USER MOD reduce.3.24.130724 H: found=0, std=0, add=1216, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1214 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 121 ASN : amide:sc= -0.0153 X(o=-6.8,f=-7.1) USER MOD Set 1.2: A 142 ASN : amide:sc= -6.89! C(o=-6.8!,f=-18!) USER MOD Set 1.3: A 144 ASN : amide:sc= -0.105 X(o=-6.8,f=-6.6) USER MOD Set 1.4: A 147 THR OG1 : rot -77:sc= 0.236 USER MOD Set 2.1: A 105 ASN : amide:sc= 0.346 K(o=0.71,f=-0.18) USER MOD Set 2.2: A 139 THR OG1 : rot 152:sc= 0.367 USER MOD Set 3.1: A 80 CYS SG : rot 150:sc= -0.793 USER MOD Set 3.2: A 103 ASN : amide:sc= -1.98 K(o=-2.8,f=-4.8!) USER MOD Set 4.1: A 38 TYR OH : rot 180:sc= 1.05 USER MOD Set 4.2: A 47 ASN : amide:sc= 0.0434 K(o=1.1,f=-4.9!) USER MOD Set 5.1: A 35 THR OG1 : rot 141:sc= 2.07 USER MOD Set 5.2: A 66 TYR OH : rot 80:sc= 0.311 USER MOD Set 6.1: A 32 TYR OH : rot 148:sc= 1.15 USER MOD Set 6.2: A 82 SER OG : rot 143:sc= 1.05 USER MOD Set 6.3: A 84 CYS SG : rot -110:sc= -1.13 USER MOD Set 6.4: A 96 HIS : no HD1:sc= -4.2! C(o=-3.1!,f=-8.9!) USER MOD Set 7.1: A 9 SER OG : rot 180:sc= 0 USER MOD Set 7.2: A 69 TYR OH : rot 180:sc= 0 USER MOD Set 8.1: A 8 ASN : amide:sc= -0.459 X(o=0.76,f=1.1) USER MOD Set 8.2: A 158 SER OG : rot -116:sc= 1.22 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot -160:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 CYS SG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot -84:sc= 1.62 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 ASN : amide:sc= -0.293 K(o=-0.29,f=-2.8!) USER MOD Single : A 30 LYS NZ :NH3+ -135:sc= 1.19 (180deg=-0.526) USER MOD Single : A 39 HIS :FLIP no HD1:sc= -4.06! C(o=-5!,f=-4.1!) USER MOD Single : A 45 CYS SG : rot 180:sc= 0 USER MOD Single : A 49 ASN :FLIP amide:sc= -0.18 F(o=-1.1,f=-0.18) USER MOD Single : A 50 THR OG1 : rot 13:sc= 1.21 USER MOD Single : A 51 GLN : amide:sc=-0.00717 X(o=-0.0072,f=-0.0068) USER MOD Single : A 55 CYS SG : rot 180:sc= -0.276 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 ASN : amide:sc= -5.01! C(o=-5!,f=-6!) USER MOD Single : A 65 ASN : amide:sc= 0.443 K(o=0.44,f=-3.5!) USER MOD Single : A 85 SER OG : rot 11:sc= 0.444! USER MOD Single : A 87 LYS NZ :NH3+ -126:sc= 0.215 (180deg=-0.0308) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ -168:sc= -0.0136 (180deg=-0.147) USER MOD Single : A 97 CYS SG : rot 180:sc= -0.174 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot -53:sc= 1.16 USER MOD Single : A 112 THR OG1 : rot 56:sc= 0.23 USER MOD Single : A 115 SER OG : rot 46:sc= 0.64 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 MET CE :methyl 170:sc= 0 (180deg=-0.0162) USER MOD Single : A 127 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 134 ASN : amide:sc= -0.597 K(o=-0.6,f=-7.7!) USER MOD Single : A 141 SER OG : rot 38:sc= 0.0996 USER MOD Single : A 145 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0596) USER MOD Single : A 149 CYS SG : rot 59:sc= 0.249 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 9.099 23.150 -12.478 1.00 0.00 N ATOM 2 CA GLY A 1 7.834 22.531 -12.128 1.00 0.00 C ATOM 3 C GLY A 1 7.917 21.725 -10.847 1.00 0.00 C ATOM 4 O GLY A 1 7.631 22.235 -9.765 1.00 0.00 O ATOM 0 H1 GLY A 1 8.989 23.689 -13.361 1.00 0.00 H new ATOM 0 H2 GLY A 1 9.394 23.792 -11.715 1.00 0.00 H new ATOM 0 H3 GLY A 1 9.821 22.413 -12.610 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.073 23.304 -12.019 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.514 21.881 -12.942 1.00 0.00 H new ATOM 8 N SER A 2 8.308 20.460 -10.971 1.00 0.00 N ATOM 9 CA SER A 2 8.423 19.579 -9.814 1.00 0.00 C ATOM 10 C SER A 2 9.661 18.695 -9.926 1.00 0.00 C ATOM 11 O SER A 2 10.290 18.619 -10.981 1.00 0.00 O ATOM 12 CB SER A 2 7.171 18.710 -9.683 1.00 0.00 C ATOM 13 OG SER A 2 7.184 17.651 -10.624 1.00 0.00 O ATOM 0 H SER A 2 8.550 20.023 -11.860 1.00 0.00 H new ATOM 0 HA SER A 2 8.521 20.199 -8.923 1.00 0.00 H new ATOM 0 HB2 SER A 2 7.111 18.303 -8.674 1.00 0.00 H new ATOM 0 HB3 SER A 2 6.282 19.323 -9.833 1.00 0.00 H new ATOM 0 HG SER A 2 6.374 17.110 -10.518 1.00 0.00 H new ATOM 19 N SER A 3 10.004 18.027 -8.829 1.00 0.00 N ATOM 20 CA SER A 3 11.168 17.150 -8.801 1.00 0.00 C ATOM 21 C SER A 3 10.750 15.688 -8.926 1.00 0.00 C ATOM 22 O SER A 3 11.366 14.915 -9.659 1.00 0.00 O ATOM 23 CB SER A 3 11.958 17.357 -7.507 1.00 0.00 C ATOM 24 OG SER A 3 13.238 16.754 -7.589 1.00 0.00 O ATOM 0 H SER A 3 9.492 18.077 -7.948 1.00 0.00 H new ATOM 0 HA SER A 3 11.803 17.403 -9.650 1.00 0.00 H new ATOM 0 HB2 SER A 3 12.067 18.424 -7.310 1.00 0.00 H new ATOM 0 HB3 SER A 3 11.406 16.933 -6.668 1.00 0.00 H new ATOM 0 HG SER A 3 13.723 16.902 -6.751 1.00 0.00 H new ATOM 30 N GLY A 4 9.698 15.316 -8.203 1.00 0.00 N ATOM 31 CA GLY A 4 9.215 13.948 -8.246 1.00 0.00 C ATOM 32 C GLY A 4 8.259 13.635 -7.112 1.00 0.00 C ATOM 33 O GLY A 4 7.055 13.496 -7.326 1.00 0.00 O ATOM 0 H GLY A 4 9.172 15.937 -7.589 1.00 0.00 H new ATOM 0 HA2 GLY A 4 8.714 13.772 -9.198 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.063 13.265 -8.201 1.00 0.00 H new ATOM 37 N SER A 5 8.797 13.521 -5.902 1.00 0.00 N ATOM 38 CA SER A 5 7.985 13.216 -4.730 1.00 0.00 C ATOM 39 C SER A 5 6.701 14.041 -4.729 1.00 0.00 C ATOM 40 O SER A 5 5.607 13.507 -4.544 1.00 0.00 O ATOM 41 CB SER A 5 8.778 13.484 -3.449 1.00 0.00 C ATOM 42 OG SER A 5 8.016 13.158 -2.300 1.00 0.00 O ATOM 0 H SER A 5 9.792 13.635 -5.708 1.00 0.00 H new ATOM 0 HA SER A 5 7.718 12.160 -4.769 1.00 0.00 H new ATOM 0 HB2 SER A 5 9.697 12.899 -3.458 1.00 0.00 H new ATOM 0 HB3 SER A 5 9.069 14.534 -3.411 1.00 0.00 H new ATOM 0 HG SER A 5 8.390 13.616 -1.519 1.00 0.00 H new ATOM 48 N SER A 6 6.844 15.346 -4.937 1.00 0.00 N ATOM 49 CA SER A 6 5.697 16.246 -4.956 1.00 0.00 C ATOM 50 C SER A 6 5.165 16.418 -6.376 1.00 0.00 C ATOM 51 O SER A 6 5.697 17.203 -7.160 1.00 0.00 O ATOM 52 CB SER A 6 6.082 17.609 -4.376 1.00 0.00 C ATOM 53 OG SER A 6 4.938 18.314 -3.928 1.00 0.00 O ATOM 0 H SER A 6 7.742 15.803 -5.095 1.00 0.00 H new ATOM 0 HA SER A 6 4.911 15.806 -4.342 1.00 0.00 H new ATOM 0 HB2 SER A 6 6.776 17.472 -3.547 1.00 0.00 H new ATOM 0 HB3 SER A 6 6.602 18.196 -5.133 1.00 0.00 H new ATOM 0 HG SER A 6 5.211 19.181 -3.560 1.00 0.00 H new ATOM 59 N GLY A 7 4.111 15.675 -6.700 1.00 0.00 N ATOM 60 CA GLY A 7 3.524 15.758 -8.024 1.00 0.00 C ATOM 61 C GLY A 7 2.830 14.474 -8.433 1.00 0.00 C ATOM 62 O GLY A 7 2.994 14.002 -9.557 1.00 0.00 O ATOM 0 H GLY A 7 3.653 15.017 -6.069 1.00 0.00 H new ATOM 0 HA2 GLY A 7 2.807 16.579 -8.049 1.00 0.00 H new ATOM 0 HA3 GLY A 7 4.303 15.993 -8.749 1.00 0.00 H new ATOM 66 N ASN A 8 2.053 13.905 -7.516 1.00 0.00 N ATOM 67 CA ASN A 8 1.334 12.666 -7.786 1.00 0.00 C ATOM 68 C ASN A 8 -0.097 12.742 -7.261 1.00 0.00 C ATOM 69 O ASN A 8 -0.424 13.603 -6.444 1.00 0.00 O ATOM 70 CB ASN A 8 2.060 11.480 -7.147 1.00 0.00 C ATOM 71 CG ASN A 8 3.523 11.418 -7.542 1.00 0.00 C ATOM 72 OD1 ASN A 8 4.410 11.636 -6.717 1.00 0.00 O ATOM 73 ND2 ASN A 8 3.781 11.119 -8.810 1.00 0.00 N ATOM 0 H ASN A 8 1.906 14.283 -6.580 1.00 0.00 H new ATOM 0 HA ASN A 8 1.300 12.524 -8.866 1.00 0.00 H new ATOM 0 HB2 ASN A 8 1.982 11.551 -6.062 1.00 0.00 H new ATOM 0 HB3 ASN A 8 1.567 10.554 -7.442 1.00 0.00 H new ATOM 0 HD21 ASN A 8 4.746 11.062 -9.134 1.00 0.00 H new ATOM 0 HD22 ASN A 8 3.014 10.946 -9.459 1.00 0.00 H new ATOM 80 N SER A 9 -0.945 11.835 -7.735 1.00 0.00 N ATOM 81 CA SER A 9 -2.341 11.802 -7.317 1.00 0.00 C ATOM 82 C SER A 9 -2.764 10.383 -6.949 1.00 0.00 C ATOM 83 O SER A 9 -3.442 10.166 -5.945 1.00 0.00 O ATOM 84 CB SER A 9 -3.242 12.342 -8.429 1.00 0.00 C ATOM 85 OG SER A 9 -3.427 13.741 -8.301 1.00 0.00 O ATOM 0 H SER A 9 -0.689 11.113 -8.409 1.00 0.00 H new ATOM 0 HA SER A 9 -2.445 12.435 -6.436 1.00 0.00 H new ATOM 0 HB2 SER A 9 -2.801 12.118 -9.400 1.00 0.00 H new ATOM 0 HB3 SER A 9 -4.209 11.839 -8.394 1.00 0.00 H new ATOM 0 HG SER A 9 -4.005 14.062 -9.024 1.00 0.00 H new ATOM 91 N ALA A 10 -2.358 9.419 -7.770 1.00 0.00 N ATOM 92 CA ALA A 10 -2.692 8.021 -7.531 1.00 0.00 C ATOM 93 C ALA A 10 -1.433 7.174 -7.378 1.00 0.00 C ATOM 94 O ALA A 10 -0.485 7.308 -8.152 1.00 0.00 O ATOM 95 CB ALA A 10 -3.557 7.484 -8.662 1.00 0.00 C ATOM 0 H ALA A 10 -1.797 9.582 -8.606 1.00 0.00 H new ATOM 0 HA ALA A 10 -3.254 7.962 -6.599 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -3.799 6.439 -8.470 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -4.478 8.064 -8.723 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -3.015 7.564 -9.604 1.00 0.00 H new ATOM 101 N LEU A 11 -1.430 6.304 -6.374 1.00 0.00 N ATOM 102 CA LEU A 11 -0.286 5.435 -6.119 1.00 0.00 C ATOM 103 C LEU A 11 -0.471 4.079 -6.792 1.00 0.00 C ATOM 104 O LEU A 11 -1.587 3.567 -6.882 1.00 0.00 O ATOM 105 CB LEU A 11 -0.089 5.247 -4.613 1.00 0.00 C ATOM 106 CG LEU A 11 0.713 4.016 -4.190 1.00 0.00 C ATOM 107 CD1 LEU A 11 2.151 4.124 -4.673 1.00 0.00 C ATOM 108 CD2 LEU A 11 0.668 3.845 -2.678 1.00 0.00 C ATOM 0 H LEU A 11 -2.206 6.181 -5.724 1.00 0.00 H new ATOM 0 HA LEU A 11 0.600 5.910 -6.539 1.00 0.00 H new ATOM 0 HB2 LEU A 11 0.408 6.133 -4.218 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -1.071 5.196 -4.142 1.00 0.00 H new ATOM 0 HG LEU A 11 0.262 3.136 -4.649 1.00 0.00 H new ATOM 0 HD11 LEU A 11 2.707 3.239 -4.363 1.00 0.00 H new ATOM 0 HD12 LEU A 11 2.165 4.198 -5.760 1.00 0.00 H new ATOM 0 HD13 LEU A 11 2.614 5.012 -4.243 1.00 0.00 H new ATOM 0 HD21 LEU A 11 1.244 2.964 -2.394 1.00 0.00 H new ATOM 0 HD22 LEU A 11 1.094 4.727 -2.199 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -0.366 3.721 -2.356 1.00 0.00 H new ATOM 120 N ARG A 12 0.630 3.502 -7.261 1.00 0.00 N ATOM 121 CA ARG A 12 0.589 2.204 -7.925 1.00 0.00 C ATOM 122 C ARG A 12 1.869 1.417 -7.661 1.00 0.00 C ATOM 123 O ARG A 12 2.961 1.984 -7.626 1.00 0.00 O ATOM 124 CB ARG A 12 0.390 2.384 -9.431 1.00 0.00 C ATOM 125 CG ARG A 12 1.610 2.946 -10.144 1.00 0.00 C ATOM 126 CD ARG A 12 1.537 2.709 -11.644 1.00 0.00 C ATOM 127 NE ARG A 12 2.665 3.312 -12.349 1.00 0.00 N ATOM 128 CZ ARG A 12 2.764 3.358 -13.673 1.00 0.00 C ATOM 129 NH1 ARG A 12 1.808 2.840 -14.431 1.00 0.00 N ATOM 130 NH2 ARG A 12 3.822 3.924 -14.240 1.00 0.00 N ATOM 0 H ARG A 12 1.561 3.912 -7.194 1.00 0.00 H new ATOM 0 HA ARG A 12 -0.252 1.643 -7.518 1.00 0.00 H new ATOM 0 HB2 ARG A 12 0.133 1.421 -9.873 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -0.457 3.048 -9.600 1.00 0.00 H new ATOM 0 HG2 ARG A 12 1.687 4.015 -9.947 1.00 0.00 H new ATOM 0 HG3 ARG A 12 2.512 2.482 -9.745 1.00 0.00 H new ATOM 0 HD2 ARG A 12 1.518 1.637 -11.841 1.00 0.00 H new ATOM 0 HD3 ARG A 12 0.605 3.121 -12.031 1.00 0.00 H new ATOM 0 HE ARG A 12 3.418 3.720 -11.795 1.00 0.00 H new ATOM 0 HH11 ARG A 12 0.994 2.405 -13.998 1.00 0.00 H new ATOM 0 HH12 ARG A 12 1.887 2.877 -15.447 1.00 0.00 H new ATOM 0 HH21 ARG A 12 4.559 4.324 -13.659 1.00 0.00 H new ATOM 0 HH22 ARG A 12 3.898 3.959 -15.257 1.00 0.00 H new ATOM 144 N ILE A 13 1.726 0.109 -7.475 1.00 0.00 N ATOM 145 CA ILE A 13 2.870 -0.754 -7.215 1.00 0.00 C ATOM 146 C ILE A 13 2.725 -2.091 -7.933 1.00 0.00 C ATOM 147 O ILE A 13 1.633 -2.656 -8.003 1.00 0.00 O ATOM 148 CB ILE A 13 3.050 -1.012 -5.707 1.00 0.00 C ATOM 149 CG1 ILE A 13 3.128 0.314 -4.947 1.00 0.00 C ATOM 150 CG2 ILE A 13 4.297 -1.847 -5.456 1.00 0.00 C ATOM 151 CD1 ILE A 13 2.719 0.203 -3.495 1.00 0.00 C ATOM 0 H ILE A 13 0.829 -0.376 -7.500 1.00 0.00 H new ATOM 0 HA ILE A 13 3.749 -0.234 -7.594 1.00 0.00 H new ATOM 0 HB ILE A 13 2.186 -1.568 -5.343 1.00 0.00 H new ATOM 0 HG12 ILE A 13 4.148 0.695 -5.001 1.00 0.00 H new ATOM 0 HG13 ILE A 13 2.488 1.045 -5.441 1.00 0.00 H new ATOM 0 HG21 ILE A 13 4.410 -2.020 -4.386 1.00 0.00 H new ATOM 0 HG22 ILE A 13 4.204 -2.803 -5.971 1.00 0.00 H new ATOM 0 HG23 ILE A 13 5.172 -1.316 -5.832 1.00 0.00 H new ATOM 0 HD11 ILE A 13 2.799 1.180 -3.019 1.00 0.00 H new ATOM 0 HD12 ILE A 13 1.689 -0.148 -3.433 1.00 0.00 H new ATOM 0 HD13 ILE A 13 3.374 -0.503 -2.985 1.00 0.00 H new ATOM 163 N LYS A 14 3.834 -2.594 -8.466 1.00 0.00 N ATOM 164 CA LYS A 14 3.832 -3.867 -9.177 1.00 0.00 C ATOM 165 C LYS A 14 4.678 -4.902 -8.442 1.00 0.00 C ATOM 166 O LYS A 14 5.775 -4.600 -7.971 1.00 0.00 O ATOM 167 CB LYS A 14 4.361 -3.680 -10.601 1.00 0.00 C ATOM 168 CG LYS A 14 4.324 -4.948 -11.435 1.00 0.00 C ATOM 169 CD LYS A 14 5.315 -4.888 -12.585 1.00 0.00 C ATOM 170 CE LYS A 14 5.353 -6.198 -13.357 1.00 0.00 C ATOM 171 NZ LYS A 14 6.254 -6.119 -14.540 1.00 0.00 N ATOM 0 H LYS A 14 4.746 -2.139 -8.419 1.00 0.00 H new ATOM 0 HA LYS A 14 2.804 -4.228 -9.221 1.00 0.00 H new ATOM 0 HB2 LYS A 14 3.773 -2.910 -11.100 1.00 0.00 H new ATOM 0 HB3 LYS A 14 5.387 -3.316 -10.553 1.00 0.00 H new ATOM 0 HG2 LYS A 14 4.550 -5.807 -10.803 1.00 0.00 H new ATOM 0 HG3 LYS A 14 3.318 -5.097 -11.828 1.00 0.00 H new ATOM 0 HD2 LYS A 14 5.043 -4.075 -13.259 1.00 0.00 H new ATOM 0 HD3 LYS A 14 6.309 -4.663 -12.199 1.00 0.00 H new ATOM 0 HE2 LYS A 14 5.689 -6.998 -12.698 1.00 0.00 H new ATOM 0 HE3 LYS A 14 4.346 -6.456 -13.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 6.252 -7.031 -15.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 5.919 -5.372 -15.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 7.221 -5.898 -14.226 1.00 0.00 H new ATOM 185 N ILE A 15 4.162 -6.123 -8.349 1.00 0.00 N ATOM 186 CA ILE A 15 4.872 -7.202 -7.674 1.00 0.00 C ATOM 187 C ILE A 15 5.597 -8.095 -8.675 1.00 0.00 C ATOM 188 O ILE A 15 5.084 -8.374 -9.760 1.00 0.00 O ATOM 189 CB ILE A 15 3.914 -8.066 -6.833 1.00 0.00 C ATOM 190 CG1 ILE A 15 3.120 -7.190 -5.862 1.00 0.00 C ATOM 191 CG2 ILE A 15 4.689 -9.135 -6.077 1.00 0.00 C ATOM 192 CD1 ILE A 15 3.988 -6.449 -4.869 1.00 0.00 C ATOM 0 H ILE A 15 3.255 -6.389 -8.732 1.00 0.00 H new ATOM 0 HA ILE A 15 5.602 -6.734 -7.013 1.00 0.00 H new ATOM 0 HB ILE A 15 3.212 -8.560 -7.504 1.00 0.00 H new ATOM 0 HG12 ILE A 15 2.536 -6.467 -6.432 1.00 0.00 H new ATOM 0 HG13 ILE A 15 2.412 -7.815 -5.318 1.00 0.00 H new ATOM 0 HG21 ILE A 15 3.998 -9.737 -5.487 1.00 0.00 H new ATOM 0 HG22 ILE A 15 5.213 -9.775 -6.787 1.00 0.00 H new ATOM 0 HG23 ILE A 15 5.412 -8.660 -5.414 1.00 0.00 H new ATOM 0 HD11 ILE A 15 3.358 -5.848 -4.213 1.00 0.00 H new ATOM 0 HD12 ILE A 15 4.553 -7.166 -4.273 1.00 0.00 H new ATOM 0 HD13 ILE A 15 4.679 -5.798 -5.405 1.00 0.00 H new ATOM 204 N LEU A 16 6.792 -8.541 -8.305 1.00 0.00 N ATOM 205 CA LEU A 16 7.588 -9.405 -9.170 1.00 0.00 C ATOM 206 C LEU A 16 7.433 -10.869 -8.769 1.00 0.00 C ATOM 207 O LEU A 16 6.791 -11.650 -9.472 1.00 0.00 O ATOM 208 CB LEU A 16 9.062 -9.001 -9.109 1.00 0.00 C ATOM 209 CG LEU A 16 9.524 -7.990 -10.159 1.00 0.00 C ATOM 210 CD1 LEU A 16 9.392 -8.574 -11.557 1.00 0.00 C ATOM 211 CD2 LEU A 16 8.730 -6.698 -10.041 1.00 0.00 C ATOM 0 H LEU A 16 7.231 -8.319 -7.412 1.00 0.00 H new ATOM 0 HA LEU A 16 7.227 -9.287 -10.192 1.00 0.00 H new ATOM 0 HB2 LEU A 16 9.264 -8.587 -8.121 1.00 0.00 H new ATOM 0 HB3 LEU A 16 9.669 -9.901 -9.208 1.00 0.00 H new ATOM 0 HG LEU A 16 10.575 -7.764 -9.980 1.00 0.00 H new ATOM 0 HD11 LEU A 16 9.725 -7.840 -12.291 1.00 0.00 H new ATOM 0 HD12 LEU A 16 10.006 -9.471 -11.636 1.00 0.00 H new ATOM 0 HD13 LEU A 16 8.350 -8.830 -11.748 1.00 0.00 H new ATOM 0 HD21 LEU A 16 9.072 -5.990 -10.796 1.00 0.00 H new ATOM 0 HD22 LEU A 16 7.671 -6.907 -10.193 1.00 0.00 H new ATOM 0 HD23 LEU A 16 8.877 -6.270 -9.049 1.00 0.00 H new ATOM 223 N CYS A 17 8.023 -11.232 -7.636 1.00 0.00 N ATOM 224 CA CYS A 17 7.949 -12.602 -7.141 1.00 0.00 C ATOM 225 C CYS A 17 8.471 -12.692 -5.710 1.00 0.00 C ATOM 226 O CYS A 17 8.999 -11.721 -5.170 1.00 0.00 O ATOM 227 CB CYS A 17 8.749 -13.538 -8.048 1.00 0.00 C ATOM 228 SG CYS A 17 10.538 -13.282 -7.979 1.00 0.00 S ATOM 0 H CYS A 17 8.558 -10.597 -7.043 1.00 0.00 H new ATOM 0 HA CYS A 17 6.903 -12.908 -7.147 1.00 0.00 H new ATOM 0 HB2 CYS A 17 8.529 -14.569 -7.772 1.00 0.00 H new ATOM 0 HB3 CYS A 17 8.413 -13.405 -9.076 1.00 0.00 H new ATOM 0 HG CYS A 17 11.128 -14.121 -8.778 1.00 0.00 H new ATOM 234 N ALA A 18 8.318 -13.864 -5.103 1.00 0.00 N ATOM 235 CA ALA A 18 8.774 -14.081 -3.735 1.00 0.00 C ATOM 236 C ALA A 18 9.783 -15.222 -3.668 1.00 0.00 C ATOM 237 O ALA A 18 9.904 -16.014 -4.602 1.00 0.00 O ATOM 238 CB ALA A 18 7.590 -14.365 -2.823 1.00 0.00 C ATOM 0 H ALA A 18 7.882 -14.678 -5.537 1.00 0.00 H new ATOM 0 HA ALA A 18 9.270 -13.172 -3.394 1.00 0.00 H new ATOM 0 HB1 ALA A 18 7.945 -14.525 -1.805 1.00 0.00 H new ATOM 0 HB2 ALA A 18 6.906 -13.516 -2.840 1.00 0.00 H new ATOM 0 HB3 ALA A 18 7.069 -15.257 -3.170 1.00 0.00 H new ATOM 244 N THR A 19 10.507 -15.300 -2.555 1.00 0.00 N ATOM 245 CA THR A 19 11.507 -16.343 -2.366 1.00 0.00 C ATOM 246 C THR A 19 11.577 -16.780 -0.908 1.00 0.00 C ATOM 247 O THR A 19 11.207 -16.028 -0.006 1.00 0.00 O ATOM 248 CB THR A 19 12.903 -15.872 -2.817 1.00 0.00 C ATOM 249 OG1 THR A 19 13.899 -16.803 -2.380 1.00 0.00 O ATOM 250 CG2 THR A 19 13.213 -14.491 -2.260 1.00 0.00 C ATOM 0 H THR A 19 10.419 -14.653 -1.771 1.00 0.00 H new ATOM 0 HA THR A 19 11.201 -17.189 -2.981 1.00 0.00 H new ATOM 0 HB THR A 19 12.910 -15.818 -3.906 1.00 0.00 H new ATOM 0 HG1 THR A 19 14.148 -16.605 -1.453 1.00 0.00 H new ATOM 0 HG21 THR A 19 14.203 -14.179 -2.591 1.00 0.00 H new ATOM 0 HG22 THR A 19 12.469 -13.779 -2.618 1.00 0.00 H new ATOM 0 HG23 THR A 19 13.189 -14.524 -1.171 1.00 0.00 H new ATOM 258 N TYR A 20 12.055 -17.999 -0.682 1.00 0.00 N ATOM 259 CA TYR A 20 12.172 -18.536 0.668 1.00 0.00 C ATOM 260 C TYR A 20 10.814 -18.568 1.361 1.00 0.00 C ATOM 261 O TYR A 20 10.716 -18.355 2.570 1.00 0.00 O ATOM 262 CB TYR A 20 13.157 -17.701 1.488 1.00 0.00 C ATOM 263 CG TYR A 20 14.369 -17.251 0.704 1.00 0.00 C ATOM 264 CD1 TYR A 20 15.148 -18.165 0.006 1.00 0.00 C ATOM 265 CD2 TYR A 20 14.734 -15.911 0.661 1.00 0.00 C ATOM 266 CE1 TYR A 20 16.257 -17.758 -0.711 1.00 0.00 C ATOM 267 CE2 TYR A 20 15.840 -15.495 -0.055 1.00 0.00 C ATOM 268 CZ TYR A 20 16.598 -16.422 -0.739 1.00 0.00 C ATOM 269 OH TYR A 20 17.701 -16.012 -1.453 1.00 0.00 O ATOM 0 H TYR A 20 12.368 -18.634 -1.417 1.00 0.00 H new ATOM 0 HA TYR A 20 12.546 -19.557 0.594 1.00 0.00 H new ATOM 0 HB2 TYR A 20 12.640 -16.824 1.877 1.00 0.00 H new ATOM 0 HB3 TYR A 20 13.487 -18.284 2.348 1.00 0.00 H new ATOM 0 HD1 TYR A 20 14.882 -19.212 0.024 1.00 0.00 H new ATOM 0 HD2 TYR A 20 14.143 -15.182 1.196 1.00 0.00 H new ATOM 0 HE1 TYR A 20 16.853 -18.482 -1.246 1.00 0.00 H new ATOM 0 HE2 TYR A 20 16.109 -14.449 -0.079 1.00 0.00 H new ATOM 0 HH TYR A 20 17.802 -15.041 -1.371 1.00 0.00 H new ATOM 279 N VAL A 21 9.767 -18.835 0.587 1.00 0.00 N ATOM 280 CA VAL A 21 8.414 -18.897 1.125 1.00 0.00 C ATOM 281 C VAL A 21 8.252 -20.081 2.071 1.00 0.00 C ATOM 282 O VAL A 21 9.085 -20.986 2.097 1.00 0.00 O ATOM 283 CB VAL A 21 7.367 -19.005 0.000 1.00 0.00 C ATOM 284 CG1 VAL A 21 5.959 -18.944 0.573 1.00 0.00 C ATOM 285 CG2 VAL A 21 7.579 -17.909 -1.032 1.00 0.00 C ATOM 0 H VAL A 21 9.830 -19.012 -0.416 1.00 0.00 H new ATOM 0 HA VAL A 21 8.250 -17.971 1.676 1.00 0.00 H new ATOM 0 HB VAL A 21 7.490 -19.968 -0.496 1.00 0.00 H new ATOM 0 HG11 VAL A 21 5.233 -19.022 -0.236 1.00 0.00 H new ATOM 0 HG12 VAL A 21 5.814 -19.769 1.271 1.00 0.00 H new ATOM 0 HG13 VAL A 21 5.820 -17.998 1.096 1.00 0.00 H new ATOM 0 HG21 VAL A 21 6.831 -18.001 -1.819 1.00 0.00 H new ATOM 0 HG22 VAL A 21 7.484 -16.935 -0.553 1.00 0.00 H new ATOM 0 HG23 VAL A 21 8.575 -18.005 -1.465 1.00 0.00 H new ATOM 295 N ASN A 22 7.173 -20.068 2.848 1.00 0.00 N ATOM 296 CA ASN A 22 6.901 -21.142 3.796 1.00 0.00 C ATOM 297 C ASN A 22 6.163 -22.293 3.119 1.00 0.00 C ATOM 298 O ASN A 22 5.121 -22.743 3.596 1.00 0.00 O ATOM 299 CB ASN A 22 6.077 -20.615 4.973 1.00 0.00 C ATOM 300 CG ASN A 22 6.907 -19.789 5.936 1.00 0.00 C ATOM 301 OD1 ASN A 22 7.187 -18.617 5.685 1.00 0.00 O ATOM 302 ND2 ASN A 22 7.305 -20.398 7.047 1.00 0.00 N ATOM 0 H ASN A 22 6.473 -19.326 2.839 1.00 0.00 H new ATOM 0 HA ASN A 22 7.856 -21.515 4.167 1.00 0.00 H new ATOM 0 HB2 ASN A 22 5.254 -20.009 4.594 1.00 0.00 H new ATOM 0 HB3 ASN A 22 5.634 -21.455 5.508 1.00 0.00 H new ATOM 0 HD21 ASN A 22 7.866 -19.892 7.733 1.00 0.00 H new ATOM 0 HD22 ASN A 22 7.050 -21.371 7.215 1.00 0.00 H new ATOM 309 N VAL A 23 6.711 -22.765 2.004 1.00 0.00 N ATOM 310 CA VAL A 23 6.107 -23.864 1.261 1.00 0.00 C ATOM 311 C VAL A 23 6.894 -25.156 1.453 1.00 0.00 C ATOM 312 O VAL A 23 7.989 -25.312 0.915 1.00 0.00 O ATOM 313 CB VAL A 23 6.022 -23.546 -0.243 1.00 0.00 C ATOM 314 CG1 VAL A 23 4.858 -22.608 -0.527 1.00 0.00 C ATOM 315 CG2 VAL A 23 7.332 -22.948 -0.735 1.00 0.00 C ATOM 0 H VAL A 23 7.573 -22.403 1.595 1.00 0.00 H new ATOM 0 HA VAL A 23 5.099 -23.994 1.654 1.00 0.00 H new ATOM 0 HB VAL A 23 5.847 -24.476 -0.784 1.00 0.00 H new ATOM 0 HG11 VAL A 23 4.815 -22.395 -1.595 1.00 0.00 H new ATOM 0 HG12 VAL A 23 3.926 -23.079 -0.213 1.00 0.00 H new ATOM 0 HG13 VAL A 23 4.998 -21.677 0.023 1.00 0.00 H new ATOM 0 HG21 VAL A 23 7.255 -22.729 -1.800 1.00 0.00 H new ATOM 0 HG22 VAL A 23 7.539 -22.027 -0.189 1.00 0.00 H new ATOM 0 HG23 VAL A 23 8.142 -23.659 -0.568 1.00 0.00 H new ATOM 325 N ASN A 24 6.327 -26.079 2.223 1.00 0.00 N ATOM 326 CA ASN A 24 6.977 -27.358 2.486 1.00 0.00 C ATOM 327 C ASN A 24 6.244 -28.495 1.781 1.00 0.00 C ATOM 328 O ASN A 24 6.713 -29.015 0.768 1.00 0.00 O ATOM 329 CB ASN A 24 7.029 -27.627 3.992 1.00 0.00 C ATOM 330 CG ASN A 24 7.840 -26.584 4.737 1.00 0.00 C ATOM 331 OD1 ASN A 24 7.672 -25.383 4.525 1.00 0.00 O ATOM 332 ND2 ASN A 24 8.724 -27.040 5.616 1.00 0.00 N ATOM 0 H ASN A 24 5.420 -25.966 2.675 1.00 0.00 H new ATOM 0 HA ASN A 24 7.994 -27.308 2.097 1.00 0.00 H new ATOM 0 HB2 ASN A 24 6.015 -27.647 4.390 1.00 0.00 H new ATOM 0 HB3 ASN A 24 7.460 -28.613 4.168 1.00 0.00 H new ATOM 0 HD21 ASN A 24 9.298 -26.386 6.148 1.00 0.00 H new ATOM 0 HD22 ASN A 24 8.829 -28.044 5.759 1.00 0.00 H new ATOM 339 N ILE A 25 5.092 -28.875 2.322 1.00 0.00 N ATOM 340 CA ILE A 25 4.294 -29.949 1.744 1.00 0.00 C ATOM 341 C ILE A 25 3.770 -29.563 0.365 1.00 0.00 C ATOM 342 O ILE A 25 3.838 -28.400 -0.033 1.00 0.00 O ATOM 343 CB ILE A 25 3.103 -30.316 2.649 1.00 0.00 C ATOM 344 CG1 ILE A 25 2.260 -29.075 2.948 1.00 0.00 C ATOM 345 CG2 ILE A 25 3.595 -30.952 3.940 1.00 0.00 C ATOM 346 CD1 ILE A 25 1.200 -28.799 1.904 1.00 0.00 C ATOM 0 H ILE A 25 4.690 -28.455 3.160 1.00 0.00 H new ATOM 0 HA ILE A 25 4.950 -30.815 1.652 1.00 0.00 H new ATOM 0 HB ILE A 25 2.478 -31.039 2.126 1.00 0.00 H new ATOM 0 HG12 ILE A 25 1.779 -29.197 3.919 1.00 0.00 H new ATOM 0 HG13 ILE A 25 2.917 -28.209 3.025 1.00 0.00 H new ATOM 0 HG21 ILE A 25 2.742 -31.206 4.569 1.00 0.00 H new ATOM 0 HG22 ILE A 25 4.157 -31.857 3.709 1.00 0.00 H new ATOM 0 HG23 ILE A 25 4.239 -30.250 4.469 1.00 0.00 H new ATOM 0 HD11 ILE A 25 0.641 -27.905 2.181 1.00 0.00 H new ATOM 0 HD12 ILE A 25 1.675 -28.645 0.935 1.00 0.00 H new ATOM 0 HD13 ILE A 25 0.519 -29.648 1.843 1.00 0.00 H new ATOM 358 N ARG A 26 3.246 -30.547 -0.360 1.00 0.00 N ATOM 359 CA ARG A 26 2.709 -30.310 -1.694 1.00 0.00 C ATOM 360 C ARG A 26 1.197 -30.509 -1.716 1.00 0.00 C ATOM 361 O ARG A 26 0.700 -31.514 -2.225 1.00 0.00 O ATOM 362 CB ARG A 26 3.372 -31.245 -2.707 1.00 0.00 C ATOM 363 CG ARG A 26 4.876 -31.056 -2.818 1.00 0.00 C ATOM 364 CD ARG A 26 5.617 -31.850 -1.753 1.00 0.00 C ATOM 365 NE ARG A 26 5.797 -33.247 -2.138 1.00 0.00 N ATOM 366 CZ ARG A 26 4.961 -34.219 -1.790 1.00 0.00 C ATOM 367 NH1 ARG A 26 3.893 -33.946 -1.053 1.00 0.00 N ATOM 368 NH2 ARG A 26 5.193 -35.466 -2.178 1.00 0.00 N ATOM 0 H ARG A 26 3.182 -31.515 -0.045 1.00 0.00 H new ATOM 0 HA ARG A 26 2.925 -29.277 -1.967 1.00 0.00 H new ATOM 0 HB2 ARG A 26 3.164 -32.277 -2.426 1.00 0.00 H new ATOM 0 HB3 ARG A 26 2.921 -31.084 -3.686 1.00 0.00 H new ATOM 0 HG2 ARG A 26 5.211 -31.370 -3.807 1.00 0.00 H new ATOM 0 HG3 ARG A 26 5.119 -29.998 -2.720 1.00 0.00 H new ATOM 0 HD2 ARG A 26 6.591 -31.395 -1.574 1.00 0.00 H new ATOM 0 HD3 ARG A 26 5.065 -31.801 -0.814 1.00 0.00 H new ATOM 0 HE ARG A 26 6.609 -33.490 -2.705 1.00 0.00 H new ATOM 0 HH11 ARG A 26 3.712 -32.988 -0.752 1.00 0.00 H new ATOM 0 HH12 ARG A 26 3.252 -34.694 -0.787 1.00 0.00 H new ATOM 0 HH21 ARG A 26 6.014 -35.680 -2.744 1.00 0.00 H new ATOM 0 HH22 ARG A 26 4.550 -36.211 -1.910 1.00 0.00 H new ATOM 382 N ASP A 27 0.470 -29.546 -1.159 1.00 0.00 N ATOM 383 CA ASP A 27 -0.986 -29.615 -1.114 1.00 0.00 C ATOM 384 C ASP A 27 -1.605 -28.278 -1.508 1.00 0.00 C ATOM 385 O ASP A 27 -2.545 -28.229 -2.302 1.00 0.00 O ATOM 386 CB ASP A 27 -1.455 -30.017 0.285 1.00 0.00 C ATOM 387 CG ASP A 27 -2.943 -30.307 0.335 1.00 0.00 C ATOM 388 OD1 ASP A 27 -3.404 -31.176 -0.435 1.00 0.00 O ATOM 389 OD2 ASP A 27 -3.645 -29.666 1.144 1.00 0.00 O ATOM 0 H ASP A 27 0.866 -28.708 -0.732 1.00 0.00 H new ATOM 0 HA ASP A 27 -1.313 -30.370 -1.829 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -0.904 -30.900 0.610 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -1.220 -29.218 0.988 1.00 0.00 H new ATOM 394 N ILE A 28 -1.074 -27.197 -0.948 1.00 0.00 N ATOM 395 CA ILE A 28 -1.575 -25.860 -1.241 1.00 0.00 C ATOM 396 C ILE A 28 -1.950 -25.724 -2.713 1.00 0.00 C ATOM 397 O ILE A 28 -1.124 -25.949 -3.598 1.00 0.00 O ATOM 398 CB ILE A 28 -0.537 -24.779 -0.885 1.00 0.00 C ATOM 399 CG1 ILE A 28 -0.179 -24.855 0.600 1.00 0.00 C ATOM 400 CG2 ILE A 28 -1.069 -23.398 -1.237 1.00 0.00 C ATOM 401 CD1 ILE A 28 1.236 -24.414 0.904 1.00 0.00 C ATOM 0 H ILE A 28 -0.296 -27.221 -0.288 1.00 0.00 H new ATOM 0 HA ILE A 28 -2.464 -25.714 -0.627 1.00 0.00 H new ATOM 0 HB ILE A 28 0.367 -24.958 -1.467 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -0.874 -24.234 1.165 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -0.314 -25.880 0.946 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -0.324 -22.645 -0.980 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -1.279 -23.350 -2.306 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -1.985 -23.208 -0.678 1.00 0.00 H new ATOM 0 HD11 ILE A 28 1.420 -24.494 1.975 1.00 0.00 H new ATOM 0 HD12 ILE A 28 1.939 -25.051 0.367 1.00 0.00 H new ATOM 0 HD13 ILE A 28 1.370 -23.379 0.589 1.00 0.00 H new ATOM 413 N ASP A 29 -3.200 -25.354 -2.967 1.00 0.00 N ATOM 414 CA ASP A 29 -3.684 -25.185 -4.332 1.00 0.00 C ATOM 415 C ASP A 29 -3.018 -23.986 -5.001 1.00 0.00 C ATOM 416 O ASP A 29 -2.322 -24.129 -6.006 1.00 0.00 O ATOM 417 CB ASP A 29 -5.204 -25.009 -4.339 1.00 0.00 C ATOM 418 CG ASP A 29 -5.939 -26.332 -4.423 1.00 0.00 C ATOM 419 OD1 ASP A 29 -5.324 -27.325 -4.864 1.00 0.00 O ATOM 420 OD2 ASP A 29 -7.130 -26.374 -4.050 1.00 0.00 O ATOM 0 H ASP A 29 -3.896 -25.165 -2.246 1.00 0.00 H new ATOM 0 HA ASP A 29 -3.427 -26.082 -4.896 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -5.510 -24.483 -3.435 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -5.491 -24.383 -5.184 1.00 0.00 H new ATOM 425 N LYS A 30 -3.238 -22.803 -4.436 1.00 0.00 N ATOM 426 CA LYS A 30 -2.659 -21.578 -4.976 1.00 0.00 C ATOM 427 C LYS A 30 -2.369 -20.577 -3.862 1.00 0.00 C ATOM 428 O LYS A 30 -2.715 -20.807 -2.703 1.00 0.00 O ATOM 429 CB LYS A 30 -3.604 -20.954 -6.005 1.00 0.00 C ATOM 430 CG LYS A 30 -3.840 -21.829 -7.223 1.00 0.00 C ATOM 431 CD LYS A 30 -2.664 -21.777 -8.184 1.00 0.00 C ATOM 432 CE LYS A 30 -2.779 -22.841 -9.265 1.00 0.00 C ATOM 433 NZ LYS A 30 -2.548 -24.208 -8.723 1.00 0.00 N ATOM 0 H LYS A 30 -3.813 -22.667 -3.605 1.00 0.00 H new ATOM 0 HA LYS A 30 -1.719 -21.834 -5.464 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -4.561 -20.745 -5.527 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -3.194 -19.997 -6.329 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -4.006 -22.858 -6.906 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -4.745 -21.503 -7.736 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -2.614 -20.791 -8.646 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -1.735 -21.917 -7.631 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -3.769 -22.793 -9.719 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -2.056 -22.636 -10.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -1.916 -24.732 -9.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -2.110 -24.139 -7.782 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -3.456 -24.709 -8.646 1.00 0.00 H new ATOM 447 N ILE A 31 -1.735 -19.466 -4.222 1.00 0.00 N ATOM 448 CA ILE A 31 -1.402 -18.429 -3.253 1.00 0.00 C ATOM 449 C ILE A 31 -1.795 -17.049 -3.769 1.00 0.00 C ATOM 450 O ILE A 31 -2.325 -16.914 -4.872 1.00 0.00 O ATOM 451 CB ILE A 31 0.101 -18.432 -2.920 1.00 0.00 C ATOM 452 CG1 ILE A 31 0.926 -18.688 -4.184 1.00 0.00 C ATOM 453 CG2 ILE A 31 0.407 -19.480 -1.860 1.00 0.00 C ATOM 454 CD1 ILE A 31 2.390 -18.342 -4.030 1.00 0.00 C ATOM 0 H ILE A 31 -1.442 -19.261 -5.177 1.00 0.00 H new ATOM 0 HA ILE A 31 -1.966 -18.650 -2.347 1.00 0.00 H new ATOM 0 HB ILE A 31 0.372 -17.453 -2.524 1.00 0.00 H new ATOM 0 HG12 ILE A 31 0.836 -19.739 -4.460 1.00 0.00 H new ATOM 0 HG13 ILE A 31 0.508 -18.106 -5.005 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.474 -19.470 -1.635 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -0.157 -19.257 -0.954 1.00 0.00 H new ATOM 0 HG23 ILE A 31 0.124 -20.465 -2.230 1.00 0.00 H new ATOM 0 HD11 ILE A 31 2.913 -18.549 -4.964 1.00 0.00 H new ATOM 0 HD12 ILE A 31 2.490 -17.285 -3.784 1.00 0.00 H new ATOM 0 HD13 ILE A 31 2.824 -18.943 -3.231 1.00 0.00 H new ATOM 466 N TYR A 32 -1.530 -16.026 -2.964 1.00 0.00 N ATOM 467 CA TYR A 32 -1.855 -14.655 -3.338 1.00 0.00 C ATOM 468 C TYR A 32 -1.227 -13.661 -2.366 1.00 0.00 C ATOM 469 O TYR A 32 -0.648 -14.048 -1.352 1.00 0.00 O ATOM 470 CB TYR A 32 -3.372 -14.461 -3.374 1.00 0.00 C ATOM 471 CG TYR A 32 -4.002 -14.358 -2.003 1.00 0.00 C ATOM 472 CD1 TYR A 32 -3.972 -13.166 -1.290 1.00 0.00 C ATOM 473 CD2 TYR A 32 -4.628 -15.454 -1.422 1.00 0.00 C ATOM 474 CE1 TYR A 32 -4.546 -13.069 -0.037 1.00 0.00 C ATOM 475 CE2 TYR A 32 -5.206 -15.366 -0.170 1.00 0.00 C ATOM 476 CZ TYR A 32 -5.162 -14.171 0.518 1.00 0.00 C ATOM 477 OH TYR A 32 -5.735 -14.078 1.766 1.00 0.00 O ATOM 0 H TYR A 32 -1.091 -16.120 -2.048 1.00 0.00 H new ATOM 0 HA TYR A 32 -1.447 -14.470 -4.332 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -3.601 -13.557 -3.939 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -3.824 -15.295 -3.911 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -3.492 -12.301 -1.722 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -4.663 -16.391 -1.958 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -4.512 -12.135 0.505 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -5.689 -16.227 0.267 1.00 0.00 H new ATOM 0 HH TYR A 32 -6.512 -14.674 1.815 1.00 0.00 H new ATOM 487 N VAL A 33 -1.347 -12.376 -2.685 1.00 0.00 N ATOM 488 CA VAL A 33 -0.793 -11.324 -1.840 1.00 0.00 C ATOM 489 C VAL A 33 -1.863 -10.311 -1.450 1.00 0.00 C ATOM 490 O VAL A 33 -2.776 -10.028 -2.226 1.00 0.00 O ATOM 491 CB VAL A 33 0.362 -10.588 -2.545 1.00 0.00 C ATOM 492 CG1 VAL A 33 0.875 -9.446 -1.681 1.00 0.00 C ATOM 493 CG2 VAL A 33 1.484 -11.558 -2.883 1.00 0.00 C ATOM 0 H VAL A 33 -1.823 -12.038 -3.522 1.00 0.00 H new ATOM 0 HA VAL A 33 -0.411 -11.809 -0.941 1.00 0.00 H new ATOM 0 HB VAL A 33 -0.015 -10.165 -3.476 1.00 0.00 H new ATOM 0 HG11 VAL A 33 1.691 -8.938 -2.196 1.00 0.00 H new ATOM 0 HG12 VAL A 33 0.067 -8.739 -1.495 1.00 0.00 H new ATOM 0 HG13 VAL A 33 1.236 -9.842 -0.732 1.00 0.00 H new ATOM 0 HG21 VAL A 33 2.292 -11.021 -3.381 1.00 0.00 H new ATOM 0 HG22 VAL A 33 1.861 -12.012 -1.967 1.00 0.00 H new ATOM 0 HG23 VAL A 33 1.105 -12.337 -3.544 1.00 0.00 H new ATOM 503 N ARG A 34 -1.745 -9.768 -0.243 1.00 0.00 N ATOM 504 CA ARG A 34 -2.703 -8.787 0.251 1.00 0.00 C ATOM 505 C ARG A 34 -1.987 -7.553 0.793 1.00 0.00 C ATOM 506 O ARG A 34 -1.227 -7.636 1.758 1.00 0.00 O ATOM 507 CB ARG A 34 -3.578 -9.403 1.344 1.00 0.00 C ATOM 508 CG ARG A 34 -4.394 -8.381 2.119 1.00 0.00 C ATOM 509 CD ARG A 34 -5.492 -9.047 2.933 1.00 0.00 C ATOM 510 NE ARG A 34 -6.645 -8.170 3.118 1.00 0.00 N ATOM 511 CZ ARG A 34 -7.627 -8.417 3.978 1.00 0.00 C ATOM 512 NH1 ARG A 34 -7.596 -9.510 4.728 1.00 0.00 N ATOM 513 NH2 ARG A 34 -8.643 -7.571 4.088 1.00 0.00 N ATOM 0 H ARG A 34 -0.995 -9.991 0.411 1.00 0.00 H new ATOM 0 HA ARG A 34 -3.336 -8.482 -0.583 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -4.255 -10.127 0.891 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -2.943 -9.952 2.040 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -3.738 -7.818 2.783 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -4.836 -7.666 1.426 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -5.809 -9.962 2.433 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -5.097 -9.336 3.907 1.00 0.00 H new ATOM 0 HE ARG A 34 -6.699 -7.321 2.556 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -6.817 -10.163 4.645 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -8.351 -9.697 5.388 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -8.671 -6.730 3.512 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -9.396 -7.762 4.749 1.00 0.00 H new ATOM 527 N THR A 35 -2.235 -6.408 0.164 1.00 0.00 N ATOM 528 CA THR A 35 -1.613 -5.157 0.581 1.00 0.00 C ATOM 529 C THR A 35 -2.657 -4.164 1.078 1.00 0.00 C ATOM 530 O THR A 35 -3.857 -4.427 1.018 1.00 0.00 O ATOM 531 CB THR A 35 -0.816 -4.515 -0.570 1.00 0.00 C ATOM 532 OG1 THR A 35 -1.701 -4.149 -1.635 1.00 0.00 O ATOM 533 CG2 THR A 35 0.246 -5.471 -1.092 1.00 0.00 C ATOM 0 H THR A 35 -2.862 -6.321 -0.636 1.00 0.00 H new ATOM 0 HA THR A 35 -0.929 -5.399 1.395 1.00 0.00 H new ATOM 0 HB THR A 35 -0.322 -3.622 -0.186 1.00 0.00 H new ATOM 0 HG1 THR A 35 -1.423 -3.288 -2.010 1.00 0.00 H new ATOM 0 HG21 THR A 35 0.796 -4.996 -1.904 1.00 0.00 H new ATOM 0 HG22 THR A 35 0.935 -5.724 -0.286 1.00 0.00 H new ATOM 0 HG23 THR A 35 -0.231 -6.379 -1.460 1.00 0.00 H new ATOM 541 N GLY A 36 -2.192 -3.019 1.568 1.00 0.00 N ATOM 542 CA GLY A 36 -3.099 -2.002 2.068 1.00 0.00 C ATOM 543 C GLY A 36 -2.424 -1.044 3.028 1.00 0.00 C ATOM 544 O GLY A 36 -1.527 -1.433 3.776 1.00 0.00 O ATOM 0 H GLY A 36 -1.203 -2.777 1.628 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -3.509 -1.441 1.228 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -3.938 -2.483 2.570 1.00 0.00 H new ATOM 548 N ILE A 37 -2.853 0.214 3.006 1.00 0.00 N ATOM 549 CA ILE A 37 -2.283 1.230 3.881 1.00 0.00 C ATOM 550 C ILE A 37 -3.036 1.302 5.205 1.00 0.00 C ATOM 551 O ILE A 37 -4.262 1.189 5.241 1.00 0.00 O ATOM 552 CB ILE A 37 -2.302 2.620 3.217 1.00 0.00 C ATOM 553 CG1 ILE A 37 -1.179 2.731 2.184 1.00 0.00 C ATOM 554 CG2 ILE A 37 -2.172 3.711 4.269 1.00 0.00 C ATOM 555 CD1 ILE A 37 -1.515 2.089 0.856 1.00 0.00 C ATOM 0 H ILE A 37 -3.593 0.553 2.392 1.00 0.00 H new ATOM 0 HA ILE A 37 -1.249 0.940 4.069 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.255 2.749 2.704 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -0.948 3.784 2.022 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -0.279 2.266 2.586 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -2.187 4.687 3.784 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -3.003 3.641 4.970 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -1.232 3.587 4.807 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.674 2.206 0.172 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -1.717 1.028 1.005 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -2.397 2.570 0.432 1.00 0.00 H new ATOM 567 N TYR A 38 -2.296 1.490 6.292 1.00 0.00 N ATOM 568 CA TYR A 38 -2.893 1.576 7.619 1.00 0.00 C ATOM 569 C TYR A 38 -2.252 2.695 8.434 1.00 0.00 C ATOM 570 O TYR A 38 -1.028 2.829 8.471 1.00 0.00 O ATOM 571 CB TYR A 38 -2.744 0.244 8.355 1.00 0.00 C ATOM 572 CG TYR A 38 -3.556 -0.878 7.748 1.00 0.00 C ATOM 573 CD1 TYR A 38 -3.178 -1.464 6.546 1.00 0.00 C ATOM 574 CD2 TYR A 38 -4.702 -1.352 8.375 1.00 0.00 C ATOM 575 CE1 TYR A 38 -3.917 -2.488 5.987 1.00 0.00 C ATOM 576 CE2 TYR A 38 -5.446 -2.377 7.824 1.00 0.00 C ATOM 577 CZ TYR A 38 -5.049 -2.942 6.630 1.00 0.00 C ATOM 578 OH TYR A 38 -5.789 -3.962 6.077 1.00 0.00 O ATOM 0 H TYR A 38 -1.281 1.586 6.280 1.00 0.00 H new ATOM 0 HA TYR A 38 -3.953 1.801 7.499 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -1.692 -0.042 8.361 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -3.044 0.377 9.394 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -2.291 -1.113 6.040 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -5.016 -0.911 9.309 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -3.610 -2.931 5.051 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -6.334 -2.734 8.325 1.00 0.00 H new ATOM 0 HH TYR A 38 -6.554 -4.162 6.656 1.00 0.00 H new ATOM 588 N HIS A 39 -3.088 3.496 9.087 1.00 0.00 N ATOM 589 CA HIS A 39 -2.604 4.604 9.904 1.00 0.00 C ATOM 590 C HIS A 39 -3.188 4.537 11.311 1.00 0.00 C ATOM 591 O HIS A 39 -4.361 4.843 11.523 1.00 0.00 O ATOM 592 CB HIS A 39 -2.963 5.940 9.253 1.00 0.00 C ATOM 593 CG HIS A 39 -2.716 7.123 10.138 1.00 0.00 C ATOM 594 ND1 HIS A 39 -2.156 7.207 11.367 1.00 0.00 N flip ATOM 595 CD2 HIS A 39 -3.062 8.410 9.786 1.00 0.00 C flip ATOM 596 CE1 HIS A 39 -2.171 8.531 11.731 1.00 0.00 C flip ATOM 597 NE2 HIS A 39 -2.723 9.236 10.760 1.00 0.00 N flip ATOM 0 H HIS A 39 -4.103 3.399 9.067 1.00 0.00 H new ATOM 0 HA HIS A 39 -1.519 4.523 9.976 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -2.384 6.055 8.336 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -4.015 5.924 8.966 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -3.536 8.698 8.859 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -1.793 8.931 12.660 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -2.864 10.246 10.762 1.00 0.00 H new ATOM 606 N GLY A 40 -2.362 4.133 12.272 1.00 0.00 N ATOM 607 CA GLY A 40 -2.815 4.032 13.647 1.00 0.00 C ATOM 608 C GLY A 40 -3.596 2.760 13.908 1.00 0.00 C ATOM 609 O GLY A 40 -4.739 2.806 14.361 1.00 0.00 O ATOM 0 H GLY A 40 -1.387 3.874 12.122 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -1.953 4.069 14.314 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -3.439 4.893 13.885 1.00 0.00 H new ATOM 613 N GLY A 41 -2.979 1.618 13.619 1.00 0.00 N ATOM 614 CA GLY A 41 -3.639 0.343 13.830 1.00 0.00 C ATOM 615 C GLY A 41 -5.030 0.304 13.228 1.00 0.00 C ATOM 616 O GLY A 41 -5.947 -0.276 13.807 1.00 0.00 O ATOM 0 H GLY A 41 -2.033 1.553 13.242 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -3.035 -0.452 13.393 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -3.704 0.143 14.900 1.00 0.00 H new ATOM 620 N GLU A 42 -5.186 0.925 12.063 1.00 0.00 N ATOM 621 CA GLU A 42 -6.476 0.960 11.384 1.00 0.00 C ATOM 622 C GLU A 42 -6.294 1.131 9.879 1.00 0.00 C ATOM 623 O GLU A 42 -5.409 1.849 9.412 1.00 0.00 O ATOM 624 CB GLU A 42 -7.338 2.097 11.937 1.00 0.00 C ATOM 625 CG GLU A 42 -7.105 3.429 11.245 1.00 0.00 C ATOM 626 CD GLU A 42 -7.350 4.613 12.160 1.00 0.00 C ATOM 627 OE1 GLU A 42 -6.425 4.979 12.916 1.00 0.00 O ATOM 628 OE2 GLU A 42 -8.464 5.174 12.121 1.00 0.00 O ATOM 0 H GLU A 42 -4.436 1.410 11.570 1.00 0.00 H new ATOM 0 HA GLU A 42 -6.979 0.011 11.566 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -8.389 1.825 11.839 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -7.136 2.210 13.002 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -6.081 3.467 10.874 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -7.761 3.503 10.378 1.00 0.00 H new ATOM 635 N PRO A 43 -7.152 0.456 9.099 1.00 0.00 N ATOM 636 CA PRO A 43 -7.106 0.517 7.635 1.00 0.00 C ATOM 637 C PRO A 43 -7.536 1.878 7.098 1.00 0.00 C ATOM 638 O PRO A 43 -8.111 2.690 7.823 1.00 0.00 O ATOM 639 CB PRO A 43 -8.099 -0.565 7.204 1.00 0.00 C ATOM 640 CG PRO A 43 -9.043 -0.692 8.350 1.00 0.00 C ATOM 641 CD PRO A 43 -8.232 -0.417 9.586 1.00 0.00 C ATOM 0 HA PRO A 43 -6.097 0.366 7.252 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -8.622 -0.281 6.290 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -7.593 -1.509 7.002 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -9.866 0.016 8.258 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -9.482 -1.689 8.385 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -8.828 0.073 10.357 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -7.840 -1.336 10.022 1.00 0.00 H new ATOM 649 N LEU A 44 -7.254 2.121 5.822 1.00 0.00 N ATOM 650 CA LEU A 44 -7.612 3.385 5.187 1.00 0.00 C ATOM 651 C LEU A 44 -8.551 3.154 4.007 1.00 0.00 C ATOM 652 O LEU A 44 -9.500 3.910 3.799 1.00 0.00 O ATOM 653 CB LEU A 44 -6.354 4.116 4.717 1.00 0.00 C ATOM 654 CG LEU A 44 -5.720 5.076 5.725 1.00 0.00 C ATOM 655 CD1 LEU A 44 -5.101 4.305 6.880 1.00 0.00 C ATOM 656 CD2 LEU A 44 -4.676 5.950 5.045 1.00 0.00 C ATOM 0 H LEU A 44 -6.779 1.460 5.207 1.00 0.00 H new ATOM 0 HA LEU A 44 -8.128 4.001 5.924 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -5.609 3.372 4.436 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -6.599 4.677 3.815 1.00 0.00 H new ATOM 0 HG LEU A 44 -6.502 5.722 6.124 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -4.655 5.005 7.587 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -5.873 3.723 7.384 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -4.331 3.634 6.499 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -4.235 6.627 5.777 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -3.896 5.320 4.618 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -5.148 6.530 4.252 1.00 0.00 H new ATOM 668 N CYS A 45 -8.280 2.105 3.239 1.00 0.00 N ATOM 669 CA CYS A 45 -9.101 1.773 2.080 1.00 0.00 C ATOM 670 C CYS A 45 -9.180 0.263 1.884 1.00 0.00 C ATOM 671 O CYS A 45 -8.401 -0.491 2.468 1.00 0.00 O ATOM 672 CB CYS A 45 -8.535 2.434 0.822 1.00 0.00 C ATOM 673 SG CYS A 45 -7.014 1.671 0.208 1.00 0.00 S ATOM 0 H CYS A 45 -7.498 1.470 3.398 1.00 0.00 H new ATOM 0 HA CYS A 45 -10.108 2.151 2.259 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -9.289 2.400 0.036 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -8.342 3.486 1.033 1.00 0.00 H new ATOM 0 HG CYS A 45 -6.614 2.298 -0.859 1.00 0.00 H new ATOM 679 N ASP A 46 -10.128 -0.172 1.061 1.00 0.00 N ATOM 680 CA ASP A 46 -10.310 -1.594 0.788 1.00 0.00 C ATOM 681 C ASP A 46 -8.990 -2.243 0.383 1.00 0.00 C ATOM 682 O ASP A 46 -8.301 -1.763 -0.515 1.00 0.00 O ATOM 683 CB ASP A 46 -11.351 -1.794 -0.315 1.00 0.00 C ATOM 684 CG ASP A 46 -12.618 -1.000 -0.066 1.00 0.00 C ATOM 685 OD1 ASP A 46 -13.001 -0.850 1.113 1.00 0.00 O ATOM 686 OD2 ASP A 46 -13.228 -0.531 -1.050 1.00 0.00 O ATOM 0 H ASP A 46 -10.782 0.439 0.571 1.00 0.00 H new ATOM 0 HA ASP A 46 -10.664 -2.072 1.702 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -10.923 -1.498 -1.273 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -11.598 -2.853 -0.390 1.00 0.00 H new ATOM 691 N ASN A 47 -8.645 -3.337 1.054 1.00 0.00 N ATOM 692 CA ASN A 47 -7.407 -4.052 0.766 1.00 0.00 C ATOM 693 C ASN A 47 -7.384 -4.538 -0.680 1.00 0.00 C ATOM 694 O ASN A 47 -8.412 -4.936 -1.229 1.00 0.00 O ATOM 695 CB ASN A 47 -7.245 -5.238 1.718 1.00 0.00 C ATOM 696 CG ASN A 47 -7.016 -4.802 3.152 1.00 0.00 C ATOM 697 OD1 ASN A 47 -7.775 -5.165 4.051 1.00 0.00 O ATOM 698 ND2 ASN A 47 -5.966 -4.019 3.372 1.00 0.00 N ATOM 0 H ASN A 47 -9.205 -3.748 1.801 1.00 0.00 H new ATOM 0 HA ASN A 47 -6.576 -3.362 0.912 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -8.136 -5.864 1.669 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -6.406 -5.852 1.390 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -5.762 -3.694 4.317 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -5.364 -3.743 2.596 1.00 0.00 H new ATOM 705 N VAL A 48 -6.204 -4.504 -1.292 1.00 0.00 N ATOM 706 CA VAL A 48 -6.046 -4.943 -2.673 1.00 0.00 C ATOM 707 C VAL A 48 -5.384 -6.314 -2.742 1.00 0.00 C ATOM 708 O VAL A 48 -4.382 -6.565 -2.073 1.00 0.00 O ATOM 709 CB VAL A 48 -5.209 -3.939 -3.489 1.00 0.00 C ATOM 710 CG1 VAL A 48 -5.096 -4.390 -4.937 1.00 0.00 C ATOM 711 CG2 VAL A 48 -5.814 -2.546 -3.401 1.00 0.00 C ATOM 0 H VAL A 48 -5.344 -4.177 -0.853 1.00 0.00 H new ATOM 0 HA VAL A 48 -7.046 -5.004 -3.102 1.00 0.00 H new ATOM 0 HB VAL A 48 -4.205 -3.901 -3.066 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -4.502 -3.668 -5.497 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -4.614 -5.367 -4.977 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -6.092 -4.458 -5.376 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -5.210 -1.850 -3.983 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -6.829 -2.565 -3.797 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -5.837 -2.224 -2.360 1.00 0.00 H new ATOM 721 N ASN A 49 -5.951 -7.199 -3.556 1.00 0.00 N ATOM 722 CA ASN A 49 -5.415 -8.546 -3.712 1.00 0.00 C ATOM 723 C ASN A 49 -4.955 -8.786 -5.147 1.00 0.00 C ATOM 724 O ASN A 49 -5.606 -8.355 -6.100 1.00 0.00 O ATOM 725 CB ASN A 49 -6.469 -9.585 -3.323 1.00 0.00 C ATOM 726 CG ASN A 49 -7.812 -9.318 -3.974 1.00 0.00 C ATOM 727 OD1 ASN A 49 -7.892 -9.543 -5.280 1.00 0.00 O flip ATOM 728 ND2 ASN A 49 -8.767 -8.913 -3.310 1.00 0.00 N flip ATOM 0 H ASN A 49 -6.781 -7.007 -4.117 1.00 0.00 H new ATOM 0 HA ASN A 49 -4.554 -8.646 -3.051 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -6.120 -10.577 -3.610 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -6.588 -9.590 -2.240 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -8.661 -8.754 -2.308 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -9.664 -8.737 -3.762 1.00 0.00 H new ATOM 735 N THR A 50 -3.828 -9.476 -5.294 1.00 0.00 N ATOM 736 CA THR A 50 -3.280 -9.773 -6.612 1.00 0.00 C ATOM 737 C THR A 50 -3.689 -11.165 -7.077 1.00 0.00 C ATOM 738 O THR A 50 -3.945 -12.051 -6.261 1.00 0.00 O ATOM 739 CB THR A 50 -1.743 -9.673 -6.616 1.00 0.00 C ATOM 740 OG1 THR A 50 -1.261 -9.592 -7.962 1.00 0.00 O ATOM 741 CG2 THR A 50 -1.121 -10.875 -5.921 1.00 0.00 C ATOM 0 H THR A 50 -3.277 -9.840 -4.516 1.00 0.00 H new ATOM 0 HA THR A 50 -3.687 -9.030 -7.298 1.00 0.00 H new ATOM 0 HB THR A 50 -1.458 -8.772 -6.073 1.00 0.00 H new ATOM 0 HG1 THR A 50 -2.011 -9.419 -8.568 1.00 0.00 H new ATOM 0 HG21 THR A 50 -0.035 -10.782 -5.936 1.00 0.00 H new ATOM 0 HG22 THR A 50 -1.467 -10.918 -4.888 1.00 0.00 H new ATOM 0 HG23 THR A 50 -1.415 -11.787 -6.440 1.00 0.00 H new ATOM 749 N GLN A 51 -3.749 -11.352 -8.391 1.00 0.00 N ATOM 750 CA GLN A 51 -4.128 -12.638 -8.964 1.00 0.00 C ATOM 751 C GLN A 51 -3.473 -13.786 -8.203 1.00 0.00 C ATOM 752 O GLN A 51 -2.500 -13.587 -7.475 1.00 0.00 O ATOM 753 CB GLN A 51 -3.734 -12.699 -10.441 1.00 0.00 C ATOM 754 CG GLN A 51 -2.260 -12.996 -10.665 1.00 0.00 C ATOM 755 CD GLN A 51 -1.942 -13.311 -12.114 1.00 0.00 C ATOM 756 OE1 GLN A 51 -1.346 -14.344 -12.420 1.00 0.00 O ATOM 757 NE2 GLN A 51 -2.341 -12.421 -13.015 1.00 0.00 N ATOM 0 H GLN A 51 -3.540 -10.629 -9.079 1.00 0.00 H new ATOM 0 HA GLN A 51 -5.210 -12.740 -8.880 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -4.330 -13.466 -10.936 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -3.981 -11.748 -10.914 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -1.668 -12.139 -10.345 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -1.964 -13.839 -10.040 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -2.832 -11.578 -12.717 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -2.156 -12.580 -14.005 1.00 0.00 H new ATOM 766 N ARG A 52 -4.013 -14.988 -8.376 1.00 0.00 N ATOM 767 CA ARG A 52 -3.482 -16.168 -7.704 1.00 0.00 C ATOM 768 C ARG A 52 -2.398 -16.833 -8.548 1.00 0.00 C ATOM 769 O ARG A 52 -2.463 -16.827 -9.778 1.00 0.00 O ATOM 770 CB ARG A 52 -4.605 -17.167 -7.418 1.00 0.00 C ATOM 771 CG ARG A 52 -5.311 -16.926 -6.094 1.00 0.00 C ATOM 772 CD ARG A 52 -6.394 -17.964 -5.843 1.00 0.00 C ATOM 773 NE ARG A 52 -7.421 -17.945 -6.881 1.00 0.00 N ATOM 774 CZ ARG A 52 -8.405 -17.053 -6.924 1.00 0.00 C ATOM 775 NH1 ARG A 52 -8.494 -16.112 -5.994 1.00 0.00 N ATOM 776 NH2 ARG A 52 -9.302 -17.101 -7.901 1.00 0.00 N ATOM 0 H ARG A 52 -4.818 -15.170 -8.976 1.00 0.00 H new ATOM 0 HA ARG A 52 -3.039 -15.849 -6.760 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -5.337 -17.119 -8.224 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -4.192 -18.176 -7.422 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -4.584 -16.954 -5.282 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -5.753 -15.930 -6.092 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -5.943 -18.955 -5.798 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -6.855 -17.779 -4.873 1.00 0.00 H new ATOM 0 HE ARG A 52 -7.381 -18.655 -7.612 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -7.806 -16.071 -5.242 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -9.251 -15.429 -6.030 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -9.236 -17.823 -8.619 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -10.057 -16.416 -7.934 1.00 0.00 H new ATOM 790 N VAL A 53 -1.402 -17.405 -7.880 1.00 0.00 N ATOM 791 CA VAL A 53 -0.305 -18.075 -8.568 1.00 0.00 C ATOM 792 C VAL A 53 0.110 -19.345 -7.835 1.00 0.00 C ATOM 793 O VAL A 53 -0.042 -19.468 -6.619 1.00 0.00 O ATOM 794 CB VAL A 53 0.920 -17.150 -8.703 1.00 0.00 C ATOM 795 CG1 VAL A 53 0.482 -15.720 -8.979 1.00 0.00 C ATOM 796 CG2 VAL A 53 1.781 -17.220 -7.451 1.00 0.00 C ATOM 0 H VAL A 53 -1.332 -17.418 -6.862 1.00 0.00 H new ATOM 0 HA VAL A 53 -0.667 -18.335 -9.563 1.00 0.00 H new ATOM 0 HB VAL A 53 1.519 -17.491 -9.548 1.00 0.00 H new ATOM 0 HG11 VAL A 53 1.361 -15.082 -9.071 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -0.089 -15.687 -9.907 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.140 -15.365 -8.157 1.00 0.00 H new ATOM 0 HG21 VAL A 53 2.642 -16.561 -7.564 1.00 0.00 H new ATOM 0 HG22 VAL A 53 1.194 -16.906 -6.588 1.00 0.00 H new ATOM 0 HG23 VAL A 53 2.125 -18.244 -7.303 1.00 0.00 H new ATOM 806 N PRO A 54 0.647 -20.315 -8.589 1.00 0.00 N ATOM 807 CA PRO A 54 1.096 -21.595 -8.032 1.00 0.00 C ATOM 808 C PRO A 54 2.342 -21.445 -7.166 1.00 0.00 C ATOM 809 O PRO A 54 3.285 -20.744 -7.534 1.00 0.00 O ATOM 810 CB PRO A 54 1.407 -22.433 -9.275 1.00 0.00 C ATOM 811 CG PRO A 54 1.719 -21.436 -10.336 1.00 0.00 C ATOM 812 CD PRO A 54 0.858 -20.238 -10.045 1.00 0.00 C ATOM 0 HA PRO A 54 0.347 -22.040 -7.377 1.00 0.00 H new ATOM 0 HB2 PRO A 54 2.250 -23.102 -9.101 1.00 0.00 H new ATOM 0 HB3 PRO A 54 0.558 -23.056 -9.555 1.00 0.00 H new ATOM 0 HG2 PRO A 54 2.776 -21.170 -10.322 1.00 0.00 H new ATOM 0 HG3 PRO A 54 1.505 -21.839 -11.326 1.00 0.00 H new ATOM 0 HD2 PRO A 54 1.352 -19.309 -10.331 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -0.085 -20.279 -10.590 1.00 0.00 H new ATOM 820 N CYS A 55 2.339 -22.107 -6.014 1.00 0.00 N ATOM 821 CA CYS A 55 3.469 -22.046 -5.094 1.00 0.00 C ATOM 822 C CYS A 55 4.787 -22.234 -5.839 1.00 0.00 C ATOM 823 O CYS A 55 5.730 -21.465 -5.656 1.00 0.00 O ATOM 824 CB CYS A 55 3.327 -23.113 -4.008 1.00 0.00 C ATOM 825 SG CYS A 55 2.991 -24.772 -4.642 1.00 0.00 S ATOM 0 H CYS A 55 1.567 -22.692 -5.695 1.00 0.00 H new ATOM 0 HA CYS A 55 3.473 -21.061 -4.627 1.00 0.00 H new ATOM 0 HB2 CYS A 55 4.243 -23.140 -3.418 1.00 0.00 H new ATOM 0 HB3 CYS A 55 2.522 -22.824 -3.333 1.00 0.00 H new ATOM 0 HG CYS A 55 2.890 -25.604 -3.648 1.00 0.00 H new ATOM 831 N SER A 56 4.844 -23.262 -6.680 1.00 0.00 N ATOM 832 CA SER A 56 6.048 -23.555 -7.449 1.00 0.00 C ATOM 833 C SER A 56 6.587 -22.293 -8.115 1.00 0.00 C ATOM 834 O SER A 56 7.798 -22.103 -8.220 1.00 0.00 O ATOM 835 CB SER A 56 5.756 -24.619 -8.508 1.00 0.00 C ATOM 836 OG SER A 56 6.909 -25.395 -8.783 1.00 0.00 O ATOM 0 H SER A 56 4.070 -23.906 -6.846 1.00 0.00 H new ATOM 0 HA SER A 56 6.805 -23.934 -6.762 1.00 0.00 H new ATOM 0 HB2 SER A 56 4.951 -25.268 -8.164 1.00 0.00 H new ATOM 0 HB3 SER A 56 5.410 -24.140 -9.424 1.00 0.00 H new ATOM 0 HG SER A 56 6.696 -26.069 -9.462 1.00 0.00 H new ATOM 842 N ASN A 57 5.678 -21.433 -8.562 1.00 0.00 N ATOM 843 CA ASN A 57 6.062 -20.188 -9.219 1.00 0.00 C ATOM 844 C ASN A 57 5.273 -19.010 -8.654 1.00 0.00 C ATOM 845 O ASN A 57 4.223 -18.629 -9.171 1.00 0.00 O ATOM 846 CB ASN A 57 5.834 -20.292 -10.728 1.00 0.00 C ATOM 847 CG ASN A 57 6.851 -21.189 -11.406 1.00 0.00 C ATOM 848 OD1 ASN A 57 7.987 -20.783 -11.652 1.00 0.00 O ATOM 849 ND2 ASN A 57 6.447 -22.417 -11.711 1.00 0.00 N ATOM 0 H ASN A 57 4.671 -21.575 -8.482 1.00 0.00 H new ATOM 0 HA ASN A 57 7.122 -20.018 -9.030 1.00 0.00 H new ATOM 0 HB2 ASN A 57 4.832 -20.677 -10.916 1.00 0.00 H new ATOM 0 HB3 ASN A 57 5.881 -19.296 -11.169 1.00 0.00 H new ATOM 0 HD21 ASN A 57 7.088 -23.066 -12.168 1.00 0.00 H new ATOM 0 HD22 ASN A 57 5.496 -22.711 -11.488 1.00 0.00 H new ATOM 856 N PRO A 58 5.791 -18.418 -7.568 1.00 0.00 N ATOM 857 CA PRO A 58 5.153 -17.274 -6.910 1.00 0.00 C ATOM 858 C PRO A 58 5.222 -16.006 -7.755 1.00 0.00 C ATOM 859 O PRO A 58 4.784 -14.939 -7.326 1.00 0.00 O ATOM 860 CB PRO A 58 5.966 -17.105 -5.624 1.00 0.00 C ATOM 861 CG PRO A 58 7.300 -17.690 -5.940 1.00 0.00 C ATOM 862 CD PRO A 58 7.040 -18.819 -6.899 1.00 0.00 C ATOM 0 HA PRO A 58 4.090 -17.443 -6.739 1.00 0.00 H new ATOM 0 HB2 PRO A 58 6.050 -16.055 -5.344 1.00 0.00 H new ATOM 0 HB3 PRO A 58 5.495 -17.621 -4.787 1.00 0.00 H new ATOM 0 HG2 PRO A 58 7.958 -16.944 -6.385 1.00 0.00 H new ATOM 0 HG3 PRO A 58 7.792 -18.051 -5.037 1.00 0.00 H new ATOM 0 HD2 PRO A 58 7.857 -18.938 -7.611 1.00 0.00 H new ATOM 0 HD3 PRO A 58 6.930 -19.771 -6.379 1.00 0.00 H new ATOM 870 N ARG A 59 5.775 -16.131 -8.957 1.00 0.00 N ATOM 871 CA ARG A 59 5.903 -14.995 -9.861 1.00 0.00 C ATOM 872 C ARG A 59 4.540 -14.367 -10.140 1.00 0.00 C ATOM 873 O ARG A 59 3.605 -15.049 -10.558 1.00 0.00 O ATOM 874 CB ARG A 59 6.553 -15.432 -11.175 1.00 0.00 C ATOM 875 CG ARG A 59 7.374 -14.340 -11.841 1.00 0.00 C ATOM 876 CD ARG A 59 8.041 -14.842 -13.112 1.00 0.00 C ATOM 877 NE ARG A 59 9.112 -13.953 -13.556 1.00 0.00 N ATOM 878 CZ ARG A 59 10.323 -13.932 -13.010 1.00 0.00 C ATOM 879 NH1 ARG A 59 10.615 -14.747 -12.006 1.00 0.00 N ATOM 880 NH2 ARG A 59 11.244 -13.095 -13.469 1.00 0.00 N ATOM 0 H ARG A 59 6.142 -17.008 -9.327 1.00 0.00 H new ATOM 0 HA ARG A 59 6.537 -14.250 -9.380 1.00 0.00 H new ATOM 0 HB2 ARG A 59 7.195 -16.292 -10.985 1.00 0.00 H new ATOM 0 HB3 ARG A 59 5.775 -15.761 -11.864 1.00 0.00 H new ATOM 0 HG2 ARG A 59 6.731 -13.492 -12.077 1.00 0.00 H new ATOM 0 HG3 ARG A 59 8.134 -13.980 -11.147 1.00 0.00 H new ATOM 0 HD2 ARG A 59 8.446 -15.839 -12.939 1.00 0.00 H new ATOM 0 HD3 ARG A 59 7.295 -14.933 -13.901 1.00 0.00 H new ATOM 0 HE ARG A 59 8.920 -13.314 -14.327 1.00 0.00 H new ATOM 0 HH11 ARG A 59 9.909 -15.392 -11.651 1.00 0.00 H new ATOM 0 HH12 ARG A 59 11.545 -14.729 -11.589 1.00 0.00 H new ATOM 0 HH21 ARG A 59 11.023 -12.467 -14.242 1.00 0.00 H new ATOM 0 HH22 ARG A 59 12.174 -13.079 -13.049 1.00 0.00 H new ATOM 894 N TRP A 60 4.437 -13.064 -9.904 1.00 0.00 N ATOM 895 CA TRP A 60 3.188 -12.344 -10.130 1.00 0.00 C ATOM 896 C TRP A 60 3.300 -11.426 -11.342 1.00 0.00 C ATOM 897 O TRP A 60 2.525 -11.538 -12.290 1.00 0.00 O ATOM 898 CB TRP A 60 2.815 -11.529 -8.890 1.00 0.00 C ATOM 899 CG TRP A 60 2.090 -12.328 -7.850 1.00 0.00 C ATOM 900 CD1 TRP A 60 0.768 -12.668 -7.853 1.00 0.00 C ATOM 901 CD2 TRP A 60 2.647 -12.884 -6.654 1.00 0.00 C ATOM 902 NE1 TRP A 60 0.469 -13.403 -6.730 1.00 0.00 N ATOM 903 CE2 TRP A 60 1.605 -13.550 -5.980 1.00 0.00 C ATOM 904 CE3 TRP A 60 3.925 -12.886 -6.089 1.00 0.00 C ATOM 905 CZ2 TRP A 60 1.804 -14.209 -4.769 1.00 0.00 C ATOM 906 CZ3 TRP A 60 4.121 -13.541 -4.887 1.00 0.00 C ATOM 907 CH2 TRP A 60 3.065 -14.195 -4.238 1.00 0.00 C ATOM 0 H TRP A 60 5.202 -12.485 -9.557 1.00 0.00 H new ATOM 0 HA TRP A 60 2.405 -13.077 -10.325 1.00 0.00 H new ATOM 0 HB2 TRP A 60 3.722 -11.113 -8.451 1.00 0.00 H new ATOM 0 HB3 TRP A 60 2.191 -10.687 -9.191 1.00 0.00 H new ATOM 0 HD1 TRP A 60 0.061 -12.399 -8.624 1.00 0.00 H new ATOM 0 HE1 TRP A 60 -0.450 -13.778 -6.494 1.00 0.00 H new ATOM 0 HE3 TRP A 60 4.745 -12.385 -6.582 1.00 0.00 H new ATOM 0 HZ2 TRP A 60 0.992 -14.713 -4.267 1.00 0.00 H new ATOM 0 HZ3 TRP A 60 5.105 -13.549 -4.441 1.00 0.00 H new ATOM 0 HH2 TRP A 60 3.250 -14.698 -3.300 1.00 0.00 H new ATOM 918 N ASN A 61 4.271 -10.519 -11.305 1.00 0.00 N ATOM 919 CA ASN A 61 4.484 -9.581 -12.401 1.00 0.00 C ATOM 920 C ASN A 61 3.175 -8.906 -12.801 1.00 0.00 C ATOM 921 O ASN A 61 2.793 -8.916 -13.971 1.00 0.00 O ATOM 922 CB ASN A 61 5.087 -10.304 -13.607 1.00 0.00 C ATOM 923 CG ASN A 61 6.193 -11.264 -13.213 1.00 0.00 C ATOM 924 OD1 ASN A 61 6.738 -11.181 -12.112 1.00 0.00 O ATOM 925 ND2 ASN A 61 6.528 -12.181 -14.112 1.00 0.00 N ATOM 0 H ASN A 61 4.923 -10.414 -10.528 1.00 0.00 H new ATOM 0 HA ASN A 61 5.179 -8.813 -12.060 1.00 0.00 H new ATOM 0 HB2 ASN A 61 4.302 -10.853 -14.128 1.00 0.00 H new ATOM 0 HB3 ASN A 61 5.481 -9.568 -14.308 1.00 0.00 H new ATOM 0 HD21 ASN A 61 7.265 -12.855 -13.903 1.00 0.00 H new ATOM 0 HD22 ASN A 61 6.049 -12.212 -15.012 1.00 0.00 H new ATOM 932 N GLU A 62 2.494 -8.320 -11.821 1.00 0.00 N ATOM 933 CA GLU A 62 1.229 -7.641 -12.071 1.00 0.00 C ATOM 934 C GLU A 62 1.248 -6.227 -11.497 1.00 0.00 C ATOM 935 O GLU A 62 1.826 -5.983 -10.438 1.00 0.00 O ATOM 936 CB GLU A 62 0.070 -8.434 -11.464 1.00 0.00 C ATOM 937 CG GLU A 62 -1.274 -7.734 -11.583 1.00 0.00 C ATOM 938 CD GLU A 62 -2.443 -8.677 -11.373 1.00 0.00 C ATOM 939 OE1 GLU A 62 -2.600 -9.183 -10.242 1.00 0.00 O ATOM 940 OE2 GLU A 62 -3.200 -8.909 -12.339 1.00 0.00 O ATOM 0 H GLU A 62 2.797 -8.302 -10.847 1.00 0.00 H new ATOM 0 HA GLU A 62 1.089 -7.575 -13.150 1.00 0.00 H new ATOM 0 HB2 GLU A 62 0.009 -9.405 -11.955 1.00 0.00 H new ATOM 0 HB3 GLU A 62 0.281 -8.621 -10.411 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -1.326 -6.928 -10.851 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -1.355 -7.275 -12.568 1.00 0.00 H new ATOM 947 N TRP A 63 0.613 -5.299 -12.205 1.00 0.00 N ATOM 948 CA TRP A 63 0.557 -3.909 -11.766 1.00 0.00 C ATOM 949 C TRP A 63 -0.631 -3.678 -10.839 1.00 0.00 C ATOM 950 O TRP A 63 -1.777 -3.609 -11.287 1.00 0.00 O ATOM 951 CB TRP A 63 0.466 -2.976 -12.974 1.00 0.00 C ATOM 952 CG TRP A 63 1.791 -2.719 -13.627 1.00 0.00 C ATOM 953 CD1 TRP A 63 2.370 -3.455 -14.622 1.00 0.00 C ATOM 954 CD2 TRP A 63 2.701 -1.655 -13.330 1.00 0.00 C ATOM 955 NE1 TRP A 63 3.586 -2.911 -14.961 1.00 0.00 N ATOM 956 CE2 TRP A 63 3.812 -1.806 -14.184 1.00 0.00 C ATOM 957 CE3 TRP A 63 2.686 -0.588 -12.428 1.00 0.00 C ATOM 958 CZ2 TRP A 63 4.894 -0.931 -14.159 1.00 0.00 C ATOM 959 CZ3 TRP A 63 3.761 0.280 -12.405 1.00 0.00 C ATOM 960 CH2 TRP A 63 4.852 0.105 -13.266 1.00 0.00 C ATOM 0 H TRP A 63 0.130 -5.484 -13.084 1.00 0.00 H new ATOM 0 HA TRP A 63 1.471 -3.691 -11.214 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -0.215 -3.408 -13.707 1.00 0.00 H new ATOM 0 HB3 TRP A 63 0.034 -2.026 -12.659 1.00 0.00 H new ATOM 0 HD1 TRP A 63 1.936 -4.334 -15.075 1.00 0.00 H new ATOM 0 HE1 TRP A 63 4.218 -3.272 -15.676 1.00 0.00 H new ATOM 0 HE3 TRP A 63 1.849 -0.444 -11.761 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 5.737 -1.065 -14.821 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 3.760 1.108 -11.711 1.00 0.00 H new ATOM 0 HH2 TRP A 63 5.676 0.802 -13.224 1.00 0.00 H new ATOM 971 N LEU A 64 -0.353 -3.559 -9.546 1.00 0.00 N ATOM 972 CA LEU A 64 -1.400 -3.335 -8.555 1.00 0.00 C ATOM 973 C LEU A 64 -1.641 -1.843 -8.346 1.00 0.00 C ATOM 974 O LEU A 64 -0.732 -1.105 -7.968 1.00 0.00 O ATOM 975 CB LEU A 64 -1.023 -3.994 -7.228 1.00 0.00 C ATOM 976 CG LEU A 64 -2.188 -4.421 -6.335 1.00 0.00 C ATOM 977 CD1 LEU A 64 -3.085 -5.410 -7.064 1.00 0.00 C ATOM 978 CD2 LEU A 64 -1.673 -5.023 -5.036 1.00 0.00 C ATOM 0 H LEU A 64 0.589 -3.614 -9.159 1.00 0.00 H new ATOM 0 HA LEU A 64 -2.321 -3.784 -8.927 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -0.415 -4.873 -7.442 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -0.396 -3.301 -6.667 1.00 0.00 H new ATOM 0 HG LEU A 64 -2.777 -3.537 -6.093 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -3.909 -5.703 -6.413 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -3.483 -4.944 -7.965 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -2.507 -6.293 -7.337 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -2.517 -5.321 -4.413 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -1.059 -5.896 -5.258 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -1.073 -4.284 -4.505 1.00 0.00 H new ATOM 990 N ASN A 65 -2.873 -1.408 -8.591 1.00 0.00 N ATOM 991 CA ASN A 65 -3.234 -0.004 -8.427 1.00 0.00 C ATOM 992 C ASN A 65 -3.897 0.232 -7.074 1.00 0.00 C ATOM 993 O ASN A 65 -4.744 -0.549 -6.641 1.00 0.00 O ATOM 994 CB ASN A 65 -4.173 0.437 -9.552 1.00 0.00 C ATOM 995 CG ASN A 65 -5.360 -0.493 -9.712 1.00 0.00 C ATOM 996 OD1 ASN A 65 -5.199 -1.679 -10.003 1.00 0.00 O ATOM 997 ND2 ASN A 65 -6.560 0.042 -9.523 1.00 0.00 N ATOM 0 H ASN A 65 -3.637 -2.007 -8.903 1.00 0.00 H new ATOM 0 HA ASN A 65 -2.320 0.589 -8.472 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -4.531 1.446 -9.348 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -3.618 0.478 -10.489 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -7.396 -0.535 -9.618 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -6.646 1.030 -9.283 1.00 0.00 H new ATOM 1004 N TYR A 66 -3.506 1.315 -6.411 1.00 0.00 N ATOM 1005 CA TYR A 66 -4.060 1.654 -5.106 1.00 0.00 C ATOM 1006 C TYR A 66 -5.023 2.833 -5.213 1.00 0.00 C ATOM 1007 O TYR A 66 -4.691 3.870 -5.787 1.00 0.00 O ATOM 1008 CB TYR A 66 -2.937 1.986 -4.122 1.00 0.00 C ATOM 1009 CG TYR A 66 -2.138 0.779 -3.685 1.00 0.00 C ATOM 1010 CD1 TYR A 66 -1.177 0.219 -4.518 1.00 0.00 C ATOM 1011 CD2 TYR A 66 -2.344 0.198 -2.440 1.00 0.00 C ATOM 1012 CE1 TYR A 66 -0.445 -0.884 -4.124 1.00 0.00 C ATOM 1013 CE2 TYR A 66 -1.616 -0.904 -2.036 1.00 0.00 C ATOM 1014 CZ TYR A 66 -0.668 -1.442 -2.882 1.00 0.00 C ATOM 1015 OH TYR A 66 0.060 -2.540 -2.485 1.00 0.00 O ATOM 0 H TYR A 66 -2.807 1.973 -6.756 1.00 0.00 H new ATOM 0 HA TYR A 66 -4.612 0.789 -4.738 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -2.264 2.709 -4.582 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -3.366 2.465 -3.242 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -0.999 0.654 -5.490 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -3.087 0.615 -1.776 1.00 0.00 H new ATOM 0 HE1 TYR A 66 0.298 -1.307 -4.784 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -1.788 -1.342 -1.064 1.00 0.00 H new ATOM 0 HH TYR A 66 0.943 -2.251 -2.172 1.00 0.00 H new ATOM 1025 N ASP A 67 -6.217 2.665 -4.655 1.00 0.00 N ATOM 1026 CA ASP A 67 -7.229 3.715 -4.685 1.00 0.00 C ATOM 1027 C ASP A 67 -6.958 4.763 -3.609 1.00 0.00 C ATOM 1028 O ASP A 67 -7.871 5.196 -2.907 1.00 0.00 O ATOM 1029 CB ASP A 67 -8.622 3.115 -4.490 1.00 0.00 C ATOM 1030 CG ASP A 67 -9.706 3.942 -5.153 1.00 0.00 C ATOM 1031 OD1 ASP A 67 -9.854 3.846 -6.389 1.00 0.00 O ATOM 1032 OD2 ASP A 67 -10.407 4.686 -4.435 1.00 0.00 O ATOM 0 H ASP A 67 -6.508 1.812 -4.177 1.00 0.00 H new ATOM 0 HA ASP A 67 -7.184 4.201 -5.660 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -8.639 2.104 -4.898 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -8.833 3.032 -3.424 1.00 0.00 H new ATOM 1037 N ILE A 68 -5.697 5.163 -3.486 1.00 0.00 N ATOM 1038 CA ILE A 68 -5.306 6.159 -2.496 1.00 0.00 C ATOM 1039 C ILE A 68 -4.888 7.464 -3.165 1.00 0.00 C ATOM 1040 O ILE A 68 -4.625 7.501 -4.367 1.00 0.00 O ATOM 1041 CB ILE A 68 -4.149 5.653 -1.615 1.00 0.00 C ATOM 1042 CG1 ILE A 68 -2.870 5.515 -2.444 1.00 0.00 C ATOM 1043 CG2 ILE A 68 -4.515 4.325 -0.971 1.00 0.00 C ATOM 1044 CD1 ILE A 68 -2.010 6.759 -2.442 1.00 0.00 C ATOM 0 H ILE A 68 -4.929 4.813 -4.059 1.00 0.00 H new ATOM 0 HA ILE A 68 -6.178 6.339 -1.868 1.00 0.00 H new ATOM 0 HB ILE A 68 -3.970 6.381 -0.824 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -2.286 4.679 -2.059 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -3.138 5.270 -3.472 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -3.687 3.981 -0.351 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -5.403 4.453 -0.352 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -4.718 3.588 -1.748 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -1.121 6.588 -3.049 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -2.577 7.594 -2.855 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -1.711 6.993 -1.420 1.00 0.00 H new ATOM 1056 N TYR A 69 -4.826 8.533 -2.378 1.00 0.00 N ATOM 1057 CA TYR A 69 -4.440 9.841 -2.894 1.00 0.00 C ATOM 1058 C TYR A 69 -3.123 10.302 -2.278 1.00 0.00 C ATOM 1059 O TYR A 69 -3.013 10.451 -1.060 1.00 0.00 O ATOM 1060 CB TYR A 69 -5.537 10.868 -2.610 1.00 0.00 C ATOM 1061 CG TYR A 69 -5.832 11.778 -3.781 1.00 0.00 C ATOM 1062 CD1 TYR A 69 -5.891 11.279 -5.076 1.00 0.00 C ATOM 1063 CD2 TYR A 69 -6.051 13.137 -3.593 1.00 0.00 C ATOM 1064 CE1 TYR A 69 -6.160 12.106 -6.150 1.00 0.00 C ATOM 1065 CE2 TYR A 69 -6.321 13.972 -4.660 1.00 0.00 C ATOM 1066 CZ TYR A 69 -6.374 13.452 -5.936 1.00 0.00 C ATOM 1067 OH TYR A 69 -6.642 14.281 -7.002 1.00 0.00 O ATOM 0 H TYR A 69 -5.038 8.519 -1.380 1.00 0.00 H new ATOM 0 HA TYR A 69 -4.304 9.753 -3.972 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -6.450 10.343 -2.329 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -5.242 11.475 -1.754 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -5.724 10.226 -5.247 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -6.009 13.548 -2.595 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -6.202 11.701 -7.150 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -6.490 15.026 -4.496 1.00 0.00 H new ATOM 0 HH TYR A 69 -6.769 15.198 -6.680 1.00 0.00 H new ATOM 1077 N ILE A 70 -2.127 10.528 -3.127 1.00 0.00 N ATOM 1078 CA ILE A 70 -0.818 10.975 -2.668 1.00 0.00 C ATOM 1079 C ILE A 70 -0.931 12.252 -1.842 1.00 0.00 C ATOM 1080 O ILE A 70 -0.440 12.338 -0.716 1.00 0.00 O ATOM 1081 CB ILE A 70 0.139 11.224 -3.848 1.00 0.00 C ATOM 1082 CG1 ILE A 70 0.777 9.910 -4.303 1.00 0.00 C ATOM 1083 CG2 ILE A 70 1.210 12.232 -3.459 1.00 0.00 C ATOM 1084 CD1 ILE A 70 -0.003 9.204 -5.390 1.00 0.00 C ATOM 0 H ILE A 70 -2.201 10.409 -4.137 1.00 0.00 H new ATOM 0 HA ILE A 70 -0.414 10.177 -2.046 1.00 0.00 H new ATOM 0 HB ILE A 70 -0.434 11.635 -4.679 1.00 0.00 H new ATOM 0 HG12 ILE A 70 1.786 10.111 -4.663 1.00 0.00 H new ATOM 0 HG13 ILE A 70 0.872 9.245 -3.445 1.00 0.00 H new ATOM 0 HG21 ILE A 70 1.878 12.397 -4.304 1.00 0.00 H new ATOM 0 HG22 ILE A 70 0.739 13.174 -3.180 1.00 0.00 H new ATOM 0 HG23 ILE A 70 1.781 11.848 -2.614 1.00 0.00 H new ATOM 0 HD11 ILE A 70 0.508 8.281 -5.663 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -1.004 8.971 -5.027 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -0.075 9.851 -6.264 1.00 0.00 H new ATOM 1096 N PRO A 71 -1.596 13.268 -2.411 1.00 0.00 N ATOM 1097 CA PRO A 71 -1.792 14.558 -1.745 1.00 0.00 C ATOM 1098 C PRO A 71 -2.755 14.461 -0.566 1.00 0.00 C ATOM 1099 O PRO A 71 -3.072 15.465 0.072 1.00 0.00 O ATOM 1100 CB PRO A 71 -2.384 15.441 -2.847 1.00 0.00 C ATOM 1101 CG PRO A 71 -3.039 14.487 -3.784 1.00 0.00 C ATOM 1102 CD PRO A 71 -2.207 13.235 -3.751 1.00 0.00 C ATOM 0 HA PRO A 71 -0.864 14.944 -1.324 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -3.102 16.153 -2.441 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -1.609 16.021 -3.349 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -4.065 14.282 -3.478 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -3.084 14.899 -4.792 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -2.817 12.343 -3.893 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -1.452 13.233 -4.537 1.00 0.00 H new ATOM 1110 N ASP A 72 -3.214 13.248 -0.282 1.00 0.00 N ATOM 1111 CA ASP A 72 -4.140 13.020 0.822 1.00 0.00 C ATOM 1112 C ASP A 72 -3.607 11.945 1.764 1.00 0.00 C ATOM 1113 O ASP A 72 -4.177 11.699 2.828 1.00 0.00 O ATOM 1114 CB ASP A 72 -5.513 12.611 0.288 1.00 0.00 C ATOM 1115 CG ASP A 72 -6.641 13.026 1.213 1.00 0.00 C ATOM 1116 OD1 ASP A 72 -7.054 14.203 1.155 1.00 0.00 O ATOM 1117 OD2 ASP A 72 -7.111 12.172 1.993 1.00 0.00 O ATOM 0 H ASP A 72 -2.960 12.407 -0.800 1.00 0.00 H new ATOM 0 HA ASP A 72 -4.238 13.951 1.380 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -5.667 13.061 -0.693 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -5.539 11.530 0.150 1.00 0.00 H new ATOM 1122 N LEU A 73 -2.511 11.308 1.367 1.00 0.00 N ATOM 1123 CA LEU A 73 -1.901 10.258 2.176 1.00 0.00 C ATOM 1124 C LEU A 73 -1.097 10.855 3.327 1.00 0.00 C ATOM 1125 O LEU A 73 -0.090 11.535 3.126 1.00 0.00 O ATOM 1126 CB LEU A 73 -0.997 9.379 1.309 1.00 0.00 C ATOM 1127 CG LEU A 73 -0.900 7.909 1.718 1.00 0.00 C ATOM 1128 CD1 LEU A 73 -0.482 7.786 3.175 1.00 0.00 C ATOM 1129 CD2 LEU A 73 -2.225 7.200 1.479 1.00 0.00 C ATOM 0 H LEU A 73 -2.026 11.500 0.490 1.00 0.00 H new ATOM 0 HA LEU A 73 -2.700 9.646 2.594 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -1.355 9.427 0.281 1.00 0.00 H new ATOM 0 HB3 LEU A 73 0.006 9.805 1.317 1.00 0.00 H new ATOM 0 HG LEU A 73 -0.139 7.430 1.102 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -0.418 6.733 3.448 1.00 0.00 H new ATOM 0 HD12 LEU A 73 0.491 8.257 3.315 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -1.219 8.281 3.808 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -2.137 6.155 1.776 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -3.006 7.680 2.068 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -2.482 7.256 0.421 1.00 0.00 H new ATOM 1141 N PRO A 74 -1.548 10.595 4.562 1.00 0.00 N ATOM 1142 CA PRO A 74 -0.884 11.095 5.770 1.00 0.00 C ATOM 1143 C PRO A 74 0.462 10.420 6.013 1.00 0.00 C ATOM 1144 O PRO A 74 0.603 9.211 5.827 1.00 0.00 O ATOM 1145 CB PRO A 74 -1.868 10.743 6.888 1.00 0.00 C ATOM 1146 CG PRO A 74 -2.640 9.583 6.362 1.00 0.00 C ATOM 1147 CD PRO A 74 -2.742 9.792 4.876 1.00 0.00 C ATOM 0 HA PRO A 74 -0.660 12.159 5.701 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -1.345 10.486 7.809 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -2.523 11.583 7.118 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -2.136 8.644 6.590 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -3.629 9.534 6.818 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -2.743 8.845 4.336 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.660 10.314 4.606 1.00 0.00 H new ATOM 1155 N ARG A 75 1.447 11.208 6.430 1.00 0.00 N ATOM 1156 CA ARG A 75 2.782 10.685 6.698 1.00 0.00 C ATOM 1157 C ARG A 75 2.714 9.460 7.605 1.00 0.00 C ATOM 1158 O ARG A 75 3.440 8.487 7.406 1.00 0.00 O ATOM 1159 CB ARG A 75 3.654 11.763 7.343 1.00 0.00 C ATOM 1160 CG ARG A 75 3.733 13.048 6.534 1.00 0.00 C ATOM 1161 CD ARG A 75 4.673 12.902 5.348 1.00 0.00 C ATOM 1162 NE ARG A 75 4.720 14.115 4.535 1.00 0.00 N ATOM 1163 CZ ARG A 75 3.755 14.474 3.695 1.00 0.00 C ATOM 1164 NH1 ARG A 75 2.674 13.719 3.559 1.00 0.00 N ATOM 1165 NH2 ARG A 75 3.871 15.592 2.990 1.00 0.00 N ATOM 0 H ARG A 75 1.346 12.210 6.590 1.00 0.00 H new ATOM 0 HA ARG A 75 3.226 10.388 5.748 1.00 0.00 H new ATOM 0 HB2 ARG A 75 3.261 11.991 8.334 1.00 0.00 H new ATOM 0 HB3 ARG A 75 4.661 11.369 7.482 1.00 0.00 H new ATOM 0 HG2 ARG A 75 2.738 13.318 6.180 1.00 0.00 H new ATOM 0 HG3 ARG A 75 4.076 13.861 7.173 1.00 0.00 H new ATOM 0 HD2 ARG A 75 5.675 12.667 5.706 1.00 0.00 H new ATOM 0 HD3 ARG A 75 4.350 12.064 4.730 1.00 0.00 H new ATOM 0 HE ARG A 75 5.538 14.719 4.617 1.00 0.00 H new ATOM 0 HH11 ARG A 75 2.581 12.859 4.100 1.00 0.00 H new ATOM 0 HH12 ARG A 75 1.935 13.998 2.913 1.00 0.00 H new ATOM 0 HH21 ARG A 75 4.701 16.176 3.093 1.00 0.00 H new ATOM 0 HH22 ARG A 75 3.130 15.868 2.345 1.00 0.00 H new ATOM 1179 N ALA A 76 1.837 9.516 8.602 1.00 0.00 N ATOM 1180 CA ALA A 76 1.673 8.412 9.539 1.00 0.00 C ATOM 1181 C ALA A 76 1.379 7.108 8.804 1.00 0.00 C ATOM 1182 O ALA A 76 1.937 6.061 9.131 1.00 0.00 O ATOM 1183 CB ALA A 76 0.564 8.722 10.532 1.00 0.00 C ATOM 0 H ALA A 76 1.229 10.315 8.781 1.00 0.00 H new ATOM 0 HA ALA A 76 2.609 8.289 10.084 1.00 0.00 H new ATOM 0 HB1 ALA A 76 0.453 7.888 11.225 1.00 0.00 H new ATOM 0 HB2 ALA A 76 0.815 9.625 11.088 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -0.372 8.875 9.996 1.00 0.00 H new ATOM 1189 N ALA A 77 0.499 7.180 7.811 1.00 0.00 N ATOM 1190 CA ALA A 77 0.132 6.006 7.030 1.00 0.00 C ATOM 1191 C ALA A 77 1.368 5.309 6.472 1.00 0.00 C ATOM 1192 O ALA A 77 2.410 5.935 6.276 1.00 0.00 O ATOM 1193 CB ALA A 77 -0.811 6.396 5.900 1.00 0.00 C ATOM 0 H ALA A 77 0.027 8.039 7.529 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.380 5.307 7.691 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -1.077 5.509 5.325 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -1.714 6.842 6.317 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -0.318 7.117 5.248 1.00 0.00 H new ATOM 1199 N ARG A 78 1.246 4.010 6.219 1.00 0.00 N ATOM 1200 CA ARG A 78 2.354 3.227 5.686 1.00 0.00 C ATOM 1201 C ARG A 78 1.842 2.057 4.851 1.00 0.00 C ATOM 1202 O ARG A 78 0.645 1.769 4.835 1.00 0.00 O ATOM 1203 CB ARG A 78 3.235 2.709 6.824 1.00 0.00 C ATOM 1204 CG ARG A 78 3.737 3.803 7.752 1.00 0.00 C ATOM 1205 CD ARG A 78 4.587 3.233 8.877 1.00 0.00 C ATOM 1206 NE ARG A 78 3.775 2.780 10.002 1.00 0.00 N ATOM 1207 CZ ARG A 78 4.251 2.605 11.230 1.00 0.00 C ATOM 1208 NH1 ARG A 78 5.530 2.845 11.488 1.00 0.00 N ATOM 1209 NH2 ARG A 78 3.449 2.191 12.202 1.00 0.00 N ATOM 0 H ARG A 78 0.390 3.477 6.375 1.00 0.00 H new ATOM 0 HA ARG A 78 2.948 3.877 5.043 1.00 0.00 H new ATOM 0 HB2 ARG A 78 2.671 1.981 7.407 1.00 0.00 H new ATOM 0 HB3 ARG A 78 4.090 2.183 6.400 1.00 0.00 H new ATOM 0 HG2 ARG A 78 4.322 4.525 7.182 1.00 0.00 H new ATOM 0 HG3 ARG A 78 2.888 4.342 8.173 1.00 0.00 H new ATOM 0 HD2 ARG A 78 5.178 2.399 8.498 1.00 0.00 H new ATOM 0 HD3 ARG A 78 5.290 3.992 9.220 1.00 0.00 H new ATOM 0 HE ARG A 78 2.787 2.587 9.836 1.00 0.00 H new ATOM 0 HH11 ARG A 78 6.149 3.164 10.743 1.00 0.00 H new ATOM 0 HH12 ARG A 78 5.894 2.710 12.431 1.00 0.00 H new ATOM 0 HH21 ARG A 78 2.465 2.006 12.007 1.00 0.00 H new ATOM 0 HH22 ARG A 78 3.816 2.057 13.144 1.00 0.00 H new ATOM 1223 N LEU A 79 2.756 1.386 4.159 1.00 0.00 N ATOM 1224 CA LEU A 79 2.398 0.247 3.321 1.00 0.00 C ATOM 1225 C LEU A 79 2.553 -1.063 4.087 1.00 0.00 C ATOM 1226 O LEU A 79 3.566 -1.290 4.749 1.00 0.00 O ATOM 1227 CB LEU A 79 3.267 0.221 2.063 1.00 0.00 C ATOM 1228 CG LEU A 79 2.936 -0.868 1.041 1.00 0.00 C ATOM 1229 CD1 LEU A 79 1.502 -0.728 0.557 1.00 0.00 C ATOM 1230 CD2 LEU A 79 3.905 -0.812 -0.131 1.00 0.00 C ATOM 0 H LEU A 79 3.751 1.611 4.162 1.00 0.00 H new ATOM 0 HA LEU A 79 1.353 0.355 3.031 1.00 0.00 H new ATOM 0 HB2 LEU A 79 3.187 1.190 1.570 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.307 0.102 2.366 1.00 0.00 H new ATOM 0 HG LEU A 79 3.040 -1.838 1.526 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.285 -1.511 -0.169 1.00 0.00 H new ATOM 0 HD12 LEU A 79 0.822 -0.820 1.404 1.00 0.00 H new ATOM 0 HD13 LEU A 79 1.370 0.247 0.089 1.00 0.00 H new ATOM 0 HD21 LEU A 79 3.654 -1.594 -0.848 1.00 0.00 H new ATOM 0 HD22 LEU A 79 3.834 0.162 -0.616 1.00 0.00 H new ATOM 0 HD23 LEU A 79 4.922 -0.964 0.230 1.00 0.00 H new ATOM 1242 N CYS A 80 1.543 -1.920 3.992 1.00 0.00 N ATOM 1243 CA CYS A 80 1.567 -3.209 4.676 1.00 0.00 C ATOM 1244 C CYS A 80 1.152 -4.333 3.732 1.00 0.00 C ATOM 1245 O CYS A 80 0.269 -4.158 2.892 1.00 0.00 O ATOM 1246 CB CYS A 80 0.642 -3.181 5.893 1.00 0.00 C ATOM 1247 SG CYS A 80 1.013 -1.862 7.072 1.00 0.00 S ATOM 0 H CYS A 80 0.697 -1.746 3.449 1.00 0.00 H new ATOM 0 HA CYS A 80 2.588 -3.397 5.009 1.00 0.00 H new ATOM 0 HB2 CYS A 80 -0.387 -3.069 5.551 1.00 0.00 H new ATOM 0 HB3 CYS A 80 0.705 -4.141 6.406 1.00 0.00 H new ATOM 0 HG CYS A 80 -0.081 -1.495 7.671 1.00 0.00 H new ATOM 1253 N LEU A 81 1.797 -5.486 3.874 1.00 0.00 N ATOM 1254 CA LEU A 81 1.496 -6.639 3.033 1.00 0.00 C ATOM 1255 C LEU A 81 1.724 -7.942 3.793 1.00 0.00 C ATOM 1256 O LEU A 81 2.474 -7.980 4.769 1.00 0.00 O ATOM 1257 CB LEU A 81 2.361 -6.614 1.771 1.00 0.00 C ATOM 1258 CG LEU A 81 3.834 -6.257 1.974 1.00 0.00 C ATOM 1259 CD1 LEU A 81 4.630 -7.488 2.379 1.00 0.00 C ATOM 1260 CD2 LEU A 81 4.411 -5.639 0.709 1.00 0.00 C ATOM 0 H LEU A 81 2.531 -5.647 4.563 1.00 0.00 H new ATOM 0 HA LEU A 81 0.445 -6.585 2.748 1.00 0.00 H new ATOM 0 HB2 LEU A 81 2.307 -7.595 1.298 1.00 0.00 H new ATOM 0 HB3 LEU A 81 1.928 -5.899 1.072 1.00 0.00 H new ATOM 0 HG LEU A 81 3.904 -5.524 2.778 1.00 0.00 H new ATOM 0 HD11 LEU A 81 5.676 -7.215 2.519 1.00 0.00 H new ATOM 0 HD12 LEU A 81 4.231 -7.889 3.311 1.00 0.00 H new ATOM 0 HD13 LEU A 81 4.554 -8.244 1.597 1.00 0.00 H new ATOM 0 HD21 LEU A 81 5.460 -5.391 0.871 1.00 0.00 H new ATOM 0 HD22 LEU A 81 4.329 -6.350 -0.113 1.00 0.00 H new ATOM 0 HD23 LEU A 81 3.858 -4.733 0.462 1.00 0.00 H new ATOM 1272 N SER A 82 1.074 -9.008 3.338 1.00 0.00 N ATOM 1273 CA SER A 82 1.204 -10.313 3.976 1.00 0.00 C ATOM 1274 C SER A 82 0.835 -11.431 3.007 1.00 0.00 C ATOM 1275 O SER A 82 -0.206 -11.381 2.352 1.00 0.00 O ATOM 1276 CB SER A 82 0.316 -10.387 5.220 1.00 0.00 C ATOM 1277 OG SER A 82 -1.037 -10.615 4.867 1.00 0.00 O ATOM 0 H SER A 82 0.452 -8.994 2.530 1.00 0.00 H new ATOM 0 HA SER A 82 2.245 -10.442 4.273 1.00 0.00 H new ATOM 0 HB2 SER A 82 0.665 -11.187 5.873 1.00 0.00 H new ATOM 0 HB3 SER A 82 0.396 -9.458 5.784 1.00 0.00 H new ATOM 0 HG SER A 82 -1.450 -11.213 5.524 1.00 0.00 H new ATOM 1283 N ILE A 83 1.696 -12.439 2.921 1.00 0.00 N ATOM 1284 CA ILE A 83 1.461 -13.571 2.033 1.00 0.00 C ATOM 1285 C ILE A 83 0.594 -14.628 2.707 1.00 0.00 C ATOM 1286 O ILE A 83 0.906 -15.096 3.803 1.00 0.00 O ATOM 1287 CB ILE A 83 2.784 -14.219 1.584 1.00 0.00 C ATOM 1288 CG1 ILE A 83 3.742 -13.154 1.045 1.00 0.00 C ATOM 1289 CG2 ILE A 83 2.521 -15.284 0.530 1.00 0.00 C ATOM 1290 CD1 ILE A 83 5.177 -13.623 0.950 1.00 0.00 C ATOM 0 H ILE A 83 2.563 -12.495 3.455 1.00 0.00 H new ATOM 0 HA ILE A 83 0.941 -13.182 1.158 1.00 0.00 H new ATOM 0 HB ILE A 83 3.249 -14.696 2.447 1.00 0.00 H new ATOM 0 HG12 ILE A 83 3.405 -12.840 0.057 1.00 0.00 H new ATOM 0 HG13 ILE A 83 3.697 -12.277 1.690 1.00 0.00 H new ATOM 0 HG21 ILE A 83 3.466 -15.733 0.223 1.00 0.00 H new ATOM 0 HG22 ILE A 83 1.871 -16.054 0.945 1.00 0.00 H new ATOM 0 HG23 ILE A 83 2.037 -14.829 -0.334 1.00 0.00 H new ATOM 0 HD11 ILE A 83 5.798 -12.817 0.560 1.00 0.00 H new ATOM 0 HD12 ILE A 83 5.533 -13.909 1.940 1.00 0.00 H new ATOM 0 HD13 ILE A 83 5.236 -14.482 0.281 1.00 0.00 H new ATOM 1302 N CYS A 84 -0.496 -15.001 2.045 1.00 0.00 N ATOM 1303 CA CYS A 84 -1.409 -16.005 2.580 1.00 0.00 C ATOM 1304 C CYS A 84 -1.596 -17.152 1.592 1.00 0.00 C ATOM 1305 O CYS A 84 -1.492 -16.963 0.380 1.00 0.00 O ATOM 1306 CB CYS A 84 -2.762 -15.371 2.907 1.00 0.00 C ATOM 1307 SG CYS A 84 -2.650 -13.860 3.893 1.00 0.00 S ATOM 0 H CYS A 84 -0.769 -14.624 1.138 1.00 0.00 H new ATOM 0 HA CYS A 84 -0.973 -16.406 3.495 1.00 0.00 H new ATOM 0 HB2 CYS A 84 -3.281 -15.146 1.975 1.00 0.00 H new ATOM 0 HB3 CYS A 84 -3.372 -16.098 3.444 1.00 0.00 H new ATOM 0 HG CYS A 84 -3.103 -14.088 5.090 1.00 0.00 H new ATOM 1313 N SER A 85 -1.872 -18.341 2.118 1.00 0.00 N ATOM 1314 CA SER A 85 -2.068 -19.520 1.283 1.00 0.00 C ATOM 1315 C SER A 85 -3.539 -19.922 1.247 1.00 0.00 C ATOM 1316 O SER A 85 -4.175 -20.086 2.289 1.00 0.00 O ATOM 1317 CB SER A 85 -1.221 -20.684 1.800 1.00 0.00 C ATOM 1318 OG SER A 85 -1.849 -21.323 2.898 1.00 0.00 O ATOM 0 H SER A 85 -1.965 -18.513 3.119 1.00 0.00 H new ATOM 0 HA SER A 85 -1.752 -19.273 0.269 1.00 0.00 H new ATOM 0 HB2 SER A 85 -1.060 -21.405 0.999 1.00 0.00 H new ATOM 0 HB3 SER A 85 -0.239 -20.318 2.101 1.00 0.00 H new ATOM 0 HG SER A 85 -2.770 -20.998 2.983 1.00 0.00 H new ATOM 1324 N VAL A 86 -4.075 -20.080 0.041 1.00 0.00 N ATOM 1325 CA VAL A 86 -5.471 -20.464 -0.132 1.00 0.00 C ATOM 1326 C VAL A 86 -5.590 -21.921 -0.564 1.00 0.00 C ATOM 1327 O VAL A 86 -4.897 -22.368 -1.478 1.00 0.00 O ATOM 1328 CB VAL A 86 -6.174 -19.572 -1.172 1.00 0.00 C ATOM 1329 CG1 VAL A 86 -5.866 -20.052 -2.582 1.00 0.00 C ATOM 1330 CG2 VAL A 86 -7.674 -19.546 -0.923 1.00 0.00 C ATOM 0 H VAL A 86 -3.563 -19.948 -0.831 1.00 0.00 H new ATOM 0 HA VAL A 86 -5.958 -20.334 0.835 1.00 0.00 H new ATOM 0 HB VAL A 86 -5.795 -18.555 -1.070 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -6.371 -19.410 -3.303 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -4.790 -20.013 -2.753 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -6.216 -21.077 -2.702 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -8.155 -18.911 -1.667 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -8.073 -20.558 -0.997 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -7.871 -19.150 0.073 1.00 0.00 H new ATOM 1340 N LYS A 87 -6.475 -22.658 0.098 1.00 0.00 N ATOM 1341 CA LYS A 87 -6.688 -24.066 -0.218 1.00 0.00 C ATOM 1342 C LYS A 87 -8.103 -24.498 0.154 1.00 0.00 C ATOM 1343 O LYS A 87 -8.599 -24.173 1.231 1.00 0.00 O ATOM 1344 CB LYS A 87 -5.668 -24.936 0.519 1.00 0.00 C ATOM 1345 CG LYS A 87 -5.981 -26.421 0.463 1.00 0.00 C ATOM 1346 CD LYS A 87 -5.520 -27.038 -0.847 1.00 0.00 C ATOM 1347 CE LYS A 87 -5.938 -28.497 -0.953 1.00 0.00 C ATOM 1348 NZ LYS A 87 -7.328 -28.640 -1.466 1.00 0.00 N ATOM 0 H LYS A 87 -7.057 -22.304 0.857 1.00 0.00 H new ATOM 0 HA LYS A 87 -6.557 -24.195 -1.292 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -4.680 -24.765 0.090 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -5.622 -24.622 1.562 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -5.495 -26.928 1.296 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -7.054 -26.572 0.580 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -5.939 -26.477 -1.682 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -4.435 -26.963 -0.924 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -5.251 -29.024 -1.615 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -5.862 -28.969 0.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -7.883 -29.221 -0.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -7.765 -27.700 -1.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -7.308 -29.099 -2.399 1.00 0.00 H new ATOM 1362 N GLY A 88 -8.748 -25.235 -0.746 1.00 0.00 N ATOM 1363 CA GLY A 88 -10.098 -25.701 -0.493 1.00 0.00 C ATOM 1364 C GLY A 88 -10.489 -26.860 -1.388 1.00 0.00 C ATOM 1365 O GLY A 88 -9.732 -27.248 -2.279 1.00 0.00 O ATOM 0 H GLY A 88 -8.359 -25.517 -1.646 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -10.184 -26.006 0.550 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -10.797 -24.878 -0.643 1.00 0.00 H new ATOM 1369 N ARG A 89 -11.673 -27.416 -1.151 1.00 0.00 N ATOM 1370 CA ARG A 89 -12.161 -28.540 -1.941 1.00 0.00 C ATOM 1371 C ARG A 89 -13.385 -28.139 -2.759 1.00 0.00 C ATOM 1372 O ARG A 89 -14.036 -27.134 -2.471 1.00 0.00 O ATOM 1373 CB ARG A 89 -12.507 -29.720 -1.030 1.00 0.00 C ATOM 1374 CG ARG A 89 -11.341 -30.192 -0.176 1.00 0.00 C ATOM 1375 CD ARG A 89 -11.259 -29.418 1.130 1.00 0.00 C ATOM 1376 NE ARG A 89 -12.046 -30.046 2.188 1.00 0.00 N ATOM 1377 CZ ARG A 89 -11.851 -29.820 3.483 1.00 0.00 C ATOM 1378 NH1 ARG A 89 -10.900 -28.984 3.877 1.00 0.00 N ATOM 1379 NH2 ARG A 89 -12.608 -30.430 4.386 1.00 0.00 N ATOM 0 H ARG A 89 -12.312 -27.106 -0.418 1.00 0.00 H new ATOM 0 HA ARG A 89 -11.369 -28.840 -2.627 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -13.332 -29.435 -0.378 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -12.857 -30.551 -1.643 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -11.451 -31.255 0.036 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -10.410 -30.072 -0.731 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -10.218 -29.348 1.445 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -11.613 -28.399 0.971 1.00 0.00 H new ATOM 0 HE ARG A 89 -12.786 -30.694 1.918 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -10.316 -28.513 3.186 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -10.752 -28.812 4.871 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -13.341 -31.073 4.087 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -12.457 -30.256 5.380 1.00 0.00 H new ATOM 1393 N LYS A 90 -13.693 -28.931 -3.780 1.00 0.00 N ATOM 1394 CA LYS A 90 -14.839 -28.660 -4.640 1.00 0.00 C ATOM 1395 C LYS A 90 -16.122 -28.556 -3.821 1.00 0.00 C ATOM 1396 O LYS A 90 -16.373 -29.375 -2.937 1.00 0.00 O ATOM 1397 CB LYS A 90 -14.983 -29.760 -5.695 1.00 0.00 C ATOM 1398 CG LYS A 90 -14.086 -29.563 -6.905 1.00 0.00 C ATOM 1399 CD LYS A 90 -14.694 -28.587 -7.897 1.00 0.00 C ATOM 1400 CE LYS A 90 -15.585 -29.298 -8.904 1.00 0.00 C ATOM 1401 NZ LYS A 90 -15.849 -28.456 -10.103 1.00 0.00 N ATOM 0 H LYS A 90 -13.165 -29.766 -4.032 1.00 0.00 H new ATOM 0 HA LYS A 90 -14.669 -27.706 -5.139 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -14.756 -30.723 -5.237 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -16.021 -29.801 -6.025 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -13.113 -29.195 -6.581 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -13.917 -30.522 -7.394 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -15.275 -27.837 -7.361 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -13.899 -28.058 -8.423 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -15.112 -30.231 -9.212 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -16.531 -29.561 -8.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -16.460 -28.976 -10.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -16.323 -27.577 -9.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -14.949 -28.226 -10.570 1.00 0.00 H new ATOM 1415 N GLY A 91 -16.931 -27.545 -4.122 1.00 0.00 N ATOM 1416 CA GLY A 91 -18.178 -27.354 -3.404 1.00 0.00 C ATOM 1417 C GLY A 91 -17.987 -26.610 -2.098 1.00 0.00 C ATOM 1418 O GLY A 91 -18.777 -25.730 -1.756 1.00 0.00 O ATOM 0 H GLY A 91 -16.745 -26.855 -4.850 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -18.876 -26.802 -4.034 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -18.630 -28.325 -3.203 1.00 0.00 H new ATOM 1422 N ALA A 92 -16.937 -26.964 -1.365 1.00 0.00 N ATOM 1423 CA ALA A 92 -16.645 -26.323 -0.088 1.00 0.00 C ATOM 1424 C ALA A 92 -15.870 -25.025 -0.290 1.00 0.00 C ATOM 1425 O ALA A 92 -15.388 -24.742 -1.387 1.00 0.00 O ATOM 1426 CB ALA A 92 -15.866 -27.271 0.812 1.00 0.00 C ATOM 0 H ALA A 92 -16.274 -27.691 -1.633 1.00 0.00 H new ATOM 0 HA ALA A 92 -17.592 -26.079 0.393 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -15.655 -26.780 1.762 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -16.456 -28.170 0.992 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -14.928 -27.544 0.328 1.00 0.00 H new ATOM 1432 N LYS A 93 -15.754 -24.239 0.775 1.00 0.00 N ATOM 1433 CA LYS A 93 -15.037 -22.971 0.716 1.00 0.00 C ATOM 1434 C LYS A 93 -13.536 -23.186 0.883 1.00 0.00 C ATOM 1435 O LYS A 93 -13.096 -24.262 1.286 1.00 0.00 O ATOM 1436 CB LYS A 93 -15.551 -22.020 1.800 1.00 0.00 C ATOM 1437 CG LYS A 93 -16.711 -21.151 1.346 1.00 0.00 C ATOM 1438 CD LYS A 93 -16.249 -20.050 0.407 1.00 0.00 C ATOM 1439 CE LYS A 93 -17.414 -19.194 -0.065 1.00 0.00 C ATOM 1440 NZ LYS A 93 -18.368 -19.971 -0.905 1.00 0.00 N ATOM 0 H LYS A 93 -16.148 -24.458 1.690 1.00 0.00 H new ATOM 0 HA LYS A 93 -15.215 -22.527 -0.263 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -15.863 -22.604 2.666 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -14.733 -21.378 2.126 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -17.455 -21.769 0.845 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -17.197 -20.709 2.215 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -15.517 -19.422 0.914 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -15.748 -20.492 -0.455 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -17.939 -18.787 0.799 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -17.034 -18.347 -0.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -19.030 -19.319 -1.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -17.841 -20.504 -1.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -18.900 -20.633 -0.305 1.00 0.00 H new ATOM 1454 N GLU A 94 -12.757 -22.155 0.573 1.00 0.00 N ATOM 1455 CA GLU A 94 -11.306 -22.232 0.690 1.00 0.00 C ATOM 1456 C GLU A 94 -10.850 -21.821 2.088 1.00 0.00 C ATOM 1457 O GLU A 94 -11.666 -21.466 2.938 1.00 0.00 O ATOM 1458 CB GLU A 94 -10.638 -21.340 -0.358 1.00 0.00 C ATOM 1459 CG GLU A 94 -10.598 -21.958 -1.746 1.00 0.00 C ATOM 1460 CD GLU A 94 -10.629 -20.918 -2.849 1.00 0.00 C ATOM 1461 OE1 GLU A 94 -11.064 -19.779 -2.577 1.00 0.00 O ATOM 1462 OE2 GLU A 94 -10.220 -21.243 -3.983 1.00 0.00 O ATOM 0 H GLU A 94 -13.106 -21.257 0.239 1.00 0.00 H new ATOM 0 HA GLU A 94 -11.009 -23.267 0.518 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -11.171 -20.390 -0.407 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -9.620 -21.118 -0.039 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -9.695 -22.561 -1.845 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -11.446 -22.633 -1.864 1.00 0.00 H new ATOM 1469 N GLU A 95 -9.541 -21.873 2.316 1.00 0.00 N ATOM 1470 CA GLU A 95 -8.978 -21.508 3.610 1.00 0.00 C ATOM 1471 C GLU A 95 -7.697 -20.697 3.436 1.00 0.00 C ATOM 1472 O GLU A 95 -6.692 -21.202 2.934 1.00 0.00 O ATOM 1473 CB GLU A 95 -8.692 -22.761 4.439 1.00 0.00 C ATOM 1474 CG GLU A 95 -8.379 -22.469 5.897 1.00 0.00 C ATOM 1475 CD GLU A 95 -7.744 -23.650 6.606 1.00 0.00 C ATOM 1476 OE1 GLU A 95 -8.491 -24.478 7.166 1.00 0.00 O ATOM 1477 OE2 GLU A 95 -6.499 -23.745 6.600 1.00 0.00 O ATOM 0 H GLU A 95 -8.852 -22.164 1.622 1.00 0.00 H new ATOM 0 HA GLU A 95 -9.709 -20.893 4.135 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -9.555 -23.425 4.388 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -7.852 -23.295 3.996 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.709 -21.611 5.956 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -9.298 -22.191 6.413 1.00 0.00 H new ATOM 1484 N HIS A 96 -7.740 -19.436 3.855 1.00 0.00 N ATOM 1485 CA HIS A 96 -6.584 -18.554 3.746 1.00 0.00 C ATOM 1486 C HIS A 96 -5.773 -18.558 5.038 1.00 0.00 C ATOM 1487 O HIS A 96 -6.323 -18.397 6.128 1.00 0.00 O ATOM 1488 CB HIS A 96 -7.031 -17.129 3.416 1.00 0.00 C ATOM 1489 CG HIS A 96 -7.924 -17.044 2.216 1.00 0.00 C ATOM 1490 ND1 HIS A 96 -7.946 -15.956 1.370 1.00 0.00 N ATOM 1491 CD2 HIS A 96 -8.828 -17.922 1.721 1.00 0.00 C ATOM 1492 CE1 HIS A 96 -8.827 -16.167 0.408 1.00 0.00 C ATOM 1493 NE2 HIS A 96 -9.375 -17.353 0.598 1.00 0.00 N ATOM 0 H HIS A 96 -8.563 -19.002 4.273 1.00 0.00 H new ATOM 0 HA HIS A 96 -5.952 -18.924 2.939 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -7.553 -16.712 4.277 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -6.150 -16.510 3.247 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -9.073 -18.890 2.133 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -9.059 -15.485 -0.397 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -10.089 -17.778 0.006 1.00 0.00 H new ATOM 1502 N CYS A 97 -4.464 -18.745 4.909 1.00 0.00 N ATOM 1503 CA CYS A 97 -3.578 -18.772 6.067 1.00 0.00 C ATOM 1504 C CYS A 97 -2.360 -17.881 5.841 1.00 0.00 C ATOM 1505 O CYS A 97 -1.654 -17.996 4.839 1.00 0.00 O ATOM 1506 CB CYS A 97 -3.129 -20.205 6.358 1.00 0.00 C ATOM 1507 SG CYS A 97 -2.439 -20.440 8.013 1.00 0.00 S ATOM 0 H CYS A 97 -3.993 -18.880 4.014 1.00 0.00 H new ATOM 0 HA CYS A 97 -4.131 -18.390 6.925 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -3.980 -20.874 6.233 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -2.382 -20.498 5.620 1.00 0.00 H new ATOM 0 HG CYS A 97 -2.090 -21.683 8.165 1.00 0.00 H new ATOM 1513 N PRO A 98 -2.108 -16.971 6.793 1.00 0.00 N ATOM 1514 CA PRO A 98 -0.976 -16.042 6.719 1.00 0.00 C ATOM 1515 C PRO A 98 0.364 -16.746 6.900 1.00 0.00 C ATOM 1516 O PRO A 98 0.455 -17.765 7.587 1.00 0.00 O ATOM 1517 CB PRO A 98 -1.234 -15.077 7.879 1.00 0.00 C ATOM 1518 CG PRO A 98 -2.058 -15.856 8.845 1.00 0.00 C ATOM 1519 CD PRO A 98 -2.908 -16.778 8.014 1.00 0.00 C ATOM 0 HA PRO A 98 -0.911 -15.554 5.746 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -0.300 -14.745 8.333 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -1.759 -14.184 7.541 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -1.426 -16.420 9.531 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -2.677 -15.195 9.452 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -3.095 -17.722 8.525 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -3.880 -16.338 7.792 1.00 0.00 H new ATOM 1527 N LEU A 99 1.404 -16.197 6.281 1.00 0.00 N ATOM 1528 CA LEU A 99 2.741 -16.772 6.374 1.00 0.00 C ATOM 1529 C LEU A 99 3.740 -15.746 6.898 1.00 0.00 C ATOM 1530 O LEU A 99 4.492 -16.018 7.833 1.00 0.00 O ATOM 1531 CB LEU A 99 3.192 -17.288 5.006 1.00 0.00 C ATOM 1532 CG LEU A 99 2.193 -18.173 4.259 1.00 0.00 C ATOM 1533 CD1 LEU A 99 2.712 -18.508 2.870 1.00 0.00 C ATOM 1534 CD2 LEU A 99 1.913 -19.444 5.048 1.00 0.00 C ATOM 0 H LEU A 99 1.347 -15.354 5.709 1.00 0.00 H new ATOM 0 HA LEU A 99 2.703 -17.605 7.075 1.00 0.00 H new ATOM 0 HB2 LEU A 99 3.428 -16.430 4.376 1.00 0.00 H new ATOM 0 HB3 LEU A 99 4.116 -17.850 5.139 1.00 0.00 H new ATOM 0 HG LEU A 99 1.258 -17.623 4.152 1.00 0.00 H new ATOM 0 HD11 LEU A 99 1.988 -19.138 2.353 1.00 0.00 H new ATOM 0 HD12 LEU A 99 2.860 -17.588 2.305 1.00 0.00 H new ATOM 0 HD13 LEU A 99 3.660 -19.039 2.954 1.00 0.00 H new ATOM 0 HD21 LEU A 99 1.200 -20.062 4.502 1.00 0.00 H new ATOM 0 HD22 LEU A 99 2.841 -19.998 5.187 1.00 0.00 H new ATOM 0 HD23 LEU A 99 1.497 -19.184 6.021 1.00 0.00 H new ATOM 1546 N ALA A 100 3.741 -14.565 6.289 1.00 0.00 N ATOM 1547 CA ALA A 100 4.644 -13.496 6.697 1.00 0.00 C ATOM 1548 C ALA A 100 3.956 -12.137 6.623 1.00 0.00 C ATOM 1549 O ALA A 100 2.788 -12.042 6.246 1.00 0.00 O ATOM 1550 CB ALA A 100 5.896 -13.504 5.832 1.00 0.00 C ATOM 0 H ALA A 100 3.127 -14.324 5.511 1.00 0.00 H new ATOM 0 HA ALA A 100 4.931 -13.672 7.734 1.00 0.00 H new ATOM 0 HB1 ALA A 100 6.561 -12.701 6.148 1.00 0.00 H new ATOM 0 HB2 ALA A 100 6.406 -14.461 5.939 1.00 0.00 H new ATOM 0 HB3 ALA A 100 5.618 -13.356 4.788 1.00 0.00 H new ATOM 1556 N TRP A 101 4.686 -11.089 6.987 1.00 0.00 N ATOM 1557 CA TRP A 101 4.145 -9.735 6.962 1.00 0.00 C ATOM 1558 C TRP A 101 5.264 -8.702 6.894 1.00 0.00 C ATOM 1559 O TRP A 101 6.220 -8.758 7.667 1.00 0.00 O ATOM 1560 CB TRP A 101 3.279 -9.487 8.199 1.00 0.00 C ATOM 1561 CG TRP A 101 4.008 -9.714 9.489 1.00 0.00 C ATOM 1562 CD1 TRP A 101 4.148 -10.899 10.153 1.00 0.00 C ATOM 1563 CD2 TRP A 101 4.693 -8.730 10.270 1.00 0.00 C ATOM 1564 NE1 TRP A 101 4.880 -10.711 11.301 1.00 0.00 N ATOM 1565 CE2 TRP A 101 5.227 -9.390 11.395 1.00 0.00 C ATOM 1566 CE3 TRP A 101 4.910 -7.357 10.129 1.00 0.00 C ATOM 1567 CZ2 TRP A 101 5.961 -8.721 12.371 1.00 0.00 C ATOM 1568 CZ3 TRP A 101 5.639 -6.695 11.098 1.00 0.00 C ATOM 1569 CH2 TRP A 101 6.158 -7.376 12.207 1.00 0.00 C ATOM 0 H TRP A 101 5.654 -11.151 7.303 1.00 0.00 H new ATOM 0 HA TRP A 101 3.528 -9.633 6.069 1.00 0.00 H new ATOM 0 HB2 TRP A 101 2.908 -8.462 8.175 1.00 0.00 H new ATOM 0 HB3 TRP A 101 2.408 -10.142 8.162 1.00 0.00 H new ATOM 0 HD1 TRP A 101 3.743 -11.845 9.824 1.00 0.00 H new ATOM 0 HE1 TRP A 101 5.125 -11.438 11.974 1.00 0.00 H new ATOM 0 HE3 TRP A 101 4.515 -6.823 9.278 1.00 0.00 H new ATOM 0 HZ2 TRP A 101 6.361 -9.244 13.227 1.00 0.00 H new ATOM 0 HZ3 TRP A 101 5.812 -5.634 10.999 1.00 0.00 H new ATOM 0 HH2 TRP A 101 6.724 -6.830 12.947 1.00 0.00 H new ATOM 1580 N GLY A 102 5.139 -7.759 5.965 1.00 0.00 N ATOM 1581 CA GLY A 102 6.148 -6.727 5.815 1.00 0.00 C ATOM 1582 C GLY A 102 5.545 -5.350 5.624 1.00 0.00 C ATOM 1583 O GLY A 102 4.623 -5.174 4.829 1.00 0.00 O ATOM 0 H GLY A 102 4.357 -7.691 5.314 1.00 0.00 H new ATOM 0 HA2 GLY A 102 6.790 -6.720 6.696 1.00 0.00 H new ATOM 0 HA3 GLY A 102 6.782 -6.964 4.961 1.00 0.00 H new ATOM 1587 N ASN A 103 6.065 -4.371 6.357 1.00 0.00 N ATOM 1588 CA ASN A 103 5.570 -3.002 6.266 1.00 0.00 C ATOM 1589 C ASN A 103 6.646 -2.069 5.718 1.00 0.00 C ATOM 1590 O ASN A 103 7.793 -2.098 6.166 1.00 0.00 O ATOM 1591 CB ASN A 103 5.107 -2.513 7.639 1.00 0.00 C ATOM 1592 CG ASN A 103 4.120 -3.464 8.289 1.00 0.00 C ATOM 1593 OD1 ASN A 103 4.213 -4.680 8.124 1.00 0.00 O ATOM 1594 ND2 ASN A 103 3.169 -2.912 9.033 1.00 0.00 N ATOM 0 H ASN A 103 6.829 -4.500 7.021 1.00 0.00 H new ATOM 0 HA ASN A 103 4.723 -2.994 5.580 1.00 0.00 H new ATOM 0 HB2 ASN A 103 5.973 -2.392 8.290 1.00 0.00 H new ATOM 0 HB3 ASN A 103 4.646 -1.531 7.535 1.00 0.00 H new ATOM 0 HD21 ASN A 103 2.477 -3.501 9.496 1.00 0.00 H new ATOM 0 HD22 ASN A 103 3.130 -1.899 9.142 1.00 0.00 H new ATOM 1601 N ILE A 104 6.268 -1.245 4.747 1.00 0.00 N ATOM 1602 CA ILE A 104 7.200 -0.303 4.140 1.00 0.00 C ATOM 1603 C ILE A 104 6.760 1.138 4.379 1.00 0.00 C ATOM 1604 O ILE A 104 5.638 1.518 4.049 1.00 0.00 O ATOM 1605 CB ILE A 104 7.334 -0.541 2.624 1.00 0.00 C ATOM 1606 CG1 ILE A 104 7.980 -1.902 2.355 1.00 0.00 C ATOM 1607 CG2 ILE A 104 8.146 0.574 1.982 1.00 0.00 C ATOM 1608 CD1 ILE A 104 7.918 -2.324 0.904 1.00 0.00 C ATOM 0 H ILE A 104 5.323 -1.211 4.364 1.00 0.00 H new ATOM 0 HA ILE A 104 8.168 -0.469 4.613 1.00 0.00 H new ATOM 0 HB ILE A 104 6.338 -0.539 2.181 1.00 0.00 H new ATOM 0 HG12 ILE A 104 9.023 -1.869 2.671 1.00 0.00 H new ATOM 0 HG13 ILE A 104 7.485 -2.657 2.966 1.00 0.00 H new ATOM 0 HG21 ILE A 104 8.232 0.391 0.911 1.00 0.00 H new ATOM 0 HG22 ILE A 104 7.648 1.529 2.149 1.00 0.00 H new ATOM 0 HG23 ILE A 104 9.141 0.602 2.426 1.00 0.00 H new ATOM 0 HD11 ILE A 104 8.395 -3.297 0.787 1.00 0.00 H new ATOM 0 HD12 ILE A 104 6.877 -2.390 0.588 1.00 0.00 H new ATOM 0 HD13 ILE A 104 8.438 -1.590 0.289 1.00 0.00 H new ATOM 1620 N ASN A 105 7.654 1.935 4.955 1.00 0.00 N ATOM 1621 CA ASN A 105 7.358 3.335 5.238 1.00 0.00 C ATOM 1622 C ASN A 105 7.143 4.118 3.946 1.00 0.00 C ATOM 1623 O ASN A 105 8.084 4.677 3.382 1.00 0.00 O ATOM 1624 CB ASN A 105 8.496 3.965 6.045 1.00 0.00 C ATOM 1625 CG ASN A 105 8.321 3.770 7.539 1.00 0.00 C ATOM 1626 OD1 ASN A 105 8.744 2.757 8.097 1.00 0.00 O ATOM 1627 ND2 ASN A 105 7.696 4.742 8.194 1.00 0.00 N ATOM 0 H ASN A 105 8.588 1.636 5.235 1.00 0.00 H new ATOM 0 HA ASN A 105 6.440 3.375 5.824 1.00 0.00 H new ATOM 0 HB2 ASN A 105 9.445 3.528 5.733 1.00 0.00 H new ATOM 0 HB3 ASN A 105 8.548 5.031 5.824 1.00 0.00 H new ATOM 0 HD21 ASN A 105 7.550 4.667 9.201 1.00 0.00 H new ATOM 0 HD22 ASN A 105 7.362 5.564 7.690 1.00 0.00 H new ATOM 1634 N LEU A 106 5.898 4.154 3.484 1.00 0.00 N ATOM 1635 CA LEU A 106 5.557 4.868 2.258 1.00 0.00 C ATOM 1636 C LEU A 106 6.412 6.123 2.104 1.00 0.00 C ATOM 1637 O LEU A 106 6.858 6.451 1.005 1.00 0.00 O ATOM 1638 CB LEU A 106 4.075 5.244 2.259 1.00 0.00 C ATOM 1639 CG LEU A 106 3.112 4.179 1.734 1.00 0.00 C ATOM 1640 CD1 LEU A 106 1.671 4.575 2.017 1.00 0.00 C ATOM 1641 CD2 LEU A 106 3.323 3.958 0.243 1.00 0.00 C ATOM 0 H LEU A 106 5.108 3.697 3.940 1.00 0.00 H new ATOM 0 HA LEU A 106 5.757 4.208 1.414 1.00 0.00 H new ATOM 0 HB2 LEU A 106 3.785 5.496 3.279 1.00 0.00 H new ATOM 0 HB3 LEU A 106 3.949 6.146 1.660 1.00 0.00 H new ATOM 0 HG LEU A 106 3.318 3.243 2.253 1.00 0.00 H new ATOM 0 HD11 LEU A 106 1.000 3.805 1.636 1.00 0.00 H new ATOM 0 HD12 LEU A 106 1.527 4.682 3.092 1.00 0.00 H new ATOM 0 HD13 LEU A 106 1.451 5.523 1.526 1.00 0.00 H new ATOM 0 HD21 LEU A 106 2.629 3.197 -0.114 1.00 0.00 H new ATOM 0 HD22 LEU A 106 3.145 4.891 -0.292 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.347 3.628 0.065 1.00 0.00 H new ATOM 1653 N PHE A 107 6.636 6.819 3.213 1.00 0.00 N ATOM 1654 CA PHE A 107 7.438 8.037 3.202 1.00 0.00 C ATOM 1655 C PHE A 107 8.817 7.786 3.805 1.00 0.00 C ATOM 1656 O PHE A 107 8.945 7.528 5.003 1.00 0.00 O ATOM 1657 CB PHE A 107 6.726 9.149 3.974 1.00 0.00 C ATOM 1658 CG PHE A 107 5.396 9.529 3.388 1.00 0.00 C ATOM 1659 CD1 PHE A 107 5.309 10.507 2.411 1.00 0.00 C ATOM 1660 CD2 PHE A 107 4.234 8.908 3.815 1.00 0.00 C ATOM 1661 CE1 PHE A 107 4.087 10.859 1.869 1.00 0.00 C ATOM 1662 CE2 PHE A 107 3.009 9.256 3.277 1.00 0.00 C ATOM 1663 CZ PHE A 107 2.935 10.233 2.304 1.00 0.00 C ATOM 0 H PHE A 107 6.274 6.561 4.131 1.00 0.00 H new ATOM 0 HA PHE A 107 7.566 8.348 2.165 1.00 0.00 H new ATOM 0 HB2 PHE A 107 6.581 8.829 5.006 1.00 0.00 H new ATOM 0 HB3 PHE A 107 7.367 10.030 4.001 1.00 0.00 H new ATOM 0 HD1 PHE A 107 6.207 11.000 2.069 1.00 0.00 H new ATOM 0 HD2 PHE A 107 4.285 8.144 4.576 1.00 0.00 H new ATOM 0 HE1 PHE A 107 4.033 11.622 1.107 1.00 0.00 H new ATOM 0 HE2 PHE A 107 2.110 8.764 3.618 1.00 0.00 H new ATOM 0 HZ PHE A 107 1.979 10.507 1.884 1.00 0.00 H new ATOM 1673 N ASP A 108 9.846 7.862 2.968 1.00 0.00 N ATOM 1674 CA ASP A 108 11.216 7.644 3.418 1.00 0.00 C ATOM 1675 C ASP A 108 11.538 8.521 4.623 1.00 0.00 C ATOM 1676 O ASP A 108 10.740 9.373 5.015 1.00 0.00 O ATOM 1677 CB ASP A 108 12.200 7.933 2.283 1.00 0.00 C ATOM 1678 CG ASP A 108 13.460 7.097 2.382 1.00 0.00 C ATOM 1679 OD1 ASP A 108 13.344 5.871 2.592 1.00 0.00 O ATOM 1680 OD2 ASP A 108 14.562 7.668 2.250 1.00 0.00 O ATOM 0 H ASP A 108 9.757 8.073 1.974 1.00 0.00 H new ATOM 0 HA ASP A 108 11.313 6.600 3.715 1.00 0.00 H new ATOM 0 HB2 ASP A 108 11.714 7.740 1.327 1.00 0.00 H new ATOM 0 HB3 ASP A 108 12.467 8.990 2.298 1.00 0.00 H new ATOM 1685 N TYR A 109 12.711 8.305 5.208 1.00 0.00 N ATOM 1686 CA TYR A 109 13.137 9.073 6.372 1.00 0.00 C ATOM 1687 C TYR A 109 13.099 10.570 6.080 1.00 0.00 C ATOM 1688 O TYR A 109 12.779 11.378 6.953 1.00 0.00 O ATOM 1689 CB TYR A 109 14.549 8.660 6.793 1.00 0.00 C ATOM 1690 CG TYR A 109 15.641 9.367 6.023 1.00 0.00 C ATOM 1691 CD1 TYR A 109 16.025 8.927 4.761 1.00 0.00 C ATOM 1692 CD2 TYR A 109 16.292 10.472 6.557 1.00 0.00 C ATOM 1693 CE1 TYR A 109 17.023 9.569 4.054 1.00 0.00 C ATOM 1694 CE2 TYR A 109 17.290 11.121 5.856 1.00 0.00 C ATOM 1695 CZ TYR A 109 17.652 10.666 4.606 1.00 0.00 C ATOM 1696 OH TYR A 109 18.647 11.309 3.905 1.00 0.00 O ATOM 0 H TYR A 109 13.384 7.605 4.895 1.00 0.00 H new ATOM 0 HA TYR A 109 12.445 8.862 7.188 1.00 0.00 H new ATOM 0 HB2 TYR A 109 14.676 8.863 7.856 1.00 0.00 H new ATOM 0 HB3 TYR A 109 14.659 7.584 6.658 1.00 0.00 H new ATOM 0 HD1 TYR A 109 15.535 8.069 4.326 1.00 0.00 H new ATOM 0 HD2 TYR A 109 16.013 10.830 7.537 1.00 0.00 H new ATOM 0 HE1 TYR A 109 17.309 9.214 3.075 1.00 0.00 H new ATOM 0 HE2 TYR A 109 17.784 11.980 6.285 1.00 0.00 H new ATOM 0 HH TYR A 109 18.985 12.062 4.433 1.00 0.00 H new ATOM 1706 N THR A 110 13.429 10.934 4.845 1.00 0.00 N ATOM 1707 CA THR A 110 13.434 12.333 4.436 1.00 0.00 C ATOM 1708 C THR A 110 12.060 12.765 3.936 1.00 0.00 C ATOM 1709 O THR A 110 11.945 13.672 3.112 1.00 0.00 O ATOM 1710 CB THR A 110 14.474 12.592 3.330 1.00 0.00 C ATOM 1711 OG1 THR A 110 14.479 13.979 2.976 1.00 0.00 O ATOM 1712 CG2 THR A 110 14.175 11.750 2.098 1.00 0.00 C ATOM 0 H THR A 110 13.696 10.279 4.110 1.00 0.00 H new ATOM 0 HA THR A 110 13.698 12.918 5.317 1.00 0.00 H new ATOM 0 HB THR A 110 15.455 12.312 3.713 1.00 0.00 H new ATOM 0 HG1 THR A 110 13.567 14.264 2.757 1.00 0.00 H new ATOM 0 HG21 THR A 110 14.923 11.950 1.330 1.00 0.00 H new ATOM 0 HG22 THR A 110 14.202 10.693 2.364 1.00 0.00 H new ATOM 0 HG23 THR A 110 13.186 12.003 1.716 1.00 0.00 H new ATOM 1720 N ASP A 111 11.020 12.109 4.440 1.00 0.00 N ATOM 1721 CA ASP A 111 9.652 12.427 4.046 1.00 0.00 C ATOM 1722 C ASP A 111 9.533 12.525 2.529 1.00 0.00 C ATOM 1723 O ASP A 111 9.036 13.518 1.996 1.00 0.00 O ATOM 1724 CB ASP A 111 9.204 13.739 4.691 1.00 0.00 C ATOM 1725 CG ASP A 111 7.700 13.819 4.858 1.00 0.00 C ATOM 1726 OD1 ASP A 111 6.977 13.323 3.968 1.00 0.00 O ATOM 1727 OD2 ASP A 111 7.244 14.377 5.879 1.00 0.00 O ATOM 0 H ASP A 111 11.098 11.354 5.122 1.00 0.00 H new ATOM 0 HA ASP A 111 9.004 11.622 4.392 1.00 0.00 H new ATOM 0 HB2 ASP A 111 9.681 13.842 5.666 1.00 0.00 H new ATOM 0 HB3 ASP A 111 9.544 14.575 4.080 1.00 0.00 H new ATOM 1732 N THR A 112 9.993 11.488 1.835 1.00 0.00 N ATOM 1733 CA THR A 112 9.940 11.458 0.379 1.00 0.00 C ATOM 1734 C THR A 112 9.542 10.077 -0.128 1.00 0.00 C ATOM 1735 O THR A 112 10.321 9.126 -0.049 1.00 0.00 O ATOM 1736 CB THR A 112 11.296 11.849 -0.240 1.00 0.00 C ATOM 1737 OG1 THR A 112 11.650 13.178 0.155 1.00 0.00 O ATOM 1738 CG2 THR A 112 11.242 11.763 -1.758 1.00 0.00 C ATOM 0 H THR A 112 10.407 10.658 2.259 1.00 0.00 H new ATOM 0 HA THR A 112 9.187 12.185 0.075 1.00 0.00 H new ATOM 0 HB THR A 112 12.051 11.150 0.121 1.00 0.00 H new ATOM 0 HG1 THR A 112 11.654 13.238 1.133 1.00 0.00 H new ATOM 0 HG21 THR A 112 12.210 12.043 -2.173 1.00 0.00 H new ATOM 0 HG22 THR A 112 11.001 10.743 -2.056 1.00 0.00 H new ATOM 0 HG23 THR A 112 10.476 12.441 -2.134 1.00 0.00 H new ATOM 1746 N LEU A 113 8.325 9.973 -0.650 1.00 0.00 N ATOM 1747 CA LEU A 113 7.822 8.706 -1.172 1.00 0.00 C ATOM 1748 C LEU A 113 8.944 7.901 -1.821 1.00 0.00 C ATOM 1749 O LEU A 113 9.728 8.432 -2.608 1.00 0.00 O ATOM 1750 CB LEU A 113 6.706 8.958 -2.187 1.00 0.00 C ATOM 1751 CG LEU A 113 5.370 9.431 -1.613 1.00 0.00 C ATOM 1752 CD1 LEU A 113 4.577 10.193 -2.664 1.00 0.00 C ATOM 1753 CD2 LEU A 113 4.567 8.251 -1.088 1.00 0.00 C ATOM 0 H LEU A 113 7.668 10.750 -0.723 1.00 0.00 H new ATOM 0 HA LEU A 113 7.422 8.130 -0.338 1.00 0.00 H new ATOM 0 HB2 LEU A 113 7.055 9.702 -2.903 1.00 0.00 H new ATOM 0 HB3 LEU A 113 6.534 8.037 -2.743 1.00 0.00 H new ATOM 0 HG LEU A 113 5.573 10.105 -0.781 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.629 10.522 -2.237 1.00 0.00 H new ATOM 0 HD12 LEU A 113 5.148 11.062 -2.992 1.00 0.00 H new ATOM 0 HD13 LEU A 113 4.385 9.542 -3.517 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.620 8.607 -0.683 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.374 7.551 -1.901 1.00 0.00 H new ATOM 0 HD23 LEU A 113 5.131 7.748 -0.302 1.00 0.00 H new ATOM 1765 N VAL A 114 9.012 6.617 -1.487 1.00 0.00 N ATOM 1766 CA VAL A 114 10.035 5.737 -2.040 1.00 0.00 C ATOM 1767 C VAL A 114 9.884 5.598 -3.550 1.00 0.00 C ATOM 1768 O VAL A 114 8.901 6.060 -4.131 1.00 0.00 O ATOM 1769 CB VAL A 114 9.979 4.338 -1.398 1.00 0.00 C ATOM 1770 CG1 VAL A 114 10.353 4.410 0.074 1.00 0.00 C ATOM 1771 CG2 VAL A 114 8.597 3.726 -1.576 1.00 0.00 C ATOM 0 H VAL A 114 8.371 6.163 -0.836 1.00 0.00 H new ATOM 0 HA VAL A 114 10.999 6.193 -1.815 1.00 0.00 H new ATOM 0 HB VAL A 114 10.703 3.697 -1.901 1.00 0.00 H new ATOM 0 HG11 VAL A 114 10.308 3.412 0.510 1.00 0.00 H new ATOM 0 HG12 VAL A 114 11.364 4.804 0.174 1.00 0.00 H new ATOM 0 HG13 VAL A 114 9.655 5.066 0.595 1.00 0.00 H new ATOM 0 HG21 VAL A 114 8.575 2.738 -1.117 1.00 0.00 H new ATOM 0 HG22 VAL A 114 7.852 4.364 -1.100 1.00 0.00 H new ATOM 0 HG23 VAL A 114 8.373 3.637 -2.639 1.00 0.00 H new ATOM 1781 N SER A 115 10.862 4.958 -4.182 1.00 0.00 N ATOM 1782 CA SER A 115 10.839 4.761 -5.626 1.00 0.00 C ATOM 1783 C SER A 115 11.818 3.666 -6.041 1.00 0.00 C ATOM 1784 O SER A 115 12.557 3.133 -5.214 1.00 0.00 O ATOM 1785 CB SER A 115 11.183 6.066 -6.346 1.00 0.00 C ATOM 1786 OG SER A 115 10.015 6.821 -6.617 1.00 0.00 O ATOM 0 H SER A 115 11.681 4.567 -3.716 1.00 0.00 H new ATOM 0 HA SER A 115 9.833 4.452 -5.909 1.00 0.00 H new ATOM 0 HB2 SER A 115 11.866 6.654 -5.733 1.00 0.00 H new ATOM 0 HB3 SER A 115 11.702 5.845 -7.279 1.00 0.00 H new ATOM 0 HG SER A 115 9.448 6.844 -5.818 1.00 0.00 H new ATOM 1792 N GLY A 116 11.816 3.335 -7.329 1.00 0.00 N ATOM 1793 CA GLY A 116 12.706 2.306 -7.832 1.00 0.00 C ATOM 1794 C GLY A 116 12.438 0.951 -7.207 1.00 0.00 C ATOM 1795 O GLY A 116 11.939 0.864 -6.084 1.00 0.00 O ATOM 0 H GLY A 116 11.213 3.762 -8.033 1.00 0.00 H new ATOM 0 HA2 GLY A 116 12.596 2.232 -8.914 1.00 0.00 H new ATOM 0 HA3 GLY A 116 13.738 2.595 -7.636 1.00 0.00 H new ATOM 1799 N LYS A 117 12.769 -0.110 -7.934 1.00 0.00 N ATOM 1800 CA LYS A 117 12.561 -1.468 -7.446 1.00 0.00 C ATOM 1801 C LYS A 117 13.314 -1.698 -6.140 1.00 0.00 C ATOM 1802 O LYS A 117 14.380 -1.123 -5.918 1.00 0.00 O ATOM 1803 CB LYS A 117 13.016 -2.485 -8.495 1.00 0.00 C ATOM 1804 CG LYS A 117 12.766 -3.928 -8.092 1.00 0.00 C ATOM 1805 CD LYS A 117 13.218 -4.895 -9.174 1.00 0.00 C ATOM 1806 CE LYS A 117 12.072 -5.267 -10.103 1.00 0.00 C ATOM 1807 NZ LYS A 117 12.562 -5.875 -11.371 1.00 0.00 N ATOM 0 H LYS A 117 13.183 -0.056 -8.865 1.00 0.00 H new ATOM 0 HA LYS A 117 11.495 -1.600 -7.259 1.00 0.00 H new ATOM 0 HB2 LYS A 117 12.498 -2.284 -9.433 1.00 0.00 H new ATOM 0 HB3 LYS A 117 14.081 -2.348 -8.683 1.00 0.00 H new ATOM 0 HG2 LYS A 117 13.296 -4.145 -7.164 1.00 0.00 H new ATOM 0 HG3 LYS A 117 11.704 -4.073 -7.894 1.00 0.00 H new ATOM 0 HD2 LYS A 117 14.025 -4.445 -9.752 1.00 0.00 H new ATOM 0 HD3 LYS A 117 13.621 -5.796 -8.713 1.00 0.00 H new ATOM 0 HE2 LYS A 117 11.407 -5.967 -9.597 1.00 0.00 H new ATOM 0 HE3 LYS A 117 11.485 -4.377 -10.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 11.751 -6.115 -11.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 13.176 -5.197 -11.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 13.101 -6.738 -11.157 1.00 0.00 H new ATOM 1821 N MET A 118 12.755 -2.543 -5.280 1.00 0.00 N ATOM 1822 CA MET A 118 13.376 -2.850 -3.997 1.00 0.00 C ATOM 1823 C MET A 118 12.937 -4.222 -3.494 1.00 0.00 C ATOM 1824 O MET A 118 11.843 -4.688 -3.812 1.00 0.00 O ATOM 1825 CB MET A 118 13.022 -1.778 -2.964 1.00 0.00 C ATOM 1826 CG MET A 118 13.494 -2.109 -1.558 1.00 0.00 C ATOM 1827 SD MET A 118 13.570 -0.658 -0.491 1.00 0.00 S ATOM 1828 CE MET A 118 11.828 -0.311 -0.265 1.00 0.00 C ATOM 0 H MET A 118 11.873 -3.027 -5.448 1.00 0.00 H new ATOM 0 HA MET A 118 14.457 -2.864 -4.140 1.00 0.00 H new ATOM 0 HB2 MET A 118 13.462 -0.829 -3.272 1.00 0.00 H new ATOM 0 HB3 MET A 118 11.941 -1.640 -2.952 1.00 0.00 H new ATOM 0 HG2 MET A 118 12.821 -2.845 -1.117 1.00 0.00 H new ATOM 0 HG3 MET A 118 14.481 -2.570 -1.609 1.00 0.00 H new ATOM 0 HE1 MET A 118 11.705 0.446 0.510 1.00 0.00 H new ATOM 0 HE2 MET A 118 11.406 0.056 -1.200 1.00 0.00 H new ATOM 0 HE3 MET A 118 11.311 -1.223 0.033 1.00 0.00 H new ATOM 1838 N ALA A 119 13.796 -4.863 -2.710 1.00 0.00 N ATOM 1839 CA ALA A 119 13.495 -6.180 -2.162 1.00 0.00 C ATOM 1840 C ALA A 119 13.922 -6.278 -0.702 1.00 0.00 C ATOM 1841 O ALA A 119 15.061 -5.966 -0.354 1.00 0.00 O ATOM 1842 CB ALA A 119 14.177 -7.262 -2.987 1.00 0.00 C ATOM 0 H ALA A 119 14.707 -4.492 -2.440 1.00 0.00 H new ATOM 0 HA ALA A 119 12.416 -6.328 -2.208 1.00 0.00 H new ATOM 0 HB1 ALA A 119 13.944 -8.241 -2.567 1.00 0.00 H new ATOM 0 HB2 ALA A 119 13.820 -7.214 -4.016 1.00 0.00 H new ATOM 0 HB3 ALA A 119 15.256 -7.107 -2.970 1.00 0.00 H new ATOM 1848 N LEU A 120 13.000 -6.713 0.151 1.00 0.00 N ATOM 1849 CA LEU A 120 13.280 -6.852 1.576 1.00 0.00 C ATOM 1850 C LEU A 120 12.647 -8.122 2.134 1.00 0.00 C ATOM 1851 O LEU A 120 11.752 -8.702 1.521 1.00 0.00 O ATOM 1852 CB LEU A 120 12.761 -5.632 2.339 1.00 0.00 C ATOM 1853 CG LEU A 120 11.281 -5.299 2.146 1.00 0.00 C ATOM 1854 CD1 LEU A 120 10.425 -6.092 3.122 1.00 0.00 C ATOM 1855 CD2 LEU A 120 11.043 -3.806 2.316 1.00 0.00 C ATOM 0 H LEU A 120 12.052 -6.975 -0.120 1.00 0.00 H new ATOM 0 HA LEU A 120 14.360 -6.920 1.704 1.00 0.00 H new ATOM 0 HB2 LEU A 120 12.942 -5.790 3.402 1.00 0.00 H new ATOM 0 HB3 LEU A 120 13.350 -4.765 2.041 1.00 0.00 H new ATOM 0 HG LEU A 120 10.994 -5.578 1.132 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.375 -5.843 2.971 1.00 0.00 H new ATOM 0 HD12 LEU A 120 10.573 -7.159 2.952 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.713 -5.844 4.143 1.00 0.00 H new ATOM 0 HD21 LEU A 120 9.984 -3.588 2.175 1.00 0.00 H new ATOM 0 HD22 LEU A 120 11.346 -3.501 3.318 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.628 -3.258 1.577 1.00 0.00 H new ATOM 1867 N ASN A 121 13.117 -8.547 3.302 1.00 0.00 N ATOM 1868 CA ASN A 121 12.596 -9.748 3.944 1.00 0.00 C ATOM 1869 C ASN A 121 11.387 -9.418 4.815 1.00 0.00 C ATOM 1870 O ASN A 121 11.276 -8.314 5.349 1.00 0.00 O ATOM 1871 CB ASN A 121 13.683 -10.412 4.792 1.00 0.00 C ATOM 1872 CG ASN A 121 14.885 -10.829 3.967 1.00 0.00 C ATOM 1873 OD1 ASN A 121 15.628 -9.987 3.462 1.00 0.00 O ATOM 1874 ND2 ASN A 121 15.082 -12.134 3.826 1.00 0.00 N ATOM 0 H ASN A 121 13.858 -8.078 3.823 1.00 0.00 H new ATOM 0 HA ASN A 121 12.282 -10.440 3.163 1.00 0.00 H new ATOM 0 HB2 ASN A 121 14.003 -9.722 5.573 1.00 0.00 H new ATOM 0 HB3 ASN A 121 13.267 -11.287 5.291 1.00 0.00 H new ATOM 0 HD21 ASN A 121 15.875 -12.474 3.282 1.00 0.00 H new ATOM 0 HD22 ASN A 121 14.441 -12.797 4.262 1.00 0.00 H new ATOM 1881 N LEU A 122 10.485 -10.383 4.954 1.00 0.00 N ATOM 1882 CA LEU A 122 9.283 -10.196 5.761 1.00 0.00 C ATOM 1883 C LEU A 122 9.366 -11.000 7.054 1.00 0.00 C ATOM 1884 O LEU A 122 10.077 -12.002 7.130 1.00 0.00 O ATOM 1885 CB LEU A 122 8.043 -10.611 4.968 1.00 0.00 C ATOM 1886 CG LEU A 122 8.063 -10.288 3.473 1.00 0.00 C ATOM 1887 CD1 LEU A 122 7.090 -11.183 2.721 1.00 0.00 C ATOM 1888 CD2 LEU A 122 7.731 -8.821 3.240 1.00 0.00 C ATOM 0 H LEU A 122 10.562 -11.302 4.519 1.00 0.00 H new ATOM 0 HA LEU A 122 9.207 -9.139 6.016 1.00 0.00 H new ATOM 0 HB2 LEU A 122 7.904 -11.686 5.085 1.00 0.00 H new ATOM 0 HB3 LEU A 122 7.173 -10.127 5.412 1.00 0.00 H new ATOM 0 HG LEU A 122 9.067 -10.477 3.093 1.00 0.00 H new ATOM 0 HD11 LEU A 122 7.118 -10.939 1.659 1.00 0.00 H new ATOM 0 HD12 LEU A 122 7.373 -12.226 2.861 1.00 0.00 H new ATOM 0 HD13 LEU A 122 6.081 -11.026 3.103 1.00 0.00 H new ATOM 0 HD21 LEU A 122 7.750 -8.609 2.171 1.00 0.00 H new ATOM 0 HD22 LEU A 122 6.738 -8.605 3.635 1.00 0.00 H new ATOM 0 HD23 LEU A 122 8.467 -8.197 3.747 1.00 0.00 H new ATOM 1900 N TRP A 123 8.633 -10.556 8.068 1.00 0.00 N ATOM 1901 CA TRP A 123 8.622 -11.235 9.359 1.00 0.00 C ATOM 1902 C TRP A 123 7.513 -12.280 9.414 1.00 0.00 C ATOM 1903 O TRP A 123 6.411 -12.079 8.903 1.00 0.00 O ATOM 1904 CB TRP A 123 8.441 -10.222 10.491 1.00 0.00 C ATOM 1905 CG TRP A 123 9.253 -8.976 10.307 1.00 0.00 C ATOM 1906 CD1 TRP A 123 8.936 -7.898 9.531 1.00 0.00 C ATOM 1907 CD2 TRP A 123 10.517 -8.680 10.911 1.00 0.00 C ATOM 1908 NE1 TRP A 123 9.928 -6.950 9.616 1.00 0.00 N ATOM 1909 CE2 TRP A 123 10.908 -7.405 10.457 1.00 0.00 C ATOM 1910 CE3 TRP A 123 11.356 -9.367 11.793 1.00 0.00 C ATOM 1911 CZ2 TRP A 123 12.101 -6.807 10.854 1.00 0.00 C ATOM 1912 CZ3 TRP A 123 12.539 -8.772 12.186 1.00 0.00 C ATOM 1913 CH2 TRP A 123 12.903 -7.503 11.718 1.00 0.00 C ATOM 0 H TRP A 123 8.038 -9.729 8.022 1.00 0.00 H new ATOM 0 HA TRP A 123 9.580 -11.740 9.484 1.00 0.00 H new ATOM 0 HB2 TRP A 123 7.387 -9.953 10.564 1.00 0.00 H new ATOM 0 HB3 TRP A 123 8.716 -10.690 11.436 1.00 0.00 H new ATOM 0 HD1 TRP A 123 8.038 -7.804 8.938 1.00 0.00 H new ATOM 0 HE1 TRP A 123 9.933 -6.053 9.131 1.00 0.00 H new ATOM 0 HE3 TRP A 123 11.084 -10.345 12.161 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 12.384 -5.829 10.493 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 13.195 -9.295 12.866 1.00 0.00 H new ATOM 0 HH2 TRP A 123 13.834 -7.065 12.045 1.00 0.00 H new ATOM 1924 N PRO A 124 7.808 -13.425 10.048 1.00 0.00 N ATOM 1925 CA PRO A 124 6.848 -14.524 10.185 1.00 0.00 C ATOM 1926 C PRO A 124 5.704 -14.180 11.133 1.00 0.00 C ATOM 1927 O PRO A 124 5.922 -13.619 12.207 1.00 0.00 O ATOM 1928 CB PRO A 124 7.694 -15.664 10.759 1.00 0.00 C ATOM 1929 CG PRO A 124 8.817 -14.985 11.465 1.00 0.00 C ATOM 1930 CD PRO A 124 9.102 -13.734 10.680 1.00 0.00 C ATOM 0 HA PRO A 124 6.368 -14.766 9.237 1.00 0.00 H new ATOM 0 HB2 PRO A 124 7.113 -16.282 11.443 1.00 0.00 H new ATOM 0 HB3 PRO A 124 8.062 -16.320 9.970 1.00 0.00 H new ATOM 0 HG2 PRO A 124 8.545 -14.747 12.493 1.00 0.00 H new ATOM 0 HG3 PRO A 124 9.696 -15.628 11.508 1.00 0.00 H new ATOM 0 HD2 PRO A 124 9.438 -12.922 11.325 1.00 0.00 H new ATOM 0 HD3 PRO A 124 9.884 -13.895 9.937 1.00 0.00 H new ATOM 1938 N VAL A 125 4.485 -14.521 10.729 1.00 0.00 N ATOM 1939 CA VAL A 125 3.306 -14.249 11.543 1.00 0.00 C ATOM 1940 C VAL A 125 3.215 -15.216 12.718 1.00 0.00 C ATOM 1941 O VAL A 125 3.445 -16.418 12.584 1.00 0.00 O ATOM 1942 CB VAL A 125 2.014 -14.347 10.711 1.00 0.00 C ATOM 1943 CG1 VAL A 125 2.170 -13.604 9.392 1.00 0.00 C ATOM 1944 CG2 VAL A 125 1.644 -15.803 10.471 1.00 0.00 C ATOM 0 H VAL A 125 4.288 -14.986 9.843 1.00 0.00 H new ATOM 0 HA VAL A 125 3.410 -13.232 11.920 1.00 0.00 H new ATOM 0 HB VAL A 125 1.205 -13.878 11.272 1.00 0.00 H new ATOM 0 HG11 VAL A 125 1.247 -13.684 8.818 1.00 0.00 H new ATOM 0 HG12 VAL A 125 2.384 -12.554 9.589 1.00 0.00 H new ATOM 0 HG13 VAL A 125 2.991 -14.041 8.823 1.00 0.00 H new ATOM 0 HG21 VAL A 125 0.729 -15.853 9.882 1.00 0.00 H new ATOM 0 HG22 VAL A 125 2.451 -16.299 9.932 1.00 0.00 H new ATOM 0 HG23 VAL A 125 1.487 -16.301 11.428 1.00 0.00 H new ATOM 1954 N PRO A 126 2.872 -14.681 13.899 1.00 0.00 N ATOM 1955 CA PRO A 126 2.741 -15.479 15.122 1.00 0.00 C ATOM 1956 C PRO A 126 1.533 -16.410 15.081 1.00 0.00 C ATOM 1957 O PRO A 126 0.597 -16.194 14.311 1.00 0.00 O ATOM 1958 CB PRO A 126 2.567 -14.425 16.217 1.00 0.00 C ATOM 1959 CG PRO A 126 1.995 -13.241 15.516 1.00 0.00 C ATOM 1960 CD PRO A 126 2.583 -13.256 14.132 1.00 0.00 C ATOM 0 HA PRO A 126 3.599 -16.134 15.275 1.00 0.00 H new ATOM 0 HB2 PRO A 126 1.901 -14.778 17.004 1.00 0.00 H new ATOM 0 HB3 PRO A 126 3.519 -14.184 16.689 1.00 0.00 H new ATOM 0 HG2 PRO A 126 0.907 -13.297 15.479 1.00 0.00 H new ATOM 0 HG3 PRO A 126 2.249 -12.318 16.038 1.00 0.00 H new ATOM 0 HD2 PRO A 126 1.884 -12.862 13.394 1.00 0.00 H new ATOM 0 HD3 PRO A 126 3.486 -12.648 14.072 1.00 0.00 H new ATOM 1968 N HIS A 127 1.561 -17.444 15.915 1.00 0.00 N ATOM 1969 CA HIS A 127 0.466 -18.407 15.974 1.00 0.00 C ATOM 1970 C HIS A 127 -0.848 -17.715 16.322 1.00 0.00 C ATOM 1971 O HIS A 127 -1.833 -17.829 15.594 1.00 0.00 O ATOM 1972 CB HIS A 127 0.772 -19.495 17.004 1.00 0.00 C ATOM 1973 CG HIS A 127 1.741 -20.527 16.515 1.00 0.00 C ATOM 1974 ND1 HIS A 127 3.022 -20.651 17.011 1.00 0.00 N ATOM 1975 CD2 HIS A 127 1.610 -21.488 15.571 1.00 0.00 C ATOM 1976 CE1 HIS A 127 3.638 -21.642 16.391 1.00 0.00 C ATOM 1977 NE2 HIS A 127 2.802 -22.167 15.513 1.00 0.00 N ATOM 0 H HIS A 127 2.328 -17.637 16.559 1.00 0.00 H new ATOM 0 HA HIS A 127 0.364 -18.866 14.991 1.00 0.00 H new ATOM 0 HB2 HIS A 127 1.173 -19.029 17.904 1.00 0.00 H new ATOM 0 HB3 HIS A 127 -0.158 -19.987 17.288 1.00 0.00 H new ATOM 0 HD2 HIS A 127 0.731 -21.684 14.974 1.00 0.00 H new ATOM 0 HE1 HIS A 127 4.652 -21.967 16.571 1.00 0.00 H new ATOM 0 HE2 HIS A 127 3.009 -22.950 14.893 1.00 0.00 H new ATOM 1986 N GLY A 128 -0.855 -16.998 17.442 1.00 0.00 N ATOM 1987 CA GLY A 128 -2.054 -16.299 17.867 1.00 0.00 C ATOM 1988 C GLY A 128 -2.738 -15.572 16.726 1.00 0.00 C ATOM 1989 O GLY A 128 -3.867 -15.899 16.360 1.00 0.00 O ATOM 0 H GLY A 128 -0.052 -16.889 18.062 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -2.750 -17.013 18.308 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -1.796 -15.583 18.647 1.00 0.00 H new ATOM 1993 N LEU A 129 -2.053 -14.583 16.162 1.00 0.00 N ATOM 1994 CA LEU A 129 -2.602 -13.806 15.056 1.00 0.00 C ATOM 1995 C LEU A 129 -3.488 -14.674 14.168 1.00 0.00 C ATOM 1996 O LEU A 129 -3.067 -15.730 13.697 1.00 0.00 O ATOM 1997 CB LEU A 129 -1.472 -13.195 14.226 1.00 0.00 C ATOM 1998 CG LEU A 129 -1.899 -12.403 12.990 1.00 0.00 C ATOM 1999 CD1 LEU A 129 -2.544 -11.087 13.396 1.00 0.00 C ATOM 2000 CD2 LEU A 129 -0.708 -12.155 12.077 1.00 0.00 C ATOM 0 H LEU A 129 -1.117 -14.300 16.452 1.00 0.00 H new ATOM 0 HA LEU A 129 -3.212 -13.005 15.474 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -0.889 -12.537 14.871 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -0.808 -13.998 13.907 1.00 0.00 H new ATOM 0 HG LEU A 129 -2.635 -12.991 12.442 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -2.841 -10.537 12.503 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -3.423 -11.286 14.009 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -1.831 -10.493 13.967 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -1.031 -11.590 11.203 1.00 0.00 H new ATOM 0 HD22 LEU A 129 0.051 -11.588 12.615 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -0.289 -13.109 11.758 1.00 0.00 H new ATOM 2012 N GLU A 130 -4.717 -14.220 13.943 1.00 0.00 N ATOM 2013 CA GLU A 130 -5.662 -14.955 13.111 1.00 0.00 C ATOM 2014 C GLU A 130 -5.891 -14.237 11.784 1.00 0.00 C ATOM 2015 O GLU A 130 -6.051 -14.872 10.741 1.00 0.00 O ATOM 2016 CB GLU A 130 -6.993 -15.131 13.844 1.00 0.00 C ATOM 2017 CG GLU A 130 -7.648 -13.818 14.241 1.00 0.00 C ATOM 2018 CD GLU A 130 -8.843 -14.015 15.154 1.00 0.00 C ATOM 2019 OE1 GLU A 130 -9.764 -14.766 14.771 1.00 0.00 O ATOM 2020 OE2 GLU A 130 -8.857 -13.417 16.250 1.00 0.00 O ATOM 0 H GLU A 130 -5.081 -13.347 14.325 1.00 0.00 H new ATOM 0 HA GLU A 130 -5.237 -15.937 12.905 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -7.678 -15.691 13.207 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -6.829 -15.731 14.739 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -6.914 -13.186 14.741 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -7.965 -13.288 13.343 1.00 0.00 H new ATOM 2027 N ASP A 131 -5.907 -12.909 11.832 1.00 0.00 N ATOM 2028 CA ASP A 131 -6.116 -12.104 10.634 1.00 0.00 C ATOM 2029 C ASP A 131 -5.126 -12.489 9.540 1.00 0.00 C ATOM 2030 O ASP A 131 -4.343 -13.427 9.698 1.00 0.00 O ATOM 2031 CB ASP A 131 -5.977 -10.617 10.964 1.00 0.00 C ATOM 2032 CG ASP A 131 -7.295 -9.989 11.373 1.00 0.00 C ATOM 2033 OD1 ASP A 131 -7.704 -10.174 12.538 1.00 0.00 O ATOM 2034 OD2 ASP A 131 -7.916 -9.311 10.528 1.00 0.00 O ATOM 0 H ASP A 131 -5.778 -12.368 12.687 1.00 0.00 H new ATOM 0 HA ASP A 131 -7.125 -12.296 10.269 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -5.253 -10.493 11.769 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -5.581 -10.091 10.096 1.00 0.00 H new ATOM 2039 N LEU A 132 -5.166 -11.761 8.429 1.00 0.00 N ATOM 2040 CA LEU A 132 -4.273 -12.028 7.307 1.00 0.00 C ATOM 2041 C LEU A 132 -3.164 -10.983 7.234 1.00 0.00 C ATOM 2042 O LEU A 132 -1.981 -11.321 7.165 1.00 0.00 O ATOM 2043 CB LEU A 132 -5.060 -12.045 5.996 1.00 0.00 C ATOM 2044 CG LEU A 132 -6.346 -12.872 5.996 1.00 0.00 C ATOM 2045 CD1 LEU A 132 -7.244 -12.463 4.838 1.00 0.00 C ATOM 2046 CD2 LEU A 132 -6.025 -14.358 5.925 1.00 0.00 C ATOM 0 H LEU A 132 -5.807 -10.982 8.281 1.00 0.00 H new ATOM 0 HA LEU A 132 -3.817 -13.006 7.462 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -5.312 -11.018 5.734 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -4.408 -12.424 5.209 1.00 0.00 H new ATOM 0 HG LEU A 132 -6.878 -12.680 6.927 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -8.154 -13.062 4.854 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -7.502 -11.408 4.933 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -6.720 -12.625 3.896 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -6.952 -14.931 5.926 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -5.470 -14.567 5.010 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -5.422 -14.642 6.788 1.00 0.00 H new ATOM 2058 N LEU A 133 -3.553 -9.713 7.251 1.00 0.00 N ATOM 2059 CA LEU A 133 -2.591 -8.618 7.189 1.00 0.00 C ATOM 2060 C LEU A 133 -2.286 -8.082 8.584 1.00 0.00 C ATOM 2061 O LEU A 133 -3.155 -8.057 9.454 1.00 0.00 O ATOM 2062 CB LEU A 133 -3.128 -7.491 6.304 1.00 0.00 C ATOM 2063 CG LEU A 133 -2.091 -6.497 5.780 1.00 0.00 C ATOM 2064 CD1 LEU A 133 -1.345 -7.080 4.590 1.00 0.00 C ATOM 2065 CD2 LEU A 133 -2.756 -5.182 5.403 1.00 0.00 C ATOM 0 H LEU A 133 -4.527 -9.416 7.307 1.00 0.00 H new ATOM 0 HA LEU A 133 -1.667 -9.003 6.757 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -3.637 -7.938 5.450 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -3.878 -6.938 6.869 1.00 0.00 H new ATOM 0 HG LEU A 133 -1.370 -6.302 6.574 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -0.611 -6.358 4.231 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -0.836 -7.995 4.893 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -2.052 -7.306 3.792 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -2.003 -4.487 5.032 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -3.500 -5.360 4.626 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -3.243 -4.756 6.280 1.00 0.00 H new ATOM 2077 N ASN A 134 -1.045 -7.652 8.789 1.00 0.00 N ATOM 2078 CA ASN A 134 -0.624 -7.115 10.078 1.00 0.00 C ATOM 2079 C ASN A 134 -0.276 -5.634 9.962 1.00 0.00 C ATOM 2080 O ASN A 134 0.851 -5.259 9.640 1.00 0.00 O ATOM 2081 CB ASN A 134 0.580 -7.893 10.610 1.00 0.00 C ATOM 2082 CG ASN A 134 1.041 -7.390 11.964 1.00 0.00 C ATOM 2083 OD1 ASN A 134 0.454 -6.467 12.529 1.00 0.00 O ATOM 2084 ND2 ASN A 134 2.098 -7.997 12.492 1.00 0.00 N ATOM 0 H ASN A 134 -0.313 -7.665 8.079 1.00 0.00 H new ATOM 0 HA ASN A 134 -1.454 -7.222 10.777 1.00 0.00 H new ATOM 0 HB2 ASN A 134 0.322 -8.949 10.687 1.00 0.00 H new ATOM 0 HB3 ASN A 134 1.402 -7.817 9.898 1.00 0.00 H new ATOM 0 HD21 ASN A 134 2.454 -7.702 13.401 1.00 0.00 H new ATOM 0 HD22 ASN A 134 2.554 -8.758 11.988 1.00 0.00 H new ATOM 2091 N PRO A 135 -1.267 -4.771 10.232 1.00 0.00 N ATOM 2092 CA PRO A 135 -1.090 -3.317 10.166 1.00 0.00 C ATOM 2093 C PRO A 135 -0.195 -2.791 11.284 1.00 0.00 C ATOM 2094 O PRO A 135 0.614 -1.888 11.070 1.00 0.00 O ATOM 2095 CB PRO A 135 -2.514 -2.779 10.324 1.00 0.00 C ATOM 2096 CG PRO A 135 -3.242 -3.845 11.067 1.00 0.00 C ATOM 2097 CD PRO A 135 -2.636 -5.147 10.622 1.00 0.00 C ATOM 0 HA PRO A 135 -0.603 -3.007 9.242 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -2.523 -1.837 10.873 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -2.974 -2.587 9.355 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -3.135 -3.713 12.144 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -4.309 -3.815 10.846 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -2.637 -5.885 11.424 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -3.186 -5.582 9.788 1.00 0.00 H new ATOM 2105 N ILE A 136 -0.346 -3.362 12.474 1.00 0.00 N ATOM 2106 CA ILE A 136 0.450 -2.950 13.624 1.00 0.00 C ATOM 2107 C ILE A 136 1.889 -3.437 13.498 1.00 0.00 C ATOM 2108 O ILE A 136 2.793 -2.908 14.144 1.00 0.00 O ATOM 2109 CB ILE A 136 -0.147 -3.482 14.941 1.00 0.00 C ATOM 2110 CG1 ILE A 136 -1.648 -3.189 15.000 1.00 0.00 C ATOM 2111 CG2 ILE A 136 0.567 -2.863 16.133 1.00 0.00 C ATOM 2112 CD1 ILE A 136 -2.362 -3.919 16.117 1.00 0.00 C ATOM 0 H ILE A 136 -1.011 -4.111 12.667 1.00 0.00 H new ATOM 0 HA ILE A 136 0.438 -1.860 13.643 1.00 0.00 H new ATOM 0 HB ILE A 136 -0.005 -4.562 14.978 1.00 0.00 H new ATOM 0 HG12 ILE A 136 -1.796 -2.116 15.125 1.00 0.00 H new ATOM 0 HG13 ILE A 136 -2.102 -3.465 14.048 1.00 0.00 H new ATOM 0 HG21 ILE A 136 0.134 -3.248 17.056 1.00 0.00 H new ATOM 0 HG22 ILE A 136 1.626 -3.117 16.095 1.00 0.00 H new ATOM 0 HG23 ILE A 136 0.453 -1.779 16.103 1.00 0.00 H new ATOM 0 HD11 ILE A 136 -3.422 -3.664 16.099 1.00 0.00 H new ATOM 0 HD12 ILE A 136 -2.245 -4.994 15.982 1.00 0.00 H new ATOM 0 HD13 ILE A 136 -1.934 -3.625 17.076 1.00 0.00 H new ATOM 2124 N GLY A 137 2.095 -4.449 12.661 1.00 0.00 N ATOM 2125 CA GLY A 137 3.428 -4.990 12.464 1.00 0.00 C ATOM 2126 C GLY A 137 4.471 -3.907 12.276 1.00 0.00 C ATOM 2127 O GLY A 137 4.178 -2.839 11.738 1.00 0.00 O ATOM 0 H GLY A 137 1.363 -4.904 12.116 1.00 0.00 H new ATOM 0 HA2 GLY A 137 3.698 -5.605 13.323 1.00 0.00 H new ATOM 0 HA3 GLY A 137 3.426 -5.644 11.592 1.00 0.00 H new ATOM 2131 N VAL A 138 5.693 -4.180 12.723 1.00 0.00 N ATOM 2132 CA VAL A 138 6.783 -3.220 12.602 1.00 0.00 C ATOM 2133 C VAL A 138 7.088 -2.916 11.140 1.00 0.00 C ATOM 2134 O VAL A 138 6.472 -3.479 10.235 1.00 0.00 O ATOM 2135 CB VAL A 138 8.064 -3.736 13.286 1.00 0.00 C ATOM 2136 CG1 VAL A 138 7.752 -4.258 14.680 1.00 0.00 C ATOM 2137 CG2 VAL A 138 8.721 -4.816 12.439 1.00 0.00 C ATOM 0 H VAL A 138 5.952 -5.058 13.172 1.00 0.00 H new ATOM 0 HA VAL A 138 6.457 -2.307 13.099 1.00 0.00 H new ATOM 0 HB VAL A 138 8.763 -2.905 13.383 1.00 0.00 H new ATOM 0 HG11 VAL A 138 8.669 -4.618 15.147 1.00 0.00 H new ATOM 0 HG12 VAL A 138 7.329 -3.455 15.283 1.00 0.00 H new ATOM 0 HG13 VAL A 138 7.035 -5.076 14.610 1.00 0.00 H new ATOM 0 HG21 VAL A 138 9.624 -5.169 12.937 1.00 0.00 H new ATOM 0 HG22 VAL A 138 8.029 -5.648 12.309 1.00 0.00 H new ATOM 0 HG23 VAL A 138 8.981 -4.405 11.463 1.00 0.00 H new ATOM 2147 N THR A 139 8.045 -2.021 10.914 1.00 0.00 N ATOM 2148 CA THR A 139 8.432 -1.640 9.562 1.00 0.00 C ATOM 2149 C THR A 139 9.923 -1.863 9.333 1.00 0.00 C ATOM 2150 O THR A 139 10.706 -1.910 10.281 1.00 0.00 O ATOM 2151 CB THR A 139 8.095 -0.165 9.275 1.00 0.00 C ATOM 2152 OG1 THR A 139 8.802 0.685 10.185 1.00 0.00 O ATOM 2153 CG2 THR A 139 6.599 0.083 9.400 1.00 0.00 C ATOM 0 H THR A 139 8.566 -1.546 11.651 1.00 0.00 H new ATOM 0 HA THR A 139 7.864 -2.274 8.881 1.00 0.00 H new ATOM 0 HB THR A 139 8.401 0.062 8.254 1.00 0.00 H new ATOM 0 HG1 THR A 139 8.966 1.553 9.761 1.00 0.00 H new ATOM 0 HG21 THR A 139 6.385 1.132 9.193 1.00 0.00 H new ATOM 0 HG22 THR A 139 6.065 -0.544 8.686 1.00 0.00 H new ATOM 0 HG23 THR A 139 6.273 -0.161 10.411 1.00 0.00 H new ATOM 2161 N GLY A 140 10.309 -1.999 8.068 1.00 0.00 N ATOM 2162 CA GLY A 140 11.706 -2.215 7.738 1.00 0.00 C ATOM 2163 C GLY A 140 11.965 -3.607 7.197 1.00 0.00 C ATOM 2164 O GLY A 140 11.086 -4.467 7.230 1.00 0.00 O ATOM 0 H GLY A 140 9.680 -1.963 7.266 1.00 0.00 H new ATOM 0 HA2 GLY A 140 12.020 -1.477 7.000 1.00 0.00 H new ATOM 0 HA3 GLY A 140 12.315 -2.055 8.628 1.00 0.00 H new ATOM 2168 N SER A 141 13.176 -3.829 6.696 1.00 0.00 N ATOM 2169 CA SER A 141 13.548 -5.125 6.140 1.00 0.00 C ATOM 2170 C SER A 141 14.004 -6.078 7.241 1.00 0.00 C ATOM 2171 O SER A 141 14.860 -5.737 8.056 1.00 0.00 O ATOM 2172 CB SER A 141 14.658 -4.958 5.101 1.00 0.00 C ATOM 2173 OG SER A 141 15.767 -4.263 5.646 1.00 0.00 O ATOM 0 H SER A 141 13.916 -3.128 6.664 1.00 0.00 H new ATOM 0 HA SER A 141 12.669 -5.551 5.656 1.00 0.00 H new ATOM 0 HB2 SER A 141 14.978 -5.937 4.745 1.00 0.00 H new ATOM 0 HB3 SER A 141 14.273 -4.415 4.237 1.00 0.00 H new ATOM 0 HG SER A 141 15.899 -4.537 6.578 1.00 0.00 H new ATOM 2179 N ASN A 142 13.425 -7.274 7.257 1.00 0.00 N ATOM 2180 CA ASN A 142 13.771 -8.277 8.257 1.00 0.00 C ATOM 2181 C ASN A 142 15.215 -8.738 8.088 1.00 0.00 C ATOM 2182 O ASN A 142 15.668 -9.054 6.988 1.00 0.00 O ATOM 2183 CB ASN A 142 12.826 -9.476 8.155 1.00 0.00 C ATOM 2184 CG ASN A 142 13.303 -10.659 8.975 1.00 0.00 C ATOM 2185 OD1 ASN A 142 14.462 -11.064 8.886 1.00 0.00 O ATOM 2186 ND2 ASN A 142 12.407 -11.221 9.779 1.00 0.00 N ATOM 0 H ASN A 142 12.714 -7.572 6.589 1.00 0.00 H new ATOM 0 HA ASN A 142 13.666 -7.823 9.242 1.00 0.00 H new ATOM 0 HB2 ASN A 142 11.832 -9.181 8.491 1.00 0.00 H new ATOM 0 HB3 ASN A 142 12.734 -9.775 7.111 1.00 0.00 H new ATOM 0 HD21 ASN A 142 12.669 -12.021 10.354 1.00 0.00 H new ATOM 0 HD22 ASN A 142 11.457 -10.852 9.821 1.00 0.00 H new ATOM 2193 N PRO A 143 15.958 -8.779 9.205 1.00 0.00 N ATOM 2194 CA PRO A 143 17.362 -9.201 9.207 1.00 0.00 C ATOM 2195 C PRO A 143 17.519 -10.692 8.931 1.00 0.00 C ATOM 2196 O PRO A 143 18.294 -11.094 8.064 1.00 0.00 O ATOM 2197 CB PRO A 143 17.830 -8.867 10.626 1.00 0.00 C ATOM 2198 CG PRO A 143 16.590 -8.895 11.450 1.00 0.00 C ATOM 2199 CD PRO A 143 15.484 -8.416 10.551 1.00 0.00 C ATOM 0 HA PRO A 143 17.938 -8.706 8.426 1.00 0.00 H new ATOM 0 HB2 PRO A 143 18.559 -9.594 10.984 1.00 0.00 H new ATOM 0 HB3 PRO A 143 18.309 -7.889 10.665 1.00 0.00 H new ATOM 0 HG2 PRO A 143 16.387 -9.902 11.816 1.00 0.00 H new ATOM 0 HG3 PRO A 143 16.688 -8.252 12.325 1.00 0.00 H new ATOM 0 HD2 PRO A 143 14.536 -8.899 10.787 1.00 0.00 H new ATOM 0 HD3 PRO A 143 15.326 -7.342 10.645 1.00 0.00 H new ATOM 2207 N ASN A 144 16.778 -11.508 9.674 1.00 0.00 N ATOM 2208 CA ASN A 144 16.836 -12.956 9.509 1.00 0.00 C ATOM 2209 C ASN A 144 16.952 -13.331 8.034 1.00 0.00 C ATOM 2210 O ASN A 144 16.256 -12.775 7.184 1.00 0.00 O ATOM 2211 CB ASN A 144 15.593 -13.610 10.117 1.00 0.00 C ATOM 2212 CG ASN A 144 15.587 -13.542 11.632 1.00 0.00 C ATOM 2213 OD1 ASN A 144 16.369 -14.220 12.298 1.00 0.00 O ATOM 2214 ND2 ASN A 144 14.701 -12.720 12.183 1.00 0.00 N ATOM 0 H ASN A 144 16.131 -11.191 10.396 1.00 0.00 H new ATOM 0 HA ASN A 144 17.722 -13.321 10.029 1.00 0.00 H new ATOM 0 HB2 ASN A 144 14.701 -13.118 9.730 1.00 0.00 H new ATOM 0 HB3 ASN A 144 15.544 -14.652 9.803 1.00 0.00 H new ATOM 0 HD21 ASN A 144 14.650 -12.632 13.198 1.00 0.00 H new ATOM 0 HD22 ASN A 144 14.072 -12.177 11.591 1.00 0.00 H new ATOM 2221 N LYS A 145 17.835 -14.279 7.738 1.00 0.00 N ATOM 2222 CA LYS A 145 18.042 -14.731 6.368 1.00 0.00 C ATOM 2223 C LYS A 145 17.098 -15.880 6.025 1.00 0.00 C ATOM 2224 O LYS A 145 16.761 -16.091 4.861 1.00 0.00 O ATOM 2225 CB LYS A 145 19.493 -15.173 6.169 1.00 0.00 C ATOM 2226 CG LYS A 145 20.511 -14.123 6.580 1.00 0.00 C ATOM 2227 CD LYS A 145 20.451 -12.904 5.676 1.00 0.00 C ATOM 2228 CE LYS A 145 21.194 -11.723 6.282 1.00 0.00 C ATOM 2229 NZ LYS A 145 22.615 -12.057 6.580 1.00 0.00 N ATOM 0 H LYS A 145 18.419 -14.749 8.430 1.00 0.00 H new ATOM 0 HA LYS A 145 17.828 -13.896 5.700 1.00 0.00 H new ATOM 0 HB2 LYS A 145 19.669 -16.082 6.744 1.00 0.00 H new ATOM 0 HB3 LYS A 145 19.647 -15.425 5.120 1.00 0.00 H new ATOM 0 HG2 LYS A 145 20.328 -13.822 7.611 1.00 0.00 H new ATOM 0 HG3 LYS A 145 21.512 -14.553 6.547 1.00 0.00 H new ATOM 0 HD2 LYS A 145 20.883 -13.148 4.706 1.00 0.00 H new ATOM 0 HD3 LYS A 145 19.411 -12.630 5.502 1.00 0.00 H new ATOM 0 HE2 LYS A 145 21.156 -10.878 5.594 1.00 0.00 H new ATOM 0 HE3 LYS A 145 20.694 -11.411 7.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 23.130 -11.189 6.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 22.655 -12.725 7.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 23.053 -12.490 5.742 1.00 0.00 H new ATOM 2243 N GLU A 146 16.675 -16.617 7.048 1.00 0.00 N ATOM 2244 CA GLU A 146 15.769 -17.743 6.853 1.00 0.00 C ATOM 2245 C GLU A 146 14.317 -17.275 6.827 1.00 0.00 C ATOM 2246 O GLU A 146 13.435 -17.916 7.401 1.00 0.00 O ATOM 2247 CB GLU A 146 15.963 -18.779 7.962 1.00 0.00 C ATOM 2248 CG GLU A 146 15.780 -18.216 9.361 1.00 0.00 C ATOM 2249 CD GLU A 146 15.275 -19.252 10.346 1.00 0.00 C ATOM 2250 OE1 GLU A 146 14.521 -20.154 9.925 1.00 0.00 O ATOM 2251 OE2 GLU A 146 15.636 -19.161 11.538 1.00 0.00 O ATOM 0 H GLU A 146 16.945 -16.455 8.018 1.00 0.00 H new ATOM 0 HA GLU A 146 16.002 -18.202 5.892 1.00 0.00 H new ATOM 0 HB2 GLU A 146 15.256 -19.595 7.813 1.00 0.00 H new ATOM 0 HB3 GLU A 146 16.963 -19.205 7.879 1.00 0.00 H new ATOM 0 HG2 GLU A 146 16.730 -17.817 9.715 1.00 0.00 H new ATOM 0 HG3 GLU A 146 15.078 -17.383 9.324 1.00 0.00 H new ATOM 2258 N THR A 147 14.075 -16.152 6.158 1.00 0.00 N ATOM 2259 CA THR A 147 12.731 -15.597 6.058 1.00 0.00 C ATOM 2260 C THR A 147 12.372 -15.283 4.610 1.00 0.00 C ATOM 2261 O THR A 147 13.236 -15.016 3.775 1.00 0.00 O ATOM 2262 CB THR A 147 12.590 -14.314 6.899 1.00 0.00 C ATOM 2263 OG1 THR A 147 13.748 -13.489 6.733 1.00 0.00 O ATOM 2264 CG2 THR A 147 12.408 -14.650 8.372 1.00 0.00 C ATOM 0 H THR A 147 14.792 -15.609 5.677 1.00 0.00 H new ATOM 0 HA THR A 147 12.047 -16.353 6.443 1.00 0.00 H new ATOM 0 HB THR A 147 11.708 -13.775 6.553 1.00 0.00 H new ATOM 0 HG1 THR A 147 14.488 -13.855 7.261 1.00 0.00 H new ATOM 0 HG21 THR A 147 12.311 -13.729 8.946 1.00 0.00 H new ATOM 0 HG22 THR A 147 11.509 -15.253 8.499 1.00 0.00 H new ATOM 0 HG23 THR A 147 13.274 -15.209 8.727 1.00 0.00 H new ATOM 2272 N PRO A 148 11.067 -15.316 4.303 1.00 0.00 N ATOM 2273 CA PRO A 148 10.564 -15.037 2.955 1.00 0.00 C ATOM 2274 C PRO A 148 10.717 -13.569 2.572 1.00 0.00 C ATOM 2275 O PRO A 148 10.448 -12.676 3.376 1.00 0.00 O ATOM 2276 CB PRO A 148 9.083 -15.414 3.044 1.00 0.00 C ATOM 2277 CG PRO A 148 8.739 -15.262 4.485 1.00 0.00 C ATOM 2278 CD PRO A 148 9.982 -15.628 5.248 1.00 0.00 C ATOM 0 HA PRO A 148 11.114 -15.589 2.193 1.00 0.00 H new ATOM 0 HB2 PRO A 148 8.471 -14.763 2.420 1.00 0.00 H new ATOM 0 HB3 PRO A 148 8.913 -16.435 2.702 1.00 0.00 H new ATOM 0 HG2 PRO A 148 8.431 -14.240 4.707 1.00 0.00 H new ATOM 0 HG3 PRO A 148 7.908 -15.912 4.758 1.00 0.00 H new ATOM 0 HD2 PRO A 148 10.073 -15.051 6.169 1.00 0.00 H new ATOM 0 HD3 PRO A 148 9.985 -16.681 5.530 1.00 0.00 H new ATOM 2286 N CYS A 149 11.150 -13.326 1.339 1.00 0.00 N ATOM 2287 CA CYS A 149 11.340 -11.966 0.850 1.00 0.00 C ATOM 2288 C CYS A 149 10.543 -11.732 -0.430 1.00 0.00 C ATOM 2289 O CYS A 149 10.371 -12.643 -1.241 1.00 0.00 O ATOM 2290 CB CYS A 149 12.824 -11.694 0.597 1.00 0.00 C ATOM 2291 SG CYS A 149 13.141 -10.360 -0.580 1.00 0.00 S ATOM 0 H CYS A 149 11.376 -14.053 0.661 1.00 0.00 H new ATOM 0 HA CYS A 149 10.977 -11.278 1.614 1.00 0.00 H new ATOM 0 HB2 CYS A 149 13.304 -11.449 1.545 1.00 0.00 H new ATOM 0 HB3 CYS A 149 13.292 -12.607 0.229 1.00 0.00 H new ATOM 0 HG CYS A 149 12.600 -9.260 -0.146 1.00 0.00 H new ATOM 2297 N LEU A 150 10.058 -10.508 -0.603 1.00 0.00 N ATOM 2298 CA LEU A 150 9.277 -10.155 -1.784 1.00 0.00 C ATOM 2299 C LEU A 150 9.938 -9.015 -2.553 1.00 0.00 C ATOM 2300 O LEU A 150 10.703 -8.234 -1.987 1.00 0.00 O ATOM 2301 CB LEU A 150 7.857 -9.756 -1.379 1.00 0.00 C ATOM 2302 CG LEU A 150 6.822 -10.882 -1.365 1.00 0.00 C ATOM 2303 CD1 LEU A 150 5.659 -10.526 -0.453 1.00 0.00 C ATOM 2304 CD2 LEU A 150 6.328 -11.171 -2.775 1.00 0.00 C ATOM 0 H LEU A 150 10.191 -9.743 0.059 1.00 0.00 H new ATOM 0 HA LEU A 150 9.231 -11.029 -2.434 1.00 0.00 H new ATOM 0 HB2 LEU A 150 7.895 -9.312 -0.384 1.00 0.00 H new ATOM 0 HB3 LEU A 150 7.511 -8.980 -2.061 1.00 0.00 H new ATOM 0 HG LEU A 150 7.298 -11.783 -0.978 1.00 0.00 H new ATOM 0 HD11 LEU A 150 4.933 -11.339 -0.456 1.00 0.00 H new ATOM 0 HD12 LEU A 150 6.026 -10.371 0.561 1.00 0.00 H new ATOM 0 HD13 LEU A 150 5.183 -9.613 -0.810 1.00 0.00 H new ATOM 0 HD21 LEU A 150 5.592 -11.975 -2.745 1.00 0.00 H new ATOM 0 HD22 LEU A 150 5.869 -10.274 -3.191 1.00 0.00 H new ATOM 0 HD23 LEU A 150 7.169 -11.471 -3.401 1.00 0.00 H new ATOM 2316 N GLU A 151 9.635 -8.925 -3.844 1.00 0.00 N ATOM 2317 CA GLU A 151 10.199 -7.879 -4.689 1.00 0.00 C ATOM 2318 C GLU A 151 9.096 -7.035 -5.320 1.00 0.00 C ATOM 2319 O GLU A 151 8.247 -7.548 -6.050 1.00 0.00 O ATOM 2320 CB GLU A 151 11.075 -8.494 -5.783 1.00 0.00 C ATOM 2321 CG GLU A 151 12.042 -7.507 -6.415 1.00 0.00 C ATOM 2322 CD GLU A 151 12.990 -8.167 -7.398 1.00 0.00 C ATOM 2323 OE1 GLU A 151 12.584 -9.159 -8.038 1.00 0.00 O ATOM 2324 OE2 GLU A 151 14.137 -7.691 -7.526 1.00 0.00 O ATOM 0 H GLU A 151 9.003 -9.563 -4.327 1.00 0.00 H new ATOM 0 HA GLU A 151 10.813 -7.233 -4.062 1.00 0.00 H new ATOM 0 HB2 GLU A 151 11.641 -9.324 -5.360 1.00 0.00 H new ATOM 0 HB3 GLU A 151 10.433 -8.909 -6.560 1.00 0.00 H new ATOM 0 HG2 GLU A 151 11.477 -6.728 -6.928 1.00 0.00 H new ATOM 0 HG3 GLU A 151 12.620 -7.018 -5.631 1.00 0.00 H new ATOM 2331 N LEU A 152 9.114 -5.739 -5.032 1.00 0.00 N ATOM 2332 CA LEU A 152 8.115 -4.822 -5.571 1.00 0.00 C ATOM 2333 C LEU A 152 8.780 -3.631 -6.254 1.00 0.00 C ATOM 2334 O LEU A 152 9.965 -3.370 -6.050 1.00 0.00 O ATOM 2335 CB LEU A 152 7.189 -4.332 -4.455 1.00 0.00 C ATOM 2336 CG LEU A 152 7.787 -3.310 -3.488 1.00 0.00 C ATOM 2337 CD1 LEU A 152 9.089 -3.829 -2.899 1.00 0.00 C ATOM 2338 CD2 LEU A 152 8.011 -1.979 -4.191 1.00 0.00 C ATOM 0 H LEU A 152 9.809 -5.299 -4.429 1.00 0.00 H new ATOM 0 HA LEU A 152 7.527 -5.361 -6.314 1.00 0.00 H new ATOM 0 HB2 LEU A 152 6.302 -3.894 -4.912 1.00 0.00 H new ATOM 0 HB3 LEU A 152 6.857 -5.196 -3.880 1.00 0.00 H new ATOM 0 HG LEU A 152 7.081 -3.154 -2.673 1.00 0.00 H new ATOM 0 HD11 LEU A 152 9.499 -3.088 -2.213 1.00 0.00 H new ATOM 0 HD12 LEU A 152 8.900 -4.757 -2.359 1.00 0.00 H new ATOM 0 HD13 LEU A 152 9.803 -4.015 -3.702 1.00 0.00 H new ATOM 0 HD21 LEU A 152 8.437 -1.263 -3.488 1.00 0.00 H new ATOM 0 HD22 LEU A 152 8.697 -2.120 -5.026 1.00 0.00 H new ATOM 0 HD23 LEU A 152 7.059 -1.599 -4.563 1.00 0.00 H new ATOM 2350 N GLU A 153 8.008 -2.913 -7.064 1.00 0.00 N ATOM 2351 CA GLU A 153 8.523 -1.749 -7.776 1.00 0.00 C ATOM 2352 C GLU A 153 7.682 -0.512 -7.477 1.00 0.00 C ATOM 2353 O GLU A 153 6.477 -0.490 -7.732 1.00 0.00 O ATOM 2354 CB GLU A 153 8.545 -2.014 -9.282 1.00 0.00 C ATOM 2355 CG GLU A 153 9.530 -3.094 -9.697 1.00 0.00 C ATOM 2356 CD GLU A 153 9.414 -3.457 -11.165 1.00 0.00 C ATOM 2357 OE1 GLU A 153 8.368 -4.015 -11.557 1.00 0.00 O ATOM 2358 OE2 GLU A 153 10.369 -3.182 -11.921 1.00 0.00 O ATOM 0 H GLU A 153 7.025 -3.117 -7.243 1.00 0.00 H new ATOM 0 HA GLU A 153 9.541 -1.565 -7.432 1.00 0.00 H new ATOM 0 HB2 GLU A 153 7.545 -2.303 -9.606 1.00 0.00 H new ATOM 0 HB3 GLU A 153 8.794 -1.089 -9.801 1.00 0.00 H new ATOM 0 HG2 GLU A 153 10.545 -2.754 -9.490 1.00 0.00 H new ATOM 0 HG3 GLU A 153 9.363 -3.985 -9.092 1.00 0.00 H new ATOM 2365 N PHE A 154 8.324 0.517 -6.934 1.00 0.00 N ATOM 2366 CA PHE A 154 7.636 1.758 -6.599 1.00 0.00 C ATOM 2367 C PHE A 154 7.649 2.723 -7.780 1.00 0.00 C ATOM 2368 O PHE A 154 8.657 3.376 -8.050 1.00 0.00 O ATOM 2369 CB PHE A 154 8.288 2.414 -5.380 1.00 0.00 C ATOM 2370 CG PHE A 154 7.908 1.771 -4.077 1.00 0.00 C ATOM 2371 CD1 PHE A 154 6.600 1.814 -3.624 1.00 0.00 C ATOM 2372 CD2 PHE A 154 8.860 1.125 -3.306 1.00 0.00 C ATOM 2373 CE1 PHE A 154 6.247 1.222 -2.425 1.00 0.00 C ATOM 2374 CE2 PHE A 154 8.514 0.532 -2.107 1.00 0.00 C ATOM 2375 CZ PHE A 154 7.206 0.581 -1.665 1.00 0.00 C ATOM 0 H PHE A 154 9.321 0.516 -6.716 1.00 0.00 H new ATOM 0 HA PHE A 154 6.600 1.518 -6.362 1.00 0.00 H new ATOM 0 HB2 PHE A 154 9.371 2.375 -5.493 1.00 0.00 H new ATOM 0 HB3 PHE A 154 8.008 3.467 -5.351 1.00 0.00 H new ATOM 0 HD1 PHE A 154 5.847 2.316 -4.214 1.00 0.00 H new ATOM 0 HD2 PHE A 154 9.884 1.084 -3.646 1.00 0.00 H new ATOM 0 HE1 PHE A 154 5.223 1.261 -2.083 1.00 0.00 H new ATOM 0 HE2 PHE A 154 9.266 0.030 -1.516 1.00 0.00 H new ATOM 0 HZ PHE A 154 6.934 0.119 -0.727 1.00 0.00 H new ATOM 2385 N ASP A 155 6.523 2.808 -8.480 1.00 0.00 N ATOM 2386 CA ASP A 155 6.404 3.694 -9.632 1.00 0.00 C ATOM 2387 C ASP A 155 5.254 4.678 -9.444 1.00 0.00 C ATOM 2388 O ASP A 155 4.161 4.298 -9.026 1.00 0.00 O ATOM 2389 CB ASP A 155 6.191 2.879 -10.909 1.00 0.00 C ATOM 2390 CG ASP A 155 7.482 2.291 -11.443 1.00 0.00 C ATOM 2391 OD1 ASP A 155 8.289 3.053 -12.014 1.00 0.00 O ATOM 2392 OD2 ASP A 155 7.685 1.068 -11.291 1.00 0.00 O ATOM 0 H ASP A 155 5.680 2.274 -8.270 1.00 0.00 H new ATOM 0 HA ASP A 155 7.331 4.260 -9.722 1.00 0.00 H new ATOM 0 HB2 ASP A 155 5.484 2.074 -10.709 1.00 0.00 H new ATOM 0 HB3 ASP A 155 5.742 3.515 -11.672 1.00 0.00 H new ATOM 2397 N TRP A 156 5.510 5.944 -9.754 1.00 0.00 N ATOM 2398 CA TRP A 156 4.496 6.984 -9.618 1.00 0.00 C ATOM 2399 C TRP A 156 4.229 7.663 -10.957 1.00 0.00 C ATOM 2400 O TRP A 156 4.967 8.559 -11.368 1.00 0.00 O ATOM 2401 CB TRP A 156 4.936 8.022 -8.585 1.00 0.00 C ATOM 2402 CG TRP A 156 5.488 7.415 -7.331 1.00 0.00 C ATOM 2403 CD1 TRP A 156 6.760 6.960 -7.131 1.00 0.00 C ATOM 2404 CD2 TRP A 156 4.784 7.194 -6.104 1.00 0.00 C ATOM 2405 NE1 TRP A 156 6.890 6.471 -5.854 1.00 0.00 N ATOM 2406 CE2 TRP A 156 5.692 6.603 -5.203 1.00 0.00 C ATOM 2407 CE3 TRP A 156 3.476 7.439 -5.677 1.00 0.00 C ATOM 2408 CZ2 TRP A 156 5.331 6.254 -3.904 1.00 0.00 C ATOM 2409 CZ3 TRP A 156 3.119 7.092 -4.388 1.00 0.00 C ATOM 2410 CH2 TRP A 156 4.044 6.506 -3.514 1.00 0.00 C ATOM 0 H TRP A 156 6.410 6.275 -10.101 1.00 0.00 H new ATOM 0 HA TRP A 156 3.573 6.514 -9.280 1.00 0.00 H new ATOM 0 HB2 TRP A 156 5.692 8.669 -9.030 1.00 0.00 H new ATOM 0 HB3 TRP A 156 4.085 8.654 -8.330 1.00 0.00 H new ATOM 0 HD1 TRP A 156 7.548 6.982 -7.869 1.00 0.00 H new ATOM 0 HE1 TRP A 156 7.741 6.074 -5.455 1.00 0.00 H new ATOM 0 HE3 TRP A 156 2.757 7.892 -6.343 1.00 0.00 H new ATOM 0 HZ2 TRP A 156 6.042 5.801 -3.229 1.00 0.00 H new ATOM 0 HZ3 TRP A 156 2.110 7.276 -4.049 1.00 0.00 H new ATOM 0 HH2 TRP A 156 3.735 6.248 -2.512 1.00 0.00 H new ATOM 2421 N PHE A 157 3.170 7.231 -11.634 1.00 0.00 N ATOM 2422 CA PHE A 157 2.807 7.797 -12.928 1.00 0.00 C ATOM 2423 C PHE A 157 2.074 9.124 -12.754 1.00 0.00 C ATOM 2424 O PHE A 157 2.459 10.139 -13.336 1.00 0.00 O ATOM 2425 CB PHE A 157 1.930 6.816 -13.710 1.00 0.00 C ATOM 2426 CG PHE A 157 0.489 6.831 -13.286 1.00 0.00 C ATOM 2427 CD1 PHE A 157 -0.404 7.727 -13.852 1.00 0.00 C ATOM 2428 CD2 PHE A 157 0.028 5.950 -12.322 1.00 0.00 C ATOM 2429 CE1 PHE A 157 -1.730 7.743 -13.464 1.00 0.00 C ATOM 2430 CE2 PHE A 157 -1.298 5.961 -11.930 1.00 0.00 C ATOM 2431 CZ PHE A 157 -2.178 6.858 -12.502 1.00 0.00 C ATOM 0 H PHE A 157 2.548 6.491 -11.308 1.00 0.00 H new ATOM 0 HA PHE A 157 3.725 7.979 -13.488 1.00 0.00 H new ATOM 0 HB2 PHE A 157 1.990 7.054 -14.772 1.00 0.00 H new ATOM 0 HB3 PHE A 157 2.326 5.808 -13.586 1.00 0.00 H new ATOM 0 HD1 PHE A 157 -0.060 8.421 -14.605 1.00 0.00 H new ATOM 0 HD2 PHE A 157 0.712 5.246 -11.871 1.00 0.00 H new ATOM 0 HE1 PHE A 157 -2.416 8.447 -13.912 1.00 0.00 H new ATOM 0 HE2 PHE A 157 -1.645 5.269 -11.177 1.00 0.00 H new ATOM 0 HZ PHE A 157 -3.214 6.868 -12.198 1.00 0.00 H new ATOM 2441 N SER A 158 1.016 9.108 -11.950 1.00 0.00 N ATOM 2442 CA SER A 158 0.226 10.309 -11.702 1.00 0.00 C ATOM 2443 C SER A 158 1.122 11.540 -11.612 1.00 0.00 C ATOM 2444 O SER A 158 1.129 12.382 -12.508 1.00 0.00 O ATOM 2445 CB SER A 158 -0.582 10.156 -10.412 1.00 0.00 C ATOM 2446 OG SER A 158 0.263 9.866 -9.313 1.00 0.00 O ATOM 0 H SER A 158 0.686 8.277 -11.459 1.00 0.00 H new ATOM 0 HA SER A 158 -0.460 10.442 -12.538 1.00 0.00 H new ATOM 0 HB2 SER A 158 -1.137 11.073 -10.216 1.00 0.00 H new ATOM 0 HB3 SER A 158 -1.316 9.359 -10.531 1.00 0.00 H new ATOM 0 HG SER A 158 0.050 8.976 -8.962 1.00 0.00 H new TER 2452 SER A 158