0.00 H new ATOM 0 HB3 GLU A 32 0.483 -5.487 -7.650 1.00 0.00 H new ATOM 0 HG2 GLU A 32 1.657 -2.793 -6.983 1.00 0.00 H new ATOM 0 HG3 GLU A 32 2.324 -3.726 -8.308 1.00 0.00 H new ATOM 460 N GLY A 33 0.606 -6.784 -4.624 1.00 0.00 N ATOM 461 CA GLY A 33 0.184 -8.073 -4.108 1.00 0.00 C ATOM 462 C GLY A 33 0.641 -9.224 -4.982 1.00 0.00 C ATOM 463 O GLY A 33 -0.138 -10.125 -5.293 1.00 0.00 O ATOM 0 H GLY A 33 1.601 -6.585 -4.519 1.00 0.00 H new ATOM 0 HA2 GLY A 33 0.580 -8.205 -3.101 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -0.903 -8.091 -4.028 1.00 0.00 H new ATOM 467 N LYS A 34 1.908 -9.195 -5.381 1.00 0.00 N ATOM 468 CA LYS A 34 2.469 -10.244 -6.224 1.00 0.00 C ATOM 469 C LYS A 34 3.248 -11.255 -5.390 1.00 0.00 C ATOM 470 O LYS A 34 2.825 -12.401 -5.231 1.00 0.00 O ATOM 471 CB LYS A 34 3.383 -9.635 -7.290 1.00 0.00 C ATOM 472 CG LYS A 34 2.786 -8.422 -7.983 1.00 0.00 C ATOM 473 CD LYS A 34 1.578 -8.799 -8.823 1.00 0.00 C ATOM 474 CE LYS A 34 1.978 -9.151 -10.248 1.00 0.00 C ATOM 475 NZ LYS A 34 2.306 -10.596 -10.391 1.00 0.00 N ATOM 0 H LYS A 34 2.566 -8.456 -5.134 1.00 0.00 H new ATOM 0 HA LYS A 34 1.644 -10.762 -6.713 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.328 -9.350 -6.827 1.00 0.00 H new ATOM 0 HB3 LYS A 34 3.611 -10.394 -8.038 1.00 0.00 H new ATOM 0 HG2 LYS A 34 2.495 -7.682 -7.237 1.00 0.00 H new ATOM 0 HG3 LYS A 34 3.540 -7.956 -8.617 1.00 0.00 H new ATOM 0 HD2 LYS A 34 1.067 -9.647 -8.367 1.00 0.00 H new ATOM 0 HD3 LYS A 34 0.870 -7.970 -8.837 1.00 0.00 H new ATOM 0 HE2 LYS A 34 1.165 -8.894 -10.927 1.00 0.00 H new ATOM 0 HE3 LYS A 34 2.840 -8.552 -10.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 2.127 -10.897 -11.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 3.308 -10.749 -10.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 1.712 -11.153 -9.744 1.00 0.00 H new ATOM 489 N ASP A 35 4.387 -10.825 -4.857 1.00 0.00 N ATOM 490 CA ASP A 35 5.223 -11.692 -4.036 1.00 0.00 C ATOM 491 C ASP A 35 5.055 -11.366 -2.556 1.00 0.00 C ATOM 492 O ASP A 35 5.962 -11.589 -1.753 1.00 0.00 O ATOM 493 CB ASP A 35 6.692 -11.551 -4.439 1.00 0.00 C ATOM 494 CG ASP A 35 7.089 -10.108 -4.680 1.00 0.00 C ATOM 495 OD1 ASP A 35 7.423 -9.412 -3.697 1.00 0.00 O ATOM 496 OD2 ASP A 35 7.068 -9.674 -5.850 1.00 0.00 O ATOM 0 H ASP A 35 4.752 -9.880 -4.979 1.00 0.00 H new ATOM 0 HA ASP A 35 4.907 -12.722 -4.201 1.00 0.00 H new ATOM 0 HB2 ASP A 35 7.323 -11.973 -3.656 1.00 0.00 H new ATOM 0 HB3 ASP A 35 6.875 -12.131 -5.343 1.00 0.00 H new ATOM 501 N VAL A 36 3.889 -10.837 -2.200 1.00 0.00 N ATOM 502 CA VAL A 36 3.602 -10.480 -0.816 1.00 0.00 C ATOM 503 C VAL A 36 3.193 -11.705 -0.006 1.00 0.00 C ATOM 504 O VAL A 36 2.690 -11.585 1.111 1.00 0.00 O ATOM 505 CB VAL A 36 2.483 -9.425 -0.729 1.00 0.00 C ATOM 506 CG1 VAL A 36 2.311 -8.946 0.705 1.00 0.00 C ATOM 507 CG2 VAL A 36 2.780 -8.257 -1.657 1.00 0.00 C ATOM 0 H VAL A 36 3.128 -10.646 -2.851 1.00 0.00 H new ATOM 0 HA VAL A 36 4.519 -10.062 -0.400 1.00 0.00 H new ATOM 0 HB VAL A 36 1.548 -9.885 -1.048 1.00 0.00 H new ATOM 0 HG11 VAL A 36 1.516 -8.201 0.747 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.050 -9.791 1.342 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.243 -8.502 1.055 1.00 0.00 H new ATOM 0 HG21 VAL A 36 1.979 -7.521 -1.583 1.00 0.00 H new ATOM 0 HG22 VAL A 36 3.725 -7.796 -1.370 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.849 -8.616 -2.684 1.00 0.00 H new ATOM 517 N PHE A 37 3.414 -12.885 -0.576 1.00 0.00 N ATOM 518 CA PHE A 37 3.069 -14.134 0.093 1.00 0.00 C ATOM 519 C PHE A 37 3.487 -14.099 1.560 1.00 0.00 C ATOM 520 O PHE A 37 4.468 -13.449 1.921 1.00 0.00 O ATOM 521 CB PHE A 37 3.737 -15.316 -0.611 1.00 0.00 C ATOM 522 CG PHE A 37 3.689 -15.226 -2.110 1.00 0.00 C ATOM 523 CD1 PHE A 37 2.527 -14.839 -2.757 1.00 0.00 C ATOM 524 CD2 PHE A 37 4.806 -15.529 -2.871 1.00 0.00 C ATOM 525 CE1 PHE A 37 2.480 -14.754 -4.136 1.00 0.00 C ATOM 526 CE2 PHE A 37 4.765 -15.446 -4.250 1.00 0.00 C ATOM 527 CZ PHE A 37 3.600 -15.059 -4.884 1.00 0.00 C ATOM 0 H PHE A 37 3.830 -13.002 -1.500 1.00 0.00 H new ATOM 0 HA PHE A 37 1.987 -14.256 0.045 1.00 0.00 H new ATOM 0 HB2 PHE A 37 4.777 -15.378 -0.292 1.00 0.00 H new ATOM 0 HB3 PHE A 37 3.251 -16.239 -0.295 1.00 0.00 H new ATOM 0 HD1 PHE A 37 1.647 -14.601 -2.177 1.00 0.00 H new ATOM 0 HD2 PHE A 37 5.719 -15.834 -2.381 1.00 0.00 H new ATOM 0 HE1 PHE A 37 1.568 -14.449 -4.628 1.00 0.00 H new ATOM 0 HE2 PHE A 37 5.643 -15.684 -4.832 1.00 0.00 H new ATOM 0 HZ PHE A 37 3.565 -14.995 -5.962 1.00 0.00 H new ATOM 537 N ARG A 38 2.736 -14.803 2.401 1.00 0.00 N ATOM 538 CA ARG A 38 3.027 -14.851 3.828 1.00 0.00 C ATOM 539 C ARG A 38 4.484 -15.229 4.074 1.00 0.00 C ATOM 540 O ARG A 38 5.018 -16.130 3.427 1.00 0.00 O ATOM 541 CB ARG A 38 2.104 -15.853 4.525 1.00 0.00 C ATOM 542 CG ARG A 38 1.952 -15.607 6.017 1.00 0.00 C ATOM 543 CD ARG A 38 1.081 -16.668 6.671 1.00 0.00 C ATOM 544 NE ARG A 38 1.354 -16.795 8.100 1.00 0.00 N ATOM 545 CZ ARG A 38 0.916 -17.803 8.845 1.00 0.00 C ATOM 546 NH1 ARG A 38 0.189 -18.768 8.299 1.00 0.00 N ATOM 547 NH2 ARG A 38 1.206 -17.849 10.139 1.00 0.00 N ATOM 0 H ARG A 38 1.921 -15.348 2.118 1.00 0.00 H new ATOM 0 HA ARG A 38 2.853 -13.858 4.242 1.00 0.00 H new ATOM 0 HB2 ARG A 38 1.120 -15.814 4.057 1.00 0.00 H new ATOM 0 HB3 ARG A 38 2.491 -16.860 4.369 1.00 0.00 H new ATOM 0 HG2 ARG A 38 2.935 -15.601 6.488 1.00 0.00 H new ATOM 0 HG3 ARG A 38 1.514 -14.623 6.182 1.00 0.00 H new ATOM 0 HD2 ARG A 38 0.031 -16.416 6.523 1.00 0.00 H new ATOM 0 HD3 ARG A 38 1.250 -17.628 6.183 1.00 0.00 H new ATOM 0 HE ARG A 38 1.912 -16.070 8.550 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -0.035 -18.737 7.304 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -0.146 -19.541 8.874 1.00 0.00 H new ATOM 0 HH21 ARG A 38 1.766 -17.109 10.563 1.00 0.00 H new ATOM 0 HH22 ARG A 38 0.869 -18.624 10.710 1.00 0.00 H new ATOM 561 N GLU A 39 5.121 -14.534 5.011 1.00 0.00 N ATOM 562 CA GLU A 39 6.517 -14.797 5.339 1.00 0.00 C ATOM 563 C GLU A 39 7.425 -14.477 4.155 1.00 0.00 C ATOM 564 O GLU A 39 8.506 -15.047 4.016 1.00 0.00 O ATOM 565 CB GLU A 39 6.700 -16.258 5.755 1.00 0.00 C ATOM 566 CG GLU A 39 5.853 -16.661 6.951 1.00 0.00 C ATOM 567 CD GLU A 39 5.627 -18.159 7.027 1.00 0.00 C ATOM 568 OE1 GLU A 39 5.121 -18.734 6.041 1.00 0.00 O ATOM 569 OE2 GLU A 39 5.957 -18.755 8.074 1.00 0.00 O ATOM 0 H GLU A 39 4.693 -13.785 5.556 1.00 0.00 H new ATOM 0 HA GLU A 39 6.795 -14.151 6.172 1.00 0.00 H new ATOM 0 HB2 GLU A 39 6.451 -16.901 4.911 1.00 0.00 H new ATOM 0 HB3 GLU A 39 7.750 -16.432 5.989 1.00 0.00 H new ATOM 0 HG2 GLU A 39 6.339 -16.324 7.866 1.00 0.00 H new ATOM 0 HG3 GLU A 39 4.890 -16.154 6.897 1.00 0.00 H new ATOM 576 N ALA A 40 6.976 -13.560 3.304 1.00 0.00 N ATOM 577 CA ALA A 40 7.746 -13.162 2.133 1.00 0.00 C ATOM 578 C ALA A 40 8.198 -11.710 2.240 1.00 0.00 C ATOM 579 O ALA A 40 7.463 -10.854 2.735 1.00 0.00 O ATOM 580 CB ALA A 40 6.928 -13.371 0.867 1.00 0.00 C ATOM 0 H ALA A 40 6.082 -13.079 3.404 1.00 0.00 H new ATOM 0 HA ALA A 40 8.636 -13.789 2.084 1.00 0.00 H new ATOM 0 HB1 ALA A 40 7.516 -13.069 0.000 1.00 0.00 H new ATOM 0 HB2 ALA A 40 6.661 -14.424 0.776 1.00 0.00 H new ATOM 0 HB3 ALA A 40 6.020 -12.770 0.917 1.00 0.00 H new ATOM 586 N THR A 41 9.412 -11.436 1.773 1.00 0.00 N ATOM 587 CA THR A 41 9.962 -10.087 1.819 1.00 0.00 C ATOM 588 C THR A 41 9.523 -9.273 0.607 1.00 0.00 C ATOM 589 O THR A 41 10.100 -9.391 -0.475 1.00 0.00 O ATOM 590 CB THR A 41 11.501 -10.110 1.878 1.00 0.00 C ATOM 591 OG1 THR A 41 11.938 -10.952 2.950 1.00 0.00 O ATOM 592 CG2 THR A 41 12.056 -8.706 2.071 1.00 0.00 C ATOM 0 H THR A 41 10.033 -12.131 1.358 1.00 0.00 H new ATOM 0 HA THR A 41 9.578 -9.619 2.726 1.00 0.00 H new ATOM 0 HB THR A 41 11.873 -10.504 0.932 1.00 0.00 H new ATOM 0 HG1 THR A 41 12.918 -10.962 2.979 1.00 0.00 H new ATOM 0 HG21 THR A 41 13.145 -8.747 2.110 1.00 0.00 H new ATOM 0 HG22 THR A 41 11.746 -8.075 1.238 1.00 0.00 H new ATOM 0 HG23 THR A 41 11.675 -8.289 3.003 1.00 0.00 H new ATOM 600 N THR A 42 8.499 -8.446 0.794 1.00 0.00 N ATOM 601 CA THR A 42 7.983 -7.613 -0.285 1.00 0.00 C ATOM 602 C THR A 42 8.115 -6.133 0.053 1.00 0.00 C ATOM 603 O THR A 42 7.982 -5.736 1.211 1.00 0.00 O ATOM 604 CB THR A 42 6.505 -7.930 -0.581 1.00 0.00 C ATOM 605 OG1 THR A 42 6.100 -7.288 -1.795 1.00 0.00 O ATOM 606 CG2 THR A 42 5.613 -7.473 0.563 1.00 0.00 C ATOM 0 H THR A 42 8.011 -8.335 1.683 1.00 0.00 H new ATOM 0 HA THR A 42 8.579 -7.836 -1.170 1.00 0.00 H new ATOM 0 HB THR A 42 6.403 -9.010 -0.690 1.00 0.00 H new ATOM 0 HG1 THR A 42 6.437 -7.796 -2.562 1.00 0.00 H new ATOM 0 HG21 THR A 42 4.574 -7.708 0.331 1.00 0.00 H new ATOM 0 HG22 THR A 42 5.905 -7.986 1.479 1.00 0.00 H new ATOM 0 HG23 THR A 42 5.720 -6.397 0.700 1.00 0.00 H new ATOM 614 N ASP A 43 8.377 -5.320 -0.964 1.00 0.00 N ATOM 615 CA ASP A 43 8.525 -3.881 -0.775 1.00 0.00 C ATOM 616 C ASP A 43 8.096 -3.121 -2.026 1.00 0.00 C ATOM 617 O ASP A 43 8.109 -3.666 -3.131 1.00 0.00 O ATOM 618 CB ASP A 43 9.975 -3.538 -0.427 1.00 0.00 C ATOM 619 CG ASP A 43 10.923 -3.787 -1.583 1.00 0.00 C ATOM 620 OD1 ASP A 43 10.553 -3.469 -2.733 1.00 0.00 O ATOM 621 OD2 ASP A 43 12.034 -4.300 -1.338 1.00 0.00 O ATOM 0 H ASP A 43 8.491 -5.632 -1.928 1.00 0.00 H new ATOM 0 HA ASP A 43 7.880 -3.579 0.050 1.00 0.00 H new ATOM 0 HB2 ASP A 43 10.036 -2.491 -0.130 1.00 0.00 H new ATOM 0 HB3 ASP A 43 10.290 -4.132 0.431 1.00 0.00 H new ATOM 626 N PHE A 44 7.715 -1.861 -1.846 1.00 0.00 N ATOM 627 CA PHE A 44 7.280 -1.027 -2.960 1.00 0.00 C ATOM 628 C PHE A 44 8.110 0.251 -3.039 1.00 0.00 C ATOM 629 O PHE A 44 8.935 0.525 -2.167 1.00 0.00 O ATOM 630 CB PHE A 44 5.797 -0.677 -2.814 1.00 0.00 C ATOM 631 CG PHE A 44 5.472 0.034 -1.531 1.00 0.00 C ATOM 632 CD1 PHE A 44 5.184 -0.682 -0.381 1.00 0.00 C ATOM 633 CD2 PHE A 44 5.456 1.418 -1.476 1.00 0.00 C ATOM 634 CE1 PHE A 44 4.884 -0.030 0.800 1.00 0.00 C ATOM 635 CE2 PHE A 44 5.157 2.076 -0.298 1.00 0.00 C ATOM 636 CZ PHE A 44 4.872 1.350 0.842 1.00 0.00 C ATOM 0 H PHE A 44 7.699 -1.395 -0.939 1.00 0.00 H new ATOM 0 HA PHE A 44 7.424 -1.591 -3.882 1.00 0.00 H new ATOM 0 HB2 PHE A 44 5.495 -0.051 -3.654 1.00 0.00 H new ATOM 0 HB3 PHE A 44 5.208 -1.593 -2.872 1.00 0.00 H new ATOM 0 HD1 PHE A 44 5.194 -1.762 -0.407 1.00 0.00 H new ATOM 0 HD2 PHE A 44 5.680 1.990 -2.364 1.00 0.00 H new ATOM 0 HE1 PHE A 44 4.659 -0.600 1.690 1.00 0.00 H new ATOM 0 HE2 PHE A 44 5.146 3.156 -0.269 1.00 0.00 H new ATOM 0 HZ PHE A 44 4.640 1.861 1.765 1.00 0.00 H new ATOM 646 N THR A 45 7.885 1.031 -4.092 1.00 0.00 N ATOM 647 CA THR A 45 8.612 2.279 -4.287 1.00 0.00 C ATOM 648 C THR A 45 7.654 3.452 -4.465 1.00 0.00 C ATOM 649 O THR A 45 6.732 3.395 -5.278 1.00 0.00 O ATOM 650 CB THR A 45 9.543 2.201 -5.512 1.00 0.00 C ATOM 651 OG1 THR A 45 10.456 1.108 -5.365 1.00 0.00 O ATOM 652 CG2 THR A 45 10.320 3.498 -5.684 1.00 0.00 C ATOM 0 H THR A 45 7.205 0.820 -4.823 1.00 0.00 H new ATOM 0 HA THR A 45 9.213 2.437 -3.392 1.00 0.00 H new ATOM 0 HB THR A 45 8.929 2.043 -6.398 1.00 0.00 H new ATOM 0 HG1 THR A 45 11.205 1.382 -4.796 1.00 0.00 H new ATOM 0 HG21 THR A 45 10.971 3.420 -6.555 1.00 0.00 H new ATOM 0 HG22 THR A 45 9.623 4.324 -5.825 1.00 0.00 H new ATOM 0 HG23 THR A 45 10.924 3.681 -4.795 1.00 0.00 H new ATOM 660 N VAL A 46 7.879 4.515 -3.699 1.00 0.00 N ATOM 661 CA VAL A 46 7.037 5.702 -3.774 1.00 0.00 C ATOM 662 C VAL A 46 7.716 6.809 -4.572 1.00 0.00 C ATOM 663 O VAL A 46 8.745 7.344 -4.159 1.00 0.00 O ATOM 664 CB VAL A 46 6.692 6.235 -2.370 1.00 0.00 C ATOM 665 CG1 VAL A 46 5.894 7.526 -2.470 1.00 0.00 C ATOM 666 CG2 VAL A 46 5.927 5.186 -1.576 1.00 0.00 C ATOM 0 H VAL A 46 8.637 4.578 -3.020 1.00 0.00 H new ATOM 0 HA VAL A 46 6.118 5.406 -4.279 1.00 0.00 H new ATOM 0 HB VAL A 46 7.622 6.451 -1.843 1.00 0.00 H new ATOM 0 HG11 VAL A 46 5.660 7.887 -1.469 1.00 0.00 H new ATOM 0 HG12 VAL A 46 6.481 8.277 -2.998 1.00 0.00 H new ATOM 0 HG13 VAL A 46 4.968 7.340 -3.015 1.00 0.00 H new ATOM 0 HG21 VAL A 46 5.691 5.579 -0.587 1.00 0.00 H new ATOM 0 HG22 VAL A 46 5.003 4.937 -2.098 1.00 0.00 H new ATOM 0 HG23 VAL A 46 6.538 4.289 -1.474 1.00 0.00 H new ATOM 676 N ASP A 47 7.134 7.148 -5.717 1.00 0.00 N ATOM 677 CA ASP A 47 7.682 8.193 -6.573 1.00 0.00 C ATOM 678 C ASP A 47 7.185 9.569 -6.139 1.00 0.00 C ATOM 679 O ASP A 47 5.980 9.818 -6.093 1.00 0.00 O ATOM 680 CB ASP A 47 7.302 7.938 -8.033 1.00 0.00 C ATOM 681 CG ASP A 47 8.339 8.470 -9.003 1.00 0.00 C ATOM 682 OD1 ASP A 47 8.303 9.682 -9.302 1.00 0.00 O ATOM 683 OD2 ASP A 47 9.185 7.675 -9.463 1.00 0.00 O ATOM 0 H ASP A 47 6.283 6.714 -6.074 1.00 0.00 H new ATOM 0 HA ASP A 47 8.768 8.172 -6.479 1.00 0.00 H new ATOM 0 HB2 ASP A 47 7.177 6.867 -8.191 1.00 0.00 H new ATOM 0 HB3 ASP A 47 6.340 8.406 -8.242 1.00 0.00 H new ATOM 688 N SER A 48 8.121 10.457 -5.820 1.00 0.00 N ATOM 689 CA SER A 48 7.777 11.806 -5.384 1.00 0.00 C ATOM 690 C SER A 48 8.637 12.843 -6.100 1.00 0.00 C ATOM 691 O SER A 48 9.837 12.647 -6.289 1.00 0.00 O ATOM 692 CB SER A 48 7.956 11.936 -3.870 1.00 0.00 C ATOM 693 OG SER A 48 9.210 11.421 -3.458 1.00 0.00 O ATOM 0 H SER A 48 9.123 10.267 -5.855 1.00 0.00 H new ATOM 0 HA SER A 48 6.732 11.988 -5.636 1.00 0.00 H new ATOM 0 HB2 SER A 48 7.877 12.984 -3.580 1.00 0.00 H new ATOM 0 HB3 SER A 48 7.155 11.402 -3.359 1.00 0.00 H new ATOM 0 HG SER A 48 9.844 11.468 -4.204 1.00 0.00 H new ATOM 699 N ARG A 49 8.013 13.948 -6.496 1.00 0.00 N ATOM 700 CA ARG A 49 8.719 15.016 -7.192 1.00 0.00 C ATOM 701 C ARG A 49 8.540 16.348 -6.469 1.00 0.00 C ATOM 702 O ARG A 49 9.463 16.874 -5.847 1.00 0.00 O ATOM 703 CB ARG A 49 8.217 15.135 -8.632 1.00 0.00 C ATOM 704 CG ARG A 49 9.081 14.395 -9.641 1.00 0.00 C ATOM 705 CD ARG A 49 8.328 14.140 -10.938 1.00 0.00 C ATOM 706 NE ARG A 49 9.228 13.789 -12.033 1.00 0.00 N ATOM 707 CZ ARG A 49 8.823 13.225 -13.165 1.00 0.00 C ATOM 708 NH1 ARG A 49 7.539 12.950 -13.351 1.00 0.00 N ATOM 709 NH2 ARG A 49 9.703 12.935 -14.116 1.00 0.00 N ATOM 0 H ARG A 49 7.020 14.126 -6.346 1.00 0.00 H new ATOM 0 HA ARG A 49 9.780 14.768 -7.203 1.00 0.00 H new ATOM 0 HB2 ARG A 49 7.199 14.749 -8.686 1.00 0.00 H new ATOM 0 HB3 ARG A 49 8.174 16.189 -8.907 1.00 0.00 H new ATOM 0 HG2 ARG A 49 9.979 14.977 -9.849 1.00 0.00 H new ATOM 0 HG3 ARG A 49 9.407 13.446 -9.216 1.00 0.00 H new ATOM 0 HD2 ARG A 49 7.609 13.335 -10.787 1.00 0.00 H new ATOM 0 HD3 ARG A 49 7.759 15.030 -11.208 1.00 0.00 H new ATOM 0 HE ARG A 49 10.222 13.988 -11.922 1.00 0.00 H new ATOM 0 HH11 ARG A 49 6.859 13.172 -12.623 1.00 0.00 H new ATOM 0 HH12 ARG A 49 7.231 12.517 -14.222 1.00 0.00 H new ATOM 0 HH21 ARG A 49 10.691 13.145 -13.978 1.00 0.00 H new ATOM 0 HH22 ARG A 49 9.391 12.502 -14.985 1.00 0.00 H new ATOM 723 N PRO A 50 7.323 16.907 -6.551 1.00 0.00 N ATOM 724 CA PRO A 50 6.994 18.184 -5.910 1.00 0.00 C ATOM 725 C PRO A 50 6.949 18.075 -4.390 1.00 0.00 C ATOM 726 O PRO A 50 6.598 19.033 -3.699 1.00 0.00 O ATOM 727 CB PRO A 50 5.605 18.511 -6.465 1.00 0.00 C ATOM 728 CG PRO A 50 5.021 17.190 -6.828 1.00 0.00 C ATOM 729 CD PRO A 50 6.175 16.336 -7.275 1.00 0.00 C ATOM 0 HA PRO A 50 7.742 18.949 -6.117 1.00 0.00 H new ATOM 0 HB2 PRO A 50 4.993 19.024 -5.723 1.00 0.00 H new ATOM 0 HB3 PRO A 50 5.670 19.167 -7.333 1.00 0.00 H new ATOM 0 HG2 PRO A 50 4.511 16.741 -5.976 1.00 0.00 H new ATOM 0 HG3 PRO A 50 4.282 17.295 -7.623 1.00 0.00 H new ATOM 0 HD2 PRO A 50 6.021 15.287 -7.021 1.00 0.00 H new ATOM 0 HD3 PRO A 50 6.316 16.385 -8.355 1.00 0.00 H new ATOM 737 N LEU A 51 7.307 16.904 -3.875 1.00 0.00 N ATOM 738 CA LEU A 51 7.308 16.671 -2.435 1.00 0.00 C ATOM 739 C LEU A 51 8.733 16.585 -1.898 1.00 0.00 C ATOM 740 O LEU A 51 9.069 17.213 -0.893 1.00 0.00 O ATOM 741 CB LEU A 51 6.549 15.384 -2.106 1.00 0.00 C ATOM 742 CG LEU A 51 5.262 15.144 -2.896 1.00 0.00 C ATOM 743 CD1 LEU A 51 4.503 13.953 -2.330 1.00 0.00 C ATOM 744 CD2 LEU A 51 4.388 16.390 -2.884 1.00 0.00 C ATOM 0 H LEU A 51 7.600 16.102 -4.433 1.00 0.00 H new ATOM 0 HA LEU A 51 6.809 17.513 -1.956 1.00 0.00 H new ATOM 0 HB2 LEU A 51 7.217 14.539 -2.273 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.304 15.392 -1.044 1.00 0.00 H new ATOM 0 HG LEU A 51 5.529 14.922 -3.929 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.590 13.797 -2.905 1.00 0.00 H new ATOM 0 HD12 LEU A 51 5.127 13.061 -2.391 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.248 14.146 -1.288 1.00 0.00 H new ATOM 0 HD21 LEU A 51 3.477 16.201 -3.451 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.130 16.643 -1.856 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.931 17.220 -3.337 1.00 0.00 H new ATOM 756 N THR A 52 9.569 15.805 -2.575 1.00 0.00 N ATOM 757 CA THR A 52 10.959 15.638 -2.168 1.00 0.00 C ATOM 758 C THR A 52 11.886 15.601 -3.377 1.00 0.00 C ATOM 759 O THR A 52 11.429 15.533 -4.518 1.00 0.00 O ATOM 760 CB THR A 52 11.152 14.349 -1.347 1.00 0.00 C ATOM 761 OG1 THR A 52 12.403 14.395 -0.651 1.00 0.00 O ATOM 762 CG2 THR A 52 11.111 13.123 -2.247 1.00 0.00 C ATOM 0 H THR A 52 9.308 15.278 -3.409 1.00 0.00 H new ATOM 0 HA THR A 52 11.212 16.497 -1.547 1.00 0.00 H new ATOM 0 HB THR A 52 10.338 14.278 -0.626 1.00 0.00 H new ATOM 0 HG1 THR A 52 12.510 13.580 -0.117 1.00 0.00 H new ATOM 0 HG21 THR A 52 11.249 12.225 -1.645 1.00 0.00 H new ATOM 0 HG22 THR A 52 10.147 13.075 -2.753 1.00 0.00 H new ATOM 0 HG23 THR A 52 11.907 13.189 -2.988 1.00 0.00 H new ATOM 770 N GLN A 53 13.189 15.646 -3.120 1.00 0.00 N ATOM 771 CA GLN A 53 14.180 15.617 -4.189 1.00 0.00 C ATOM 772 C GLN A 53 15.312 14.650 -3.856 1.00 0.00 C ATOM 773 O GLN A 53 15.800 13.927 -4.725 1.00 0.00 O ATOM 774 CB GLN A 53 14.744 17.018 -4.428 1.00 0.00 C ATOM 775 CG GLN A 53 13.676 18.065 -4.701 1.00 0.00 C ATOM 776 CD GLN A 53 13.062 17.927 -6.080 1.00 0.00 C ATOM 777 OE1 GLN A 53 13.685 18.268 -7.087 1.00 0.00 O ATOM 778 NE2 GLN A 53 11.835 17.424 -6.134 1.00 0.00 N ATOM 0 H GLN A 53 13.583 15.703 -2.181 1.00 0.00 H new ATOM 0 HA GLN A 53 13.687 15.272 -5.098 1.00 0.00 H new ATOM 0 HB2 GLN A 53 15.324 17.321 -3.556 1.00 0.00 H new ATOM 0 HB3 GLN A 53 15.432 16.984 -5.272 1.00 0.00 H new ATOM 0 HG2 GLN A 53 12.892 17.983 -3.948 1.00 0.00 H new ATOM 0 HG3 GLN A 53 14.112 19.059 -4.600 1.00 0.00 H new ATOM 0 HE21 GLN A 53 11.356 17.155 -5.275 1.00 0.00 H new ATOM 0 HE22 GLN A 53 11.371 17.307 -7.035 1.00 0.00 H new ATOM 787 N VAL A 54 15.725 14.643 -2.593 1.00 0.00 N ATOM 788 CA VAL A 54 16.799 13.764 -2.145 1.00 0.00 C ATOM 789 C VAL A 54 16.269 12.676 -1.218 1.00 0.00 C ATOM 790 O VAL A 54 16.899 12.337 -0.218 1.00 0.00 O ATOM 791 CB VAL A 54 17.902 14.554 -1.415 1.00 0.00 C ATOM 792 CG1 VAL A 54 18.446 15.661 -2.305 1.00 0.00 C ATOM 793 CG2 VAL A 54 17.372 15.122 -0.107 1.00 0.00 C ATOM 0 H VAL A 54 15.332 15.236 -1.862 1.00 0.00 H new ATOM 0 HA VAL A 54 17.223 13.302 -3.037 1.00 0.00 H new ATOM 0 HB VAL A 54 18.721 13.872 -1.184 1.00 0.00 H new ATOM 0 HG11 VAL A 54 19.224 16.207 -1.772 1.00 0.00 H new ATOM 0 HG12 VAL A 54 18.865 15.226 -3.212 1.00 0.00 H new ATOM 0 HG13 VAL A 54 17.639 16.344 -2.570 1.00 0.00 H new ATOM 0 HG21 VAL A 54 18.164 15.677 0.396 1.00 0.00 H new ATOM 0 HG22 VAL A 54 16.535 15.790 -0.313 1.00 0.00 H new ATOM 0 HG23 VAL A 54 17.037 14.307 0.534 1.00 0.00 H new ATOM 803 N GLY A 55 15.105 12.132 -1.559 1.00 0.00 N ATOM 804 CA GLY A 55 14.509 11.087 -0.747 1.00 0.00 C ATOM 805 C GLY A 55 13.730 11.640 0.430 1.00 0.00 C ATOM 806 O GLY A 55 12.513 11.806 0.355 1.00 0.00 O ATOM 0 H GLY A 55 14.564 12.396 -2.383 1.00 0.00 H new ATOM 0 HA2 GLY A 55 13.845 10.484 -1.367 1.00 0.00 H new ATOM 0 HA3 GLY A 55 15.293 10.424 -0.381 1.00 0.00 H new ATOM 810 N GLY A 56 14.433 11.927 1.521 1.00 0.00 N ATOM 811 CA GLY A 56 13.782 12.460 2.704 1.00 0.00 C ATOM 812 C GLY A 56 13.300 11.370 3.641 1.00 0.00 C ATOM 813 O GLY A 56 13.387 10.184 3.322 1.00 0.00 O ATOM 0 H GLY A 56 15.441 11.800 1.607 1.00 0.00 H new ATOM 0 HA2 GLY A 56 14.477 13.111 3.235 1.00 0.00 H new ATOM 0 HA3 GLY A 56 12.935 13.076 2.402 1.00 0.00 H new ATOM 817 N ASP A 57 12.792 11.772 4.801 1.00 0.00 N ATOM 818 CA ASP A 57 12.294 10.821 5.788 1.00 0.00 C ATOM 819 C ASP A 57 10.934 11.256 6.324 1.00 0.00 C ATOM 820 O ASP A 57 10.659 11.137 7.519 1.00 0.00 O ATOM 821 CB ASP A 57 13.290 10.682 6.941 1.00 0.00 C ATOM 822 CG ASP A 57 12.931 9.549 7.882 1.00 0.00 C ATOM 823 OD1 ASP A 57 12.324 8.562 7.418 1.00 0.00 O ATOM 824 OD2 ASP A 57 13.257 9.650 9.084 1.00 0.00 O ATOM 0 H ASP A 57 12.714 12.750 5.081 1.00 0.00 H new ATOM 0 HA ASP A 57 12.179 9.854 5.299 1.00 0.00 H new ATOM 0 HB2 ASP A 57 14.288 10.512 6.537 1.00 0.00 H new ATOM 0 HB3 ASP A 57 13.327 11.617 7.500 1.00 0.00 H new ATOM 829 N HIS A 58 10.087 11.762 5.434 1.00 0.00 N ATOM 830 CA HIS A 58 8.755 12.215 5.818 1.00 0.00 C ATOM 831 C HIS A 58 7.690 11.224 5.359 1.00 0.00 C ATOM 832 O HIS A 58 6.562 11.609 5.048 1.00 0.00 O ATOM 833 CB HIS A 58 8.472 13.596 5.224 1.00 0.00 C ATOM 834 CG HIS A 58 8.926 14.726 6.095 1.00 0.00 C ATOM 835 ND1 HIS A 58 8.298 15.954 6.124 1.00 0.00 N ATOM 836 CD2 HIS A 58 9.953 14.810 6.974 1.00 0.00 C ATOM 837 CE1 HIS A 58 8.920 16.744 6.981 1.00 0.00 C ATOM 838 NE2 HIS A 58 9.927 16.074 7.511 1.00 0.00 N ATOM 0 H HIS A 58 10.299 11.869 4.442 1.00 0.00 H new ATOM 0 HA HIS A 58 8.721 12.281 6.905 1.00 0.00 H new ATOM 0 HB2 HIS A 58 8.965 13.674 4.255 1.00 0.00 H new ATOM 0 HB3 HIS A 58 7.401 13.693 5.045 1.00 0.00 H new ATOM 0 HD1 HIS A 58 7.481 16.212 5.570 1.00 0.00 H new ATOM 0 HD2 HIS A 58 10.661 14.029 7.209 1.00 0.00 H new ATOM 0 HE1 HIS A 58 8.651 17.765 7.209 1.00 0.00 H new ATOM 846 N ILE A 59 8.055 9.947 5.318 1.00 0.00 N ATOM 847 CA ILE A 59 7.131 8.901 4.898 1.00 0.00 C ATOM 848 C ILE A 59 6.824 7.945 6.045 1.00 0.00 C ATOM 849 O ILE A 59 7.700 7.614 6.844 1.00 0.00 O ATOM 850 CB ILE A 59 7.693 8.097 3.711 1.00 0.00 C ATOM 851 CG1 ILE A 59 7.912 9.013 2.504 1.00 0.00 C ATOM 852 CG2 ILE A 59 6.754 6.955 3.352 1.00 0.00 C ATOM 853 CD1 ILE A 59 6.642 9.663 2.001 1.00 0.00 C ATOM 0 H ILE A 59 8.985 9.612 5.571 1.00 0.00 H new ATOM 0 HA ILE A 59 6.212 9.398 4.587 1.00 0.00 H new ATOM 0 HB ILE A 59 8.654 7.673 4.001 1.00 0.00 H new ATOM 0 HG12 ILE A 59 8.627 9.791 2.773 1.00 0.00 H new ATOM 0 HG13 ILE A 59 8.360 8.435 1.696 1.00 0.00 H new ATOM 0 HG21 ILE A 59 7.165 6.396 2.511 1.00 0.00 H new ATOM 0 HG22 ILE A 59 6.644 6.291 4.210 1.00 0.00 H new ATOM 0 HG23 ILE A 59 5.779 7.358 3.078 1.00 0.00 H new ATOM 0 HD11 ILE A 59 6.872 10.298 1.145 1.00 0.00 H new ATOM 0 HD12 ILE A 59 5.933 8.892 1.700 1.00 0.00 H new ATOM 0 HD13 ILE A 59 6.204 10.269 2.795 1.00 0.00 H new ATOM 865 N LYS A 60 5.573 7.502 6.120 1.00 0.00 N ATOM 866 CA LYS A 60 5.149 6.581 7.167 1.00 0.00 C ATOM 867 C LYS A 60 4.016 5.685 6.678 1.00 0.00 C ATOM 868 O LYS A 60 3.073 6.154 6.041 1.00 0.00 O ATOM 869 CB LYS A 60 4.701 7.357 8.408 1.00 0.00 C ATOM 870 CG LYS A 60 4.387 6.470 9.600 1.00 0.00 C ATOM 871 CD LYS A 60 5.649 6.076 10.349 1.00 0.00 C ATOM 872 CE LYS A 60 5.406 4.884 11.262 1.00 0.00 C ATOM 873 NZ LYS A 60 6.511 4.703 12.244 1.00 0.00 N ATOM 0 H LYS A 60 4.835 7.767 5.467 1.00 0.00 H new ATOM 0 HA LYS A 60 6.000 5.951 7.428 1.00 0.00 H new ATOM 0 HB2 LYS A 60 5.484 8.063 8.687 1.00 0.00 H new ATOM 0 HB3 LYS A 60 3.817 7.944 8.160 1.00 0.00 H new ATOM 0 HG2 LYS A 60 3.710 6.993 10.276 1.00 0.00 H new ATOM 0 HG3 LYS A 60 3.869 5.573 9.261 1.00 0.00 H new ATOM 0 HD2 LYS A 60 6.437 5.834 9.635 1.00 0.00 H new ATOM 0 HD3 LYS A 60 6.002 6.922 10.939 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.465 5.021 11.795 1.00 0.00 H new ATOM 0 HE3 LYS A 60 5.303 3.981 10.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 6.308 3.881 12.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 7.405 4.547 11.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 6.593 5.555 12.835 1.00 0.00 H new ATOM 887 N ALA A 61 4.115 4.395 6.980 1.00 0.00 N ATOM 888 CA ALA A 61 3.096 3.435 6.574 1.00 0.00 C ATOM 889 C ALA A 61 2.661 2.565 7.748 1.00 0.00 C ATOM 890 O ALA A 61 3.353 2.483 8.763 1.00 0.00 O ATOM 891 CB ALA A 61 3.612 2.567 5.435 1.00 0.00 C ATOM 0 H ALA A 61 4.891 3.990 7.505 1.00 0.00 H new ATOM 0 HA ALA A 61 2.226 3.992 6.227 1.00 0.00 H new ATOM 0 HB1 ALA A 61 2.841 1.855 5.142 1.00 0.00 H new ATOM 0 HB2 ALA A 61 3.866 3.198 4.583 1.00 0.00 H new ATOM 0 HB3 ALA A 61 4.500 2.026 5.763 1.00 0.00 H new ATOM 897 N HIS A 62 1.508 1.918 7.605 1.00 0.00 N ATOM 898 CA HIS A 62 0.981 1.055 8.655 1.00 0.00 C ATOM 899 C HIS A 62 0.097 -0.040 8.066 1.00 0.00 C ATOM 900 O HIS A 62 -1.014 0.226 7.606 1.00 0.00 O ATOM 901 CB HIS A 62 0.185 1.877 9.670 1.00 0.00 C ATOM 902 CG HIS A 62 -0.311 1.076 10.833 1.00 0.00 C ATOM 903 ND1 HIS A 62 0.341 1.028 12.047 1.00 0.00 N ATOM 904 CD2 HIS A 62 -1.405 0.289 10.964 1.00 0.00 C ATOM 905 CE1 HIS A 62 -0.329 0.245 12.874 1.00 0.00 C ATOM 906 NE2 HIS A 62 -1.393 -0.216 12.241 1.00 0.00 N ATOM 0 H HIS A 62 0.922 1.975 6.772 1.00 0.00 H new ATOM 0 HA HIS A 62 1.824 0.585 9.161 1.00 0.00 H new ATOM 0 HB2 HIS A 62 0.812 2.688 10.039 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -0.666 2.336 9.166 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -2.149 0.095 10.205 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -0.054 0.020 13.894 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -2.092 -0.845 12.636 1.00 0.00 H new ATOM 914 N ILE A 63 0.598 -1.271 8.081 1.00 0.00 N ATOM 915 CA ILE A 63 -0.147 -2.405 7.548 1.00 0.00 C ATOM 916 C ILE A 63 -1.127 -2.953 8.580 1.00 0.00 C ATOM 917 O ILE A 63 -0.852 -2.941 9.779 1.00 0.00 O ATOM 918 CB ILE A 63 0.796 -3.537 7.100 1.00 0.00 C ATOM 919 CG1 ILE A 63 1.693 -3.060 5.956 1.00 0.00 C ATOM 920 CG2 ILE A 63 -0.006 -4.759 6.677 1.00 0.00 C ATOM 921 CD1 ILE A 63 2.883 -3.961 5.705 1.00 0.00 C ATOM 0 H ILE A 63 1.516 -1.508 8.456 1.00 0.00 H new ATOM 0 HA ILE A 63 -0.701 -2.041 6.683 1.00 0.00 H new ATOM 0 HB ILE A 63 1.430 -3.816 7.942 1.00 0.00 H new ATOM 0 HG12 ILE A 63 1.100 -2.992 5.044 1.00 0.00 H new ATOM 0 HG13 ILE A 63 2.050 -2.055 6.180 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.675 -5.550 6.363 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.606 -5.109 7.517 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -0.662 -4.495 5.848 1.00 0.00 H new ATOM 0 HD11 ILE A 63 3.474 -3.562 4.881 1.00 0.00 H new ATOM 0 HD12 ILE A 63 3.499 -4.009 6.603 1.00 0.00 H new ATOM 0 HD13 ILE A 63 2.534 -4.962 5.450 1.00 0.00 H new ATOM 933 N ALA A 64 -2.270 -3.435 8.105 1.00 0.00 N ATOM 934 CA ALA A 64 -3.289 -3.992 8.985 1.00 0.00 C ATOM 935 C ALA A 64 -3.805 -5.325 8.454 1.00 0.00 C ATOM 936 O ALA A 64 -4.447 -5.380 7.407 1.00 0.00 O ATOM 937 CB ALA A 64 -4.438 -3.008 9.151 1.00 0.00 C ATOM 0 H ALA A 64 -2.514 -3.451 7.115 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.834 -4.171 9.959 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -5.192 -3.437 9.811 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -4.063 -2.080 9.583 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -4.883 -2.801 8.178 1.00 0.00 H new ATOM 943 N ASN A 65 -3.518 -6.398 9.185 1.00 0.00 N ATOM 944 CA ASN A 65 -3.952 -7.732 8.786 1.00 0.00 C ATOM 945 C ASN A 65 -5.441 -7.925 9.061 1.00 0.00 C ATOM 946 O ASN A 65 -6.016 -7.310 9.958 1.00 0.00 O ATOM 947 CB ASN A 65 -3.143 -8.798 9.528 1.00 0.00 C ATOM 948 CG ASN A 65 -1.746 -8.961 8.962 1.00 0.00 C ATOM 949 OD1 ASN A 65 -1.527 -8.793 7.762 1.00 0.00 O ATOM 950 ND2 ASN A 65 -0.792 -9.291 9.825 1.00 0.00 N ATOM 0 H ASN A 65 -2.987 -6.370 10.056 1.00 0.00 H new ATOM 0 HA ASN A 65 -3.782 -7.837 7.714 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -3.076 -8.531 10.583 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -3.668 -9.752 9.474 1.00 0.00 H new ATOM 0 HD21 ASN A 65 0.167 -9.415 9.502 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -1.019 -9.420 10.811 1.00 0.00 H new ATOM 957 N PRO A 66 -6.080 -8.801 8.271 1.00 0.00 N ATOM 958 CA PRO A 66 -7.509 -9.096 8.410 1.00 0.00 C ATOM 959 C PRO A 66 -7.819 -9.872 9.686 1.00 0.00 C ATOM 960 O PRO A 66 -8.981 -10.112 10.010 1.00 0.00 O ATOM 961 CB PRO A 66 -7.817 -9.950 7.177 1.00 0.00 C ATOM 962 CG PRO A 66 -6.514 -10.574 6.815 1.00 0.00 C ATOM 963 CD PRO A 66 -5.456 -9.570 7.181 1.00 0.00 C ATOM 0 HA PRO A 66 -8.108 -8.188 8.477 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -8.571 -10.706 7.397 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -8.205 -9.341 6.360 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -6.367 -11.510 7.354 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -6.477 -10.810 5.751 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -4.536 -10.056 7.507 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -5.197 -8.932 6.336 1.00 0.00 H new ATOM 971 N SER A 67 -6.771 -10.260 10.406 1.00 0.00 N ATOM 972 CA SER A 67 -6.932 -11.011 11.646 1.00 0.00 C ATOM 973 C SER A 67 -6.910 -10.079 12.853 1.00 0.00 C ATOM 974 O SER A 67 -7.410 -10.420 13.924 1.00 0.00 O ATOM 975 CB SER A 67 -5.826 -12.060 11.777 1.00 0.00 C ATOM 976 OG SER A 67 -6.214 -13.287 11.182 1.00 0.00 O ATOM 0 H SER A 67 -5.802 -10.067 10.152 1.00 0.00 H new ATOM 0 HA SER A 67 -7.899 -11.513 11.615 1.00 0.00 H new ATOM 0 HB2 SER A 67 -4.915 -11.694 11.303 1.00 0.00 H new ATOM 0 HB3 SER A 67 -5.595 -12.220 12.830 1.00 0.00 H new ATOM 0 HG SER A 67 -5.536 -13.563 10.531 1.00 0.00 H new ATOM 982 N GLY A 68 -6.326 -8.898 12.671 1.00 0.00 N ATOM 983 CA GLY A 68 -6.249 -7.934 13.753 1.00 0.00 C ATOM 984 C GLY A 68 -4.823 -7.532 14.071 1.00 0.00 C ATOM 985 O GLY A 68 -4.586 -6.498 14.694 1.00 0.00 O ATOM 0 H GLY A 68 -5.905 -8.592 11.794 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -6.822 -7.046 13.486 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -6.712 -8.356 14.645 1.00 0.00 H new ATOM 989 N ALA A 69 -3.869 -8.354 13.644 1.00 0.00 N ATOM 990 CA ALA A 69 -2.458 -8.078 13.887 1.00 0.00 C ATOM 991 C ALA A 69 -1.967 -6.924 13.020 1.00 0.00 C ATOM 992 O ALA A 69 -2.722 -6.370 12.222 1.00 0.00 O ATOM 993 CB ALA A 69 -1.625 -9.325 13.631 1.00 0.00 C ATOM 0 H ALA A 69 -4.048 -9.216 13.128 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.345 -7.787 14.931 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -0.574 -9.105 13.816 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -1.951 -10.124 14.297 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -1.752 -9.641 12.596 1.00 0.00 H new ATOM 999 N SER A 70 -0.698 -6.566 13.184 1.00 0.00 N ATOM 1000 CA SER A 70 -0.107 -5.474 12.419 1.00 0.00 C ATOM 1001 C SER A 70 1.328 -5.804 12.019 1.00 0.00 C ATOM 1002 O SER A 70 2.151 -6.169 12.859 1.00 0.00 O ATOM 1003 CB SER A 70 -0.136 -4.179 13.233 1.00 0.00 C ATOM 1004 OG SER A 70 0.543 -4.337 14.467 1.00 0.00 O ATOM 0 H SER A 70 -0.059 -7.016 13.840 1.00 0.00 H new ATOM 0 HA SER A 70 -0.696 -5.339 11.512 1.00 0.00 H new ATOM 0 HB2 SER A 70 0.327 -3.375 12.660 1.00 0.00 H new ATOM 0 HB3 SER A 70 -1.169 -3.885 13.418 1.00 0.00 H new ATOM 0 HG SER A 70 1.182 -5.077 14.396 1.00 0.00 H new ATOM 1010 N THR A 71 1.621 -5.674 10.729 1.00 0.00 N ATOM 1011 CA THR A 71 2.955 -5.960 10.215 1.00 0.00 C ATOM 1012 C THR A 71 3.806 -4.697 10.164 1.00 0.00 C ATOM 1013 O THR A 71 3.426 -3.707 9.538 1.00 0.00 O ATOM 1014 CB THR A 71 2.893 -6.582 8.808 1.00 0.00 C ATOM 1015 OG1 THR A 71 1.943 -7.653 8.786 1.00 0.00 O ATOM 1016 CG2 THR A 71 4.260 -7.102 8.386 1.00 0.00 C ATOM 0 H THR A 71 0.952 -5.372 10.021 1.00 0.00 H new ATOM 0 HA THR A 71 3.412 -6.675 10.900 1.00 0.00 H new ATOM 0 HB THR A 71 2.583 -5.808 8.106 1.00 0.00 H new ATOM 0 HG1 THR A 71 1.670 -7.829 7.861 1.00 0.00 H new ATOM 0 HG21 THR A 71 4.192 -7.537 7.389 1.00 0.00 H new ATOM 0 HG22 THR A 71 4.975 -6.279 8.375 1.00 0.00 H new ATOM 0 HG23 THR A 71 4.594 -7.863 9.092 1.00 0.00 H new ATOM 1024 N GLU A 72 4.959 -4.738 10.824 1.00 0.00 N ATOM 1025 CA GLU A 72 5.864 -3.595 10.852 1.00 0.00 C ATOM 1026 C GLU A 72 6.256 -3.176 9.438 1.00 0.00 C ATOM 1027 O GLU A 72 6.259 -3.993 8.516 1.00 0.00 O ATOM 1028 CB GLU A 72 7.117 -3.928 11.664 1.00 0.00 C ATOM 1029 CG GLU A 72 7.907 -2.703 12.095 1.00 0.00 C ATOM 1030 CD GLU A 72 7.469 -2.173 13.446 1.00 0.00 C ATOM 1031 OE1 GLU A 72 6.252 -1.968 13.636 1.00 0.00 O ATOM 1032 OE2 GLU A 72 8.343 -1.962 14.313 1.00 0.00 O ATOM 0 H GLU A 72 5.288 -5.550 11.346 1.00 0.00 H new ATOM 0 HA GLU A 72 5.343 -2.763 11.327 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.826 -4.492 12.550 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.762 -4.576 11.071 1.00 0.00 H new ATOM 0 HG2 GLU A 72 8.967 -2.954 12.133 1.00 0.00 H new ATOM 0 HG3 GLU A 72 7.792 -1.919 11.346 1.00 0.00 H new ATOM 1039 N CYS A 73 6.586 -1.900 9.275 1.00 0.00 N ATOM 1040 CA CYS A 73 6.979 -1.372 7.974 1.00 0.00 C ATOM 1041 C CYS A 73 8.369 -0.748 8.037 1.00 0.00 C ATOM 1042 O CYS A 73 8.696 -0.030 8.982 1.00 0.00 O ATOM 1043 CB CYS A 73 5.963 -0.334 7.494 1.00 0.00 C ATOM 1044 SG CYS A 73 5.772 1.081 8.603 1.00 0.00 S ATOM 0 H CYS A 73 6.589 -1.212 10.028 1.00 0.00 H new ATOM 0 HA CYS A 73 7.004 -2.201 7.266 1.00 0.00 H new ATOM 0 HB2 CYS A 73 6.265 0.027 6.511 1.00 0.00 H new ATOM 0 HB3 CYS A 73 4.995 -0.819 7.371 1.00 0.00 H new ATOM 0 HG CYS A 73 4.508 1.332 8.772 1.00 0.00 H new ATOM 1050 N PHE A 74 9.184 -1.029 7.026 1.00 0.00 N ATOM 1051 CA PHE A 74 10.541 -0.498 6.968 1.00 0.00 C ATOM 1052 C PHE A 74 10.718 0.413 5.757 1.00 0.00 C ATOM 1053 O PHE A 74 10.958 -0.055 4.644 1.00 0.00 O ATOM 1054 CB PHE A 74 11.557 -1.641 6.913 1.00 0.00 C ATOM 1055 CG PHE A 74 11.508 -2.546 8.111 1.00 0.00 C ATOM 1056 CD1 PHE A 74 10.385 -3.316 8.369 1.00 0.00 C ATOM 1057 CD2 PHE A 74 12.584 -2.625 8.980 1.00 0.00 C ATOM 1058 CE1 PHE A 74 10.337 -4.149 9.470 1.00 0.00 C ATOM 1059 CE2 PHE A 74 12.542 -3.457 10.083 1.00 0.00 C ATOM 1060 CZ PHE A 74 11.416 -4.219 10.329 1.00 0.00 C ATOM 0 H PHE A 74 8.929 -1.621 6.236 1.00 0.00 H new ATOM 0 HA PHE A 74 10.713 0.089 7.870 1.00 0.00 H new ATOM 0 HB2 PHE A 74 11.379 -2.231 6.014 1.00 0.00 H new ATOM 0 HB3 PHE A 74 12.559 -1.221 6.825 1.00 0.00 H new ATOM 0 HD1 PHE A 74 9.538 -3.264 7.702 1.00 0.00 H new ATOM 0 HD2 PHE A 74 13.466 -2.030 8.794 1.00 0.00 H new ATOM 0 HE1 PHE A 74 9.456 -4.745 9.659 1.00 0.00 H new ATOM 0 HE2 PHE A 74 13.388 -3.511 10.752 1.00 0.00 H new ATOM 0 HZ PHE A 74 11.380 -4.868 11.191 1.00 0.00 H new ATOM 1070 N VAL A 75 10.596 1.717 5.982 1.00 0.00 N ATOM 1071 CA VAL A 75 10.742 2.695 4.911 1.00 0.00 C ATOM 1072 C VAL A 75 12.204 3.080 4.713 1.00 0.00 C ATOM 1073 O VAL A 75 12.902 3.425 5.668 1.00 0.00 O ATOM 1074 CB VAL A 75 9.922 3.967 5.196 1.00 0.00 C ATOM 1075 CG1 VAL A 75 8.441 3.635 5.306 1.00 0.00 C ATOM 1076 CG2 VAL A 75 10.419 4.648 6.462 1.00 0.00 C ATOM 0 H VAL A 75 10.396 2.121 6.897 1.00 0.00 H new ATOM 0 HA VAL A 75 10.366 2.226 4.002 1.00 0.00 H new ATOM 0 HB VAL A 75 10.054 4.657 4.363 1.00 0.00 H new ATOM 0 HG11 VAL A 75 7.878 4.546 5.508 1.00 0.00 H new ATOM 0 HG12 VAL A 75 8.096 3.195 4.370 1.00 0.00 H new ATOM 0 HG13 VAL A 75 8.287 2.926 6.119 1.00 0.00 H new ATOM 0 HG21 VAL A 75 9.829 5.545 6.648 1.00 0.00 H new ATOM 0 HG22 VAL A 75 10.318 3.965 7.306 1.00 0.00 H new ATOM 0 HG23 VAL A 75 11.467 4.922 6.340 1.00 0.00 H new ATOM 1086 N THR A 76 12.663 3.020 3.467 1.00 0.00 N ATOM 1087 CA THR A 76 14.042 3.361 3.144 1.00 0.00 C ATOM 1088 C THR A 76 14.108 4.318 1.959 1.00 0.00 C ATOM 1089 O THR A 76 13.659 3.993 0.860 1.00 0.00 O ATOM 1090 CB THR A 76 14.871 2.104 2.820 1.00 0.00 C ATOM 1091 OG1 THR A 76 14.835 1.195 3.926 1.00 0.00 O ATOM 1092 CG2 THR A 76 16.314 2.472 2.507 1.00 0.00 C ATOM 0 H THR A 76 12.099 2.738 2.665 1.00 0.00 H new ATOM 0 HA THR A 76 14.462 3.847 4.025 1.00 0.00 H new ATOM 0 HB THR A 76 14.436 1.626 1.942 1.00 0.00 H new ATOM 0 HG1 THR A 76 15.363 0.398 3.711 1.00 0.00 H new ATOM 0 HG21 THR A 76 16.879 1.568 2.281 1.00 0.00 H new ATOM 0 HG22 THR A 76 16.341 3.141 1.647 1.00 0.00 H new ATOM 0 HG23 THR A 76 16.757 2.972 3.368 1.00 0.00 H new ATOM 1100 N ASP A 77 14.672 5.499 2.189 1.00 0.00 N ATOM 1101 CA ASP A 77 14.799 6.503 1.139 1.00 0.00 C ATOM 1102 C ASP A 77 16.072 6.285 0.329 1.00 0.00 C ATOM 1103 O ASP A 77 17.152 6.099 0.889 1.00 0.00 O ATOM 1104 CB ASP A 77 14.799 7.908 1.745 1.00 0.00 C ATOM 1105 CG ASP A 77 15.918 8.104 2.749 1.00 0.00 C ATOM 1106 OD1 ASP A 77 15.701 7.811 3.943 1.00 0.00 O ATOM 1107 OD2 ASP A 77 17.010 8.553 2.341 1.00 0.00 O ATOM 0 H ASP A 77 15.048 5.784 3.093 1.00 0.00 H new ATOM 0 HA ASP A 77 13.944 6.404 0.470 1.00 0.00 H new ATOM 0 HB2 ASP A 77 14.897 8.645 0.948 1.00 0.00 H new ATOM 0 HB3 ASP A 77 13.841 8.091 2.232 1.00 0.00 H new ATOM 1112 N ASN A 78 15.938 6.307 -0.993 1.00 0.00 N ATOM 1113 CA ASN A 78 17.078 6.110 -1.881 1.00 0.00 C ATOM 1114 C ASN A 78 17.844 7.414 -2.081 1.00 0.00 C ATOM 1115 O ASN A 78 18.602 7.560 -3.040 1.00 0.00 O ATOM 1116 CB ASN A 78 16.610 5.567 -3.233 1.00 0.00 C ATOM 1117 CG ASN A 78 16.079 4.150 -3.136 1.00 0.00 C ATOM 1118 OD1 ASN A 78 16.831 3.184 -3.268 1.00 0.00 O ATOM 1119 ND2 ASN A 78 14.778 4.020 -2.903 1.00 0.00 N ATOM 0 H ASN A 78 15.051 6.459 -1.473 1.00 0.00 H new ATOM 0 HA ASN A 78 17.747 5.385 -1.418 1.00 0.00 H new ATOM 0 HB2 ASN A 78 15.831 6.217 -3.632 1.00 0.00 H new ATOM 0 HB3 ASN A 78 17.440 5.593 -3.939 1.00 0.00 H new ATOM 0 HD21 ASN A 78 14.364 3.091 -2.827 1.00 0.00 H new ATOM 0 HD22 ASN A 78 14.193 4.849 -2.800 1.00 0.00 H new ATOM 1126 N ALA A 79 17.640 8.359 -1.169 1.00 0.00 N ATOM 1127 CA ALA A 79 18.314 9.650 -1.244 1.00 0.00 C ATOM 1128 C ALA A 79 18.382 10.151 -2.682 1.00 0.00 C ATOM 1129 O ALA A 79 19.298 10.886 -3.051 1.00 0.00 O ATOM 1130 CB ALA A 79 19.711 9.551 -0.650 1.00 0.00 C ATOM 0 H ALA A 79 17.014 8.255 -0.370 1.00 0.00 H new ATOM 0 HA ALA A 79 17.735 10.369 -0.664 1.00 0.00 H new ATOM 0 HB1 ALA A 79 20.203 10.522 -0.713 1.00 0.00 H new ATOM 0 HB2 ALA A 79 19.642 9.246 0.394 1.00 0.00 H new ATOM 0 HB3 ALA A 79 20.291 8.814 -1.205 1.00 0.00 H new ATOM 1136 N ASP A 80 17.409 9.748 -3.491 1.00 0.00 N ATOM 1137 CA ASP A 80 17.359 10.157 -4.890 1.00 0.00 C ATOM 1138 C ASP A 80 16.061 10.900 -5.193 1.00 0.00 C ATOM 1139 O ASP A 80 16.006 11.730 -6.100 1.00 0.00 O ATOM 1140 CB ASP A 80 17.488 8.938 -5.805 1.00 0.00 C ATOM 1141 CG ASP A 80 17.978 9.304 -7.192 1.00 0.00 C ATOM 1142 OD1 ASP A 80 17.401 10.229 -7.800 1.00 0.00 O ATOM 1143 OD2 ASP A 80 18.939 8.664 -7.670 1.00 0.00 O ATOM 0 H ASP A 80 16.644 9.138 -3.202 1.00 0.00 H new ATOM 0 HA ASP A 80 18.195 10.831 -5.076 1.00 0.00 H new ATOM 0 HB2 ASP A 80 18.177 8.222 -5.357 1.00 0.00 H new ATOM 0 HB3 ASP A 80 16.520 8.443 -5.884 1.00 0.00 H new ATOM 1148 N GLY A 81 15.018 10.595 -4.428 1.00 0.00 N ATOM 1149 CA GLY A 81 13.734 11.242 -4.631 1.00 0.00 C ATOM 1150 C GLY A 81 12.568 10.313 -4.360 1.00 0.00 C ATOM 1151 O GLY A 81 11.424 10.756 -4.249 1.00 0.00 O ATOM 0 H GLY A 81 15.039 9.912 -3.671 1.00 0.00 H new ATOM 0 HA2 GLY A 81 13.661 12.111 -3.978 1.00 0.00 H new ATOM 0 HA3 GLY A 81 13.673 11.608 -5.656 1.00 0.00 H new ATOM 1155 N THR A 82 12.855 9.019 -4.255 1.00 0.00 N ATOM 1156 CA THR A 82 11.821 8.025 -3.998 1.00 0.00 C ATOM 1157 C THR A 82 12.096 7.265 -2.706 1.00 0.00 C ATOM 1158 O THR A 82 13.193 7.342 -2.152 1.00 0.00 O ATOM 1159 CB THR A 82 11.710 7.018 -5.158 1.00 0.00 C ATOM 1160 OG1 THR A 82 12.948 6.317 -5.319 1.00 0.00 O ATOM 1161 CG2 THR A 82 11.349 7.725 -6.456 1.00 0.00 C ATOM 0 H THR A 82 13.796 8.635 -4.344 1.00 0.00 H new ATOM 0 HA THR A 82 10.880 8.566 -3.904 1.00 0.00 H new ATOM 0 HB THR A 82 10.919 6.307 -4.918 1.00 0.00 H new ATOM 0 HG1 THR A 82 12.868 5.678 -6.057 1.00 0.00 H new ATOM 0 HG21 THR A 82 11.276 6.993 -7.261 1.00 0.00 H new ATOM 0 HG22 THR A 82 10.392 8.233 -6.340 1.00 0.00 H new ATOM 0 HG23 THR A 82 12.120 8.456 -6.699 1.00 0.00 H new ATOM 1169 N TYR A 83 11.095 6.533 -2.231 1.00 0.00 N ATOM 1170 CA TYR A 83 11.230 5.760 -1.001 1.00 0.00 C ATOM 1171 C TYR A 83 11.015 4.273 -1.266 1.00 0.00 C ATOM 1172 O TYR A 83 10.452 3.890 -2.291 1.00 0.00 O ATOM 1173 CB TYR A 83 10.230 6.253 0.047 1.00 0.00 C ATOM 1174 CG TYR A 83 10.188 7.758 0.183 1.00 0.00 C ATOM 1175 CD1 TYR A 83 9.361 8.525 -0.629 1.00 0.00 C ATOM 1176 CD2 TYR A 83 10.974 8.413 1.123 1.00 0.00 C ATOM 1177 CE1 TYR A 83 9.320 9.901 -0.508 1.00 0.00 C ATOM 1178 CE2 TYR A 83 10.938 9.788 1.251 1.00 0.00 C ATOM 1179 CZ TYR A 83 10.109 10.527 0.433 1.00 0.00 C ATOM 1180 OH TYR A 83 10.071 11.897 0.557 1.00 0.00 O ATOM 0 H TYR A 83 10.181 6.458 -2.678 1.00 0.00 H new ATOM 0 HA TYR A 83 12.242 5.900 -0.622 1.00 0.00 H new ATOM 0 HB2 TYR A 83 9.235 5.892 -0.214 1.00 0.00 H new ATOM 0 HB3 TYR A 83 10.484 5.816 1.013 1.00 0.00 H new ATOM 0 HD1 TYR A 83 8.740 8.038 -1.366 1.00 0.00 H new ATOM 0 HD2 TYR A 83 11.624 7.837 1.765 1.00 0.00 H new ATOM 0 HE1 TYR A 83 8.673 10.483 -1.148 1.00 0.00 H new ATOM 0 HE2 TYR A 83 11.555 10.281 1.987 1.00 0.00 H new ATOM 0 HH TYR A 83 10.970 12.232 0.756 1.00 0.00 H new ATOM 1190 N GLN A 84 11.468 3.442 -0.334 1.00 0.00 N ATOM 1191 CA GLN A 84 11.327 1.997 -0.466 1.00 0.00 C ATOM 1192 C GLN A 84 10.878 1.371 0.851 1.00 0.00 C ATOM 1193 O GLN A 84 11.664 1.246 1.790 1.00 0.00 O ATOM 1194 CB GLN A 84 12.648 1.372 -0.916 1.00 0.00 C ATOM 1195 CG GLN A 84 12.506 -0.054 -1.424 1.00 0.00 C ATOM 1196 CD GLN A 84 12.183 -0.116 -2.904 1.00 0.00 C ATOM 1197 OE1 GLN A 84 12.806 0.568 -3.716 1.00 0.00 O ATOM 1198 NE2 GLN A 84 11.206 -0.941 -3.263 1.00 0.00 N ATOM 0 H GLN A 84 11.936 3.744 0.521 1.00 0.00 H new ATOM 0 HA GLN A 84 10.565 1.800 -1.220 1.00 0.00 H new ATOM 0 HB2 GLN A 84 13.082 1.988 -1.704 1.00 0.00 H new ATOM 0 HB3 GLN A 84 13.348 1.383 -0.081 1.00 0.00 H new ATOM 0 HG2 GLN A 84 13.432 -0.597 -1.235 1.00 0.00 H new ATOM 0 HG3 GLN A 84 11.720 -0.559 -0.863 1.00 0.00 H new ATOM 0 HE21 GLN A 84 10.716 -1.489 -2.556 1.00 0.00 H new ATOM 0 HE22 GLN A 84 10.946 -1.026 -4.246 1.00 0.00 H new ATOM 1207 N VAL A 85 9.609 0.980 0.912 1.00 0.00 N ATOM 1208 CA VAL A 85 9.055 0.367 2.114 1.00 0.00 C ATOM 1209 C VAL A 85 9.011 -1.152 1.985 1.00 0.00 C ATOM 1210 O VAL A 85 8.390 -1.689 1.069 1.00 0.00 O ATOM 1211 CB VAL A 85 7.635 0.887 2.407 1.00 0.00 C ATOM 1212 CG1 VAL A 85 7.064 0.213 3.645 1.00 0.00 C ATOM 1213 CG2 VAL A 85 7.646 2.400 2.570 1.00 0.00 C ATOM 0 H VAL A 85 8.945 1.077 0.144 1.00 0.00 H new ATOM 0 HA VAL A 85 9.711 0.641 2.940 1.00 0.00 H new ATOM 0 HB VAL A 85 6.994 0.640 1.561 1.00 0.00 H new ATOM 0 HG11 VAL A 85 6.060 0.593 3.836 1.00 0.00 H new ATOM 0 HG12 VAL A 85 7.020 -0.864 3.485 1.00 0.00 H new ATOM 0 HG13 VAL A 85 7.702 0.426 4.502 1.00 0.00 H new ATOM 0 HG21 VAL A 85 6.635 2.751 2.777 1.00 0.00 H new ATOM 0 HG22 VAL A 85 8.301 2.672 3.398 1.00 0.00 H new ATOM 0 HG23 VAL A 85 8.010 2.862 1.652 1.00 0.00 H new ATOM 1223 N GLU A 86 9.675 -1.838 2.911 1.00 0.00 N ATOM 1224 CA GLU A 86 9.711 -3.295 2.900 1.00 0.00 C ATOM 1225 C GLU A 86 9.021 -3.866 4.136 1.00 0.00 C ATOM 1226 O GLU A 86 9.245 -3.403 5.255 1.00 0.00 O ATOM 1227 CB GLU A 86 11.158 -3.791 2.836 1.00 0.00 C ATOM 1228 CG GLU A 86 11.281 -5.305 2.785 1.00 0.00 C ATOM 1229 CD GLU A 86 12.680 -5.788 3.113 1.00 0.00 C ATOM 1230 OE1 GLU A 86 13.034 -5.809 4.311 1.00 0.00 O ATOM 1231 OE2 GLU A 86 13.421 -6.144 2.173 1.00 0.00 O ATOM 0 H GLU A 86 10.194 -1.408 3.677 1.00 0.00 H new ATOM 0 HA GLU A 86 9.176 -3.639 2.015 1.00 0.00 H new ATOM 0 HB2 GLU A 86 11.640 -3.366 1.956 1.00 0.00 H new ATOM 0 HB3 GLU A 86 11.699 -3.420 3.706 1.00 0.00 H new ATOM 0 HG2 GLU A 86 10.574 -5.747 3.487 1.00 0.00 H new ATOM 0 HG3 GLU A 86 11.004 -5.655 1.791 1.00 0.00 H new ATOM 1238 N TYR A 87 8.181 -4.873 3.925 1.00 0.00 N ATOM 1239 CA TYR A 87 7.455 -5.505 5.020 1.00 0.00 C ATOM 1240 C TYR A 87 7.162 -6.969 4.706 1.00 0.00 C ATOM 1241 O TYR A 87 6.989 -7.346 3.546 1.00 0.00 O ATOM 1242 CB TYR A 87 6.148 -4.759 5.292 1.00 0.00 C ATOM 1243 CG TYR A 87 5.068 -5.039 4.272 1.00 0.00 C ATOM 1244 CD1 TYR A 87 4.294 -6.191 4.350 1.00 0.00 C ATOM 1245 CD2 TYR A 87 4.820 -4.152 3.232 1.00 0.00 C ATOM 1246 CE1 TYR A 87 3.306 -6.451 3.420 1.00 0.00 C ATOM 1247 CE2 TYR A 87 3.833 -4.404 2.298 1.00 0.00 C ATOM 1248 CZ TYR A 87 3.079 -5.555 2.397 1.00 0.00 C ATOM 1249 OH TYR A 87 2.095 -5.810 1.469 1.00 0.00 O ATOM 0 H TYR A 87 7.986 -5.269 3.006 1.00 0.00 H new ATOM 0 HA TYR A 87 8.082 -5.461 5.910 1.00 0.00 H new ATOM 0 HB2 TYR A 87 5.782 -5.033 6.281 1.00 0.00 H new ATOM 0 HB3 TYR A 87 6.348 -3.688 5.312 1.00 0.00 H new ATOM 0 HD1 TYR A 87 4.468 -6.894 5.151 1.00 0.00 H new ATOM 0 HD2 TYR A 87 5.409 -3.250 3.152 1.00 0.00 H new ATOM 0 HE1 TYR A 87 2.714 -7.352 3.494 1.00 0.00 H new ATOM 0 HE2 TYR A 87 3.653 -3.704 1.495 1.00 0.00 H new ATOM 0 HH TYR A 87 2.158 -5.159 0.739 1.00 0.00 H new ATOM 1259 N THR A 88 7.107 -7.792 5.749 1.00 0.00 N ATOM 1260 CA THR A 88 6.836 -9.215 5.586 1.00 0.00 C ATOM 1261 C THR A 88 5.589 -9.628 6.359 1.00 0.00 C ATOM 1262 O THR A 88 5.617 -9.819 7.575 1.00 0.00 O ATOM 1263 CB THR A 88 8.026 -10.071 6.058 1.00 0.00 C ATOM 1264 OG1 THR A 88 9.255 -9.498 5.599 1.00 0.00 O ATOM 1265 CG2 THR A 88 7.903 -11.498 5.545 1.00 0.00 C ATOM 0 H THR A 88 7.247 -7.497 6.715 1.00 0.00 H new ATOM 0 HA THR A 88 6.674 -9.387 4.522 1.00 0.00 H new ATOM 0 HB THR A 88 8.020 -10.091 7.148 1.00 0.00 H new ATOM 0 HG1 THR A 88 10.007 -10.048 5.905 1.00 0.00 H new ATOM 0 HG21 THR A 88 8.755 -12.084 5.891 1.00 0.00 H new ATOM 0 HG22 THR A 88 6.981 -11.941 5.921 1.00 0.00 H new ATOM 0 HG23 THR A 88 7.885 -11.493 4.455 1.00 0.00 H new ATOM 1273 N PRO A 89 4.466 -9.771 5.639 1.00 0.00 N ATOM 1274 CA PRO A 89 3.187 -10.165 6.237 1.00 0.00 C ATOM 1275 C PRO A 89 3.188 -11.616 6.705 1.00 0.00 C ATOM 1276 O PRO A 89 3.459 -12.531 5.926 1.00 0.00 O ATOM 1277 CB PRO A 89 2.187 -9.973 5.094 1.00 0.00 C ATOM 1278 CG PRO A 89 2.999 -10.110 3.853 1.00 0.00 C ATOM 1279 CD PRO A 89 4.359 -9.561 4.185 1.00 0.00 C ATOM 0 HA PRO A 89 2.956 -9.580 7.127 1.00 0.00 H new ATOM 0 HB2 PRO A 89 1.394 -10.720 5.132 1.00 0.00 H new ATOM 0 HB3 PRO A 89 1.708 -8.996 5.147 1.00 0.00 H new ATOM 0 HG2 PRO A 89 3.064 -11.153 3.543 1.00 0.00 H new ATOM 0 HG3 PRO A 89 2.547 -9.560 3.028 1.00 0.00 H new ATOM 0 HD2 PRO A 89 5.147 -10.085 3.644 1.00 0.00 H new ATOM 0 HD3 PRO A 89 4.441 -8.506 3.924 1.00 0.00 H new ATOM 1287 N PHE A 90 2.884 -11.821 7.982 1.00 0.00 N ATOM 1288 CA PHE A 90 2.851 -13.162 8.555 1.00 0.00 C ATOM 1289 C PHE A 90 1.432 -13.724 8.543 1.00 0.00 C ATOM 1290 O PHE A 90 1.107 -14.632 9.308 1.00 0.00 O ATOM 1291 CB PHE A 90 3.392 -13.143 9.986 1.00 0.00 C ATOM 1292 CG PHE A 90 2.983 -11.925 10.765 1.00 0.00 C ATOM 1293 CD1 PHE A 90 1.755 -11.877 11.405 1.00 0.00 C ATOM 1294 CD2 PHE A 90 3.826 -10.829 10.856 1.00 0.00 C ATOM 1295 CE1 PHE A 90 1.376 -10.759 12.123 1.00 0.00 C ATOM 1296 CE2 PHE A 90 3.452 -9.709 11.573 1.00 0.00 C ATOM 1297 CZ PHE A 90 2.225 -9.672 12.206 1.00 0.00 C ATOM 0 H PHE A 90 2.657 -11.076 8.640 1.00 0.00 H new ATOM 0 HA PHE A 90 3.484 -13.806 7.944 1.00 0.00 H new ATOM 0 HB2 PHE A 90 3.044 -14.033 10.510 1.00 0.00 H new ATOM 0 HB3 PHE A 90 4.480 -13.197 9.955 1.00 0.00 H new ATOM 0 HD1 PHE A 90 1.087 -12.723 11.342 1.00 0.00 H new ATOM 0 HD2 PHE A 90 4.786 -10.851 10.361 1.00 0.00 H new ATOM 0 HE1 PHE A 90 0.417 -10.735 12.619 1.00 0.00 H new ATOM 0 HE2 PHE A 90 4.119 -8.862 11.639 1.00 0.00 H new ATOM 0 HZ PHE A 90 1.930 -8.796 12.764 1.00 0.00 H new ATOM 1307 N GLU A 91 0.592 -13.175 7.671 1.00 0.00 N ATOM 1308 CA GLU A 91 -0.792 -13.620 7.561 1.00 0.00 C ATOM 1309 C GLU A 91 -1.275 -13.544 6.116 1.00 0.00 C ATOM 1310 O GLU A 91 -1.097 -12.529 5.442 1.00 0.00 O ATOM 1311 CB GLU A 91 -1.696 -12.772 8.458 1.00 0.00 C ATOM 1312 CG GLU A 91 -1.821 -13.305 9.875 1.00 0.00 C ATOM 1313 CD GLU A 91 -2.834 -14.427 9.989 1.00 0.00 C ATOM 1314 OE1 GLU A 91 -2.449 -15.597 9.781 1.00 0.00 O ATOM 1315 OE2 GLU A 91 -4.012 -14.136 10.286 1.00 0.00 O ATOM 0 H GLU A 91 0.846 -12.422 7.031 1.00 0.00 H new ATOM 0 HA GLU A 91 -0.840 -14.659 7.887 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -1.306 -11.755 8.495 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -2.689 -12.717 8.011 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -0.848 -13.663 10.211 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -2.109 -12.492 10.541 1.00 0.00 H new ATOM 1322 N LYS A 92 -1.887 -14.625 5.645 1.00 0.00 N ATOM 1323 CA LYS A 92 -2.397 -14.683 4.280 1.00 0.00 C ATOM 1324 C LYS A 92 -3.790 -14.069 4.194 1.00 0.00 C ATOM 1325 O LYS A 92 -4.781 -14.701 4.557 1.00 0.00 O ATOM 1326 CB LYS A 92 -2.435 -16.133 3.789 1.00 0.00 C ATOM 1327 CG LYS A 92 -1.064 -16.780 3.698 1.00 0.00 C ATOM 1328 CD LYS A 92 -1.166 -18.250 3.327 1.00 0.00 C ATOM 1329 CE LYS A 92 0.102 -19.006 3.694 1.00 0.00 C ATOM 1330 NZ LYS A 92 1.157 -18.858 2.653 1.00 0.00 N ATOM 0 H LYS A 92 -2.042 -15.474 6.189 1.00 0.00 H new ATOM 0 HA LYS A 92 -1.726 -14.108 3.643 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -3.060 -16.719 4.462 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -2.908 -16.163 2.807 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -0.462 -16.257 2.955 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -0.549 -16.680 4.653 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -2.019 -18.697 3.838 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -1.351 -18.344 2.257 1.00 0.00 H new ATOM 0 HE2 LYS A 92 0.480 -18.640 4.649 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -0.131 -20.062 3.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 2.076 -19.146 3.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 0.926 -19.459 1.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 1.207 -17.865 2.348 1.00 0.00 H new ATOM 1344 N GLY A 93 -3.858 -12.833 3.708 1.00 0.00 N ATOM 1345 CA GLY A 93 -5.135 -12.155 3.581 1.00 0.00 C ATOM 1346 C GLY A 93 -4.991 -10.743 3.051 1.00 0.00 C ATOM 1347 O GLY A 93 -3.890 -10.309 2.710 1.00 0.00 O ATOM 0 H GLY A 93 -3.052 -12.289 3.400 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -5.781 -12.726 2.914 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -5.626 -12.126 4.554 1.00 0.00 H new ATOM 1351 N LEU A 94 -6.106 -10.023 2.978 1.00 0.00 N ATOM 1352 CA LEU A 94 -6.100 -8.651 2.484 1.00 0.00 C ATOM 1353 C LEU A 94 -5.856 -7.663 3.620 1.00 0.00 C ATOM 1354 O LEU A 94 -6.662 -7.554 4.545 1.00 0.00 O ATOM 1355 CB LEU A 94 -7.427 -8.332 1.791 1.00 0.00 C ATOM 1356 CG LEU A 94 -7.758 -6.849 1.627 1.00 0.00 C ATOM 1357 CD1 LEU A 94 -6.847 -6.210 0.589 1.00 0.00 C ATOM 1358 CD2 LEU A 94 -9.219 -6.668 1.240 1.00 0.00 C ATOM 0 H LEU A 94 -7.025 -10.367 3.255 1.00 0.00 H new ATOM 0 HA LEU A 94 -5.288 -8.554 1.763 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.418 -8.793 0.803 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -8.231 -8.803 2.356 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.591 -6.352 2.583 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -7.097 -5.154 0.486 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.809 -6.307 0.907 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.981 -6.710 -0.370 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.437 -5.606 1.128 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -9.412 -7.180 0.297 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -9.856 -7.089 2.018 1.00 0.00 H new ATOM 1370 N HIS A 95 -4.741 -6.945 3.543 1.00 0.00 N ATOM 1371 CA HIS A 95 -4.392 -5.963 4.564 1.00 0.00 C ATOM 1372 C HIS A 95 -4.650 -4.545 4.066 1.00 0.00 C ATOM 1373 O HIS A 95 -4.712 -4.301 2.860 1.00 0.00 O ATOM 1374 CB HIS A 95 -2.925 -6.115 4.968 1.00 0.00 C ATOM 1375 CG HIS A 95 -2.394 -7.504 4.784 1.00 0.00 C ATOM 1376 ND1 HIS A 95 -3.075 -8.630 5.194 1.00 0.00 N ATOM 1377 CD2 HIS A 95 -1.240 -7.944 4.229 1.00 0.00 C ATOM 1378 CE1 HIS A 95 -2.363 -9.704 4.901 1.00 0.00 C ATOM 1379 NE2 HIS A 95 -1.245 -9.315 4.314 1.00 0.00 N ATOM 0 H HIS A 95 -4.063 -7.024 2.785 1.00 0.00 H new ATOM 0 HA HIS A 95 -5.022 -6.143 5.435 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -2.321 -5.423 4.381 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -2.813 -5.827 6.013 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -0.461 -7.331 3.800 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -2.647 -10.726 5.106 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -0.506 -9.932 3.978 1.00 0.00 H new ATOM 1387 N VAL A 96 -4.802 -3.612 5.000 1.00 0.00 N ATOM 1388 CA VAL A 96 -5.054 -2.218 4.656 1.00 0.00 C ATOM 1389 C VAL A 96 -3.832 -1.352 4.941 1.00 0.00 C ATOM 1390 O VAL A 96 -3.509 -1.076 6.096 1.00 0.00 O ATOM 1391 CB VAL A 96 -6.259 -1.657 5.433 1.00 0.00 C ATOM 1392 CG1 VAL A 96 -6.468 -0.186 5.105 1.00 0.00 C ATOM 1393 CG2 VAL A 96 -7.513 -2.463 5.126 1.00 0.00 C ATOM 0 H VAL A 96 -4.755 -3.797 6.002 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.275 -2.191 3.589 1.00 0.00 H new ATOM 0 HB VAL A 96 -6.052 -1.741 6.500 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -7.324 0.193 5.663 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -5.577 0.378 5.380 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -6.653 -0.074 4.037 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -8.355 -2.053 5.684 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -7.726 -2.412 4.058 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -7.358 -3.502 5.416 1.00 0.00 H new ATOM 1403 N VAL A 97 -3.155 -0.926 3.879 1.00 0.00 N ATOM 1404 CA VAL A 97 -1.968 -0.089 4.015 1.00 0.00 C ATOM 1405 C VAL A 97 -2.330 1.390 3.955 1.00 0.00 C ATOM 1406 O VAL A 97 -2.807 1.882 2.933 1.00 0.00 O ATOM 1407 CB VAL A 97 -0.935 -0.399 2.915 1.00 0.00 C ATOM 1408 CG1 VAL A 97 0.244 0.558 3.006 1.00 0.00 C ATOM 1409 CG2 VAL A 97 -0.469 -1.843 3.013 1.00 0.00 C ATOM 0 H VAL A 97 -3.408 -1.146 2.916 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.531 -0.314 4.988 1.00 0.00 H new ATOM 0 HB VAL A 97 -1.411 -0.261 1.944 1.00 0.00 H new ATOM 0 HG11 VAL A 97 0.964 0.324 2.221 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.108 1.582 2.882 1.00 0.00 H new ATOM 0 HG13 VAL A 97 0.722 0.454 3.980 1.00 0.00 H new ATOM 0 HG21 VAL A 97 0.260 -2.044 2.228 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -0.010 -2.012 3.987 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -1.323 -2.510 2.894 1.00 0.00 H new ATOM 1419 N GLU A 98 -2.098 2.095 5.058 1.00 0.00 N ATOM 1420 CA GLU A 98 -2.400 3.520 5.131 1.00 0.00 C ATOM 1421 C GLU A 98 -1.130 4.354 4.982 1.00 0.00 C ATOM 1422 O GLU A 98 -0.241 4.308 5.832 1.00 0.00 O ATOM 1423 CB GLU A 98 -3.087 3.851 6.457 1.00 0.00 C ATOM 1424 CG GLU A 98 -4.573 3.532 6.469 1.00 0.00 C ATOM 1425 CD GLU A 98 -5.108 3.293 7.867 1.00 0.00 C ATOM 1426 OE1 GLU A 98 -4.759 4.073 8.778 1.00 0.00 O ATOM 1427 OE2 GLU A 98 -5.875 2.325 8.051 1.00 0.00 O ATOM 0 H GLU A 98 -1.702 1.703 5.913 1.00 0.00 H new ATOM 0 HA GLU A 98 -3.074 3.765 4.310 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -2.598 3.296 7.258 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -2.950 4.910 6.673 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -5.121 4.355 6.010 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -4.756 2.648 5.858 1.00 0.00 H new ATOM 1434 N VAL A 99 -1.053 5.114 3.895 1.00 0.00 N ATOM 1435 CA VAL A 99 0.107 5.958 3.633 1.00 0.00 C ATOM 1436 C VAL A 99 -0.220 7.429 3.869 1.00 0.00 C ATOM 1437 O VAL A 99 -1.281 7.912 3.472 1.00 0.00 O ATOM 1438 CB VAL A 99 0.616 5.782 2.190 1.00 0.00 C ATOM 1439 CG1 VAL A 99 1.905 6.561 1.979 1.00 0.00 C ATOM 1440 CG2 VAL A 99 0.816 4.307 1.873 1.00 0.00 C ATOM 0 H VAL A 99 -1.780 5.163 3.181 1.00 0.00 H new ATOM 0 HA VAL A 99 0.888 5.646 4.326 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.135 6.179 1.507 1.00 0.00 H new ATOM 0 HG11 VAL A 99 2.249 6.424 0.954 1.00 0.00 H new ATOM 0 HG12 VAL A 99 1.724 7.620 2.163 1.00 0.00 H new ATOM 0 HG13 VAL A 99 2.667 6.198 2.669 1.00 0.00 H new ATOM 0 HG21 VAL A 99 1.176 4.200 0.850 1.00 0.00 H new ATOM 0 HG22 VAL A 99 1.547 3.883 2.561 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -0.132 3.780 1.981 1.00 0.00 H new ATOM 1450 N THR A 100 0.700 8.137 4.516 1.00 0.00 N ATOM 1451 CA THR A 100 0.510 9.553 4.806 1.00 0.00 C ATOM 1452 C THR A 100 1.794 10.340 4.570 1.00 0.00 C ATOM 1453 O THR A 100 2.825 10.063 5.184 1.00 0.00 O ATOM 1454 CB THR A 100 0.047 9.773 6.258 1.00 0.00 C ATOM 1455 OG1 THR A 100 0.877 9.027 7.155 1.00 0.00 O ATOM 1456 CG2 THR A 100 -1.404 9.351 6.433 1.00 0.00 C ATOM 0 H THR A 100 1.584 7.753 4.849 1.00 0.00 H new ATOM 0 HA THR A 100 -0.264 9.912 4.128 1.00 0.00 H new ATOM 0 HB THR A 100 0.130 10.836 6.485 1.00 0.00 H new ATOM 0 HG1 THR A 100 1.815 9.118 6.885 1.00 0.00 H new ATOM 0 HG21 THR A 100 -1.709 9.516 7.467 1.00 0.00 H new ATOM 0 HG22 THR A 100 -2.037 9.941 5.770 1.00 0.00 H new ATOM 0 HG23 THR A 100 -1.508 8.294 6.188 1.00 0.00 H new ATOM 1464 N TYR A 101 1.726 11.321 3.677 1.00 0.00 N ATOM 1465 CA TYR A 101 2.885 12.147 3.359 1.00 0.00 C ATOM 1466 C TYR A 101 2.738 13.544 3.955 1.00 0.00 C ATOM 1467 O TYR A 101 1.887 14.326 3.530 1.00 0.00 O ATOM 1468 CB TYR A 101 3.068 12.243 1.843 1.00 0.00 C ATOM 1469 CG TYR A 101 4.408 12.809 1.430 1.00 0.00 C ATOM 1470 CD1 TYR A 101 4.716 14.146 1.647 1.00 0.00 C ATOM 1471 CD2 TYR A 101 5.365 12.006 0.822 1.00 0.00 C ATOM 1472 CE1 TYR A 101 5.939 14.668 1.270 1.00 0.00 C ATOM 1473 CE2 TYR A 101 6.591 12.518 0.444 1.00 0.00 C ATOM 1474 CZ TYR A 101 6.873 13.850 0.670 1.00 0.00 C ATOM 1475 OH TYR A 101 8.092 14.364 0.293 1.00 0.00 O ATOM 0 H TYR A 101 0.881 11.564 3.160 1.00 0.00 H new ATOM 0 HA TYR A 101 3.766 11.677 3.795 1.00 0.00 H new ATOM 0 HB2 TYR A 101 2.953 11.250 1.408 1.00 0.00 H new ATOM 0 HB3 TYR A 101 2.276 12.867 1.429 1.00 0.00 H new ATOM 0 HD1 TYR A 101 3.987 14.789 2.118 1.00 0.00 H new ATOM 0 HD2 TYR A 101 5.147 10.964 0.642 1.00 0.00 H new ATOM 0 HE1 TYR A 101 6.162 15.710 1.444 1.00 0.00 H new ATOM 0 HE2 TYR A 101 7.325 11.880 -0.026 1.00 0.00 H new ATOM 0 HH TYR A 101 8.793 14.003 0.875 1.00 0.00 H new ATOM 1485 N ASP A 102 3.575 13.850 4.940 1.00 0.00 N ATOM 1486 CA ASP A 102 3.541 15.153 5.594 1.00 0.00 C ATOM 1487 C ASP A 102 2.202 15.378 6.289 1.00 0.00 C ATOM 1488 O ASP A 102 1.595 16.442 6.160 1.00 0.00 O ATOM 1489 CB ASP A 102 3.795 16.266 4.575 1.00 0.00 C ATOM 1490 CG ASP A 102 5.266 16.423 4.243 1.00 0.00 C ATOM 1491 OD1 ASP A 102 6.029 15.459 4.460 1.00 0.00 O ATOM 1492 OD2 ASP A 102 5.653 17.510 3.766 1.00 0.00 O ATOM 0 H ASP A 102 4.285 13.214 5.303 1.00 0.00 H new ATOM 0 HA ASP A 102 4.328 15.174 6.347 1.00 0.00 H new ATOM 0 HB2 ASP A 102 3.240 16.052 3.662 1.00 0.00 H new ATOM 0 HB3 ASP A 102 3.412 17.208 4.967 1.00 0.00 H new ATOM 1497 N ASP A 103 1.747 14.370 7.024 1.00 0.00 N ATOM 1498 CA ASP A 103 0.479 14.457 7.740 1.00 0.00 C ATOM 1499 C ASP A 103 -0.682 14.645 6.768 1.00 0.00 C ATOM 1500 O ASP A 103 -1.678 15.292 7.091 1.00 0.00 O ATOM 1501 CB ASP A 103 0.513 15.613 8.741 1.00 0.00 C ATOM 1502 CG ASP A 103 1.080 15.197 10.085 1.00 0.00 C ATOM 1503 OD1 ASP A 103 0.741 14.092 10.555 1.00 0.00 O ATOM 1504 OD2 ASP A 103 1.862 15.979 10.666 1.00 0.00 O ATOM 0 H ASP A 103 2.237 13.483 7.140 1.00 0.00 H new ATOM 0 HA ASP A 103 0.330 13.522 8.280 1.00 0.00 H new ATOM 0 HB2 ASP A 103 1.113 16.426 8.333 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -0.497 16.000 8.880 1.00 0.00 H new ATOM 1509 N VAL A 104 -0.546 14.074 5.575 1.00 0.00 N ATOM 1510 CA VAL A 104 -1.583 14.178 4.555 1.00 0.00 C ATOM 1511 C VAL A 104 -1.673 12.899 3.731 1.00 0.00 C ATOM 1512 O VAL A 104 -0.732 12.509 3.039 1.00 0.00 O ATOM 1513 CB VAL A 104 -1.326 15.367 3.612 1.00 0.00 C ATOM 1514 CG1 VAL A 104 -2.447 15.493 2.592 1.00 0.00 C ATOM 1515 CG2 VAL A 104 -1.171 16.654 4.407 1.00 0.00 C ATOM 0 H VAL A 104 0.272 13.535 5.291 1.00 0.00 H new ATOM 0 HA VAL A 104 -2.526 14.337 5.078 1.00 0.00 H new ATOM 0 HB VAL A 104 -0.396 15.185 3.073 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -2.247 16.339 1.935 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -2.505 14.579 2.000 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -3.393 15.651 3.109 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -0.990 17.484 3.724 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -2.082 16.843 4.974 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -0.330 16.559 5.093 1.00 0.00 H new ATOM 1525 N PRO A 105 -2.832 12.228 3.803 1.00 0.00 N ATOM 1526 CA PRO A 105 -3.074 10.982 3.069 1.00 0.00 C ATOM 1527 C PRO A 105 -3.186 11.209 1.565 1.00 0.00 C ATOM 1528 O PRO A 105 -3.576 12.288 1.118 1.00 0.00 O ATOM 1529 CB PRO A 105 -4.407 10.489 3.636 1.00 0.00 C ATOM 1530 CG PRO A 105 -5.089 11.719 4.126 1.00 0.00 C ATOM 1531 CD PRO A 105 -3.997 12.634 4.608 1.00 0.00 C ATOM 0 HA PRO A 105 -2.256 10.272 3.190 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -5.000 9.985 2.872 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -4.253 9.773 4.444 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -5.668 12.188 3.330 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -5.785 11.485 4.931 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -4.251 13.682 4.448 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -3.811 12.511 5.675 1.00 0.00 H new ATOM 1539 N ILE A 106 -2.842 10.186 0.790 1.00 0.00 N ATOM 1540 CA ILE A 106 -2.907 10.274 -0.664 1.00 0.00 C ATOM 1541 C ILE A 106 -4.226 9.719 -1.190 1.00 0.00 C ATOM 1542 O ILE A 106 -4.880 8.895 -0.552 1.00 0.00 O ATOM 1543 CB ILE A 106 -1.742 9.513 -1.326 1.00 0.00 C ATOM 1544 CG1 ILE A 106 -1.544 8.154 -0.652 1.00 0.00 C ATOM 1545 CG2 ILE A 106 -0.465 10.336 -1.256 1.00 0.00 C ATOM 1546 CD1 ILE A 106 -0.552 7.264 -1.368 1.00 0.00 C ATOM 0 H ILE A 106 -2.516 9.287 1.144 1.00 0.00 H new ATOM 0 HA ILE A 106 -2.833 11.331 -0.920 1.00 0.00 H new ATOM 0 HB ILE A 106 -1.986 9.345 -2.375 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -1.206 8.311 0.372 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -2.505 7.642 -0.595 1.00 0.00 H new ATOM 0 HG21 ILE A 106 0.349 9.785 -1.728 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -0.613 11.282 -1.777 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -0.215 10.531 -0.213 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -0.461 6.318 -0.835 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -0.899 7.076 -2.384 1.00 0.00 H new ATOM 0 HD13 ILE A 106 0.420 7.756 -1.401 1.00 0.00 H new ATOM 1558 N PRO A 107 -4.627 10.180 -2.384 1.00 0.00 N ATOM 1559 CA PRO A 107 -5.871 9.742 -3.025 1.00 0.00 C ATOM 1560 C PRO A 107 -5.800 8.294 -3.498 1.00 0.00 C ATOM 1561 O PRO A 107 -6.737 7.786 -4.112 1.00 0.00 O ATOM 1562 CB PRO A 107 -6.007 10.689 -4.220 1.00 0.00 C ATOM 1563 CG PRO A 107 -4.613 11.119 -4.523 1.00 0.00 C ATOM 1564 CD PRO A 107 -3.897 11.164 -3.201 1.00 0.00 C ATOM 0 HA PRO A 107 -6.717 9.776 -2.339 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -6.461 10.186 -5.074 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -6.641 11.542 -3.979 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -4.129 10.421 -5.205 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -4.602 12.096 -5.006 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -2.845 10.899 -3.305 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -3.933 12.159 -2.758 1.00 0.00 H new ATOM 1572 N ASN A 108 -4.684 7.635 -3.206 1.00 0.00 N ATOM 1573 CA ASN A 108 -4.492 6.244 -3.602 1.00 0.00 C ATOM 1574 C ASN A 108 -4.660 5.310 -2.408 1.00 0.00 C ATOM 1575 O ASN A 108 -4.809 4.099 -2.570 1.00 0.00 O ATOM 1576 CB ASN A 108 -3.105 6.055 -4.220 1.00 0.00 C ATOM 1577 CG ASN A 108 -2.775 7.129 -5.239 1.00 0.00 C ATOM 1578 OD1 ASN A 108 -1.825 7.893 -5.067 1.00 0.00 O ATOM 1579 ND2 ASN A 108 -3.559 7.190 -6.309 1.00 0.00 N ATOM 0 H ASN A 108 -3.899 8.041 -2.697 1.00 0.00 H new ATOM 0 HA ASN A 108 -5.251 5.996 -4.344 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -2.354 6.064 -3.430 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -3.053 5.077 -4.698 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -3.385 7.891 -7.030 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -4.335 6.536 -6.410 1.00 0.00 H new ATOM 1586 N SER A 109 -4.636 5.882 -1.208 1.00 0.00 N ATOM 1587 CA SER A 109 -4.783 5.101 0.014 1.00 0.00 C ATOM 1588 C SER A 109 -6.154 5.328 0.642 1.00 0.00 C ATOM 1589 O SER A 109 -6.844 6.306 0.354 1.00 0.00 O ATOM 1590 CB SER A 109 -3.684 5.468 1.014 1.00 0.00 C ATOM 1591 OG SER A 109 -2.561 4.616 0.873 1.00 0.00 O ATOM 0 H SER A 109 -4.516 6.884 -1.057 1.00 0.00 H new ATOM 0 HA SER A 109 -4.692 4.046 -0.245 1.00 0.00 H new ATOM 0 HB2 SER A 109 -3.380 6.504 0.861 1.00 0.00 H new ATOM 0 HB3 SER A 109 -4.073 5.397 2.030 1.00 0.00 H new ATOM 0 HG SER A 109 -2.553 4.232 -0.029 1.00 0.00 H new ATOM 1597 N PRO A 110 -6.561 4.402 1.524 1.00 0.00 N ATOM 1598 CA PRO A 110 -5.749 3.233 1.875 1.00 0.00 C ATOM 1599 C PRO A 110 -5.642 2.235 0.727 1.00 0.00 C ATOM 1600 O PRO A 110 -6.499 2.196 -0.157 1.00 0.00 O ATOM 1601 CB PRO A 110 -6.508 2.615 3.052 1.00 0.00 C ATOM 1602 CG PRO A 110 -7.919 3.058 2.868 1.00 0.00 C ATOM 1603 CD PRO A 110 -7.845 4.424 2.244 1.00 0.00 C ATOM 0 HA PRO A 110 -4.720 3.507 2.110 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -6.430 1.528 3.046 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -6.107 2.958 4.006 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -8.465 2.365 2.228 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -8.445 3.093 3.822 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -8.681 4.603 1.568 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -7.870 5.212 2.997 1.00 0.00 H new ATOM 1611 N PHE A 111 -4.586 1.429 0.746 1.00 0.00 N ATOM 1612 CA PHE A 111 -4.367 0.431 -0.295 1.00 0.00 C ATOM 1613 C PHE A 111 -4.875 -0.937 0.149 1.00 0.00 C ATOM 1614 O PHE A 111 -5.170 -1.152 1.325 1.00 0.00 O ATOM 1615 CB PHE A 111 -2.880 0.346 -0.645 1.00 0.00 C ATOM 1616 CG PHE A 111 -2.395 1.496 -1.481 1.00 0.00 C ATOM 1617 CD1 PHE A 111 -2.772 1.612 -2.809 1.00 0.00 C ATOM 1618 CD2 PHE A 111 -1.560 2.460 -0.939 1.00 0.00 C ATOM 1619 CE1 PHE A 111 -2.328 2.669 -3.581 1.00 0.00 C ATOM 1620 CE2 PHE A 111 -1.113 3.519 -1.706 1.00 0.00 C ATOM 1621 CZ PHE A 111 -1.496 3.623 -3.029 1.00 0.00 C ATOM 0 H PHE A 111 -3.868 1.447 1.471 1.00 0.00 H new ATOM 0 HA PHE A 111 -4.925 0.737 -1.180 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -2.299 0.307 0.277 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -2.693 -0.586 -1.179 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -3.421 0.867 -3.246 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -1.255 2.383 0.094 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -2.631 2.749 -4.614 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -0.464 4.265 -1.271 1.00 0.00 H new ATOM 0 HZ PHE A 111 -1.146 4.449 -3.631 1.00 0.00 H new ATOM 1631 N LYS A 112 -4.976 -1.861 -0.801 1.00 0.00 N ATOM 1632 CA LYS A 112 -5.448 -3.210 -0.510 1.00 0.00 C ATOM 1633 C LYS A 112 -4.505 -4.254 -1.099 1.00 0.00 C ATOM 1634 O LYS A 112 -4.436 -4.427 -2.316 1.00 0.00 O ATOM 1635 CB LYS A 112 -6.860 -3.409 -1.067 1.00 0.00 C ATOM 1636 CG LYS A 112 -7.958 -3.004 -0.100 1.00 0.00 C ATOM 1637 CD LYS A 112 -9.199 -2.524 -0.834 1.00 0.00 C ATOM 1638 CE LYS A 112 -10.020 -3.690 -1.362 1.00 0.00 C ATOM 1639 NZ LYS A 112 -10.921 -3.276 -2.474 1.00 0.00 N ATOM 0 H LYS A 112 -4.737 -1.700 -1.780 1.00 0.00 H new ATOM 0 HA LYS A 112 -5.470 -3.336 0.572 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -6.964 -2.830 -1.985 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -6.992 -4.457 -1.334 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -8.215 -3.851 0.535 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -7.593 -2.213 0.555 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -9.810 -1.922 -0.162 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -8.906 -1.879 -1.662 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -9.351 -4.477 -1.710 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -10.614 -4.112 -0.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -11.463 -4.099 -2.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -11.577 -2.543 -2.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -10.353 -2.896 -3.258 1.00 0.00 H new ATOM 1653 N VAL A 113 -3.782 -4.950 -0.227 1.00 0.00 N ATOM 1654 CA VAL A 113 -2.845 -5.979 -0.661 1.00 0.00 C ATOM 1655 C VAL A 113 -3.408 -7.374 -0.412 1.00 0.00 C ATOM 1656 O VAL A 113 -3.377 -7.876 0.711 1.00 0.00 O ATOM 1657 CB VAL A 113 -1.491 -5.848 0.063 1.00 0.00 C ATOM 1658 CG1 VAL A 113 -0.562 -6.986 -0.331 1.00 0.00 C ATOM 1659 CG2 VAL A 113 -0.855 -4.500 -0.240 1.00 0.00 C ATOM 0 H VAL A 113 -3.827 -4.820 0.784 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.692 -5.836 -1.731 1.00 0.00 H new ATOM 0 HB VAL A 113 -1.665 -5.909 1.137 1.00 0.00 H new ATOM 0 HG11 VAL A 113 0.389 -6.876 0.190 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -1.017 -7.938 -0.059 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -0.391 -6.960 -1.407 1.00 0.00 H new ATOM 0 HG21 VAL A 113 0.100 -4.424 0.279 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -0.693 -4.407 -1.314 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -1.516 -3.702 0.098 1.00 0.00 H new ATOM 1669 N ALA A 114 -3.921 -7.996 -1.468 1.00 0.00 N ATOM 1670 CA ALA A 114 -4.489 -9.335 -1.366 1.00 0.00 C ATOM 1671 C ALA A 114 -3.403 -10.401 -1.468 1.00 0.00 C ATOM 1672 O ALA A 114 -3.012 -10.799 -2.566 1.00 0.00 O ATOM 1673 CB ALA A 114 -5.542 -9.545 -2.443 1.00 0.00 C ATOM 0 H ALA A 114 -3.955 -7.594 -2.405 1.00 0.00 H new ATOM 0 HA ALA A 114 -4.962 -9.429 -0.389 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -5.957 -10.549 -2.355 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -6.338 -8.811 -2.321 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -5.086 -9.426 -3.426 1.00 0.00 H new ATOM 1679 N VAL A 115 -2.920 -10.859 -0.318 1.00 0.00 N ATOM 1680 CA VAL A 115 -1.880 -11.880 -0.279 1.00 0.00 C ATOM 1681 C VAL A 115 -2.434 -13.245 -0.671 1.00 0.00 C ATOM 1682 O VAL A 115 -3.563 -13.593 -0.323 1.00 0.00 O ATOM 1683 CB VAL A 115 -1.243 -11.979 1.120 1.00 0.00 C ATOM 1684 CG1 VAL A 115 -0.294 -13.166 1.193 1.00 0.00 C ATOM 1685 CG2 VAL A 115 -0.521 -10.686 1.469 1.00 0.00 C ATOM 0 H VAL A 115 -3.232 -10.539 0.599 1.00 0.00 H new ATOM 0 HA VAL A 115 -1.117 -11.581 -0.998 1.00 0.00 H new ATOM 0 HB VAL A 115 -2.036 -12.134 1.851 1.00 0.00 H new ATOM 0 HG11 VAL A 115 0.146 -13.219 2.189 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -0.844 -14.085 0.990 1.00 0.00 H new ATOM 0 HG13 VAL A 115 0.497 -13.046 0.453 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -0.077 -10.773 2.461 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.263 -10.498 0.736 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -1.231 -9.859 1.461 1.00 0.00 H new ATOM 1695 N THR A 116 -1.632 -14.017 -1.397 1.00 0.00 N ATOM 1696 CA THR A 116 -2.041 -15.345 -1.838 1.00 0.00 C ATOM 1697 C THR A 116 -0.996 -16.392 -1.471 1.00 0.00 C ATOM 1698 O THR A 116 0.205 -16.140 -1.557 1.00 0.00 O ATOM 1699 CB THR A 116 -2.279 -15.383 -3.359 1.00 0.00 C ATOM 1700 OG1 THR A 116 -2.719 -16.688 -3.753 1.00 0.00 O ATOM 1701 CG2 THR A 116 -1.010 -15.021 -4.114 1.00 0.00 C ATOM 0 H THR A 116 -0.694 -13.745 -1.692 1.00 0.00 H new ATOM 0 HA THR A 116 -2.976 -15.574 -1.326 1.00 0.00 H new ATOM 0 HB THR A 116 -3.049 -14.651 -3.603 1.00 0.00 H new ATOM 0 HG1 THR A 116 -2.870 -16.704 -4.721 1.00 0.00 H new ATOM 0 HG21 THR A 116 -1.203 -15.055 -5.186 1.00 0.00 H new ATOM 0 HG22 THR A 116 -0.694 -14.016 -3.833 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.223 -15.732 -3.864 1.00 0.00 H new ATOM 1709 N GLU A 117 -1.462 -17.569 -1.063 1.00 0.00 N ATOM 1710 CA GLU A 117 -0.566 -18.655 -0.684 1.00 0.00 C ATOM 1711 C GLU A 117 0.528 -18.849 -1.731 1.00 0.00 C ATOM 1712 O GLU A 117 0.267 -19.320 -2.837 1.00 0.00 O ATOM 1713 CB GLU A 117 -1.351 -19.955 -0.504 1.00 0.00 C ATOM 1714 CG GLU A 117 -2.252 -19.958 0.719 1.00 0.00 C ATOM 1715 CD GLU A 117 -3.431 -20.900 0.574 1.00 0.00 C ATOM 1716 OE1 GLU A 117 -4.431 -20.507 -0.063 1.00 0.00 O ATOM 1717 OE2 GLU A 117 -3.353 -22.032 1.096 1.00 0.00 O ATOM 0 H GLU A 117 -2.454 -17.794 -0.987 1.00 0.00 H new ATOM 0 HA GLU A 117 -0.096 -18.389 0.263 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -1.958 -20.129 -1.392 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -0.649 -20.786 -0.430 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -1.669 -20.244 1.594 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -2.619 -18.947 0.897 1.00 0.00 H new ATOM 1724 N GLY A 118 1.754 -18.480 -1.373 1.00 0.00 N ATOM 1725 CA GLY A 118 2.869 -18.620 -2.291 1.00 0.00 C ATOM 1726 C GLY A 118 3.835 -19.709 -1.869 1.00 0.00 C ATOM 1727 O GLY A 118 3.736 -20.848 -2.326 1.00 0.00 O ATOM 0 H GLY A 118 1.995 -18.087 -0.463 1.00 0.00 H new ATOM 0 HA2 GLY A 118 2.489 -18.842 -3.288 1.00 0.00 H new ATOM 0 HA3 GLY A 118 3.402 -17.672 -2.357 1.00 0.00 H new ATOM 1731 N CYS A 119 4.772 -19.359 -0.995 1.00 0.00 N ATOM 1732 CA CYS A 119 5.763 -20.314 -0.512 1.00 0.00 C ATOM 1733 C CYS A 119 6.162 -20.004 0.927 1.00 0.00 C ATOM 1734 O CYS A 119 6.177 -18.845 1.340 1.00 0.00 O ATOM 1735 CB CYS A 119 7.000 -20.297 -1.412 1.00 0.00 C ATOM 1736 SG CYS A 119 6.681 -20.817 -3.114 1.00 0.00 S ATOM 0 H CYS A 119 4.866 -18.421 -0.606 1.00 0.00 H new ATOM 0 HA CYS A 119 5.316 -21.308 -0.540 1.00 0.00 H new ATOM 0 HB2 CYS A 119 7.414 -19.289 -1.423 1.00 0.00 H new ATOM 0 HB3 CYS A 119 7.759 -20.949 -0.980 1.00 0.00 H new ATOM 0 HG CYS A 119 5.413 -21.063 -3.262 1.00 0.00 H new ATOM 1742 N GLN A 120 6.482 -21.048 1.685 1.00 0.00 N ATOM 1743 CA GLN A 120 6.879 -20.886 3.079 1.00 0.00 C ATOM 1744 C GLN A 120 8.369 -21.156 3.256 1.00 0.00 C ATOM 1745 O GLN A 120 8.913 -22.134 2.742 1.00 0.00 O ATOM 1746 CB GLN A 120 6.068 -21.825 3.974 1.00 0.00 C ATOM 1747 CG GLN A 120 6.433 -21.727 5.446 1.00 0.00 C ATOM 1748 CD GLN A 120 5.682 -22.729 6.301 1.00 0.00 C ATOM 1749 OE1 GLN A 120 5.033 -23.640 5.786 1.00 0.00 O ATOM 1750 NE2 GLN A 120 5.765 -22.565 7.616 1.00 0.00 N ATOM 0 H GLN A 120 6.474 -22.014 1.358 1.00 0.00 H new ATOM 0 HA GLN A 120 6.679 -19.855 3.370 1.00 0.00 H new ATOM 0 HB2 GLN A 120 5.008 -21.601 3.855 1.00 0.00 H new ATOM 0 HB3 GLN A 120 6.217 -22.851 3.639 1.00 0.00 H new ATOM 0 HG2 GLN A 120 7.505 -21.887 5.562 1.00 0.00 H new ATOM 0 HG3 GLN A 120 6.221 -20.719 5.803 1.00 0.00 H new ATOM 0 HE21 GLN A 120 6.314 -21.796 8.000 1.00 0.00 H new ATOM 0 HE22 GLN A 120 5.280 -23.208 8.242 1.00 0.00 H new ATOM 1759 N PRO A 121 9.048 -20.270 3.999 1.00 0.00 N ATOM 1760 CA PRO A 121 10.485 -20.392 4.261 1.00 0.00 C ATOM 1761 C PRO A 121 10.809 -21.561 5.184 1.00 0.00 C ATOM 1762 O PRO A 121 9.936 -22.365 5.513 1.00 0.00 O ATOM 1763 CB PRO A 121 10.836 -19.064 4.937 1.00 0.00 C ATOM 1764 CG PRO A 121 9.561 -18.603 5.553 1.00 0.00 C ATOM 1765 CD PRO A 121 8.464 -19.080 4.642 1.00 0.00 C ATOM 0 HA PRO A 121 11.050 -20.585 3.349 1.00 0.00 H new ATOM 0 HB2 PRO A 121 11.614 -19.196 5.689 1.00 0.00 H new ATOM 0 HB3 PRO A 121 11.211 -18.339 4.215 1.00 0.00 H new ATOM 0 HG2 PRO A 121 9.441 -19.013 6.556 1.00 0.00 H new ATOM 0 HG3 PRO A 121 9.544 -17.517 5.649 1.00 0.00 H new ATOM 0 HD2 PRO A 121 7.559 -19.327 5.197 1.00 0.00 H new ATOM 0 HD3 PRO A 121 8.191 -18.320 3.909 1.00 0.00 H new ATOM 1773 N SER A 122 12.068 -21.650 5.600 1.00 0.00 N ATOM 1774 CA SER A 122 12.508 -22.724 6.484 1.00 0.00 C ATOM 1775 C SER A 122 13.672 -22.266 7.357 1.00 0.00 C ATOM 1776 O SER A 122 14.252 -21.204 7.132 1.00 0.00 O ATOM 1777 CB SER A 122 12.920 -23.949 5.666 1.00 0.00 C ATOM 1778 OG SER A 122 14.037 -23.661 4.843 1.00 0.00 O ATOM 0 H SER A 122 12.802 -20.991 5.339 1.00 0.00 H new ATOM 0 HA SER A 122 11.674 -22.993 7.133 1.00 0.00 H new ATOM 0 HB2 SER A 122 13.162 -24.773 6.337 1.00 0.00 H new ATOM 0 HB3 SER A 122 12.084 -24.275 5.048 1.00 0.00 H new ATOM 0 HG SER A 122 14.282 -24.461 4.332 1.00 0.00 H new ATOM 1784 N SER A 123 14.007 -23.076 8.357 1.00 0.00 N ATOM 1785 CA SER A 123 15.099 -22.754 9.268 1.00 0.00 C ATOM 1786 C SER A 123 16.398 -23.413 8.813 1.00 0.00 C ATOM 1787 O SER A 123 16.389 -24.329 7.993 1.00 0.00 O ATOM 1788 CB SER A 123 14.756 -23.204 10.689 1.00 0.00 C ATOM 1789 OG SER A 123 13.627 -22.507 11.186 1.00 0.00 O ATOM 0 H SER A 123 13.538 -23.959 8.556 1.00 0.00 H new ATOM 0 HA SER A 123 15.238 -21.673 9.261 1.00 0.00 H new ATOM 0 HB2 SER A 123 14.558 -24.276 10.697 1.00 0.00 H new ATOM 0 HB3 SER A 123 15.610 -23.033 11.344 1.00 0.00 H new ATOM 0 HG SER A 123 13.427 -22.814 12.095 1.00 0.00 H new ATOM 1795 N GLY A 124 17.516 -22.938 9.354 1.00 0.00 N ATOM 1796 CA GLY A 124 18.808 -23.491 8.993 1.00 0.00 C ATOM 1797 C GLY A 124 19.813 -23.403 10.124 1.00 0.00 C ATOM 1798 O GLY A 124 19.453 -23.341 11.300 1.00 0.00 O ATOM 0 H GLY A 124 17.550 -22.180 10.036 1.00 0.00 H new ATOM 0 HA2 GLY A 124 18.685 -24.534 8.701 1.00 0.00 H new ATOM 0 HA3 GLY A 124 19.197 -22.961 8.124 1.00 0.00 H new ATOM 1802 N PRO A 125 21.108 -23.398 9.772 1.00 0.00 N ATOM 1803 CA PRO A 125 22.195 -23.318 10.752 1.00 0.00 C ATOM 1804 C PRO A 125 22.271 -21.951 11.423 1.00 0.00 C ATOM 1805 O PRO A 125 21.706 -20.975 10.930 1.00 0.00 O ATOM 1806 CB PRO A 125 23.449 -23.572 9.912 1.00 0.00 C ATOM 1807 CG PRO A 125 23.073 -23.154 8.533 1.00 0.00 C ATOM 1808 CD PRO A 125 21.609 -23.469 8.389 1.00 0.00 C ATOM 0 HA PRO A 125 22.061 -24.028 11.568 1.00 0.00 H new ATOM 0 HB2 PRO A 125 24.297 -22.996 10.283 1.00 0.00 H new ATOM 0 HB3 PRO A 125 23.739 -24.622 9.942 1.00 0.00 H new ATOM 0 HG2 PRO A 125 23.260 -22.091 8.383 1.00 0.00 H new ATOM 0 HG3 PRO A 125 23.662 -23.689 7.789 1.00 0.00 H new ATOM 0 HD2 PRO A 125 21.105 -22.751 7.742 1.00 0.00 H new ATOM 0 HD3 PRO A 125 21.451 -24.456 7.954 1.00 0.00 H new ATOM 1816 N SER A 126 22.974 -21.888 12.549 1.00 0.00 N ATOM 1817 CA SER A 126 23.121 -20.640 13.290 1.00 0.00 C ATOM 1818 C SER A 126 23.508 -19.497 12.356 1.00 0.00 C ATOM 1819 O SER A 126 24.658 -19.392 11.930 1.00 0.00 O ATOM 1820 CB SER A 126 24.174 -20.796 14.388 1.00 0.00 C ATOM 1821 OG SER A 126 25.470 -20.948 13.835 1.00 0.00 O ATOM 0 H SER A 126 23.451 -22.686 12.968 1.00 0.00 H new ATOM 0 HA SER A 126 22.161 -20.402 13.749 1.00 0.00 H new ATOM 0 HB2 SER A 126 24.154 -19.924 15.041 1.00 0.00 H new ATOM 0 HB3 SER A 126 23.935 -21.662 15.005 1.00 0.00 H new ATOM 0 HG SER A 126 25.575 -20.338 13.076 1.00 0.00 H new ATOM 1827 N SER A 127 22.539 -18.643 12.044 1.00 0.00 N ATOM 1828 CA SER A 127 22.776 -17.509 11.158 1.00 0.00 C ATOM 1829 C SER A 127 21.907 -16.319 11.554 1.00 0.00 C ATOM 1830 O SER A 127 20.762 -16.485 11.974 1.00 0.00 O ATOM 1831 CB SER A 127 22.493 -17.901 9.707 1.00 0.00 C ATOM 1832 OG SER A 127 23.398 -18.897 9.262 1.00 0.00 O ATOM 0 H SER A 127 21.583 -18.714 12.391 1.00 0.00 H new ATOM 0 HA SER A 127 23.823 -17.219 11.251 1.00 0.00 H new ATOM 0 HB2 SER A 127 21.471 -18.269 9.619 1.00 0.00 H new ATOM 0 HB3 SER A 127 22.572 -17.022 9.068 1.00 0.00 H new ATOM 0 HG SER A 127 23.130 -19.768 9.623 1.00 0.00 H new ATOM 1838 N GLY A 128 22.460 -15.118 11.417 1.00 0.00 N ATOM 1839 CA GLY A 128 21.723 -13.918 11.765 1.00 0.00 C ATOM 1840 C GLY A 128 22.514 -12.992 12.667 1.00 0.00 C ATOM 1841 O GLY A 128 23.270 -13.447 13.525 1.00 0.00 O ATOM 0 H GLY A 128 23.406 -14.955 11.071 1.00 0.00 H new ATOM 0 HA2 GLY A 128 21.450 -13.386 10.854 1.00 0.00 H new ATOM 0 HA3 GLY A 128 20.794 -14.197 12.262 1.00 0.00 H new TER 1845 GLY A 128