USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 968 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 93 HIS : no HD1:sc= -0.0725 X(o=-0.073,f=0) USER MOD Set 1.2: A 95 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 27 ASN :FLIP amide:sc= -1.19 F(o=-1.3!,f=-0.71) USER MOD Set 2.2: A 76 THR OG1 : rot 5:sc= 0.475 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot -170:sc= -0.0546 USER MOD Single : A 17 TYR OH : rot -151:sc= 1.06 USER MOD Single : A 18 ASN : amide:sc= -0.35 K(o=-0.35,f=-8.5!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 MET CE :methyl -132:sc= -2.59 (180deg=-6.4!) USER MOD Single : A 42 MET CE :methyl 137:sc= -0.429 (180deg=-3.84!) USER MOD Single : A 43 THR OG1 : rot 120:sc= -0.7 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -106:sc= -1.16 (180deg=-3.63!) USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.714 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 HIS : no HD1:sc= -0.334 K(o=-0.33,f=-0.84) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot -101:sc= 0.063 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot 170:sc= -0.0459 USER MOD Single : A 78 THR OG1 : rot 180:sc= -0.95 USER MOD Single : A 80 TYR OH : rot 180:sc=-0.00598 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 GLN : amide:sc= -0.054 K(o=-0.054,f=-1.3!) USER MOD Single : A 88 GLN : amide:sc= -0.0139 X(o=-0.014,f=0) USER MOD Single : A 98 SER OG : rot -164:sc= 1.12 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 7:sc= 0.544 USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 MET CE :methyl -161:sc= -6.23! (180deg=-8.79!) USER MOD Single : A 127 MET CE :methyl -118:sc= -5.94! (180deg=-8.24!) USER MOD Single : A 128 ASN : amide:sc= 0.0993 K(o=0.099,f=-1.6) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 66 N LEU A 8 -13.711 -10.469 4.236 1.00 0.00 N ATOM 67 CA LEU A 8 -13.737 -9.020 4.137 1.00 0.00 C ATOM 68 C LEU A 8 -13.755 -8.614 2.661 1.00 0.00 C ATOM 69 O LEU A 8 -14.823 -8.466 2.068 1.00 0.00 O ATOM 70 CB LEU A 8 -12.579 -8.408 4.928 1.00 0.00 C ATOM 71 CG LEU A 8 -12.727 -8.422 6.451 1.00 0.00 C ATOM 72 CD1 LEU A 8 -14.143 -8.019 6.868 1.00 0.00 C ATOM 73 CD2 LEU A 8 -12.324 -9.779 7.029 1.00 0.00 C ATOM 0 HA LEU A 8 -14.646 -8.624 4.589 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -11.665 -8.941 4.667 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -12.450 -7.375 4.605 1.00 0.00 H new ATOM 0 HG LEU A 8 -12.045 -7.680 6.867 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -14.221 -8.037 7.955 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -14.357 -7.014 6.506 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -14.861 -8.719 6.441 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -12.439 -9.761 8.113 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -12.962 -10.557 6.609 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -11.284 -9.987 6.778 1.00 0.00 H new ATOM 85 N GLY A 9 -12.562 -8.446 2.112 1.00 0.00 N ATOM 86 CA GLY A 9 -12.427 -8.060 0.718 1.00 0.00 C ATOM 87 C GLY A 9 -11.017 -8.353 0.201 1.00 0.00 C ATOM 88 O GLY A 9 -10.255 -9.077 0.841 1.00 0.00 O ATOM 0 H GLY A 9 -11.679 -8.570 2.607 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -13.158 -8.599 0.115 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.645 -6.998 0.609 1.00 0.00 H new ATOM 92 N THR A 10 -10.712 -7.777 -0.952 1.00 0.00 N ATOM 93 CA THR A 10 -9.407 -7.967 -1.562 1.00 0.00 C ATOM 94 C THR A 10 -8.695 -6.623 -1.729 1.00 0.00 C ATOM 95 O THR A 10 -9.322 -5.569 -1.636 1.00 0.00 O ATOM 96 CB THR A 10 -9.606 -8.717 -2.881 1.00 0.00 C ATOM 97 OG1 THR A 10 -10.091 -9.997 -2.483 1.00 0.00 O ATOM 98 CG2 THR A 10 -8.284 -9.023 -3.587 1.00 0.00 C ATOM 0 H THR A 10 -11.346 -7.178 -1.480 1.00 0.00 H new ATOM 0 HA THR A 10 -8.757 -8.567 -0.925 1.00 0.00 H new ATOM 0 HB THR A 10 -10.241 -8.127 -3.541 1.00 0.00 H new ATOM 0 HG1 THR A 10 -10.249 -10.549 -3.278 1.00 0.00 H new ATOM 0 HG21 THR A 10 -8.483 -9.556 -4.517 1.00 0.00 H new ATOM 0 HG22 THR A 10 -7.765 -8.090 -3.807 1.00 0.00 H new ATOM 0 HG23 THR A 10 -7.661 -9.641 -2.941 1.00 0.00 H new ATOM 106 N LEU A 11 -7.395 -6.705 -1.972 1.00 0.00 N ATOM 107 CA LEU A 11 -6.592 -5.508 -2.153 1.00 0.00 C ATOM 108 C LEU A 11 -5.746 -5.653 -3.419 1.00 0.00 C ATOM 109 O LEU A 11 -5.213 -6.727 -3.695 1.00 0.00 O ATOM 110 CB LEU A 11 -5.771 -5.219 -0.894 1.00 0.00 C ATOM 111 CG LEU A 11 -4.449 -4.479 -1.111 1.00 0.00 C ATOM 112 CD1 LEU A 11 -4.694 -3.056 -1.615 1.00 0.00 C ATOM 113 CD2 LEU A 11 -3.595 -4.498 0.159 1.00 0.00 C ATOM 0 H LEU A 11 -6.878 -7.581 -2.048 1.00 0.00 H new ATOM 0 HA LEU A 11 -7.232 -4.637 -2.295 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -6.385 -4.633 -0.210 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -5.557 -6.166 -0.398 1.00 0.00 H new ATOM 0 HG LEU A 11 -3.887 -5.003 -1.885 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -3.739 -2.552 -1.761 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -5.233 -3.093 -2.562 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -5.285 -2.507 -0.882 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -2.661 -3.966 -0.022 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -4.138 -4.013 0.970 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -3.377 -5.530 0.435 1.00 0.00 H new ATOM 125 N PHE A 12 -5.648 -4.556 -4.156 1.00 0.00 N ATOM 126 CA PHE A 12 -4.876 -4.548 -5.387 1.00 0.00 C ATOM 127 C PHE A 12 -3.796 -3.465 -5.350 1.00 0.00 C ATOM 128 O PHE A 12 -4.026 -2.371 -4.835 1.00 0.00 O ATOM 129 CB PHE A 12 -5.851 -4.241 -6.525 1.00 0.00 C ATOM 130 CG PHE A 12 -7.147 -5.052 -6.470 1.00 0.00 C ATOM 131 CD1 PHE A 12 -7.106 -6.407 -6.567 1.00 0.00 C ATOM 132 CD2 PHE A 12 -8.341 -4.416 -6.323 1.00 0.00 C ATOM 133 CE1 PHE A 12 -8.309 -7.160 -6.516 1.00 0.00 C ATOM 134 CE2 PHE A 12 -9.544 -5.169 -6.271 1.00 0.00 C ATOM 135 CZ PHE A 12 -9.503 -6.525 -6.369 1.00 0.00 C ATOM 0 H PHE A 12 -6.090 -3.667 -3.924 1.00 0.00 H new ATOM 0 HA PHE A 12 -4.383 -5.510 -5.523 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -6.098 -3.179 -6.502 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -5.355 -4.432 -7.476 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -6.158 -6.911 -6.683 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -8.374 -3.339 -6.246 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -8.276 -8.237 -6.594 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -10.492 -4.665 -6.154 1.00 0.00 H new ATOM 0 HZ PHE A 12 -10.418 -7.097 -6.330 1.00 0.00 H new ATOM 145 N PHE A 13 -2.641 -3.806 -5.902 1.00 0.00 N ATOM 146 CA PHE A 13 -1.525 -2.876 -5.938 1.00 0.00 C ATOM 147 C PHE A 13 -0.407 -3.396 -6.844 1.00 0.00 C ATOM 148 O PHE A 13 -0.366 -4.582 -7.167 1.00 0.00 O ATOM 149 CB PHE A 13 -0.994 -2.758 -4.508 1.00 0.00 C ATOM 150 CG PHE A 13 -0.523 -4.085 -3.909 1.00 0.00 C ATOM 151 CD1 PHE A 13 -1.427 -5.059 -3.619 1.00 0.00 C ATOM 152 CD2 PHE A 13 0.799 -4.290 -3.665 1.00 0.00 C ATOM 153 CE1 PHE A 13 -0.991 -6.290 -3.062 1.00 0.00 C ATOM 154 CE2 PHE A 13 1.236 -5.522 -3.109 1.00 0.00 C ATOM 155 CZ PHE A 13 0.332 -6.495 -2.819 1.00 0.00 C ATOM 0 H PHE A 13 -2.454 -4.714 -6.328 1.00 0.00 H new ATOM 0 HA PHE A 13 -1.855 -1.914 -6.330 1.00 0.00 H new ATOM 0 HB2 PHE A 13 -0.165 -2.051 -4.496 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -1.777 -2.342 -3.874 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -2.477 -4.896 -3.813 1.00 0.00 H new ATOM 0 HD2 PHE A 13 1.517 -3.516 -3.894 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -1.709 -7.063 -2.831 1.00 0.00 H new ATOM 0 HE2 PHE A 13 2.286 -5.686 -2.917 1.00 0.00 H new ATOM 0 HZ PHE A 13 0.664 -7.431 -2.395 1.00 0.00 H new ATOM 165 N SER A 14 0.472 -2.482 -7.229 1.00 0.00 N ATOM 166 CA SER A 14 1.587 -2.833 -8.092 1.00 0.00 C ATOM 167 C SER A 14 2.884 -2.239 -7.539 1.00 0.00 C ATOM 168 O SER A 14 2.975 -1.031 -7.324 1.00 0.00 O ATOM 169 CB SER A 14 1.350 -2.350 -9.524 1.00 0.00 C ATOM 170 OG SER A 14 1.803 -1.013 -9.718 1.00 0.00 O ATOM 0 H SER A 14 0.434 -1.499 -6.959 1.00 0.00 H new ATOM 0 HA SER A 14 1.673 -3.919 -8.114 1.00 0.00 H new ATOM 0 HB2 SER A 14 1.865 -3.012 -10.220 1.00 0.00 H new ATOM 0 HB3 SER A 14 0.287 -2.410 -9.755 1.00 0.00 H new ATOM 0 HG SER A 14 1.495 -0.686 -10.589 1.00 0.00 H new ATOM 176 N LEU A 15 3.855 -3.114 -7.324 1.00 0.00 N ATOM 177 CA LEU A 15 5.142 -2.691 -6.800 1.00 0.00 C ATOM 178 C LEU A 15 6.054 -2.291 -7.962 1.00 0.00 C ATOM 179 O LEU A 15 6.058 -2.943 -9.005 1.00 0.00 O ATOM 180 CB LEU A 15 5.736 -3.774 -5.897 1.00 0.00 C ATOM 181 CG LEU A 15 4.957 -4.079 -4.616 1.00 0.00 C ATOM 182 CD1 LEU A 15 4.859 -5.588 -4.380 1.00 0.00 C ATOM 183 CD2 LEU A 15 5.567 -3.350 -3.417 1.00 0.00 C ATOM 0 H LEU A 15 3.776 -4.115 -7.503 1.00 0.00 H new ATOM 0 HA LEU A 15 5.025 -1.811 -6.168 1.00 0.00 H new ATOM 0 HB2 LEU A 15 5.822 -4.694 -6.475 1.00 0.00 H new ATOM 0 HB3 LEU A 15 6.747 -3.475 -5.621 1.00 0.00 H new ATOM 0 HG LEU A 15 3.940 -3.705 -4.737 1.00 0.00 H new ATOM 0 HD11 LEU A 15 4.301 -5.777 -3.463 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.346 -6.055 -5.221 1.00 0.00 H new ATOM 0 HD13 LEU A 15 5.861 -6.008 -4.288 1.00 0.00 H new ATOM 0 HD21 LEU A 15 4.995 -3.584 -2.519 1.00 0.00 H new ATOM 0 HD22 LEU A 15 6.600 -3.671 -3.283 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.542 -2.275 -3.594 1.00 0.00 H new ATOM 195 N GLU A 16 6.805 -1.223 -7.742 1.00 0.00 N ATOM 196 CA GLU A 16 7.720 -0.728 -8.758 1.00 0.00 C ATOM 197 C GLU A 16 8.898 -0.004 -8.104 1.00 0.00 C ATOM 198 O GLU A 16 8.712 1.003 -7.422 1.00 0.00 O ATOM 199 CB GLU A 16 6.996 0.185 -9.749 1.00 0.00 C ATOM 200 CG GLU A 16 7.995 0.943 -10.626 1.00 0.00 C ATOM 201 CD GLU A 16 7.602 0.860 -12.102 1.00 0.00 C ATOM 202 OE1 GLU A 16 6.416 1.129 -12.390 1.00 0.00 O ATOM 203 OE2 GLU A 16 8.497 0.531 -12.910 1.00 0.00 O ATOM 0 H GLU A 16 6.799 -0.686 -6.875 1.00 0.00 H new ATOM 0 HA GLU A 16 8.108 -1.580 -9.316 1.00 0.00 H new ATOM 0 HB2 GLU A 16 6.332 -0.408 -10.377 1.00 0.00 H new ATOM 0 HB3 GLU A 16 6.372 0.895 -9.206 1.00 0.00 H new ATOM 0 HG2 GLU A 16 8.038 1.987 -10.316 1.00 0.00 H new ATOM 0 HG3 GLU A 16 8.993 0.528 -10.488 1.00 0.00 H new ATOM 210 N TYR A 17 10.085 -0.545 -8.335 1.00 0.00 N ATOM 211 CA TYR A 17 11.294 0.038 -7.777 1.00 0.00 C ATOM 212 C TYR A 17 12.078 0.803 -8.846 1.00 0.00 C ATOM 213 O TYR A 17 12.306 0.289 -9.940 1.00 0.00 O ATOM 214 CB TYR A 17 12.140 -1.138 -7.285 1.00 0.00 C ATOM 215 CG TYR A 17 13.492 -0.729 -6.697 1.00 0.00 C ATOM 216 CD1 TYR A 17 14.552 -0.448 -7.534 1.00 0.00 C ATOM 217 CD2 TYR A 17 13.651 -0.640 -5.329 1.00 0.00 C ATOM 218 CE1 TYR A 17 15.825 -0.063 -6.981 1.00 0.00 C ATOM 219 CE2 TYR A 17 14.923 -0.255 -4.775 1.00 0.00 C ATOM 220 CZ TYR A 17 15.947 0.015 -5.628 1.00 0.00 C ATOM 221 OH TYR A 17 17.149 0.379 -5.106 1.00 0.00 O ATOM 0 H TYR A 17 10.236 -1.380 -8.901 1.00 0.00 H new ATOM 0 HA TYR A 17 11.049 0.740 -6.980 1.00 0.00 H new ATOM 0 HB2 TYR A 17 11.577 -1.686 -6.529 1.00 0.00 H new ATOM 0 HB3 TYR A 17 12.309 -1.823 -8.116 1.00 0.00 H new ATOM 0 HD1 TYR A 17 14.427 -0.517 -8.605 1.00 0.00 H new ATOM 0 HD2 TYR A 17 12.821 -0.859 -4.674 1.00 0.00 H new ATOM 0 HE1 TYR A 17 16.663 0.159 -7.625 1.00 0.00 H new ATOM 0 HE2 TYR A 17 15.061 -0.182 -3.706 1.00 0.00 H new ATOM 0 HH TYR A 17 17.258 -0.028 -4.221 1.00 0.00 H new ATOM 231 N ASN A 18 12.469 2.018 -8.491 1.00 0.00 N ATOM 232 CA ASN A 18 13.222 2.859 -9.405 1.00 0.00 C ATOM 233 C ASN A 18 14.690 2.425 -9.398 1.00 0.00 C ATOM 234 O ASN A 18 15.334 2.419 -8.350 1.00 0.00 O ATOM 235 CB ASN A 18 13.161 4.327 -8.981 1.00 0.00 C ATOM 236 CG ASN A 18 13.806 5.230 -10.035 1.00 0.00 C ATOM 237 OD1 ASN A 18 14.360 4.776 -11.023 1.00 0.00 O ATOM 238 ND2 ASN A 18 13.704 6.529 -9.770 1.00 0.00 N ATOM 0 H ASN A 18 12.278 2.440 -7.582 1.00 0.00 H new ATOM 0 HA ASN A 18 12.785 2.753 -10.398 1.00 0.00 H new ATOM 0 HB2 ASN A 18 12.123 4.623 -8.830 1.00 0.00 H new ATOM 0 HB3 ASN A 18 13.671 4.455 -8.026 1.00 0.00 H new ATOM 0 HD21 ASN A 18 14.103 7.213 -10.412 1.00 0.00 H new ATOM 0 HD22 ASN A 18 13.227 6.841 -8.924 1.00 0.00 H new ATOM 245 N PHE A 19 15.176 2.074 -10.579 1.00 0.00 N ATOM 246 CA PHE A 19 16.555 1.640 -10.722 1.00 0.00 C ATOM 247 C PHE A 19 17.477 2.828 -11.006 1.00 0.00 C ATOM 248 O PHE A 19 18.634 2.834 -10.590 1.00 0.00 O ATOM 249 CB PHE A 19 16.601 0.679 -11.911 1.00 0.00 C ATOM 250 CG PHE A 19 16.663 -0.798 -11.515 1.00 0.00 C ATOM 251 CD1 PHE A 19 15.632 -1.362 -10.831 1.00 0.00 C ATOM 252 CD2 PHE A 19 17.749 -1.546 -11.847 1.00 0.00 C ATOM 253 CE1 PHE A 19 15.689 -2.733 -10.464 1.00 0.00 C ATOM 254 CE2 PHE A 19 17.807 -2.917 -11.479 1.00 0.00 C ATOM 255 CZ PHE A 19 16.775 -3.481 -10.796 1.00 0.00 C ATOM 0 H PHE A 19 14.639 2.081 -11.446 1.00 0.00 H new ATOM 0 HA PHE A 19 16.892 1.164 -9.801 1.00 0.00 H new ATOM 0 HB2 PHE A 19 15.719 0.842 -12.531 1.00 0.00 H new ATOM 0 HB3 PHE A 19 17.470 0.917 -12.524 1.00 0.00 H new ATOM 0 HD1 PHE A 19 14.770 -0.768 -10.567 1.00 0.00 H new ATOM 0 HD2 PHE A 19 18.568 -1.098 -12.391 1.00 0.00 H new ATOM 0 HE1 PHE A 19 14.870 -3.181 -9.921 1.00 0.00 H new ATOM 0 HE2 PHE A 19 18.670 -3.511 -11.741 1.00 0.00 H new ATOM 0 HZ PHE A 19 16.818 -4.523 -10.517 1.00 0.00 H new ATOM 265 N GLU A 20 16.929 3.805 -11.713 1.00 0.00 N ATOM 266 CA GLU A 20 17.687 4.996 -12.058 1.00 0.00 C ATOM 267 C GLU A 20 18.210 5.677 -10.792 1.00 0.00 C ATOM 268 O GLU A 20 19.369 6.087 -10.737 1.00 0.00 O ATOM 269 CB GLU A 20 16.842 5.962 -12.891 1.00 0.00 C ATOM 270 CG GLU A 20 17.669 7.170 -13.336 1.00 0.00 C ATOM 271 CD GLU A 20 18.072 7.046 -14.807 1.00 0.00 C ATOM 272 OE1 GLU A 20 17.278 6.448 -15.564 1.00 0.00 O ATOM 273 OE2 GLU A 20 19.165 7.553 -15.140 1.00 0.00 O ATOM 0 H GLU A 20 15.969 3.796 -12.057 1.00 0.00 H new ATOM 0 HA GLU A 20 18.541 4.696 -12.665 1.00 0.00 H new ATOM 0 HB2 GLU A 20 16.448 5.445 -13.766 1.00 0.00 H new ATOM 0 HB3 GLU A 20 15.986 6.298 -12.307 1.00 0.00 H new ATOM 0 HG2 GLU A 20 17.093 8.084 -13.189 1.00 0.00 H new ATOM 0 HG3 GLU A 20 18.562 7.252 -12.716 1.00 0.00 H new ATOM 280 N ARG A 21 17.331 5.776 -9.805 1.00 0.00 N ATOM 281 CA ARG A 21 17.691 6.400 -8.543 1.00 0.00 C ATOM 282 C ARG A 21 17.580 5.389 -7.400 1.00 0.00 C ATOM 283 O ARG A 21 17.413 5.771 -6.243 1.00 0.00 O ATOM 284 CB ARG A 21 16.787 7.598 -8.244 1.00 0.00 C ATOM 285 CG ARG A 21 16.590 8.461 -9.492 1.00 0.00 C ATOM 286 CD ARG A 21 15.460 9.472 -9.287 1.00 0.00 C ATOM 287 NE ARG A 21 16.018 10.778 -8.873 1.00 0.00 N ATOM 288 CZ ARG A 21 15.331 11.929 -8.894 1.00 0.00 C ATOM 289 NH1 ARG A 21 14.057 11.942 -9.308 1.00 0.00 N ATOM 290 NH2 ARG A 21 15.919 13.067 -8.500 1.00 0.00 N ATOM 0 H ARG A 21 16.371 5.435 -9.854 1.00 0.00 H new ATOM 0 HA ARG A 21 18.721 6.747 -8.627 1.00 0.00 H new ATOM 0 HB2 ARG A 21 15.820 7.247 -7.884 1.00 0.00 H new ATOM 0 HB3 ARG A 21 17.225 8.199 -7.447 1.00 0.00 H new ATOM 0 HG2 ARG A 21 17.516 8.987 -9.724 1.00 0.00 H new ATOM 0 HG3 ARG A 21 16.362 7.824 -10.347 1.00 0.00 H new ATOM 0 HD2 ARG A 21 14.891 9.586 -10.210 1.00 0.00 H new ATOM 0 HD3 ARG A 21 14.767 9.107 -8.529 1.00 0.00 H new ATOM 0 HE ARG A 21 16.986 10.804 -8.552 1.00 0.00 H new ATOM 0 HH11 ARG A 21 13.609 11.076 -9.607 1.00 0.00 H new ATOM 0 HH12 ARG A 21 13.535 12.818 -9.324 1.00 0.00 H new ATOM 0 HH21 ARG A 21 16.889 13.057 -8.184 1.00 0.00 H new ATOM 0 HH22 ARG A 21 15.397 13.943 -8.516 1.00 0.00 H new ATOM 304 N LYS A 22 17.676 4.119 -7.765 1.00 0.00 N ATOM 305 CA LYS A 22 17.589 3.050 -6.785 1.00 0.00 C ATOM 306 C LYS A 22 16.567 3.430 -5.712 1.00 0.00 C ATOM 307 O LYS A 22 16.915 3.579 -4.542 1.00 0.00 O ATOM 308 CB LYS A 22 18.975 2.722 -6.225 1.00 0.00 C ATOM 309 CG LYS A 22 19.570 1.496 -6.919 1.00 0.00 C ATOM 310 CD LYS A 22 20.619 1.907 -7.955 1.00 0.00 C ATOM 311 CE LYS A 22 21.696 2.791 -7.323 1.00 0.00 C ATOM 312 NZ LYS A 22 23.027 2.466 -7.884 1.00 0.00 N ATOM 0 H LYS A 22 17.813 3.806 -8.726 1.00 0.00 H new ATOM 0 HA LYS A 22 17.234 2.132 -7.253 1.00 0.00 H new ATOM 0 HB2 LYS A 22 19.637 3.577 -6.359 1.00 0.00 H new ATOM 0 HB3 LYS A 22 18.904 2.539 -5.153 1.00 0.00 H new ATOM 0 HG2 LYS A 22 20.024 0.839 -6.178 1.00 0.00 H new ATOM 0 HG3 LYS A 22 18.777 0.928 -7.405 1.00 0.00 H new ATOM 0 HD2 LYS A 22 21.079 1.017 -8.384 1.00 0.00 H new ATOM 0 HD3 LYS A 22 20.137 2.443 -8.773 1.00 0.00 H new ATOM 0 HE2 LYS A 22 21.465 3.841 -7.503 1.00 0.00 H new ATOM 0 HE3 LYS A 22 21.705 2.647 -6.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 23.747 3.075 -7.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 23.251 1.469 -7.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 23.019 2.626 -8.912 1.00 0.00 H new ATOM 326 N ALA A 23 15.324 3.576 -6.149 1.00 0.00 N ATOM 327 CA ALA A 23 14.249 3.936 -5.241 1.00 0.00 C ATOM 328 C ALA A 23 13.182 2.840 -5.262 1.00 0.00 C ATOM 329 O ALA A 23 13.245 1.922 -6.078 1.00 0.00 O ATOM 330 CB ALA A 23 13.687 5.305 -5.631 1.00 0.00 C ATOM 0 H ALA A 23 15.038 3.451 -7.120 1.00 0.00 H new ATOM 0 HA ALA A 23 14.620 4.016 -4.219 1.00 0.00 H new ATOM 0 HB1 ALA A 23 12.880 5.575 -4.949 1.00 0.00 H new ATOM 0 HB2 ALA A 23 14.478 6.053 -5.572 1.00 0.00 H new ATOM 0 HB3 ALA A 23 13.302 5.264 -6.650 1.00 0.00 H new ATOM 336 N PHE A 24 12.225 2.973 -4.354 1.00 0.00 N ATOM 337 CA PHE A 24 11.145 2.005 -4.258 1.00 0.00 C ATOM 338 C PHE A 24 9.782 2.695 -4.333 1.00 0.00 C ATOM 339 O PHE A 24 9.487 3.583 -3.534 1.00 0.00 O ATOM 340 CB PHE A 24 11.281 1.317 -2.899 1.00 0.00 C ATOM 341 CG PHE A 24 10.316 0.147 -2.694 1.00 0.00 C ATOM 342 CD1 PHE A 24 9.907 -0.591 -3.760 1.00 0.00 C ATOM 343 CD2 PHE A 24 9.867 -0.154 -1.446 1.00 0.00 C ATOM 344 CE1 PHE A 24 9.011 -1.677 -3.570 1.00 0.00 C ATOM 345 CE2 PHE A 24 8.972 -1.239 -1.256 1.00 0.00 C ATOM 346 CZ PHE A 24 8.563 -1.978 -2.322 1.00 0.00 C ATOM 0 H PHE A 24 12.175 3.736 -3.679 1.00 0.00 H new ATOM 0 HA PHE A 24 11.208 1.294 -5.082 1.00 0.00 H new ATOM 0 HB2 PHE A 24 12.303 0.955 -2.787 1.00 0.00 H new ATOM 0 HB3 PHE A 24 11.115 2.053 -2.112 1.00 0.00 H new ATOM 0 HD1 PHE A 24 10.263 -0.352 -4.751 1.00 0.00 H new ATOM 0 HD2 PHE A 24 10.192 0.433 -0.599 1.00 0.00 H new ATOM 0 HE1 PHE A 24 8.686 -2.263 -4.417 1.00 0.00 H new ATOM 0 HE2 PHE A 24 8.616 -1.478 -0.265 1.00 0.00 H new ATOM 0 HZ PHE A 24 7.882 -2.804 -2.177 1.00 0.00 H new ATOM 356 N VAL A 25 8.987 2.262 -5.301 1.00 0.00 N ATOM 357 CA VAL A 25 7.662 2.827 -5.490 1.00 0.00 C ATOM 358 C VAL A 25 6.610 1.746 -5.236 1.00 0.00 C ATOM 359 O VAL A 25 6.566 0.739 -5.942 1.00 0.00 O ATOM 360 CB VAL A 25 7.554 3.451 -6.883 1.00 0.00 C ATOM 361 CG1 VAL A 25 6.431 4.488 -6.933 1.00 0.00 C ATOM 362 CG2 VAL A 25 8.887 4.064 -7.314 1.00 0.00 C ATOM 0 H VAL A 25 9.235 1.526 -5.963 1.00 0.00 H new ATOM 0 HA VAL A 25 7.483 3.629 -4.774 1.00 0.00 H new ATOM 0 HB VAL A 25 7.308 2.657 -7.588 1.00 0.00 H new ATOM 0 HG11 VAL A 25 6.376 4.916 -7.934 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.482 4.009 -6.690 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.634 5.279 -6.211 1.00 0.00 H new ATOM 0 HG21 VAL A 25 8.783 4.500 -8.307 1.00 0.00 H new ATOM 0 HG22 VAL A 25 9.177 4.840 -6.605 1.00 0.00 H new ATOM 0 HG23 VAL A 25 9.653 3.289 -7.337 1.00 0.00 H new ATOM 372 N VAL A 26 5.789 1.990 -4.226 1.00 0.00 N ATOM 373 CA VAL A 26 4.740 1.050 -3.869 1.00 0.00 C ATOM 374 C VAL A 26 3.377 1.670 -4.183 1.00 0.00 C ATOM 375 O VAL A 26 2.785 2.337 -3.336 1.00 0.00 O ATOM 376 CB VAL A 26 4.885 0.635 -2.404 1.00 0.00 C ATOM 377 CG1 VAL A 26 3.772 -0.333 -1.996 1.00 0.00 C ATOM 378 CG2 VAL A 26 6.264 0.027 -2.140 1.00 0.00 C ATOM 0 H VAL A 26 5.829 2.826 -3.643 1.00 0.00 H new ATOM 0 HA VAL A 26 4.827 0.139 -4.461 1.00 0.00 H new ATOM 0 HB VAL A 26 4.791 1.531 -1.791 1.00 0.00 H new ATOM 0 HG11 VAL A 26 3.898 -0.613 -0.950 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.804 0.149 -2.128 1.00 0.00 H new ATOM 0 HG13 VAL A 26 3.820 -1.226 -2.619 1.00 0.00 H new ATOM 0 HG21 VAL A 26 6.341 -0.259 -1.091 1.00 0.00 H new ATOM 0 HG22 VAL A 26 6.399 -0.854 -2.768 1.00 0.00 H new ATOM 0 HG23 VAL A 26 7.036 0.761 -2.373 1.00 0.00 H new ATOM 388 N ASN A 27 2.919 1.428 -5.403 1.00 0.00 N ATOM 389 CA ASN A 27 1.637 1.954 -5.839 1.00 0.00 C ATOM 390 C ASN A 27 0.511 1.177 -5.154 1.00 0.00 C ATOM 391 O ASN A 27 0.568 -0.048 -5.058 1.00 0.00 O ATOM 392 CB ASN A 27 1.464 1.802 -7.351 1.00 0.00 C ATOM 393 CG ASN A 27 0.006 2.014 -7.761 1.00 0.00 C ATOM 394 OD1 ASN A 27 -0.299 3.278 -8.040 1.00 0.00 O flip ATOM 395 ND2 ASN A 27 -0.790 1.092 -7.820 1.00 0.00 N flip ATOM 0 H ASN A 27 3.413 0.875 -6.103 1.00 0.00 H new ATOM 0 HA ASN A 27 1.601 3.011 -5.576 1.00 0.00 H new ATOM 0 HB2 ASN A 27 2.099 2.522 -7.867 1.00 0.00 H new ATOM 0 HB3 ASN A 27 1.792 0.809 -7.660 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -0.490 0.144 -7.592 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -1.756 1.269 -8.097 1.00 0.00 H new ATOM 402 N ILE A 28 -0.485 1.920 -4.695 1.00 0.00 N ATOM 403 CA ILE A 28 -1.621 1.316 -4.021 1.00 0.00 C ATOM 404 C ILE A 28 -2.878 1.518 -4.870 1.00 0.00 C ATOM 405 O ILE A 28 -3.460 2.602 -4.876 1.00 0.00 O ATOM 406 CB ILE A 28 -1.749 1.856 -2.596 1.00 0.00 C ATOM 407 CG1 ILE A 28 -0.457 1.632 -1.807 1.00 0.00 C ATOM 408 CG2 ILE A 28 -2.964 1.254 -1.888 1.00 0.00 C ATOM 409 CD1 ILE A 28 -0.673 1.893 -0.315 1.00 0.00 C ATOM 0 H ILE A 28 -0.529 2.936 -4.777 1.00 0.00 H new ATOM 0 HA ILE A 28 -1.474 0.241 -3.917 1.00 0.00 H new ATOM 0 HB ILE A 28 -1.910 2.933 -2.652 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -0.109 0.609 -1.954 1.00 0.00 H new ATOM 0 HG13 ILE A 28 0.324 2.292 -2.186 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -3.031 1.655 -0.877 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -3.869 1.507 -2.440 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.858 0.170 -1.842 1.00 0.00 H new ATOM 0 HD11 ILE A 28 0.261 1.727 0.222 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -0.997 2.923 -0.169 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.437 1.215 0.066 1.00 0.00 H new ATOM 421 N LYS A 29 -3.260 0.458 -5.567 1.00 0.00 N ATOM 422 CA LYS A 29 -4.437 0.505 -6.417 1.00 0.00 C ATOM 423 C LYS A 29 -5.672 0.783 -5.557 1.00 0.00 C ATOM 424 O LYS A 29 -5.644 1.654 -4.688 1.00 0.00 O ATOM 425 CB LYS A 29 -4.546 -0.771 -7.254 1.00 0.00 C ATOM 426 CG LYS A 29 -5.429 -0.548 -8.483 1.00 0.00 C ATOM 427 CD LYS A 29 -4.580 -0.404 -9.749 1.00 0.00 C ATOM 428 CE LYS A 29 -5.123 -1.284 -10.876 1.00 0.00 C ATOM 429 NZ LYS A 29 -5.381 -0.475 -12.088 1.00 0.00 N ATOM 0 H LYS A 29 -2.775 -0.439 -5.560 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.356 1.323 -7.133 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.552 -1.089 -7.569 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -4.960 -1.575 -6.645 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -6.119 -1.384 -8.596 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -6.034 0.348 -8.343 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -4.571 0.638 -10.069 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -3.548 -0.680 -9.532 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -4.408 -2.074 -11.105 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -6.044 -1.771 -10.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -5.749 -1.088 -12.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -6.080 0.264 -11.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -4.495 -0.031 -12.404 1.00 0.00 H new ATOM 443 N GLU A 30 -6.725 0.028 -5.829 1.00 0.00 N ATOM 444 CA GLU A 30 -7.968 0.182 -5.091 1.00 0.00 C ATOM 445 C GLU A 30 -8.256 -1.076 -4.269 1.00 0.00 C ATOM 446 O GLU A 30 -7.542 -2.071 -4.379 1.00 0.00 O ATOM 447 CB GLU A 30 -9.130 0.500 -6.034 1.00 0.00 C ATOM 448 CG GLU A 30 -9.406 -0.673 -6.978 1.00 0.00 C ATOM 449 CD GLU A 30 -10.123 -0.200 -8.244 1.00 0.00 C ATOM 450 OE1 GLU A 30 -9.408 0.255 -9.164 1.00 0.00 O ATOM 451 OE2 GLU A 30 -11.368 -0.303 -8.264 1.00 0.00 O ATOM 0 H GLU A 30 -6.744 -0.693 -6.550 1.00 0.00 H new ATOM 0 HA GLU A 30 -7.860 1.023 -4.406 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -10.025 0.722 -5.453 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -8.898 1.392 -6.615 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -8.467 -1.157 -7.247 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -10.015 -1.419 -6.468 1.00 0.00 H new ATOM 458 N ALA A 31 -9.305 -0.990 -3.463 1.00 0.00 N ATOM 459 CA ALA A 31 -9.696 -2.108 -2.623 1.00 0.00 C ATOM 460 C ALA A 31 -11.171 -2.433 -2.868 1.00 0.00 C ATOM 461 O ALA A 31 -11.988 -1.530 -3.045 1.00 0.00 O ATOM 462 CB ALA A 31 -9.409 -1.772 -1.158 1.00 0.00 C ATOM 0 H ALA A 31 -9.895 -0.163 -3.375 1.00 0.00 H new ATOM 0 HA ALA A 31 -9.116 -2.996 -2.873 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -9.703 -2.612 -0.528 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -8.344 -1.578 -1.031 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -9.976 -0.887 -0.870 1.00 0.00 H new ATOM 468 N ARG A 32 -11.468 -3.724 -2.872 1.00 0.00 N ATOM 469 CA ARG A 32 -12.830 -4.179 -3.092 1.00 0.00 C ATOM 470 C ARG A 32 -13.200 -5.261 -2.076 1.00 0.00 C ATOM 471 O ARG A 32 -12.421 -6.183 -1.835 1.00 0.00 O ATOM 472 CB ARG A 32 -13.002 -4.736 -4.507 1.00 0.00 C ATOM 473 CG ARG A 32 -13.579 -3.676 -5.447 1.00 0.00 C ATOM 474 CD ARG A 32 -14.681 -4.267 -6.329 1.00 0.00 C ATOM 475 NE ARG A 32 -14.769 -3.516 -7.601 1.00 0.00 N ATOM 476 CZ ARG A 32 -15.372 -3.976 -8.705 1.00 0.00 C ATOM 477 NH1 ARG A 32 -15.945 -5.188 -8.700 1.00 0.00 N ATOM 478 NH2 ARG A 32 -15.403 -3.226 -9.815 1.00 0.00 N ATOM 0 H ARG A 32 -10.788 -4.470 -2.726 1.00 0.00 H new ATOM 0 HA ARG A 32 -13.490 -3.321 -2.969 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -12.039 -5.078 -4.886 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -13.662 -5.603 -4.483 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -13.980 -2.847 -4.864 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -12.785 -3.270 -6.074 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -14.472 -5.318 -6.531 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -15.637 -4.227 -5.807 1.00 0.00 H new ATOM 0 HE ARG A 32 -14.344 -2.590 -7.639 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -15.922 -5.760 -7.856 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -16.404 -5.538 -9.541 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -14.967 -2.304 -9.820 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -15.862 -3.577 -10.655 1.00 0.00 H new ATOM 492 N GLY A 33 -14.388 -5.115 -1.509 1.00 0.00 N ATOM 493 CA GLY A 33 -14.870 -6.068 -0.524 1.00 0.00 C ATOM 494 C GLY A 33 -14.747 -5.504 0.892 1.00 0.00 C ATOM 495 O GLY A 33 -14.261 -6.183 1.795 1.00 0.00 O ATOM 0 H GLY A 33 -15.032 -4.350 -1.713 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -15.911 -6.315 -0.731 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -14.301 -6.995 -0.601 1.00 0.00 H new ATOM 499 N LEU A 34 -15.195 -4.266 1.043 1.00 0.00 N ATOM 500 CA LEU A 34 -15.142 -3.602 2.334 1.00 0.00 C ATOM 501 C LEU A 34 -16.555 -3.506 2.912 1.00 0.00 C ATOM 502 O LEU A 34 -17.420 -2.843 2.341 1.00 0.00 O ATOM 503 CB LEU A 34 -14.433 -2.252 2.213 1.00 0.00 C ATOM 504 CG LEU A 34 -12.904 -2.295 2.198 1.00 0.00 C ATOM 505 CD1 LEU A 34 -12.399 -3.570 1.519 1.00 0.00 C ATOM 506 CD2 LEU A 34 -12.326 -1.034 1.554 1.00 0.00 C ATOM 0 H LEU A 34 -15.597 -3.705 0.292 1.00 0.00 H new ATOM 0 HA LEU A 34 -14.549 -4.185 3.038 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -14.772 -1.767 1.297 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -14.751 -1.622 3.044 1.00 0.00 H new ATOM 0 HG LEU A 34 -12.552 -2.318 3.229 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -11.309 -3.576 1.521 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -12.768 -4.441 2.060 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -12.760 -3.602 0.491 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -11.237 -1.091 1.556 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -12.683 -0.953 0.527 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -12.645 -0.158 2.119 1.00 0.00 H new ATOM 518 N PRO A 35 -16.752 -4.194 4.068 1.00 0.00 N ATOM 519 CA PRO A 35 -18.045 -4.192 4.730 1.00 0.00 C ATOM 520 C PRO A 35 -18.296 -2.861 5.440 1.00 0.00 C ATOM 521 O PRO A 35 -17.443 -2.380 6.185 1.00 0.00 O ATOM 522 CB PRO A 35 -18.001 -5.375 5.684 1.00 0.00 C ATOM 523 CG PRO A 35 -16.530 -5.713 5.861 1.00 0.00 C ATOM 524 CD PRO A 35 -15.751 -4.990 4.773 1.00 0.00 C ATOM 0 HA PRO A 35 -18.875 -4.292 4.031 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -18.462 -5.124 6.639 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -18.551 -6.224 5.279 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -16.184 -5.405 6.847 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -16.375 -6.790 5.791 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -14.970 -4.359 5.198 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -15.261 -5.695 4.102 1.00 0.00 H new ATOM 532 N ALA A 36 -19.470 -2.302 5.185 1.00 0.00 N ATOM 533 CA ALA A 36 -19.844 -1.035 5.791 1.00 0.00 C ATOM 534 C ALA A 36 -19.392 -1.021 7.252 1.00 0.00 C ATOM 535 O ALA A 36 -19.330 -2.067 7.897 1.00 0.00 O ATOM 536 CB ALA A 36 -21.352 -0.825 5.644 1.00 0.00 C ATOM 0 H ALA A 36 -20.175 -2.703 4.567 1.00 0.00 H new ATOM 0 HA ALA A 36 -19.349 -0.206 5.285 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -21.633 0.125 6.098 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -21.616 -0.814 4.587 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -21.883 -1.636 6.142 1.00 0.00 H new ATOM 542 N MET A 37 -19.088 0.176 7.733 1.00 0.00 N ATOM 543 CA MET A 37 -18.644 0.340 9.106 1.00 0.00 C ATOM 544 C MET A 37 -19.541 1.326 9.858 1.00 0.00 C ATOM 545 O MET A 37 -19.858 1.115 11.028 1.00 0.00 O ATOM 546 CB MET A 37 -17.201 0.849 9.119 1.00 0.00 C ATOM 547 CG MET A 37 -16.211 -0.313 9.217 1.00 0.00 C ATOM 548 SD MET A 37 -15.584 -0.442 10.884 1.00 0.00 S ATOM 549 CE MET A 37 -14.983 -2.123 10.859 1.00 0.00 C ATOM 0 H MET A 37 -19.141 1.041 7.196 1.00 0.00 H new ATOM 0 HA MET A 37 -18.701 -0.627 9.605 1.00 0.00 H new ATOM 0 HB2 MET A 37 -17.006 1.422 8.213 1.00 0.00 H new ATOM 0 HB3 MET A 37 -17.058 1.526 9.962 1.00 0.00 H new ATOM 0 HG2 MET A 37 -16.701 -1.244 8.931 1.00 0.00 H new ATOM 0 HG3 MET A 37 -15.387 -0.159 8.521 1.00 0.00 H new ATOM 0 HE1 MET A 37 -15.338 -2.650 11.745 1.00 0.00 H new ATOM 0 HE2 MET A 37 -15.350 -2.627 9.965 1.00 0.00 H new ATOM 0 HE3 MET A 37 -13.893 -2.120 10.852 1.00 0.00 H new ATOM 614 N MET A 42 -25.089 3.470 4.608 1.00 0.00 N ATOM 615 CA MET A 42 -24.537 2.193 4.191 1.00 0.00 C ATOM 616 C MET A 42 -23.206 2.383 3.461 1.00 0.00 C ATOM 617 O MET A 42 -23.000 1.827 2.383 1.00 0.00 O ATOM 618 CB MET A 42 -25.530 1.485 3.266 1.00 0.00 C ATOM 619 CG MET A 42 -25.705 0.019 3.670 1.00 0.00 C ATOM 620 SD MET A 42 -25.547 -1.032 2.236 1.00 0.00 S ATOM 621 CE MET A 42 -23.780 -0.961 1.993 1.00 0.00 C ATOM 0 HA MET A 42 -24.359 1.588 5.080 1.00 0.00 H new ATOM 0 HB2 MET A 42 -26.493 1.994 3.303 1.00 0.00 H new ATOM 0 HB3 MET A 42 -25.178 1.543 2.236 1.00 0.00 H new ATOM 0 HG2 MET A 42 -24.957 -0.253 4.415 1.00 0.00 H new ATOM 0 HG3 MET A 42 -26.682 -0.126 4.131 1.00 0.00 H new ATOM 0 HE1 MET A 42 -23.404 -1.958 1.766 1.00 0.00 H new ATOM 0 HE2 MET A 42 -23.553 -0.290 1.164 1.00 0.00 H new ATOM 0 HE3 MET A 42 -23.303 -0.591 2.900 1.00 0.00 H new ATOM 631 N THR A 43 -22.337 3.171 4.077 1.00 0.00 N ATOM 632 CA THR A 43 -21.032 3.442 3.500 1.00 0.00 C ATOM 633 C THR A 43 -20.070 3.958 4.572 1.00 0.00 C ATOM 634 O THR A 43 -20.501 4.521 5.578 1.00 0.00 O ATOM 635 CB THR A 43 -21.223 4.416 2.335 1.00 0.00 C ATOM 636 OG1 THR A 43 -19.929 4.508 1.744 1.00 0.00 O ATOM 637 CG2 THR A 43 -21.519 5.841 2.807 1.00 0.00 C ATOM 0 H THR A 43 -22.512 3.631 4.971 1.00 0.00 H new ATOM 0 HA THR A 43 -20.576 2.532 3.111 1.00 0.00 H new ATOM 0 HB THR A 43 -22.037 4.067 1.699 1.00 0.00 H new ATOM 0 HG1 THR A 43 -19.973 4.210 0.811 1.00 0.00 H new ATOM 0 HG21 THR A 43 -21.646 6.492 1.942 1.00 0.00 H new ATOM 0 HG22 THR A 43 -22.433 5.845 3.401 1.00 0.00 H new ATOM 0 HG23 THR A 43 -20.689 6.203 3.415 1.00 0.00 H new ATOM 645 N SER A 44 -18.787 3.748 4.321 1.00 0.00 N ATOM 646 CA SER A 44 -17.761 4.186 5.253 1.00 0.00 C ATOM 647 C SER A 44 -16.569 4.762 4.486 1.00 0.00 C ATOM 648 O SER A 44 -16.559 4.763 3.257 1.00 0.00 O ATOM 649 CB SER A 44 -17.307 3.034 6.153 1.00 0.00 C ATOM 650 OG SER A 44 -17.294 1.789 5.460 1.00 0.00 O ATOM 0 H SER A 44 -18.434 3.281 3.486 1.00 0.00 H new ATOM 0 HA SER A 44 -18.185 4.963 5.889 1.00 0.00 H new ATOM 0 HB2 SER A 44 -16.309 3.246 6.537 1.00 0.00 H new ATOM 0 HB3 SER A 44 -17.972 2.963 7.014 1.00 0.00 H new ATOM 0 HG SER A 44 -16.997 1.080 6.067 1.00 0.00 H new ATOM 656 N ASP A 45 -15.592 5.237 5.245 1.00 0.00 N ATOM 657 CA ASP A 45 -14.398 5.815 4.652 1.00 0.00 C ATOM 658 C ASP A 45 -13.183 4.967 5.035 1.00 0.00 C ATOM 659 O ASP A 45 -12.395 5.357 5.896 1.00 0.00 O ATOM 660 CB ASP A 45 -14.162 7.237 5.164 1.00 0.00 C ATOM 661 CG ASP A 45 -15.313 8.213 4.914 1.00 0.00 C ATOM 662 OD1 ASP A 45 -16.354 7.745 4.405 1.00 0.00 O ATOM 663 OD2 ASP A 45 -15.125 9.407 5.236 1.00 0.00 O ATOM 0 H ASP A 45 -15.603 5.233 6.265 1.00 0.00 H new ATOM 0 HA ASP A 45 -14.536 5.839 3.571 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -13.968 7.194 6.236 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -13.262 7.632 4.693 1.00 0.00 H new ATOM 668 N PRO A 46 -13.065 3.793 4.359 1.00 0.00 N ATOM 669 CA PRO A 46 -11.960 2.887 4.620 1.00 0.00 C ATOM 670 C PRO A 46 -10.663 3.412 4.001 1.00 0.00 C ATOM 671 O PRO A 46 -10.695 4.157 3.023 1.00 0.00 O ATOM 672 CB PRO A 46 -12.398 1.553 4.037 1.00 0.00 C ATOM 673 CG PRO A 46 -13.525 1.872 3.068 1.00 0.00 C ATOM 674 CD PRO A 46 -13.979 3.298 3.334 1.00 0.00 C ATOM 0 HA PRO A 46 -11.739 2.789 5.683 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -11.571 1.060 3.526 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -12.737 0.876 4.821 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -13.184 1.766 2.038 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -14.353 1.176 3.203 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -13.927 3.905 2.430 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -15.013 3.327 3.678 1.00 0.00 H new ATOM 682 N TYR A 47 -9.552 3.003 4.597 1.00 0.00 N ATOM 683 CA TYR A 47 -8.247 3.423 4.116 1.00 0.00 C ATOM 684 C TYR A 47 -7.179 2.379 4.447 1.00 0.00 C ATOM 685 O TYR A 47 -7.156 1.838 5.551 1.00 0.00 O ATOM 686 CB TYR A 47 -7.922 4.721 4.858 1.00 0.00 C ATOM 687 CG TYR A 47 -7.634 4.530 6.349 1.00 0.00 C ATOM 688 CD1 TYR A 47 -8.648 4.152 7.205 1.00 0.00 C ATOM 689 CD2 TYR A 47 -6.360 4.735 6.837 1.00 0.00 C ATOM 690 CE1 TYR A 47 -8.377 3.972 8.608 1.00 0.00 C ATOM 691 CE2 TYR A 47 -6.088 4.555 8.240 1.00 0.00 C ATOM 692 CZ TYR A 47 -7.110 4.183 9.056 1.00 0.00 C ATOM 693 OH TYR A 47 -6.854 4.013 10.381 1.00 0.00 O ATOM 0 H TYR A 47 -9.529 2.385 5.408 1.00 0.00 H new ATOM 0 HA TYR A 47 -8.260 3.552 3.034 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -7.057 5.189 4.388 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -8.758 5.411 4.745 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -9.645 3.991 6.823 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -5.566 5.031 6.167 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -9.162 3.676 9.289 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -5.095 4.712 8.635 1.00 0.00 H new ATOM 0 HH TYR A 47 -5.908 4.197 10.558 1.00 0.00 H new ATOM 703 N ILE A 48 -6.320 2.128 3.470 1.00 0.00 N ATOM 704 CA ILE A 48 -5.252 1.158 3.643 1.00 0.00 C ATOM 705 C ILE A 48 -3.992 1.876 4.132 1.00 0.00 C ATOM 706 O ILE A 48 -3.564 2.862 3.535 1.00 0.00 O ATOM 707 CB ILE A 48 -5.043 0.355 2.358 1.00 0.00 C ATOM 708 CG1 ILE A 48 -6.336 -0.342 1.931 1.00 0.00 C ATOM 709 CG2 ILE A 48 -3.882 -0.631 2.510 1.00 0.00 C ATOM 710 CD1 ILE A 48 -6.065 -1.376 0.836 1.00 0.00 C ATOM 0 H ILE A 48 -6.342 2.580 2.556 1.00 0.00 H new ATOM 0 HA ILE A 48 -5.520 0.428 4.406 1.00 0.00 H new ATOM 0 HB ILE A 48 -4.773 1.048 1.561 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -6.792 -0.830 2.792 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -7.050 0.398 1.569 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -3.755 -1.189 1.582 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -2.966 -0.083 2.732 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -4.097 -1.324 3.324 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -7.000 -1.857 0.550 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -5.632 -0.881 -0.033 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -5.370 -2.128 1.209 1.00 0.00 H new ATOM 722 N LYS A 49 -3.433 1.353 5.214 1.00 0.00 N ATOM 723 CA LYS A 49 -2.231 1.931 5.789 1.00 0.00 C ATOM 724 C LYS A 49 -1.006 1.183 5.259 1.00 0.00 C ATOM 725 O LYS A 49 -0.920 -0.038 5.380 1.00 0.00 O ATOM 726 CB LYS A 49 -2.325 1.953 7.316 1.00 0.00 C ATOM 727 CG LYS A 49 -2.620 3.365 7.827 1.00 0.00 C ATOM 728 CD LYS A 49 -2.113 3.546 9.260 1.00 0.00 C ATOM 729 CE LYS A 49 -2.779 4.751 9.928 1.00 0.00 C ATOM 730 NZ LYS A 49 -1.773 5.566 10.645 1.00 0.00 N ATOM 0 H LYS A 49 -3.791 0.535 5.707 1.00 0.00 H new ATOM 0 HA LYS A 49 -2.126 2.972 5.484 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -3.110 1.272 7.645 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.390 1.594 7.747 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -2.146 4.098 7.174 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -3.693 3.552 7.791 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -2.318 2.645 9.839 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.031 3.681 9.253 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -3.281 5.360 9.176 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -3.545 4.411 10.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -2.241 6.380 11.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -1.313 4.986 11.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -1.057 5.906 9.971 1.00 0.00 H new ATOM 744 N MET A 50 -0.089 1.947 4.684 1.00 0.00 N ATOM 745 CA MET A 50 1.127 1.371 4.135 1.00 0.00 C ATOM 746 C MET A 50 2.280 1.470 5.136 1.00 0.00 C ATOM 747 O MET A 50 2.491 2.517 5.745 1.00 0.00 O ATOM 748 CB MET A 50 1.504 2.107 2.848 1.00 0.00 C ATOM 749 CG MET A 50 2.368 1.224 1.945 1.00 0.00 C ATOM 750 SD MET A 50 3.163 2.222 0.696 1.00 0.00 S ATOM 751 CE MET A 50 4.826 2.262 1.343 1.00 0.00 C ATOM 0 H MET A 50 -0.163 2.960 4.586 1.00 0.00 H new ATOM 0 HA MET A 50 0.945 0.318 3.922 1.00 0.00 H new ATOM 0 HB2 MET A 50 0.600 2.403 2.316 1.00 0.00 H new ATOM 0 HB3 MET A 50 2.044 3.022 3.093 1.00 0.00 H new ATOM 0 HG2 MET A 50 3.119 0.705 2.541 1.00 0.00 H new ATOM 0 HG3 MET A 50 1.752 0.459 1.473 1.00 0.00 H new ATOM 0 HE1 MET A 50 5.028 3.245 1.768 1.00 0.00 H new ATOM 0 HE2 MET A 50 4.933 1.503 2.118 1.00 0.00 H new ATOM 0 HE3 MET A 50 5.534 2.062 0.539 1.00 0.00 H new ATOM 761 N THR A 51 2.997 0.364 5.275 1.00 0.00 N ATOM 762 CA THR A 51 4.123 0.312 6.191 1.00 0.00 C ATOM 763 C THR A 51 5.199 -0.638 5.661 1.00 0.00 C ATOM 764 O THR A 51 4.917 -1.800 5.371 1.00 0.00 O ATOM 765 CB THR A 51 3.592 -0.081 7.571 1.00 0.00 C ATOM 766 OG1 THR A 51 2.620 0.919 7.867 1.00 0.00 O ATOM 767 CG2 THR A 51 4.642 0.084 8.671 1.00 0.00 C ATOM 0 H THR A 51 2.819 -0.503 4.768 1.00 0.00 H new ATOM 0 HA THR A 51 4.607 1.285 6.278 1.00 0.00 H new ATOM 0 HB THR A 51 3.251 -1.116 7.547 1.00 0.00 H new ATOM 0 HG1 THR A 51 2.224 0.740 8.745 1.00 0.00 H new ATOM 0 HG21 THR A 51 4.214 -0.208 9.630 1.00 0.00 H new ATOM 0 HG22 THR A 51 5.502 -0.548 8.450 1.00 0.00 H new ATOM 0 HG23 THR A 51 4.959 1.126 8.718 1.00 0.00 H new ATOM 775 N ILE A 52 6.408 -0.109 5.551 1.00 0.00 N ATOM 776 CA ILE A 52 7.527 -0.895 5.061 1.00 0.00 C ATOM 777 C ILE A 52 8.087 -1.745 6.203 1.00 0.00 C ATOM 778 O ILE A 52 8.931 -1.284 6.970 1.00 0.00 O ATOM 779 CB ILE A 52 8.570 0.009 4.400 1.00 0.00 C ATOM 780 CG1 ILE A 52 8.075 0.516 3.044 1.00 0.00 C ATOM 781 CG2 ILE A 52 9.920 -0.700 4.289 1.00 0.00 C ATOM 782 CD1 ILE A 52 8.931 1.683 2.549 1.00 0.00 C ATOM 0 H ILE A 52 6.637 0.855 5.793 1.00 0.00 H new ATOM 0 HA ILE A 52 7.196 -1.583 4.283 1.00 0.00 H new ATOM 0 HB ILE A 52 8.717 0.882 5.036 1.00 0.00 H new ATOM 0 HG12 ILE A 52 8.104 -0.295 2.316 1.00 0.00 H new ATOM 0 HG13 ILE A 52 7.035 0.833 3.128 1.00 0.00 H new ATOM 0 HG21 ILE A 52 10.642 -0.035 3.816 1.00 0.00 H new ATOM 0 HG22 ILE A 52 10.273 -0.969 5.285 1.00 0.00 H new ATOM 0 HG23 ILE A 52 9.809 -1.602 3.687 1.00 0.00 H new ATOM 0 HD11 ILE A 52 8.558 2.024 1.583 1.00 0.00 H new ATOM 0 HD12 ILE A 52 8.881 2.501 3.267 1.00 0.00 H new ATOM 0 HD13 ILE A 52 9.965 1.356 2.443 1.00 0.00 H new ATOM 794 N LEU A 53 7.594 -2.973 6.281 1.00 0.00 N ATOM 795 CA LEU A 53 8.034 -3.892 7.317 1.00 0.00 C ATOM 796 C LEU A 53 9.289 -4.626 6.842 1.00 0.00 C ATOM 797 O LEU A 53 9.547 -4.711 5.642 1.00 0.00 O ATOM 798 CB LEU A 53 6.893 -4.825 7.725 1.00 0.00 C ATOM 799 CG LEU A 53 5.857 -4.238 8.686 1.00 0.00 C ATOM 800 CD1 LEU A 53 4.726 -5.235 8.949 1.00 0.00 C ATOM 801 CD2 LEU A 53 6.518 -3.765 9.983 1.00 0.00 C ATOM 0 H LEU A 53 6.894 -3.353 5.643 1.00 0.00 H new ATOM 0 HA LEU A 53 8.307 -3.346 8.220 1.00 0.00 H new ATOM 0 HB2 LEU A 53 6.377 -5.152 6.822 1.00 0.00 H new ATOM 0 HB3 LEU A 53 7.324 -5.714 8.186 1.00 0.00 H new ATOM 0 HG LEU A 53 5.411 -3.362 8.214 1.00 0.00 H new ATOM 0 HD11 LEU A 53 4.003 -4.793 9.635 1.00 0.00 H new ATOM 0 HD12 LEU A 53 4.231 -5.480 8.009 1.00 0.00 H new ATOM 0 HD13 LEU A 53 5.137 -6.143 9.390 1.00 0.00 H new ATOM 0 HD21 LEU A 53 5.760 -3.352 10.648 1.00 0.00 H new ATOM 0 HD22 LEU A 53 7.008 -4.608 10.470 1.00 0.00 H new ATOM 0 HD23 LEU A 53 7.258 -2.997 9.755 1.00 0.00 H new ATOM 813 N PRO A 54 10.058 -5.152 7.833 1.00 0.00 N ATOM 814 CA PRO A 54 9.681 -5.006 9.229 1.00 0.00 C ATOM 815 C PRO A 54 9.953 -3.585 9.725 1.00 0.00 C ATOM 816 O PRO A 54 9.387 -3.155 10.728 1.00 0.00 O ATOM 817 CB PRO A 54 10.493 -6.059 9.967 1.00 0.00 C ATOM 818 CG PRO A 54 11.630 -6.438 9.033 1.00 0.00 C ATOM 819 CD PRO A 54 11.301 -5.896 7.652 1.00 0.00 C ATOM 0 HA PRO A 54 8.614 -5.156 9.395 1.00 0.00 H new ATOM 0 HB2 PRO A 54 10.876 -5.667 10.909 1.00 0.00 H new ATOM 0 HB3 PRO A 54 9.880 -6.927 10.208 1.00 0.00 H new ATOM 0 HG2 PRO A 54 12.572 -6.023 9.391 1.00 0.00 H new ATOM 0 HG3 PRO A 54 11.751 -7.521 8.999 1.00 0.00 H new ATOM 0 HD2 PRO A 54 12.097 -5.252 7.279 1.00 0.00 H new ATOM 0 HD3 PRO A 54 11.178 -6.702 6.929 1.00 0.00 H new ATOM 827 N GLU A 55 10.820 -2.895 8.998 1.00 0.00 N ATOM 828 CA GLU A 55 11.175 -1.531 9.352 1.00 0.00 C ATOM 829 C GLU A 55 10.017 -0.856 10.091 1.00 0.00 C ATOM 830 O GLU A 55 10.114 -0.584 11.287 1.00 0.00 O ATOM 831 CB GLU A 55 11.575 -0.729 8.112 1.00 0.00 C ATOM 832 CG GLU A 55 13.094 -0.715 7.935 1.00 0.00 C ATOM 833 CD GLU A 55 13.492 -1.264 6.563 1.00 0.00 C ATOM 834 OE1 GLU A 55 13.606 -2.504 6.460 1.00 0.00 O ATOM 835 OE2 GLU A 55 13.672 -0.431 5.649 1.00 0.00 O ATOM 0 H GLU A 55 11.287 -3.255 8.166 1.00 0.00 H new ATOM 0 HA GLU A 55 12.037 -1.562 10.018 1.00 0.00 H new ATOM 0 HB2 GLU A 55 11.106 -1.161 7.228 1.00 0.00 H new ATOM 0 HB3 GLU A 55 11.206 0.293 8.201 1.00 0.00 H new ATOM 0 HG2 GLU A 55 13.467 0.303 8.045 1.00 0.00 H new ATOM 0 HG3 GLU A 55 13.560 -1.312 8.719 1.00 0.00 H new ATOM 842 N LYS A 56 8.949 -0.606 9.349 1.00 0.00 N ATOM 843 CA LYS A 56 7.774 0.032 9.919 1.00 0.00 C ATOM 844 C LYS A 56 8.016 1.539 10.020 1.00 0.00 C ATOM 845 O LYS A 56 7.165 2.276 10.516 1.00 0.00 O ATOM 846 CB LYS A 56 7.403 -0.623 11.251 1.00 0.00 C ATOM 847 CG LYS A 56 5.904 -0.493 11.527 1.00 0.00 C ATOM 848 CD LYS A 56 5.572 -0.908 12.962 1.00 0.00 C ATOM 849 CE LYS A 56 4.321 -1.788 13.003 1.00 0.00 C ATOM 850 NZ LYS A 56 3.241 -1.119 13.762 1.00 0.00 N ATOM 0 H LYS A 56 8.872 -0.834 8.358 1.00 0.00 H new ATOM 0 HA LYS A 56 6.910 -0.109 9.269 1.00 0.00 H new ATOM 0 HB2 LYS A 56 7.683 -1.676 11.233 1.00 0.00 H new ATOM 0 HB3 LYS A 56 7.967 -0.157 12.059 1.00 0.00 H new ATOM 0 HG2 LYS A 56 5.588 0.537 11.360 1.00 0.00 H new ATOM 0 HG3 LYS A 56 5.346 -1.115 10.827 1.00 0.00 H new ATOM 0 HD2 LYS A 56 6.415 -1.448 13.392 1.00 0.00 H new ATOM 0 HD3 LYS A 56 5.416 -0.020 13.574 1.00 0.00 H new ATOM 0 HE2 LYS A 56 3.984 -1.998 11.988 1.00 0.00 H new ATOM 0 HE3 LYS A 56 4.558 -2.746 13.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 2.400 -1.730 13.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 3.560 -0.940 14.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 3.003 -0.216 13.305 1.00 0.00 H new ATOM 864 N LYS A 57 9.180 1.953 9.542 1.00 0.00 N ATOM 865 CA LYS A 57 9.544 3.359 9.572 1.00 0.00 C ATOM 866 C LYS A 57 8.694 4.124 8.556 1.00 0.00 C ATOM 867 O LYS A 57 7.672 4.709 8.911 1.00 0.00 O ATOM 868 CB LYS A 57 11.051 3.527 9.364 1.00 0.00 C ATOM 869 CG LYS A 57 11.756 3.834 10.686 1.00 0.00 C ATOM 870 CD LYS A 57 11.496 5.276 11.125 1.00 0.00 C ATOM 871 CE LYS A 57 12.224 5.592 12.433 1.00 0.00 C ATOM 872 NZ LYS A 57 12.168 7.042 12.721 1.00 0.00 N ATOM 0 H LYS A 57 9.884 1.339 9.132 1.00 0.00 H new ATOM 0 HA LYS A 57 9.331 3.786 10.552 1.00 0.00 H new ATOM 0 HB2 LYS A 57 11.465 2.617 8.930 1.00 0.00 H new ATOM 0 HB3 LYS A 57 11.236 4.333 8.653 1.00 0.00 H new ATOM 0 HG2 LYS A 57 11.406 3.147 11.457 1.00 0.00 H new ATOM 0 HG3 LYS A 57 12.828 3.671 10.577 1.00 0.00 H new ATOM 0 HD2 LYS A 57 11.827 5.962 10.346 1.00 0.00 H new ATOM 0 HD3 LYS A 57 10.425 5.433 11.254 1.00 0.00 H new ATOM 0 HE2 LYS A 57 11.770 5.035 13.252 1.00 0.00 H new ATOM 0 HE3 LYS A 57 13.263 5.269 12.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 12.667 7.238 13.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 12.622 7.567 11.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 11.176 7.341 12.807 1.00 0.00 H new ATOM 886 N HIS A 58 9.147 4.095 7.311 1.00 0.00 N ATOM 887 CA HIS A 58 8.441 4.778 6.241 1.00 0.00 C ATOM 888 C HIS A 58 6.961 4.392 6.275 1.00 0.00 C ATOM 889 O HIS A 58 6.562 3.392 5.680 1.00 0.00 O ATOM 890 CB HIS A 58 9.097 4.493 4.889 1.00 0.00 C ATOM 891 CG HIS A 58 10.586 4.744 4.863 1.00 0.00 C ATOM 892 ND1 HIS A 58 11.240 5.470 5.842 1.00 0.00 N ATOM 893 CD2 HIS A 58 11.539 4.358 3.968 1.00 0.00 C ATOM 894 CE1 HIS A 58 12.529 5.514 5.540 1.00 0.00 C ATOM 895 NE2 HIS A 58 12.713 4.824 4.377 1.00 0.00 N ATOM 0 H HIS A 58 9.995 3.609 7.020 1.00 0.00 H new ATOM 0 HA HIS A 58 8.503 5.856 6.389 1.00 0.00 H new ATOM 0 HB2 HIS A 58 8.909 3.454 4.618 1.00 0.00 H new ATOM 0 HB3 HIS A 58 8.621 5.112 4.128 1.00 0.00 H new ATOM 0 HD2 HIS A 58 11.368 3.772 3.077 1.00 0.00 H new ATOM 0 HE1 HIS A 58 13.299 6.009 6.113 1.00 0.00 H new ATOM 0 HE2 HIS A 58 13.605 4.689 3.901 1.00 0.00 H new ATOM 903 N LYS A 59 6.186 5.205 6.978 1.00 0.00 N ATOM 904 CA LYS A 59 4.759 4.962 7.097 1.00 0.00 C ATOM 905 C LYS A 59 3.998 5.988 6.256 1.00 0.00 C ATOM 906 O LYS A 59 4.243 7.189 6.364 1.00 0.00 O ATOM 907 CB LYS A 59 4.340 4.941 8.569 1.00 0.00 C ATOM 908 CG LYS A 59 3.749 3.583 8.952 1.00 0.00 C ATOM 909 CD LYS A 59 3.455 3.517 10.452 1.00 0.00 C ATOM 910 CE LYS A 59 4.752 3.494 11.264 1.00 0.00 C ATOM 911 NZ LYS A 59 4.643 4.386 12.440 1.00 0.00 N ATOM 0 H LYS A 59 6.520 6.033 7.471 1.00 0.00 H new ATOM 0 HA LYS A 59 4.507 3.977 6.703 1.00 0.00 H new ATOM 0 HB2 LYS A 59 5.203 5.157 9.199 1.00 0.00 H new ATOM 0 HB3 LYS A 59 3.606 5.726 8.753 1.00 0.00 H new ATOM 0 HG2 LYS A 59 2.831 3.410 8.390 1.00 0.00 H new ATOM 0 HG3 LYS A 59 4.444 2.789 8.679 1.00 0.00 H new ATOM 0 HD2 LYS A 59 2.853 4.376 10.746 1.00 0.00 H new ATOM 0 HD3 LYS A 59 2.868 2.626 10.672 1.00 0.00 H new ATOM 0 HE2 LYS A 59 4.966 2.476 11.591 1.00 0.00 H new ATOM 0 HE3 LYS A 59 5.586 3.809 10.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 5.531 4.359 12.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 4.461 5.359 12.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 3.860 4.068 13.046 1.00 0.00 H new ATOM 925 N VAL A 60 3.091 5.479 5.435 1.00 0.00 N ATOM 926 CA VAL A 60 2.294 6.336 4.576 1.00 0.00 C ATOM 927 C VAL A 60 0.859 5.806 4.523 1.00 0.00 C ATOM 928 O VAL A 60 0.634 4.603 4.636 1.00 0.00 O ATOM 929 CB VAL A 60 2.943 6.442 3.194 1.00 0.00 C ATOM 930 CG1 VAL A 60 4.201 7.312 3.245 1.00 0.00 C ATOM 931 CG2 VAL A 60 3.257 5.056 2.629 1.00 0.00 C ATOM 0 H VAL A 60 2.891 4.483 5.347 1.00 0.00 H new ATOM 0 HA VAL A 60 2.253 7.348 4.979 1.00 0.00 H new ATOM 0 HB VAL A 60 2.230 6.923 2.524 1.00 0.00 H new ATOM 0 HG11 VAL A 60 4.643 7.371 2.250 1.00 0.00 H new ATOM 0 HG12 VAL A 60 3.937 8.313 3.585 1.00 0.00 H new ATOM 0 HG13 VAL A 60 4.920 6.872 3.936 1.00 0.00 H new ATOM 0 HG21 VAL A 60 3.717 5.159 1.646 1.00 0.00 H new ATOM 0 HG22 VAL A 60 3.943 4.537 3.298 1.00 0.00 H new ATOM 0 HG23 VAL A 60 2.335 4.482 2.539 1.00 0.00 H new ATOM 941 N LYS A 61 -0.073 6.731 4.351 1.00 0.00 N ATOM 942 CA LYS A 61 -1.480 6.372 4.282 1.00 0.00 C ATOM 943 C LYS A 61 -2.086 6.946 2.999 1.00 0.00 C ATOM 944 O LYS A 61 -1.462 7.765 2.326 1.00 0.00 O ATOM 945 CB LYS A 61 -2.208 6.810 5.555 1.00 0.00 C ATOM 946 CG LYS A 61 -2.524 8.307 5.518 1.00 0.00 C ATOM 947 CD LYS A 61 -3.291 8.735 6.771 1.00 0.00 C ATOM 948 CE LYS A 61 -2.486 9.749 7.587 1.00 0.00 C ATOM 949 NZ LYS A 61 -3.206 10.103 8.830 1.00 0.00 N ATOM 0 H LYS A 61 0.118 7.729 4.257 1.00 0.00 H new ATOM 0 HA LYS A 61 -1.595 5.289 4.233 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -3.132 6.242 5.664 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -1.592 6.586 6.426 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -1.598 8.876 5.442 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -3.113 8.536 4.630 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -4.248 9.171 6.485 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -3.510 7.861 7.384 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -1.508 9.334 7.832 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -2.311 10.646 6.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -2.646 10.792 9.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -4.129 10.519 8.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -3.351 9.247 9.403 1.00 0.00 H new ATOM 963 N THR A 62 -3.294 6.492 2.699 1.00 0.00 N ATOM 964 CA THR A 62 -3.991 6.949 1.509 1.00 0.00 C ATOM 965 C THR A 62 -4.735 8.255 1.796 1.00 0.00 C ATOM 966 O THR A 62 -4.713 8.752 2.921 1.00 0.00 O ATOM 967 CB THR A 62 -4.907 5.820 1.034 1.00 0.00 C ATOM 968 OG1 THR A 62 -5.517 5.341 2.230 1.00 0.00 O ATOM 969 CG2 THR A 62 -4.126 4.615 0.507 1.00 0.00 C ATOM 0 H THR A 62 -3.808 5.812 3.260 1.00 0.00 H new ATOM 0 HA THR A 62 -3.292 7.179 0.705 1.00 0.00 H new ATOM 0 HB THR A 62 -5.568 6.194 0.253 1.00 0.00 H new ATOM 0 HG1 THR A 62 -5.071 4.517 2.517 1.00 0.00 H new ATOM 0 HG21 THR A 62 -4.824 3.843 0.183 1.00 0.00 H new ATOM 0 HG22 THR A 62 -3.508 4.923 -0.336 1.00 0.00 H new ATOM 0 HG23 THR A 62 -3.489 4.220 1.298 1.00 0.00 H new ATOM 977 N ARG A 63 -5.375 8.774 0.758 1.00 0.00 N ATOM 978 CA ARG A 63 -6.124 10.013 0.884 1.00 0.00 C ATOM 979 C ARG A 63 -7.437 9.765 1.630 1.00 0.00 C ATOM 980 O ARG A 63 -8.253 10.674 1.776 1.00 0.00 O ATOM 981 CB ARG A 63 -6.431 10.613 -0.489 1.00 0.00 C ATOM 982 CG ARG A 63 -6.625 12.128 -0.395 1.00 0.00 C ATOM 983 CD ARG A 63 -7.785 12.588 -1.280 1.00 0.00 C ATOM 984 NE ARG A 63 -7.645 14.028 -1.590 1.00 0.00 N ATOM 985 CZ ARG A 63 -8.352 14.666 -2.533 1.00 0.00 C ATOM 986 NH1 ARG A 63 -9.254 13.995 -3.262 1.00 0.00 N ATOM 987 NH2 ARG A 63 -8.158 15.975 -2.745 1.00 0.00 N ATOM 0 H ARG A 63 -5.390 8.359 -0.174 1.00 0.00 H new ATOM 0 HA ARG A 63 -5.510 10.717 1.446 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -5.616 10.389 -1.178 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -7.330 10.152 -0.898 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -6.819 12.410 0.640 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -5.709 12.635 -0.698 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.801 12.009 -2.203 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -8.733 12.407 -0.774 1.00 0.00 H new ATOM 0 HE ARG A 63 -6.968 14.569 -1.052 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -9.402 12.999 -3.099 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -9.792 14.480 -3.980 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -7.472 16.486 -2.189 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -8.696 16.461 -3.463 1.00 0.00 H new ATOM 1001 N VAL A 64 -7.601 8.531 2.082 1.00 0.00 N ATOM 1002 CA VAL A 64 -8.800 8.152 2.808 1.00 0.00 C ATOM 1003 C VAL A 64 -10.032 8.580 2.008 1.00 0.00 C ATOM 1004 O VAL A 64 -10.442 9.738 2.063 1.00 0.00 O ATOM 1005 CB VAL A 64 -8.768 8.747 4.218 1.00 0.00 C ATOM 1006 CG1 VAL A 64 -10.139 8.641 4.889 1.00 0.00 C ATOM 1007 CG2 VAL A 64 -7.687 8.078 5.070 1.00 0.00 C ATOM 0 H VAL A 64 -6.922 7.780 1.959 1.00 0.00 H new ATOM 0 HA VAL A 64 -8.848 7.070 2.926 1.00 0.00 H new ATOM 0 HB VAL A 64 -8.519 9.805 4.130 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -10.089 9.071 5.889 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -10.876 9.184 4.298 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -10.430 7.593 4.959 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -7.685 8.519 6.067 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -7.892 7.010 5.146 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -6.713 8.228 4.605 1.00 0.00 H new ATOM 1017 N LEU A 65 -10.589 7.621 1.282 1.00 0.00 N ATOM 1018 CA LEU A 65 -11.766 7.883 0.471 1.00 0.00 C ATOM 1019 C LEU A 65 -12.916 8.328 1.378 1.00 0.00 C ATOM 1020 O LEU A 65 -12.869 8.125 2.590 1.00 0.00 O ATOM 1021 CB LEU A 65 -12.101 6.669 -0.396 1.00 0.00 C ATOM 1022 CG LEU A 65 -11.512 6.670 -1.809 1.00 0.00 C ATOM 1023 CD1 LEU A 65 -11.654 8.047 -2.460 1.00 0.00 C ATOM 1024 CD2 LEU A 65 -10.061 6.187 -1.798 1.00 0.00 C ATOM 0 H LEU A 65 -10.247 6.661 1.239 1.00 0.00 H new ATOM 0 HA LEU A 65 -11.574 8.699 -0.226 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -11.756 5.773 0.120 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -13.185 6.593 -0.476 1.00 0.00 H new ATOM 0 HG LEU A 65 -12.080 5.966 -2.417 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -11.228 8.021 -3.463 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -12.709 8.314 -2.521 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -11.126 8.789 -1.861 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -9.666 6.197 -2.814 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -9.463 6.847 -1.170 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -10.018 5.172 -1.402 1.00 0.00 H new ATOM 1036 N ARG A 66 -13.921 8.925 0.755 1.00 0.00 N ATOM 1037 CA ARG A 66 -15.081 9.400 1.490 1.00 0.00 C ATOM 1038 C ARG A 66 -16.334 8.639 1.053 1.00 0.00 C ATOM 1039 O ARG A 66 -16.837 8.846 -0.050 1.00 0.00 O ATOM 1040 CB ARG A 66 -15.298 10.898 1.269 1.00 0.00 C ATOM 1041 CG ARG A 66 -14.088 11.704 1.743 1.00 0.00 C ATOM 1042 CD ARG A 66 -13.528 11.136 3.049 1.00 0.00 C ATOM 1043 NE ARG A 66 -12.762 12.179 3.768 1.00 0.00 N ATOM 1044 CZ ARG A 66 -13.322 13.210 4.414 1.00 0.00 C ATOM 1045 NH1 ARG A 66 -14.655 13.344 4.436 1.00 0.00 N ATOM 1046 NH2 ARG A 66 -12.548 14.109 5.039 1.00 0.00 N ATOM 0 H ARG A 66 -13.956 9.091 -0.251 1.00 0.00 H new ATOM 0 HA ARG A 66 -14.897 9.225 2.550 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -15.476 11.091 0.211 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -16.189 11.223 1.806 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -13.314 11.691 0.975 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -14.375 12.745 1.889 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -14.342 10.774 3.676 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -12.885 10.282 2.837 1.00 0.00 H new ATOM 0 HE ARG A 66 -11.744 12.108 3.772 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -15.244 12.660 3.961 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -15.081 14.129 4.928 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -11.533 14.008 5.022 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -12.974 14.894 5.531 1.00 0.00 H new ATOM 1060 N LYS A 67 -16.802 7.774 1.941 1.00 0.00 N ATOM 1061 CA LYS A 67 -17.987 6.982 1.661 1.00 0.00 C ATOM 1062 C LYS A 67 -17.771 6.186 0.372 1.00 0.00 C ATOM 1063 O LYS A 67 -17.812 6.747 -0.722 1.00 0.00 O ATOM 1064 CB LYS A 67 -19.232 7.871 1.633 1.00 0.00 C ATOM 1065 CG LYS A 67 -19.396 8.628 2.952 1.00 0.00 C ATOM 1066 CD LYS A 67 -20.754 9.328 3.018 1.00 0.00 C ATOM 1067 CE LYS A 67 -21.302 9.329 4.446 1.00 0.00 C ATOM 1068 NZ LYS A 67 -21.766 10.683 4.823 1.00 0.00 N ATOM 0 H LYS A 67 -16.382 7.604 2.855 1.00 0.00 H new ATOM 0 HA LYS A 67 -18.158 6.259 2.458 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -19.158 8.581 0.809 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -20.115 7.260 1.448 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -19.299 7.935 3.788 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -18.598 9.364 3.055 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -20.656 10.353 2.662 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -21.458 8.826 2.355 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -22.126 8.620 4.526 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -20.529 8.997 5.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -22.135 10.665 5.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -20.971 11.351 4.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -22.519 10.986 4.173 1.00 0.00 H new ATOM 1082 N THR A 68 -17.544 4.892 0.544 1.00 0.00 N ATOM 1083 CA THR A 68 -17.320 4.014 -0.592 1.00 0.00 C ATOM 1084 C THR A 68 -16.747 2.675 -0.126 1.00 0.00 C ATOM 1085 O THR A 68 -15.627 2.617 0.380 1.00 0.00 O ATOM 1086 CB THR A 68 -16.418 4.748 -1.587 1.00 0.00 C ATOM 1087 OG1 THR A 68 -15.838 3.705 -2.365 1.00 0.00 O ATOM 1088 CG2 THR A 68 -15.221 5.417 -0.908 1.00 0.00 C ATOM 0 H THR A 68 -17.510 4.430 1.453 1.00 0.00 H new ATOM 0 HA THR A 68 -18.256 3.773 -1.096 1.00 0.00 H new ATOM 0 HB THR A 68 -17.001 5.500 -2.119 1.00 0.00 H new ATOM 0 HG1 THR A 68 -15.364 4.093 -3.130 1.00 0.00 H new ATOM 0 HG21 THR A 68 -14.614 5.923 -1.658 1.00 0.00 H new ATOM 0 HG22 THR A 68 -15.576 6.144 -0.178 1.00 0.00 H new ATOM 0 HG23 THR A 68 -14.619 4.661 -0.404 1.00 0.00 H new ATOM 1096 N LEU A 69 -17.541 1.630 -0.313 1.00 0.00 N ATOM 1097 CA LEU A 69 -17.126 0.295 0.082 1.00 0.00 C ATOM 1098 C LEU A 69 -16.083 -0.225 -0.909 1.00 0.00 C ATOM 1099 O LEU A 69 -15.522 -1.302 -0.717 1.00 0.00 O ATOM 1100 CB LEU A 69 -18.343 -0.621 0.232 1.00 0.00 C ATOM 1101 CG LEU A 69 -19.313 -0.269 1.362 1.00 0.00 C ATOM 1102 CD1 LEU A 69 -18.561 0.266 2.583 1.00 0.00 C ATOM 1103 CD2 LEU A 69 -20.387 0.707 0.878 1.00 0.00 C ATOM 0 H LEU A 69 -18.469 1.681 -0.733 1.00 0.00 H new ATOM 0 HA LEU A 69 -16.650 0.318 1.062 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -18.895 -0.616 -0.708 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -17.989 -1.640 0.388 1.00 0.00 H new ATOM 0 HG LEU A 69 -19.823 -1.181 1.672 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -19.273 0.509 3.372 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -17.866 -0.492 2.943 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -18.008 1.163 2.305 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -21.063 0.941 1.700 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -19.914 1.623 0.526 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -20.950 0.253 0.063 1.00 0.00 H new ATOM 1115 N ASP A 70 -15.856 0.565 -1.948 1.00 0.00 N ATOM 1116 CA ASP A 70 -14.891 0.198 -2.970 1.00 0.00 C ATOM 1117 C ASP A 70 -14.128 1.446 -3.417 1.00 0.00 C ATOM 1118 O ASP A 70 -14.286 1.903 -4.548 1.00 0.00 O ATOM 1119 CB ASP A 70 -15.586 -0.396 -4.197 1.00 0.00 C ATOM 1120 CG ASP A 70 -16.433 -1.640 -3.922 1.00 0.00 C ATOM 1121 OD1 ASP A 70 -16.303 -2.178 -2.801 1.00 0.00 O ATOM 1122 OD2 ASP A 70 -17.189 -2.026 -4.839 1.00 0.00 O ATOM 0 H ASP A 70 -16.324 1.458 -2.104 1.00 0.00 H new ATOM 0 HA ASP A 70 -14.215 -0.544 -2.544 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -16.224 0.369 -4.640 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -14.828 -0.648 -4.939 1.00 0.00 H new ATOM 1127 N PRO A 71 -13.295 1.977 -2.482 1.00 0.00 N ATOM 1128 CA PRO A 71 -12.507 3.163 -2.767 1.00 0.00 C ATOM 1129 C PRO A 71 -11.325 2.830 -3.680 1.00 0.00 C ATOM 1130 O PRO A 71 -10.867 1.689 -3.716 1.00 0.00 O ATOM 1131 CB PRO A 71 -12.077 3.687 -1.407 1.00 0.00 C ATOM 1132 CG PRO A 71 -12.245 2.526 -0.441 1.00 0.00 C ATOM 1133 CD PRO A 71 -13.083 1.462 -1.132 1.00 0.00 C ATOM 0 HA PRO A 71 -13.071 3.921 -3.311 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -11.042 4.030 -1.430 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -12.688 4.538 -1.105 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -11.273 2.122 -0.157 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -12.732 2.859 0.476 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -12.567 0.502 -1.151 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -14.029 1.305 -0.615 1.00 0.00 H new ATOM 1141 N ALA A 72 -10.867 3.847 -4.396 1.00 0.00 N ATOM 1142 CA ALA A 72 -9.747 3.676 -5.306 1.00 0.00 C ATOM 1143 C ALA A 72 -8.712 4.772 -5.046 1.00 0.00 C ATOM 1144 O ALA A 72 -8.890 5.912 -5.474 1.00 0.00 O ATOM 1145 CB ALA A 72 -10.256 3.685 -6.749 1.00 0.00 C ATOM 0 H ALA A 72 -11.251 4.791 -4.364 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.259 2.716 -5.138 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -9.416 3.557 -7.432 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -10.966 2.870 -6.890 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -10.749 4.635 -6.955 1.00 0.00 H new ATOM 1151 N PHE A 73 -7.654 4.390 -4.347 1.00 0.00 N ATOM 1152 CA PHE A 73 -6.591 5.326 -4.025 1.00 0.00 C ATOM 1153 C PHE A 73 -5.612 5.466 -5.192 1.00 0.00 C ATOM 1154 O PHE A 73 -5.229 6.577 -5.556 1.00 0.00 O ATOM 1155 CB PHE A 73 -5.846 4.759 -2.815 1.00 0.00 C ATOM 1156 CG PHE A 73 -6.748 4.041 -1.809 1.00 0.00 C ATOM 1157 CD1 PHE A 73 -7.484 4.762 -0.921 1.00 0.00 C ATOM 1158 CD2 PHE A 73 -6.815 2.683 -1.803 1.00 0.00 C ATOM 1159 CE1 PHE A 73 -8.321 4.096 0.013 1.00 0.00 C ATOM 1160 CE2 PHE A 73 -7.652 2.017 -0.869 1.00 0.00 C ATOM 1161 CZ PHE A 73 -8.388 2.738 0.019 1.00 0.00 C ATOM 0 H PHE A 73 -7.510 3.444 -3.994 1.00 0.00 H new ATOM 0 HA PHE A 73 -7.012 6.310 -3.819 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -5.083 4.063 -3.164 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -5.327 5.572 -2.307 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -7.432 5.841 -0.926 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -6.231 2.111 -2.509 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -8.905 4.668 0.719 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -7.704 0.938 -0.864 1.00 0.00 H new ATOM 0 HZ PHE A 73 -9.026 2.232 0.729 1.00 0.00 H new ATOM 1171 N ASP A 74 -5.235 4.324 -5.747 1.00 0.00 N ATOM 1172 CA ASP A 74 -4.308 4.305 -6.866 1.00 0.00 C ATOM 1173 C ASP A 74 -3.203 5.335 -6.624 1.00 0.00 C ATOM 1174 O ASP A 74 -2.820 6.066 -7.536 1.00 0.00 O ATOM 1175 CB ASP A 74 -5.015 4.668 -8.173 1.00 0.00 C ATOM 1176 CG ASP A 74 -4.613 3.821 -9.382 1.00 0.00 C ATOM 1177 OD1 ASP A 74 -3.421 3.452 -9.445 1.00 0.00 O ATOM 1178 OD2 ASP A 74 -5.508 3.562 -10.216 1.00 0.00 O ATOM 0 H ASP A 74 -5.555 3.404 -5.443 1.00 0.00 H new ATOM 0 HA ASP A 74 -3.896 3.299 -6.946 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -6.091 4.575 -8.025 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -4.814 5.715 -8.399 1.00 0.00 H new ATOM 1183 N GLU A 75 -2.721 5.360 -5.390 1.00 0.00 N ATOM 1184 CA GLU A 75 -1.667 6.288 -5.017 1.00 0.00 C ATOM 1185 C GLU A 75 -0.296 5.697 -5.350 1.00 0.00 C ATOM 1186 O GLU A 75 -0.206 4.615 -5.929 1.00 0.00 O ATOM 1187 CB GLU A 75 -1.760 6.656 -3.534 1.00 0.00 C ATOM 1188 CG GLU A 75 -2.139 8.127 -3.357 1.00 0.00 C ATOM 1189 CD GLU A 75 -0.895 8.992 -3.141 1.00 0.00 C ATOM 1190 OE1 GLU A 75 -0.314 9.416 -4.164 1.00 0.00 O ATOM 1191 OE2 GLU A 75 -0.553 9.209 -1.959 1.00 0.00 O ATOM 0 H GLU A 75 -3.041 4.752 -4.636 1.00 0.00 H new ATOM 0 HA GLU A 75 -1.796 7.204 -5.594 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -2.501 6.024 -3.045 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -0.804 6.462 -3.047 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -2.680 8.475 -4.237 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -2.812 8.233 -2.506 1.00 0.00 H new ATOM 1198 N THR A 76 0.739 6.432 -4.970 1.00 0.00 N ATOM 1199 CA THR A 76 2.101 5.994 -5.222 1.00 0.00 C ATOM 1200 C THR A 76 3.069 6.684 -4.259 1.00 0.00 C ATOM 1201 O THR A 76 3.044 7.906 -4.117 1.00 0.00 O ATOM 1202 CB THR A 76 2.418 6.258 -6.695 1.00 0.00 C ATOM 1203 OG1 THR A 76 1.766 5.195 -7.386 1.00 0.00 O ATOM 1204 CG2 THR A 76 3.900 6.059 -7.020 1.00 0.00 C ATOM 0 H THR A 76 0.661 7.328 -4.489 1.00 0.00 H new ATOM 0 HA THR A 76 2.214 4.926 -5.037 1.00 0.00 H new ATOM 0 HB THR A 76 2.123 7.275 -6.953 1.00 0.00 H new ATOM 0 HG1 THR A 76 1.246 4.662 -6.749 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.071 6.259 -8.078 1.00 0.00 H new ATOM 0 HG22 THR A 76 4.499 6.744 -6.420 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.187 5.032 -6.794 1.00 0.00 H new ATOM 1212 N PHE A 77 3.901 5.872 -3.623 1.00 0.00 N ATOM 1213 CA PHE A 77 4.876 6.389 -2.678 1.00 0.00 C ATOM 1214 C PHE A 77 6.287 5.916 -3.032 1.00 0.00 C ATOM 1215 O PHE A 77 6.544 4.715 -3.101 1.00 0.00 O ATOM 1216 CB PHE A 77 4.498 5.842 -1.301 1.00 0.00 C ATOM 1217 CG PHE A 77 3.039 6.091 -0.911 1.00 0.00 C ATOM 1218 CD1 PHE A 77 2.619 7.352 -0.623 1.00 0.00 C ATOM 1219 CD2 PHE A 77 2.164 5.053 -0.852 1.00 0.00 C ATOM 1220 CE1 PHE A 77 1.265 7.584 -0.261 1.00 0.00 C ATOM 1221 CE2 PHE A 77 0.810 5.284 -0.490 1.00 0.00 C ATOM 1222 CZ PHE A 77 0.390 6.545 -0.202 1.00 0.00 C ATOM 0 H PHE A 77 3.920 4.859 -3.744 1.00 0.00 H new ATOM 0 HA PHE A 77 4.872 7.479 -2.698 1.00 0.00 H new ATOM 0 HB2 PHE A 77 4.690 4.769 -1.282 1.00 0.00 H new ATOM 0 HB3 PHE A 77 5.146 6.295 -0.551 1.00 0.00 H new ATOM 0 HD1 PHE A 77 3.315 8.177 -0.669 1.00 0.00 H new ATOM 0 HD2 PHE A 77 2.498 4.052 -1.080 1.00 0.00 H new ATOM 0 HE1 PHE A 77 0.931 8.585 -0.033 1.00 0.00 H new ATOM 0 HE2 PHE A 77 0.115 4.459 -0.444 1.00 0.00 H new ATOM 0 HZ PHE A 77 -0.639 6.721 0.074 1.00 0.00 H new ATOM 1232 N THR A 78 7.165 6.884 -3.247 1.00 0.00 N ATOM 1233 CA THR A 78 8.544 6.582 -3.592 1.00 0.00 C ATOM 1234 C THR A 78 9.432 6.647 -2.348 1.00 0.00 C ATOM 1235 O THR A 78 9.076 7.288 -1.360 1.00 0.00 O ATOM 1236 CB THR A 78 8.977 7.545 -4.699 1.00 0.00 C ATOM 1237 OG1 THR A 78 8.588 6.889 -5.902 1.00 0.00 O ATOM 1238 CG2 THR A 78 10.498 7.661 -4.812 1.00 0.00 C ATOM 0 H THR A 78 6.948 7.879 -3.189 1.00 0.00 H new ATOM 0 HA THR A 78 8.643 5.564 -3.970 1.00 0.00 H new ATOM 0 HB THR A 78 8.551 8.530 -4.510 1.00 0.00 H new ATOM 0 HG1 THR A 78 8.830 7.446 -6.671 1.00 0.00 H new ATOM 0 HG21 THR A 78 10.751 8.356 -5.612 1.00 0.00 H new ATOM 0 HG22 THR A 78 10.906 8.028 -3.870 1.00 0.00 H new ATOM 0 HG23 THR A 78 10.922 6.682 -5.034 1.00 0.00 H new ATOM 1246 N PHE A 79 10.570 5.975 -2.436 1.00 0.00 N ATOM 1247 CA PHE A 79 11.512 5.949 -1.330 1.00 0.00 C ATOM 1248 C PHE A 79 12.930 5.657 -1.824 1.00 0.00 C ATOM 1249 O PHE A 79 13.142 4.727 -2.600 1.00 0.00 O ATOM 1250 CB PHE A 79 11.069 4.823 -0.393 1.00 0.00 C ATOM 1251 CG PHE A 79 9.579 4.852 -0.046 1.00 0.00 C ATOM 1252 CD1 PHE A 79 9.108 5.753 0.856 1.00 0.00 C ATOM 1253 CD2 PHE A 79 8.726 3.975 -0.641 1.00 0.00 C ATOM 1254 CE1 PHE A 79 7.725 5.780 1.178 1.00 0.00 C ATOM 1255 CE2 PHE A 79 7.343 4.001 -0.319 1.00 0.00 C ATOM 1256 CZ PHE A 79 6.872 4.903 0.584 1.00 0.00 C ATOM 0 H PHE A 79 10.861 5.444 -3.257 1.00 0.00 H new ATOM 0 HA PHE A 79 11.523 6.916 -0.828 1.00 0.00 H new ATOM 0 HB2 PHE A 79 11.305 3.865 -0.856 1.00 0.00 H new ATOM 0 HB3 PHE A 79 11.647 4.883 0.529 1.00 0.00 H new ATOM 0 HD1 PHE A 79 9.786 6.449 1.328 1.00 0.00 H new ATOM 0 HD2 PHE A 79 9.100 3.259 -1.358 1.00 0.00 H new ATOM 0 HE1 PHE A 79 7.351 6.497 1.894 1.00 0.00 H new ATOM 0 HE2 PHE A 79 6.665 3.305 -0.791 1.00 0.00 H new ATOM 0 HZ PHE A 79 5.820 4.923 0.829 1.00 0.00 H new ATOM 1266 N TYR A 80 13.865 6.471 -1.354 1.00 0.00 N ATOM 1267 CA TYR A 80 15.257 6.312 -1.739 1.00 0.00 C ATOM 1268 C TYR A 80 16.098 5.816 -0.560 1.00 0.00 C ATOM 1269 O TYR A 80 15.925 6.276 0.567 1.00 0.00 O ATOM 1270 CB TYR A 80 15.743 7.704 -2.147 1.00 0.00 C ATOM 1271 CG TYR A 80 14.810 8.429 -3.118 1.00 0.00 C ATOM 1272 CD1 TYR A 80 14.936 8.227 -4.478 1.00 0.00 C ATOM 1273 CD2 TYR A 80 13.841 9.285 -2.635 1.00 0.00 C ATOM 1274 CE1 TYR A 80 14.057 8.909 -5.392 1.00 0.00 C ATOM 1275 CE2 TYR A 80 12.963 9.968 -3.549 1.00 0.00 C ATOM 1276 CZ TYR A 80 13.114 9.746 -4.882 1.00 0.00 C ATOM 1277 OH TYR A 80 12.284 10.391 -5.746 1.00 0.00 O ATOM 0 H TYR A 80 13.686 7.242 -0.711 1.00 0.00 H new ATOM 0 HA TYR A 80 15.352 5.583 -2.544 1.00 0.00 H new ATOM 0 HB2 TYR A 80 15.862 8.313 -1.251 1.00 0.00 H new ATOM 0 HB3 TYR A 80 16.728 7.614 -2.605 1.00 0.00 H new ATOM 0 HD1 TYR A 80 15.694 7.557 -4.856 1.00 0.00 H new ATOM 0 HD2 TYR A 80 13.741 9.442 -1.571 1.00 0.00 H new ATOM 0 HE1 TYR A 80 14.144 8.759 -6.458 1.00 0.00 H new ATOM 0 HE2 TYR A 80 12.202 10.641 -3.184 1.00 0.00 H new ATOM 0 HH TYR A 80 11.661 10.955 -5.242 1.00 0.00 H new ATOM 1287 N GLY A 81 16.990 4.885 -0.862 1.00 0.00 N ATOM 1288 CA GLY A 81 17.858 4.322 0.158 1.00 0.00 C ATOM 1289 C GLY A 81 17.883 2.794 0.075 1.00 0.00 C ATOM 1290 O GLY A 81 18.897 2.168 0.382 1.00 0.00 O ATOM 0 H GLY A 81 17.131 4.506 -1.799 1.00 0.00 H new ATOM 0 HA2 GLY A 81 18.868 4.713 0.037 1.00 0.00 H new ATOM 0 HA3 GLY A 81 17.513 4.631 1.145 1.00 0.00 H new ATOM 1294 N ILE A 82 16.755 2.238 -0.341 1.00 0.00 N ATOM 1295 CA ILE A 82 16.634 0.795 -0.468 1.00 0.00 C ATOM 1296 C ILE A 82 17.623 0.296 -1.524 1.00 0.00 C ATOM 1297 O ILE A 82 17.510 0.644 -2.698 1.00 0.00 O ATOM 1298 CB ILE A 82 15.183 0.402 -0.750 1.00 0.00 C ATOM 1299 CG1 ILE A 82 14.227 1.098 0.221 1.00 0.00 C ATOM 1300 CG2 ILE A 82 15.013 -1.119 -0.730 1.00 0.00 C ATOM 1301 CD1 ILE A 82 13.200 1.946 -0.533 1.00 0.00 C ATOM 0 H ILE A 82 15.916 2.760 -0.595 1.00 0.00 H new ATOM 0 HA ILE A 82 16.895 0.306 0.471 1.00 0.00 H new ATOM 0 HB ILE A 82 14.926 0.742 -1.753 1.00 0.00 H new ATOM 0 HG12 ILE A 82 13.713 0.353 0.828 1.00 0.00 H new ATOM 0 HG13 ILE A 82 14.794 1.730 0.905 1.00 0.00 H new ATOM 0 HG21 ILE A 82 13.972 -1.371 -0.933 1.00 0.00 H new ATOM 0 HG22 ILE A 82 15.651 -1.566 -1.492 1.00 0.00 H new ATOM 0 HG23 ILE A 82 15.295 -1.504 0.250 1.00 0.00 H new ATOM 0 HD11 ILE A 82 12.533 2.430 0.181 1.00 0.00 H new ATOM 0 HD12 ILE A 82 13.716 2.706 -1.120 1.00 0.00 H new ATOM 0 HD13 ILE A 82 12.618 1.307 -1.198 1.00 0.00 H new ATOM 1313 N PRO A 83 18.593 -0.533 -1.056 1.00 0.00 N ATOM 1314 CA PRO A 83 19.601 -1.084 -1.946 1.00 0.00 C ATOM 1315 C PRO A 83 19.016 -2.201 -2.812 1.00 0.00 C ATOM 1316 O PRO A 83 19.755 -3.011 -3.370 1.00 0.00 O ATOM 1317 CB PRO A 83 20.715 -1.563 -1.031 1.00 0.00 C ATOM 1318 CG PRO A 83 20.095 -1.689 0.351 1.00 0.00 C ATOM 1319 CD PRO A 83 18.757 -0.967 0.329 1.00 0.00 C ATOM 0 HA PRO A 83 19.978 -0.351 -2.659 1.00 0.00 H new ATOM 0 HB2 PRO A 83 21.114 -2.520 -1.369 1.00 0.00 H new ATOM 0 HB3 PRO A 83 21.545 -0.857 -1.024 1.00 0.00 H new ATOM 0 HG2 PRO A 83 19.959 -2.738 0.614 1.00 0.00 H new ATOM 0 HG3 PRO A 83 20.751 -1.254 1.105 1.00 0.00 H new ATOM 0 HD2 PRO A 83 17.946 -1.627 0.636 1.00 0.00 H new ATOM 0 HD3 PRO A 83 18.754 -0.118 1.013 1.00 0.00 H new ATOM 1327 N TYR A 84 17.694 -2.209 -2.897 1.00 0.00 N ATOM 1328 CA TYR A 84 17.001 -3.214 -3.686 1.00 0.00 C ATOM 1329 C TYR A 84 17.164 -4.604 -3.068 1.00 0.00 C ATOM 1330 O TYR A 84 16.177 -5.264 -2.747 1.00 0.00 O ATOM 1331 CB TYR A 84 17.665 -3.200 -5.064 1.00 0.00 C ATOM 1332 CG TYR A 84 16.963 -4.079 -6.102 1.00 0.00 C ATOM 1333 CD1 TYR A 84 15.614 -3.916 -6.344 1.00 0.00 C ATOM 1334 CD2 TYR A 84 17.679 -5.034 -6.795 1.00 0.00 C ATOM 1335 CE1 TYR A 84 14.954 -4.743 -7.321 1.00 0.00 C ATOM 1336 CE2 TYR A 84 17.019 -5.860 -7.772 1.00 0.00 C ATOM 1337 CZ TYR A 84 15.688 -5.674 -7.986 1.00 0.00 C ATOM 1338 OH TYR A 84 15.065 -6.455 -8.909 1.00 0.00 O ATOM 0 H TYR A 84 17.084 -1.536 -2.433 1.00 0.00 H new ATOM 0 HA TYR A 84 15.934 -2.996 -3.734 1.00 0.00 H new ATOM 0 HB2 TYR A 84 17.694 -2.174 -5.432 1.00 0.00 H new ATOM 0 HB3 TYR A 84 18.698 -3.531 -4.961 1.00 0.00 H new ATOM 0 HD1 TYR A 84 15.054 -3.169 -5.801 1.00 0.00 H new ATOM 0 HD2 TYR A 84 18.734 -5.162 -6.604 1.00 0.00 H new ATOM 0 HE1 TYR A 84 13.899 -4.626 -7.521 1.00 0.00 H new ATOM 0 HE2 TYR A 84 17.568 -6.610 -8.322 1.00 0.00 H new ATOM 0 HH TYR A 84 15.714 -7.074 -9.305 1.00 0.00 H new ATOM 1348 N THR A 85 18.417 -5.008 -2.920 1.00 0.00 N ATOM 1349 CA THR A 85 18.723 -6.307 -2.347 1.00 0.00 C ATOM 1350 C THR A 85 18.082 -6.444 -0.964 1.00 0.00 C ATOM 1351 O THR A 85 17.938 -7.552 -0.449 1.00 0.00 O ATOM 1352 CB THR A 85 20.244 -6.472 -2.331 1.00 0.00 C ATOM 1353 OG1 THR A 85 20.687 -5.507 -1.380 1.00 0.00 O ATOM 1354 CG2 THR A 85 20.894 -6.029 -3.642 1.00 0.00 C ATOM 0 H THR A 85 19.233 -4.458 -3.187 1.00 0.00 H new ATOM 0 HA THR A 85 18.301 -7.113 -2.948 1.00 0.00 H new ATOM 0 HB THR A 85 20.495 -7.515 -2.136 1.00 0.00 H new ATOM 0 HG1 THR A 85 21.663 -5.546 -1.305 1.00 0.00 H new ATOM 0 HG21 THR A 85 21.973 -6.167 -3.578 1.00 0.00 H new ATOM 0 HG22 THR A 85 20.500 -6.627 -4.464 1.00 0.00 H new ATOM 0 HG23 THR A 85 20.673 -4.977 -3.821 1.00 0.00 H new ATOM 1362 N GLN A 86 17.714 -5.302 -0.402 1.00 0.00 N ATOM 1363 CA GLN A 86 17.092 -5.280 0.911 1.00 0.00 C ATOM 1364 C GLN A 86 15.573 -5.408 0.780 1.00 0.00 C ATOM 1365 O GLN A 86 14.877 -5.624 1.772 1.00 0.00 O ATOM 1366 CB GLN A 86 17.472 -4.011 1.676 1.00 0.00 C ATOM 1367 CG GLN A 86 17.252 -4.191 3.180 1.00 0.00 C ATOM 1368 CD GLN A 86 17.951 -3.085 3.972 1.00 0.00 C ATOM 1369 OE1 GLN A 86 18.945 -2.517 3.551 1.00 0.00 O ATOM 1370 NE2 GLN A 86 17.377 -2.811 5.141 1.00 0.00 N ATOM 0 H GLN A 86 17.835 -4.385 -0.832 1.00 0.00 H new ATOM 0 HA GLN A 86 17.461 -6.132 1.482 1.00 0.00 H new ATOM 0 HB2 GLN A 86 18.517 -3.766 1.484 1.00 0.00 H new ATOM 0 HB3 GLN A 86 16.876 -3.172 1.315 1.00 0.00 H new ATOM 0 HG2 GLN A 86 16.184 -4.181 3.399 1.00 0.00 H new ATOM 0 HG3 GLN A 86 17.632 -5.163 3.493 1.00 0.00 H new ATOM 0 HE21 GLN A 86 16.546 -3.325 5.434 1.00 0.00 H new ATOM 0 HE22 GLN A 86 17.768 -2.087 5.744 1.00 0.00 H new ATOM 1379 N ILE A 87 15.102 -5.269 -0.450 1.00 0.00 N ATOM 1380 CA ILE A 87 13.679 -5.366 -0.723 1.00 0.00 C ATOM 1381 C ILE A 87 13.157 -6.711 -0.212 1.00 0.00 C ATOM 1382 O ILE A 87 12.107 -6.772 0.425 1.00 0.00 O ATOM 1383 CB ILE A 87 13.399 -5.122 -2.207 1.00 0.00 C ATOM 1384 CG1 ILE A 87 13.948 -3.765 -2.652 1.00 0.00 C ATOM 1385 CG2 ILE A 87 11.908 -5.266 -2.515 1.00 0.00 C ATOM 1386 CD1 ILE A 87 12.973 -2.638 -2.302 1.00 0.00 C ATOM 0 H ILE A 87 15.682 -5.090 -1.270 1.00 0.00 H new ATOM 0 HA ILE A 87 13.135 -4.587 -0.188 1.00 0.00 H new ATOM 0 HB ILE A 87 13.921 -5.886 -2.783 1.00 0.00 H new ATOM 0 HG12 ILE A 87 14.909 -3.582 -2.171 1.00 0.00 H new ATOM 0 HG13 ILE A 87 14.126 -3.776 -3.727 1.00 0.00 H new ATOM 0 HG21 ILE A 87 11.737 -5.087 -3.577 1.00 0.00 H new ATOM 0 HG22 ILE A 87 11.579 -6.273 -2.259 1.00 0.00 H new ATOM 0 HG23 ILE A 87 11.344 -4.540 -1.929 1.00 0.00 H new ATOM 0 HD11 ILE A 87 13.387 -1.684 -2.629 1.00 0.00 H new ATOM 0 HD12 ILE A 87 12.021 -2.812 -2.804 1.00 0.00 H new ATOM 0 HD13 ILE A 87 12.816 -2.615 -1.224 1.00 0.00 H new ATOM 1398 N GLN A 88 13.915 -7.756 -0.512 1.00 0.00 N ATOM 1399 CA GLN A 88 13.542 -9.096 -0.091 1.00 0.00 C ATOM 1400 C GLN A 88 13.455 -9.168 1.435 1.00 0.00 C ATOM 1401 O GLN A 88 12.923 -10.131 1.985 1.00 0.00 O ATOM 1402 CB GLN A 88 14.525 -10.134 -0.634 1.00 0.00 C ATOM 1403 CG GLN A 88 14.674 -10.008 -2.151 1.00 0.00 C ATOM 1404 CD GLN A 88 16.119 -10.265 -2.584 1.00 0.00 C ATOM 1405 OE1 GLN A 88 16.742 -11.243 -2.206 1.00 0.00 O ATOM 1406 NE2 GLN A 88 16.614 -9.335 -3.396 1.00 0.00 N ATOM 0 H GLN A 88 14.785 -7.702 -1.041 1.00 0.00 H new ATOM 0 HA GLN A 88 12.559 -9.325 -0.502 1.00 0.00 H new ATOM 0 HB2 GLN A 88 15.497 -10.004 -0.158 1.00 0.00 H new ATOM 0 HB3 GLN A 88 14.178 -11.136 -0.381 1.00 0.00 H new ATOM 0 HG2 GLN A 88 14.011 -10.718 -2.645 1.00 0.00 H new ATOM 0 HG3 GLN A 88 14.367 -9.011 -2.468 1.00 0.00 H new ATOM 0 HE21 GLN A 88 16.037 -8.541 -3.673 1.00 0.00 H new ATOM 0 HE22 GLN A 88 17.570 -9.416 -3.741 1.00 0.00 H new ATOM 1415 N GLU A 89 13.986 -8.137 2.076 1.00 0.00 N ATOM 1416 CA GLU A 89 13.975 -8.071 3.527 1.00 0.00 C ATOM 1417 C GLU A 89 12.910 -7.083 4.006 1.00 0.00 C ATOM 1418 O GLU A 89 12.866 -6.736 5.185 1.00 0.00 O ATOM 1419 CB GLU A 89 15.356 -7.695 4.069 1.00 0.00 C ATOM 1420 CG GLU A 89 16.288 -8.907 4.084 1.00 0.00 C ATOM 1421 CD GLU A 89 16.503 -9.416 5.511 1.00 0.00 C ATOM 1422 OE1 GLU A 89 17.341 -8.806 6.211 1.00 0.00 O ATOM 1423 OE2 GLU A 89 15.826 -10.403 5.870 1.00 0.00 O ATOM 0 H GLU A 89 14.427 -7.340 1.616 1.00 0.00 H new ATOM 0 HA GLU A 89 13.726 -9.059 3.914 1.00 0.00 H new ATOM 0 HB2 GLU A 89 15.789 -6.906 3.454 1.00 0.00 H new ATOM 0 HB3 GLU A 89 15.258 -7.295 5.078 1.00 0.00 H new ATOM 0 HG2 GLU A 89 15.866 -9.703 3.470 1.00 0.00 H new ATOM 0 HG3 GLU A 89 17.247 -8.638 3.642 1.00 0.00 H new ATOM 1430 N LEU A 90 12.077 -6.659 3.067 1.00 0.00 N ATOM 1431 CA LEU A 90 11.014 -5.718 3.378 1.00 0.00 C ATOM 1432 C LEU A 90 9.665 -6.435 3.300 1.00 0.00 C ATOM 1433 O LEU A 90 9.611 -7.637 3.046 1.00 0.00 O ATOM 1434 CB LEU A 90 11.109 -4.486 2.477 1.00 0.00 C ATOM 1435 CG LEU A 90 12.403 -3.676 2.581 1.00 0.00 C ATOM 1436 CD1 LEU A 90 12.363 -2.456 1.659 1.00 0.00 C ATOM 1437 CD2 LEU A 90 12.690 -3.287 4.033 1.00 0.00 C ATOM 0 H LEU A 90 12.117 -6.950 2.090 1.00 0.00 H new ATOM 0 HA LEU A 90 11.119 -5.347 4.398 1.00 0.00 H new ATOM 0 HB2 LEU A 90 10.987 -4.807 1.442 1.00 0.00 H new ATOM 0 HB3 LEU A 90 10.272 -3.827 2.707 1.00 0.00 H new ATOM 0 HG LEU A 90 13.227 -4.305 2.246 1.00 0.00 H new ATOM 0 HD11 LEU A 90 13.295 -1.898 1.753 1.00 0.00 H new ATOM 0 HD12 LEU A 90 12.239 -2.784 0.627 1.00 0.00 H new ATOM 0 HD13 LEU A 90 11.527 -1.815 1.939 1.00 0.00 H new ATOM 0 HD21 LEU A 90 13.615 -2.712 4.080 1.00 0.00 H new ATOM 0 HD22 LEU A 90 11.868 -2.683 4.417 1.00 0.00 H new ATOM 0 HD23 LEU A 90 12.792 -4.188 4.638 1.00 0.00 H new ATOM 1449 N ALA A 91 8.609 -5.667 3.524 1.00 0.00 N ATOM 1450 CA ALA A 91 7.263 -6.214 3.483 1.00 0.00 C ATOM 1451 C ALA A 91 6.252 -5.084 3.687 1.00 0.00 C ATOM 1452 O ALA A 91 6.289 -4.389 4.702 1.00 0.00 O ATOM 1453 CB ALA A 91 7.127 -7.316 4.535 1.00 0.00 C ATOM 0 H ALA A 91 8.658 -4.670 3.735 1.00 0.00 H new ATOM 0 HA ALA A 91 7.061 -6.665 2.511 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.118 -7.726 4.504 1.00 0.00 H new ATOM 0 HB2 ALA A 91 7.847 -8.108 4.328 1.00 0.00 H new ATOM 0 HB3 ALA A 91 7.320 -6.901 5.524 1.00 0.00 H new ATOM 1459 N LEU A 92 5.372 -4.936 2.708 1.00 0.00 N ATOM 1460 CA LEU A 92 4.353 -3.902 2.768 1.00 0.00 C ATOM 1461 C LEU A 92 3.167 -4.409 3.592 1.00 0.00 C ATOM 1462 O LEU A 92 2.484 -5.349 3.191 1.00 0.00 O ATOM 1463 CB LEU A 92 3.971 -3.444 1.359 1.00 0.00 C ATOM 1464 CG LEU A 92 5.115 -2.913 0.493 1.00 0.00 C ATOM 1465 CD1 LEU A 92 6.200 -2.266 1.355 1.00 0.00 C ATOM 1466 CD2 LEU A 92 5.679 -4.014 -0.407 1.00 0.00 C ATOM 0 H LEU A 92 5.343 -5.515 1.869 1.00 0.00 H new ATOM 0 HA LEU A 92 4.738 -3.016 3.273 1.00 0.00 H new ATOM 0 HB2 LEU A 92 3.507 -4.282 0.839 1.00 0.00 H new ATOM 0 HB3 LEU A 92 3.214 -2.664 1.445 1.00 0.00 H new ATOM 0 HG LEU A 92 4.716 -2.137 -0.160 1.00 0.00 H new ATOM 0 HD11 LEU A 92 7.001 -1.897 0.715 1.00 0.00 H new ATOM 0 HD12 LEU A 92 5.772 -1.435 1.916 1.00 0.00 H new ATOM 0 HD13 LEU A 92 6.601 -3.004 2.049 1.00 0.00 H new ATOM 0 HD21 LEU A 92 6.491 -3.609 -1.012 1.00 0.00 H new ATOM 0 HD22 LEU A 92 6.057 -4.830 0.209 1.00 0.00 H new ATOM 0 HD23 LEU A 92 4.891 -4.389 -1.061 1.00 0.00 H new ATOM 1478 N HIS A 93 2.960 -3.762 4.730 1.00 0.00 N ATOM 1479 CA HIS A 93 1.869 -4.135 5.614 1.00 0.00 C ATOM 1480 C HIS A 93 0.643 -3.272 5.309 1.00 0.00 C ATOM 1481 O HIS A 93 0.600 -2.098 5.672 1.00 0.00 O ATOM 1482 CB HIS A 93 2.304 -4.051 7.079 1.00 0.00 C ATOM 1483 CG HIS A 93 1.310 -4.642 8.049 1.00 0.00 C ATOM 1484 ND1 HIS A 93 0.711 -3.902 9.054 1.00 0.00 N ATOM 1485 CD2 HIS A 93 0.817 -5.909 8.158 1.00 0.00 C ATOM 1486 CE1 HIS A 93 -0.103 -4.698 9.731 1.00 0.00 C ATOM 1487 NE2 HIS A 93 -0.036 -5.942 9.175 1.00 0.00 N ATOM 0 H HIS A 93 3.529 -2.982 5.060 1.00 0.00 H new ATOM 0 HA HIS A 93 1.592 -5.174 5.437 1.00 0.00 H new ATOM 0 HB2 HIS A 93 3.258 -4.565 7.194 1.00 0.00 H new ATOM 0 HB3 HIS A 93 2.472 -3.006 7.338 1.00 0.00 H new ATOM 0 HD2 HIS A 93 1.077 -6.744 7.524 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -0.713 -4.412 10.575 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -0.555 -6.762 9.489 1.00 0.00 H new ATOM 1495 N PHE A 94 -0.324 -3.888 4.645 1.00 0.00 N ATOM 1496 CA PHE A 94 -1.547 -3.191 4.286 1.00 0.00 C ATOM 1497 C PHE A 94 -2.654 -3.467 5.306 1.00 0.00 C ATOM 1498 O PHE A 94 -3.175 -4.580 5.376 1.00 0.00 O ATOM 1499 CB PHE A 94 -1.983 -3.725 2.921 1.00 0.00 C ATOM 1500 CG PHE A 94 -0.948 -3.520 1.813 1.00 0.00 C ATOM 1501 CD1 PHE A 94 -0.409 -2.288 1.606 1.00 0.00 C ATOM 1502 CD2 PHE A 94 -0.566 -4.568 1.035 1.00 0.00 C ATOM 1503 CE1 PHE A 94 0.552 -2.098 0.578 1.00 0.00 C ATOM 1504 CE2 PHE A 94 0.394 -4.378 0.007 1.00 0.00 C ATOM 1505 CZ PHE A 94 0.933 -3.146 -0.200 1.00 0.00 C ATOM 0 H PHE A 94 -0.285 -4.862 4.346 1.00 0.00 H new ATOM 0 HA PHE A 94 -1.370 -2.116 4.264 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -2.198 -4.790 3.011 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -2.913 -3.235 2.631 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -0.712 -1.455 2.223 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -0.994 -5.546 1.200 1.00 0.00 H new ATOM 0 HE1 PHE A 94 0.981 -1.120 0.414 1.00 0.00 H new ATOM 0 HE2 PHE A 94 0.696 -5.211 -0.611 1.00 0.00 H new ATOM 0 HZ PHE A 94 1.663 -3.001 -0.982 1.00 0.00 H new ATOM 1515 N THR A 95 -2.981 -2.436 6.071 1.00 0.00 N ATOM 1516 CA THR A 95 -4.017 -2.554 7.083 1.00 0.00 C ATOM 1517 C THR A 95 -5.312 -1.900 6.599 1.00 0.00 C ATOM 1518 O THR A 95 -5.337 -0.706 6.307 1.00 0.00 O ATOM 1519 CB THR A 95 -3.479 -1.950 8.382 1.00 0.00 C ATOM 1520 OG1 THR A 95 -2.210 -2.574 8.556 1.00 0.00 O ATOM 1521 CG2 THR A 95 -4.282 -2.389 9.608 1.00 0.00 C ATOM 0 H THR A 95 -2.547 -1.515 6.010 1.00 0.00 H new ATOM 0 HA THR A 95 -4.269 -3.598 7.272 1.00 0.00 H new ATOM 0 HB THR A 95 -3.493 -0.862 8.310 1.00 0.00 H new ATOM 0 HG1 THR A 95 -1.790 -2.238 9.375 1.00 0.00 H new ATOM 0 HG21 THR A 95 -3.859 -1.932 10.503 1.00 0.00 H new ATOM 0 HG22 THR A 95 -5.319 -2.074 9.496 1.00 0.00 H new ATOM 0 HG23 THR A 95 -4.241 -3.474 9.700 1.00 0.00 H new ATOM 1529 N ILE A 96 -6.357 -2.712 6.530 1.00 0.00 N ATOM 1530 CA ILE A 96 -7.653 -2.227 6.087 1.00 0.00 C ATOM 1531 C ILE A 96 -8.480 -1.809 7.304 1.00 0.00 C ATOM 1532 O ILE A 96 -9.241 -2.609 7.846 1.00 0.00 O ATOM 1533 CB ILE A 96 -8.342 -3.270 5.204 1.00 0.00 C ATOM 1534 CG1 ILE A 96 -7.479 -3.616 3.989 1.00 0.00 C ATOM 1535 CG2 ILE A 96 -9.743 -2.807 4.799 1.00 0.00 C ATOM 1536 CD1 ILE A 96 -6.218 -4.374 4.410 1.00 0.00 C ATOM 0 H ILE A 96 -6.332 -3.702 6.773 1.00 0.00 H new ATOM 0 HA ILE A 96 -7.535 -1.342 5.462 1.00 0.00 H new ATOM 0 HB ILE A 96 -8.461 -4.184 5.785 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -8.055 -4.222 3.290 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -7.200 -2.702 3.464 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -10.210 -3.567 4.172 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -10.348 -2.652 5.693 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -9.671 -1.872 4.243 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.622 -4.608 3.528 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.632 -3.756 5.090 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -6.500 -5.299 4.913 1.00 0.00 H new ATOM 1548 N LEU A 97 -8.304 -0.557 7.698 1.00 0.00 N ATOM 1549 CA LEU A 97 -9.024 -0.023 8.841 1.00 0.00 C ATOM 1550 C LEU A 97 -10.280 0.703 8.353 1.00 0.00 C ATOM 1551 O LEU A 97 -10.719 0.500 7.222 1.00 0.00 O ATOM 1552 CB LEU A 97 -8.102 0.850 9.696 1.00 0.00 C ATOM 1553 CG LEU A 97 -6.783 0.208 10.128 1.00 0.00 C ATOM 1554 CD1 LEU A 97 -5.692 0.436 9.079 1.00 0.00 C ATOM 1555 CD2 LEU A 97 -6.360 0.703 11.512 1.00 0.00 C ATOM 0 H LEU A 97 -7.672 0.104 7.245 1.00 0.00 H new ATOM 0 HA LEU A 97 -9.355 -0.831 9.494 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -7.876 1.759 9.139 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -8.647 1.152 10.591 1.00 0.00 H new ATOM 0 HG LEU A 97 -6.936 -0.869 10.204 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -4.765 -0.031 9.411 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -6.001 -0.005 8.131 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -5.532 1.506 8.947 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -5.419 0.231 11.795 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -6.230 1.785 11.487 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -7.129 0.446 12.241 1.00 0.00 H new ATOM 1567 N SER A 98 -10.822 1.535 9.231 1.00 0.00 N ATOM 1568 CA SER A 98 -12.019 2.292 8.904 1.00 0.00 C ATOM 1569 C SER A 98 -11.976 3.659 9.589 1.00 0.00 C ATOM 1570 O SER A 98 -11.859 3.742 10.810 1.00 0.00 O ATOM 1571 CB SER A 98 -13.281 1.531 9.315 1.00 0.00 C ATOM 1572 OG SER A 98 -13.888 2.093 10.476 1.00 0.00 O ATOM 0 H SER A 98 -10.455 1.701 10.168 1.00 0.00 H new ATOM 0 HA SER A 98 -12.050 2.435 7.824 1.00 0.00 H new ATOM 0 HB2 SER A 98 -13.995 1.541 8.491 1.00 0.00 H new ATOM 0 HB3 SER A 98 -13.029 0.488 9.506 1.00 0.00 H new ATOM 0 HG SER A 98 -14.530 1.455 10.851 1.00 0.00 H new ATOM 1701 N ASP A 106 -10.735 1.072 13.312 1.00 0.00 N ATOM 1702 CA ASP A 106 -11.470 -0.177 13.219 1.00 0.00 C ATOM 1703 C ASP A 106 -10.819 -1.070 12.160 1.00 0.00 C ATOM 1704 O ASP A 106 -11.193 -1.023 10.989 1.00 0.00 O ATOM 1705 CB ASP A 106 -12.922 0.068 12.802 1.00 0.00 C ATOM 1706 CG ASP A 106 -13.965 -0.255 13.874 1.00 0.00 C ATOM 1707 OD1 ASP A 106 -13.653 -1.109 14.731 1.00 0.00 O ATOM 1708 OD2 ASP A 106 -15.052 0.360 13.811 1.00 0.00 O ATOM 0 HA ASP A 106 -11.451 -0.653 14.200 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -13.030 1.114 12.514 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -13.136 -0.530 11.916 1.00 0.00 H new ATOM 1713 N ILE A 107 -9.857 -1.862 12.610 1.00 0.00 N ATOM 1714 CA ILE A 107 -9.151 -2.763 11.716 1.00 0.00 C ATOM 1715 C ILE A 107 -10.126 -3.815 11.184 1.00 0.00 C ATOM 1716 O ILE A 107 -10.589 -4.673 11.933 1.00 0.00 O ATOM 1717 CB ILE A 107 -7.926 -3.358 12.413 1.00 0.00 C ATOM 1718 CG1 ILE A 107 -6.779 -2.347 12.465 1.00 0.00 C ATOM 1719 CG2 ILE A 107 -7.502 -4.671 11.752 1.00 0.00 C ATOM 1720 CD1 ILE A 107 -5.738 -2.750 13.511 1.00 0.00 C ATOM 0 H ILE A 107 -9.550 -1.898 13.582 1.00 0.00 H new ATOM 0 HA ILE A 107 -8.766 -2.219 10.853 1.00 0.00 H new ATOM 0 HB ILE A 107 -8.199 -3.589 13.443 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -6.307 -2.277 11.485 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -7.172 -1.358 12.701 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -6.629 -5.072 12.267 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -8.320 -5.389 11.811 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -7.254 -4.489 10.706 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -4.934 -2.014 13.527 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -6.208 -2.795 14.493 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -5.329 -3.729 13.259 1.00 0.00 H new ATOM 1732 N ILE A 108 -10.410 -3.713 9.894 1.00 0.00 N ATOM 1733 CA ILE A 108 -11.323 -4.645 9.252 1.00 0.00 C ATOM 1734 C ILE A 108 -10.581 -5.946 8.942 1.00 0.00 C ATOM 1735 O ILE A 108 -11.185 -7.017 8.908 1.00 0.00 O ATOM 1736 CB ILE A 108 -11.973 -4.000 8.027 1.00 0.00 C ATOM 1737 CG1 ILE A 108 -12.952 -2.899 8.440 1.00 0.00 C ATOM 1738 CG2 ILE A 108 -12.638 -5.055 7.140 1.00 0.00 C ATOM 1739 CD1 ILE A 108 -13.177 -1.908 7.297 1.00 0.00 C ATOM 0 H ILE A 108 -10.024 -2.999 9.276 1.00 0.00 H new ATOM 0 HA ILE A 108 -12.144 -4.898 9.923 1.00 0.00 H new ATOM 0 HB ILE A 108 -11.190 -3.528 7.434 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -13.903 -3.344 8.733 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -12.565 -2.372 9.312 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -13.093 -4.570 6.276 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -11.889 -5.771 6.802 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -13.407 -5.577 7.709 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -13.877 -1.136 7.617 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -12.228 -1.447 7.023 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -13.587 -2.434 6.435 1.00 0.00 H new ATOM 1751 N GLY A 109 -9.281 -5.811 8.722 1.00 0.00 N ATOM 1752 CA GLY A 109 -8.450 -6.963 8.415 1.00 0.00 C ATOM 1753 C GLY A 109 -6.972 -6.572 8.353 1.00 0.00 C ATOM 1754 O GLY A 109 -6.630 -5.399 8.495 1.00 0.00 O ATOM 0 H GLY A 109 -8.783 -4.921 8.750 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -8.595 -7.733 9.173 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -8.756 -7.393 7.461 1.00 0.00 H new ATOM 1758 N GLU A 110 -6.136 -7.577 8.140 1.00 0.00 N ATOM 1759 CA GLU A 110 -4.703 -7.353 8.057 1.00 0.00 C ATOM 1760 C GLU A 110 -4.131 -8.030 6.809 1.00 0.00 C ATOM 1761 O GLU A 110 -4.419 -9.196 6.544 1.00 0.00 O ATOM 1762 CB GLU A 110 -3.996 -7.848 9.320 1.00 0.00 C ATOM 1763 CG GLU A 110 -4.510 -7.111 10.559 1.00 0.00 C ATOM 1764 CD GLU A 110 -3.547 -7.282 11.737 1.00 0.00 C ATOM 1765 OE1 GLU A 110 -2.326 -7.315 11.471 1.00 0.00 O ATOM 1766 OE2 GLU A 110 -4.054 -7.376 12.875 1.00 0.00 O ATOM 0 H GLU A 110 -6.423 -8.549 8.022 1.00 0.00 H new ATOM 0 HA GLU A 110 -4.527 -6.280 7.978 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -4.158 -8.920 9.436 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -2.921 -7.697 9.222 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -4.629 -6.051 10.333 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -5.494 -7.492 10.831 1.00 0.00 H new ATOM 1773 N VAL A 111 -3.332 -7.268 6.076 1.00 0.00 N ATOM 1774 CA VAL A 111 -2.718 -7.779 4.862 1.00 0.00 C ATOM 1775 C VAL A 111 -1.208 -7.536 4.919 1.00 0.00 C ATOM 1776 O VAL A 111 -0.756 -6.545 5.489 1.00 0.00 O ATOM 1777 CB VAL A 111 -3.379 -7.149 3.635 1.00 0.00 C ATOM 1778 CG1 VAL A 111 -2.438 -7.177 2.429 1.00 0.00 C ATOM 1779 CG2 VAL A 111 -4.706 -7.840 3.312 1.00 0.00 C ATOM 0 H VAL A 111 -3.096 -6.301 6.299 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.872 -8.855 4.780 1.00 0.00 H new ATOM 0 HB VAL A 111 -3.592 -6.106 3.868 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -2.933 -6.723 1.571 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -1.531 -6.619 2.662 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -2.178 -8.209 2.194 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -5.155 -7.373 2.436 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -4.526 -8.896 3.109 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -5.382 -7.744 4.161 1.00 0.00 H new ATOM 1789 N LEU A 112 -0.470 -8.458 4.319 1.00 0.00 N ATOM 1790 CA LEU A 112 0.980 -8.357 4.293 1.00 0.00 C ATOM 1791 C LEU A 112 1.505 -8.946 2.983 1.00 0.00 C ATOM 1792 O LEU A 112 1.013 -9.972 2.518 1.00 0.00 O ATOM 1793 CB LEU A 112 1.584 -9.001 5.543 1.00 0.00 C ATOM 1794 CG LEU A 112 3.111 -8.981 5.636 1.00 0.00 C ATOM 1795 CD1 LEU A 112 3.604 -7.687 6.285 1.00 0.00 C ATOM 1796 CD2 LEU A 112 3.632 -10.222 6.363 1.00 0.00 C ATOM 0 H LEU A 112 -0.849 -9.279 3.847 1.00 0.00 H new ATOM 0 HA LEU A 112 1.290 -7.312 4.319 1.00 0.00 H new ATOM 0 HB2 LEU A 112 1.180 -8.495 6.420 1.00 0.00 H new ATOM 0 HB3 LEU A 112 1.250 -10.038 5.591 1.00 0.00 H new ATOM 0 HG LEU A 112 3.515 -9.007 4.624 1.00 0.00 H new ATOM 0 HD11 LEU A 112 4.693 -7.699 6.339 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.279 -6.834 5.689 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.192 -7.604 7.291 1.00 0.00 H new ATOM 0 HD21 LEU A 112 4.720 -10.183 6.415 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.221 -10.252 7.372 1.00 0.00 H new ATOM 0 HD23 LEU A 112 3.327 -11.117 5.820 1.00 0.00 H new ATOM 1808 N ILE A 113 2.498 -8.270 2.424 1.00 0.00 N ATOM 1809 CA ILE A 113 3.096 -8.713 1.176 1.00 0.00 C ATOM 1810 C ILE A 113 4.620 -8.653 1.296 1.00 0.00 C ATOM 1811 O ILE A 113 5.223 -7.606 1.068 1.00 0.00 O ATOM 1812 CB ILE A 113 2.539 -7.909 -0.001 1.00 0.00 C ATOM 1813 CG1 ILE A 113 2.580 -8.727 -1.293 1.00 0.00 C ATOM 1814 CG2 ILE A 113 3.270 -6.572 -0.145 1.00 0.00 C ATOM 1815 CD1 ILE A 113 1.443 -9.750 -1.330 1.00 0.00 C ATOM 0 H ILE A 113 2.904 -7.419 2.813 1.00 0.00 H new ATOM 0 HA ILE A 113 2.832 -9.751 0.975 1.00 0.00 H new ATOM 0 HB ILE A 113 1.492 -7.684 0.203 1.00 0.00 H new ATOM 0 HG12 ILE A 113 2.503 -8.061 -2.152 1.00 0.00 H new ATOM 0 HG13 ILE A 113 3.538 -9.240 -1.373 1.00 0.00 H new ATOM 0 HG21 ILE A 113 2.856 -6.020 -0.988 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.145 -5.989 0.767 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.331 -6.754 -0.317 1.00 0.00 H new ATOM 0 HD11 ILE A 113 1.495 -10.318 -2.259 1.00 0.00 H new ATOM 0 HD12 ILE A 113 1.537 -10.430 -0.483 1.00 0.00 H new ATOM 0 HD13 ILE A 113 0.486 -9.232 -1.275 1.00 0.00 H new ATOM 1827 N PRO A 114 5.214 -9.820 1.662 1.00 0.00 N ATOM 1828 CA PRO A 114 6.656 -9.910 1.815 1.00 0.00 C ATOM 1829 C PRO A 114 7.351 -9.945 0.452 1.00 0.00 C ATOM 1830 O PRO A 114 7.098 -10.838 -0.355 1.00 0.00 O ATOM 1831 CB PRO A 114 6.888 -11.171 2.631 1.00 0.00 C ATOM 1832 CG PRO A 114 5.611 -11.987 2.510 1.00 0.00 C ATOM 1833 CD PRO A 114 4.532 -11.081 1.940 1.00 0.00 C ATOM 0 HA PRO A 114 7.080 -9.041 2.319 1.00 0.00 H new ATOM 0 HB2 PRO A 114 7.745 -11.729 2.253 1.00 0.00 H new ATOM 0 HB3 PRO A 114 7.099 -10.929 3.672 1.00 0.00 H new ATOM 0 HG2 PRO A 114 5.768 -12.848 1.861 1.00 0.00 H new ATOM 0 HG3 PRO A 114 5.310 -12.373 3.484 1.00 0.00 H new ATOM 0 HD2 PRO A 114 4.098 -11.504 1.034 1.00 0.00 H new ATOM 0 HD3 PRO A 114 3.716 -10.942 2.650 1.00 0.00 H new ATOM 1841 N LEU A 115 8.213 -8.961 0.238 1.00 0.00 N ATOM 1842 CA LEU A 115 8.946 -8.868 -1.013 1.00 0.00 C ATOM 1843 C LEU A 115 10.098 -9.874 -1.000 1.00 0.00 C ATOM 1844 O LEU A 115 10.884 -9.936 -1.945 1.00 0.00 O ATOM 1845 CB LEU A 115 9.391 -7.426 -1.267 1.00 0.00 C ATOM 1846 CG LEU A 115 8.386 -6.337 -0.887 1.00 0.00 C ATOM 1847 CD1 LEU A 115 8.971 -4.944 -1.126 1.00 0.00 C ATOM 1848 CD2 LEU A 115 7.059 -6.536 -1.621 1.00 0.00 C ATOM 0 H LEU A 115 8.420 -8.222 0.910 1.00 0.00 H new ATOM 0 HA LEU A 115 8.302 -9.131 -1.852 1.00 0.00 H new ATOM 0 HB2 LEU A 115 10.314 -7.249 -0.715 1.00 0.00 H new ATOM 0 HB3 LEU A 115 9.627 -7.321 -2.326 1.00 0.00 H new ATOM 0 HG LEU A 115 8.179 -6.420 0.180 1.00 0.00 H new ATOM 0 HD11 LEU A 115 8.236 -4.188 -0.848 1.00 0.00 H new ATOM 0 HD12 LEU A 115 9.869 -4.818 -0.521 1.00 0.00 H new ATOM 0 HD13 LEU A 115 9.225 -4.832 -2.180 1.00 0.00 H new ATOM 0 HD21 LEU A 115 6.362 -5.749 -1.333 1.00 0.00 H new ATOM 0 HD22 LEU A 115 7.229 -6.495 -2.697 1.00 0.00 H new ATOM 0 HD23 LEU A 115 6.639 -7.507 -1.357 1.00 0.00 H new ATOM 1860 N SER A 116 10.163 -10.638 0.080 1.00 0.00 N ATOM 1861 CA SER A 116 11.207 -11.638 0.228 1.00 0.00 C ATOM 1862 C SER A 116 11.116 -12.661 -0.906 1.00 0.00 C ATOM 1863 O SER A 116 10.465 -13.695 -0.764 1.00 0.00 O ATOM 1864 CB SER A 116 11.108 -12.340 1.584 1.00 0.00 C ATOM 1865 OG SER A 116 12.024 -13.427 1.691 1.00 0.00 O ATOM 0 H SER A 116 9.510 -10.585 0.861 1.00 0.00 H new ATOM 0 HA SER A 116 12.173 -11.135 0.179 1.00 0.00 H new ATOM 0 HB2 SER A 116 11.304 -11.621 2.380 1.00 0.00 H new ATOM 0 HB3 SER A 116 10.092 -12.707 1.729 1.00 0.00 H new ATOM 0 HG SER A 116 11.931 -13.848 2.571 1.00 0.00 H new ATOM 1871 N GLY A 117 11.778 -12.336 -2.007 1.00 0.00 N ATOM 1872 CA GLY A 117 11.780 -13.213 -3.165 1.00 0.00 C ATOM 1873 C GLY A 117 11.243 -12.490 -4.402 1.00 0.00 C ATOM 1874 O GLY A 117 11.523 -12.891 -5.530 1.00 0.00 O ATOM 0 H GLY A 117 12.317 -11.477 -2.121 1.00 0.00 H new ATOM 0 HA2 GLY A 117 12.793 -13.565 -3.357 1.00 0.00 H new ATOM 0 HA3 GLY A 117 11.170 -14.093 -2.960 1.00 0.00 H new ATOM 1878 N ILE A 118 10.480 -11.437 -4.147 1.00 0.00 N ATOM 1879 CA ILE A 118 9.901 -10.655 -5.226 1.00 0.00 C ATOM 1880 C ILE A 118 11.021 -9.967 -6.010 1.00 0.00 C ATOM 1881 O ILE A 118 12.060 -9.629 -5.446 1.00 0.00 O ATOM 1882 CB ILE A 118 8.848 -9.687 -4.681 1.00 0.00 C ATOM 1883 CG1 ILE A 118 7.580 -10.434 -4.264 1.00 0.00 C ATOM 1884 CG2 ILE A 118 8.553 -8.573 -5.687 1.00 0.00 C ATOM 1885 CD1 ILE A 118 6.588 -10.521 -5.426 1.00 0.00 C ATOM 0 H ILE A 118 10.250 -11.107 -3.210 1.00 0.00 H new ATOM 0 HA ILE A 118 9.373 -11.303 -5.925 1.00 0.00 H new ATOM 0 HB ILE A 118 9.251 -9.213 -3.786 1.00 0.00 H new ATOM 0 HG12 ILE A 118 7.839 -11.437 -3.926 1.00 0.00 H new ATOM 0 HG13 ILE A 118 7.114 -9.924 -3.421 1.00 0.00 H new ATOM 0 HG21 ILE A 118 7.802 -7.900 -5.274 1.00 0.00 H new ATOM 0 HG22 ILE A 118 9.467 -8.015 -5.891 1.00 0.00 H new ATOM 0 HG23 ILE A 118 8.180 -9.009 -6.614 1.00 0.00 H new ATOM 0 HD11 ILE A 118 5.695 -11.057 -5.103 1.00 0.00 H new ATOM 0 HD12 ILE A 118 6.312 -9.516 -5.745 1.00 0.00 H new ATOM 0 HD13 ILE A 118 7.049 -11.052 -6.259 1.00 0.00 H new ATOM 1897 N GLU A 119 10.770 -9.781 -7.298 1.00 0.00 N ATOM 1898 CA GLU A 119 11.745 -9.141 -8.164 1.00 0.00 C ATOM 1899 C GLU A 119 11.115 -7.940 -8.874 1.00 0.00 C ATOM 1900 O GLU A 119 10.117 -8.084 -9.578 1.00 0.00 O ATOM 1901 CB GLU A 119 12.318 -10.136 -9.175 1.00 0.00 C ATOM 1902 CG GLU A 119 11.323 -10.404 -10.306 1.00 0.00 C ATOM 1903 CD GLU A 119 11.495 -11.818 -10.864 1.00 0.00 C ATOM 1904 OE1 GLU A 119 11.065 -12.760 -10.165 1.00 0.00 O ATOM 1905 OE2 GLU A 119 12.054 -11.924 -11.978 1.00 0.00 O ATOM 0 H GLU A 119 9.906 -10.062 -7.762 1.00 0.00 H new ATOM 0 HA GLU A 119 12.570 -8.784 -7.548 1.00 0.00 H new ATOM 0 HB2 GLU A 119 13.247 -9.745 -9.589 1.00 0.00 H new ATOM 0 HB3 GLU A 119 12.562 -11.071 -8.672 1.00 0.00 H new ATOM 0 HG2 GLU A 119 10.305 -10.276 -9.938 1.00 0.00 H new ATOM 0 HG3 GLU A 119 11.468 -9.675 -11.103 1.00 0.00 H new ATOM 1912 N LEU A 120 11.725 -6.783 -8.664 1.00 0.00 N ATOM 1913 CA LEU A 120 11.236 -5.558 -9.275 1.00 0.00 C ATOM 1914 C LEU A 120 12.351 -4.934 -10.117 1.00 0.00 C ATOM 1915 O LEU A 120 12.598 -3.732 -10.033 1.00 0.00 O ATOM 1916 CB LEU A 120 10.670 -4.617 -8.210 1.00 0.00 C ATOM 1917 CG LEU A 120 9.515 -5.170 -7.372 1.00 0.00 C ATOM 1918 CD1 LEU A 120 9.302 -4.331 -6.111 1.00 0.00 C ATOM 1919 CD2 LEU A 120 8.238 -5.284 -8.207 1.00 0.00 C ATOM 0 H LEU A 120 12.553 -6.667 -8.080 1.00 0.00 H new ATOM 0 HA LEU A 120 10.408 -5.773 -9.950 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.479 -4.334 -7.536 1.00 0.00 H new ATOM 0 HB3 LEU A 120 10.332 -3.705 -8.702 1.00 0.00 H new ATOM 0 HG LEU A 120 9.779 -6.177 -7.048 1.00 0.00 H new ATOM 0 HD11 LEU A 120 8.476 -4.745 -5.534 1.00 0.00 H new ATOM 0 HD12 LEU A 120 10.209 -4.345 -5.507 1.00 0.00 H new ATOM 0 HD13 LEU A 120 9.069 -3.304 -6.392 1.00 0.00 H new ATOM 0 HD21 LEU A 120 7.433 -5.679 -7.588 1.00 0.00 H new ATOM 0 HD22 LEU A 120 7.958 -4.299 -8.581 1.00 0.00 H new ATOM 0 HD23 LEU A 120 8.412 -5.955 -9.048 1.00 0.00 H new ATOM 1931 N SER A 121 12.994 -5.779 -10.909 1.00 0.00 N ATOM 1932 CA SER A 121 14.076 -5.325 -11.766 1.00 0.00 C ATOM 1933 C SER A 121 13.528 -4.407 -12.861 1.00 0.00 C ATOM 1934 O SER A 121 13.562 -4.753 -14.040 1.00 0.00 O ATOM 1935 CB SER A 121 14.819 -6.508 -12.389 1.00 0.00 C ATOM 1936 OG SER A 121 16.211 -6.245 -12.539 1.00 0.00 O ATOM 0 H SER A 121 12.787 -6.775 -10.975 1.00 0.00 H new ATOM 0 HA SER A 121 14.785 -4.767 -11.154 1.00 0.00 H new ATOM 0 HB2 SER A 121 14.682 -7.391 -11.765 1.00 0.00 H new ATOM 0 HB3 SER A 121 14.386 -6.736 -13.363 1.00 0.00 H new ATOM 0 HG SER A 121 16.430 -5.391 -12.112 1.00 0.00 H new ATOM 1942 N GLU A 122 13.034 -3.255 -12.430 1.00 0.00 N ATOM 1943 CA GLU A 122 12.479 -2.286 -13.359 1.00 0.00 C ATOM 1944 C GLU A 122 11.209 -2.839 -14.008 1.00 0.00 C ATOM 1945 O GLU A 122 10.666 -2.236 -14.933 1.00 0.00 O ATOM 1946 CB GLU A 122 13.509 -1.890 -14.419 1.00 0.00 C ATOM 1947 CG GLU A 122 14.271 -0.631 -14.000 1.00 0.00 C ATOM 1948 CD GLU A 122 14.914 0.049 -15.211 1.00 0.00 C ATOM 1949 OE1 GLU A 122 15.659 -0.654 -15.927 1.00 0.00 O ATOM 1950 OE2 GLU A 122 14.645 1.256 -15.392 1.00 0.00 O ATOM 0 H GLU A 122 13.007 -2.972 -11.451 1.00 0.00 H new ATOM 0 HA GLU A 122 12.216 -1.387 -12.801 1.00 0.00 H new ATOM 0 HB2 GLU A 122 14.211 -2.710 -14.573 1.00 0.00 H new ATOM 0 HB3 GLU A 122 13.008 -1.716 -15.371 1.00 0.00 H new ATOM 0 HG2 GLU A 122 13.590 0.063 -13.507 1.00 0.00 H new ATOM 0 HG3 GLU A 122 15.041 -0.892 -13.274 1.00 0.00 H new ATOM 1957 N GLY A 123 10.771 -3.981 -13.498 1.00 0.00 N ATOM 1958 CA GLY A 123 9.575 -4.622 -14.016 1.00 0.00 C ATOM 1959 C GLY A 123 8.417 -4.507 -13.023 1.00 0.00 C ATOM 1960 O GLY A 123 8.460 -5.095 -11.943 1.00 0.00 O ATOM 0 H GLY A 123 11.223 -4.479 -12.731 1.00 0.00 H new ATOM 0 HA2 GLY A 123 9.293 -4.163 -14.963 1.00 0.00 H new ATOM 0 HA3 GLY A 123 9.781 -5.673 -14.220 1.00 0.00 H new ATOM 1964 N LYS A 124 7.408 -3.747 -13.424 1.00 0.00 N ATOM 1965 CA LYS A 124 6.241 -3.547 -12.582 1.00 0.00 C ATOM 1966 C LYS A 124 5.328 -4.770 -12.686 1.00 0.00 C ATOM 1967 O LYS A 124 4.983 -5.201 -13.786 1.00 0.00 O ATOM 1968 CB LYS A 124 5.546 -2.230 -12.933 1.00 0.00 C ATOM 1969 CG LYS A 124 4.232 -2.081 -12.164 1.00 0.00 C ATOM 1970 CD LYS A 124 3.326 -1.039 -12.822 1.00 0.00 C ATOM 1971 CE LYS A 124 2.022 -1.675 -13.309 1.00 0.00 C ATOM 1972 NZ LYS A 124 0.978 -0.642 -13.490 1.00 0.00 N ATOM 0 H LYS A 124 7.375 -3.262 -14.321 1.00 0.00 H new ATOM 0 HA LYS A 124 6.536 -3.456 -11.537 1.00 0.00 H new ATOM 0 HB2 LYS A 124 6.205 -1.394 -12.700 1.00 0.00 H new ATOM 0 HB3 LYS A 124 5.351 -2.192 -14.005 1.00 0.00 H new ATOM 0 HG2 LYS A 124 3.719 -3.042 -12.125 1.00 0.00 H new ATOM 0 HG3 LYS A 124 4.440 -1.789 -11.135 1.00 0.00 H new ATOM 0 HD2 LYS A 124 3.103 -0.244 -12.110 1.00 0.00 H new ATOM 0 HD3 LYS A 124 3.846 -0.578 -13.662 1.00 0.00 H new ATOM 0 HE2 LYS A 124 2.194 -2.196 -14.251 1.00 0.00 H new ATOM 0 HE3 LYS A 124 1.683 -2.421 -12.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 0.100 -1.090 -13.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 0.802 -0.163 -12.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 1.297 0.055 -14.193 1.00 0.00 H new ATOM 1986 N MET A 125 4.962 -5.296 -11.526 1.00 0.00 N ATOM 1987 CA MET A 125 4.096 -6.462 -11.473 1.00 0.00 C ATOM 1988 C MET A 125 2.866 -6.191 -10.603 1.00 0.00 C ATOM 1989 O MET A 125 2.976 -5.588 -9.537 1.00 0.00 O ATOM 1990 CB MET A 125 4.873 -7.650 -10.903 1.00 0.00 C ATOM 1991 CG MET A 125 5.129 -7.471 -9.405 1.00 0.00 C ATOM 1992 SD MET A 125 5.904 -8.934 -8.739 1.00 0.00 S ATOM 1993 CE MET A 125 7.622 -8.488 -8.927 1.00 0.00 C ATOM 0 H MET A 125 5.249 -4.936 -10.616 1.00 0.00 H new ATOM 0 HA MET A 125 3.760 -6.689 -12.485 1.00 0.00 H new ATOM 0 HB2 MET A 125 4.313 -8.570 -11.072 1.00 0.00 H new ATOM 0 HB3 MET A 125 5.823 -7.753 -11.428 1.00 0.00 H new ATOM 0 HG2 MET A 125 5.767 -6.603 -9.238 1.00 0.00 H new ATOM 0 HG3 MET A 125 4.189 -7.280 -8.887 1.00 0.00 H new ATOM 0 HE1 MET A 125 8.238 -9.386 -8.884 1.00 0.00 H new ATOM 0 HE2 MET A 125 7.767 -7.994 -9.888 1.00 0.00 H new ATOM 0 HE3 MET A 125 7.912 -7.811 -8.124 1.00 0.00 H new ATOM 2003 N LEU A 126 1.724 -6.651 -11.091 1.00 0.00 N ATOM 2004 CA LEU A 126 0.475 -6.467 -10.371 1.00 0.00 C ATOM 2005 C LEU A 126 0.332 -7.565 -9.315 1.00 0.00 C ATOM 2006 O LEU A 126 0.672 -8.720 -9.566 1.00 0.00 O ATOM 2007 CB LEU A 126 -0.701 -6.397 -11.348 1.00 0.00 C ATOM 2008 CG LEU A 126 -1.748 -5.318 -11.062 1.00 0.00 C ATOM 2009 CD1 LEU A 126 -2.284 -5.440 -9.634 1.00 0.00 C ATOM 2010 CD2 LEU A 126 -1.189 -3.923 -11.347 1.00 0.00 C ATOM 0 H LEU A 126 1.637 -7.151 -11.976 1.00 0.00 H new ATOM 0 HA LEU A 126 0.478 -5.514 -9.842 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -0.305 -6.235 -12.351 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -1.200 -7.366 -11.355 1.00 0.00 H new ATOM 0 HG LEU A 126 -2.590 -5.471 -11.737 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.026 -4.662 -9.456 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -2.745 -6.419 -9.501 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -1.463 -5.327 -8.926 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -1.953 -3.175 -11.136 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -0.320 -3.743 -10.714 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -0.895 -3.856 -12.395 1.00 0.00 H new ATOM 2022 N MET A 127 -0.170 -7.165 -8.156 1.00 0.00 N ATOM 2023 CA MET A 127 -0.361 -8.100 -7.061 1.00 0.00 C ATOM 2024 C MET A 127 -1.657 -7.802 -6.305 1.00 0.00 C ATOM 2025 O MET A 127 -2.128 -6.665 -6.297 1.00 0.00 O ATOM 2026 CB MET A 127 0.825 -8.009 -6.098 1.00 0.00 C ATOM 2027 CG MET A 127 2.133 -8.369 -6.804 1.00 0.00 C ATOM 2028 SD MET A 127 3.060 -9.532 -5.816 1.00 0.00 S ATOM 2029 CE MET A 127 3.312 -8.556 -4.344 1.00 0.00 C ATOM 0 H MET A 127 -0.450 -6.206 -7.952 1.00 0.00 H new ATOM 0 HA MET A 127 -0.427 -9.106 -7.475 1.00 0.00 H new ATOM 0 HB2 MET A 127 0.892 -6.999 -5.693 1.00 0.00 H new ATOM 0 HB3 MET A 127 0.666 -8.681 -5.255 1.00 0.00 H new ATOM 0 HG2 MET A 127 1.921 -8.799 -7.783 1.00 0.00 H new ATOM 0 HG3 MET A 127 2.725 -7.469 -6.972 1.00 0.00 H new ATOM 0 HE1 MET A 127 4.380 -8.400 -4.189 1.00 0.00 H new ATOM 0 HE2 MET A 127 2.817 -7.592 -4.458 1.00 0.00 H new ATOM 0 HE3 MET A 127 2.894 -9.079 -3.484 1.00 0.00 H new ATOM 2039 N ASN A 128 -2.198 -8.842 -5.687 1.00 0.00 N ATOM 2040 CA ASN A 128 -3.430 -8.705 -4.930 1.00 0.00 C ATOM 2041 C ASN A 128 -3.297 -9.462 -3.607 1.00 0.00 C ATOM 2042 O ASN A 128 -2.438 -10.331 -3.468 1.00 0.00 O ATOM 2043 CB ASN A 128 -4.616 -9.297 -5.696 1.00 0.00 C ATOM 2044 CG ASN A 128 -4.181 -10.501 -6.534 1.00 0.00 C ATOM 2045 OD1 ASN A 128 -3.321 -11.277 -6.153 1.00 0.00 O ATOM 2046 ND2 ASN A 128 -4.822 -10.612 -7.694 1.00 0.00 N ATOM 0 H ASN A 128 -1.805 -9.783 -5.695 1.00 0.00 H new ATOM 0 HA ASN A 128 -3.605 -7.643 -4.759 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -5.393 -9.600 -4.994 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.051 -8.536 -6.344 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -4.604 -11.382 -8.326 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -5.532 -9.927 -7.952 1.00 0.00 H new ATOM 2053 N ARG A 129 -4.161 -9.103 -2.668 1.00 0.00 N ATOM 2054 CA ARG A 129 -4.150 -9.738 -1.361 1.00 0.00 C ATOM 2055 C ARG A 129 -5.573 -9.834 -0.806 1.00 0.00 C ATOM 2056 O ARG A 129 -6.413 -8.982 -1.091 1.00 0.00 O ATOM 2057 CB ARG A 129 -3.279 -8.955 -0.376 1.00 0.00 C ATOM 2058 CG ARG A 129 -1.901 -9.603 -0.229 1.00 0.00 C ATOM 2059 CD ARG A 129 -1.983 -10.886 0.600 1.00 0.00 C ATOM 2060 NE ARG A 129 -0.632 -11.466 0.772 1.00 0.00 N ATOM 2061 CZ ARG A 129 0.002 -12.184 -0.164 1.00 0.00 C ATOM 2062 NH1 ARG A 129 -0.588 -12.416 -1.345 1.00 0.00 N ATOM 2063 NH2 ARG A 129 1.226 -12.671 0.079 1.00 0.00 N ATOM 0 H ARG A 129 -4.872 -8.381 -2.786 1.00 0.00 H new ATOM 0 HA ARG A 129 -3.734 -10.738 -1.482 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -3.167 -7.927 -0.721 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -3.771 -8.913 0.596 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -1.494 -9.828 -1.215 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -1.215 -8.902 0.246 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -2.422 -10.672 1.574 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -2.637 -11.606 0.107 1.00 0.00 H new ATOM 0 HE ARG A 129 -0.154 -11.309 1.659 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -1.520 -12.046 -1.531 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -0.105 -12.963 -2.058 1.00 0.00 H new ATOM 0 HH21 ARG A 129 1.676 -12.495 0.977 1.00 0.00 H new ATOM 0 HH22 ARG A 129 1.708 -13.218 -0.634 1.00 0.00 H new ATOM 2077 N GLU A 130 -5.800 -10.880 -0.025 1.00 0.00 N ATOM 2078 CA GLU A 130 -7.106 -11.099 0.572 1.00 0.00 C ATOM 2079 C GLU A 130 -7.137 -10.551 2.000 1.00 0.00 C ATOM 2080 O GLU A 130 -6.182 -10.725 2.756 1.00 0.00 O ATOM 2081 CB GLU A 130 -7.479 -12.583 0.546 1.00 0.00 C ATOM 2082 CG GLU A 130 -6.917 -13.310 1.769 1.00 0.00 C ATOM 2083 CD GLU A 130 -6.639 -14.781 1.453 1.00 0.00 C ATOM 2084 OE1 GLU A 130 -7.591 -15.580 1.586 1.00 0.00 O ATOM 2085 OE2 GLU A 130 -5.481 -15.074 1.085 1.00 0.00 O ATOM 0 H GLU A 130 -5.101 -11.585 0.208 1.00 0.00 H new ATOM 0 HA GLU A 130 -7.848 -10.561 -0.018 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -8.564 -12.689 0.522 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -7.094 -13.043 -0.364 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -5.997 -12.824 2.094 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -7.624 -13.239 2.595 1.00 0.00 H new ATOM 2092 N ILE A 131 -8.243 -9.899 2.326 1.00 0.00 N ATOM 2093 CA ILE A 131 -8.410 -9.324 3.650 1.00 0.00 C ATOM 2094 C ILE A 131 -9.206 -10.294 4.526 1.00 0.00 C ATOM 2095 O ILE A 131 -10.333 -10.656 4.191 1.00 0.00 O ATOM 2096 CB ILE A 131 -9.033 -7.930 3.554 1.00 0.00 C ATOM 2097 CG1 ILE A 131 -8.074 -6.947 2.878 1.00 0.00 C ATOM 2098 CG2 ILE A 131 -9.486 -7.436 4.929 1.00 0.00 C ATOM 2099 CD1 ILE A 131 -8.756 -6.231 1.710 1.00 0.00 C ATOM 0 H ILE A 131 -9.032 -9.756 1.696 1.00 0.00 H new ATOM 0 HA ILE A 131 -7.441 -9.183 4.129 1.00 0.00 H new ATOM 0 HB ILE A 131 -9.922 -7.995 2.927 1.00 0.00 H new ATOM 0 HG12 ILE A 131 -7.727 -6.214 3.606 1.00 0.00 H new ATOM 0 HG13 ILE A 131 -7.194 -7.481 2.518 1.00 0.00 H new ATOM 0 HG21 ILE A 131 -9.925 -6.443 4.832 1.00 0.00 H new ATOM 0 HG22 ILE A 131 -10.228 -8.123 5.336 1.00 0.00 H new ATOM 0 HG23 ILE A 131 -8.628 -7.390 5.600 1.00 0.00 H new ATOM 0 HD11 ILE A 131 -8.053 -5.538 1.247 1.00 0.00 H new ATOM 0 HD12 ILE A 131 -9.081 -6.965 0.973 1.00 0.00 H new ATOM 0 HD13 ILE A 131 -9.621 -5.679 2.077 1.00 0.00 H new ATOM 2111 N ILE A 132 -8.588 -10.687 5.630 1.00 0.00 N ATOM 2112 CA ILE A 132 -9.225 -11.608 6.556 1.00 0.00 C ATOM 2113 C ILE A 132 -9.079 -11.073 7.982 1.00 0.00 C ATOM 2114 O ILE A 132 -8.612 -9.953 8.183 1.00 0.00 O ATOM 2115 CB ILE A 132 -8.672 -13.023 6.370 1.00 0.00 C ATOM 2116 CG1 ILE A 132 -7.159 -12.995 6.144 1.00 0.00 C ATOM 2117 CG2 ILE A 132 -9.407 -13.755 5.246 1.00 0.00 C ATOM 2118 CD1 ILE A 132 -6.418 -12.645 7.436 1.00 0.00 C ATOM 0 H ILE A 132 -7.653 -10.385 5.904 1.00 0.00 H new ATOM 0 HA ILE A 132 -10.293 -11.678 6.349 1.00 0.00 H new ATOM 0 HB ILE A 132 -8.849 -13.583 7.288 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -6.824 -13.966 5.780 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -6.916 -12.265 5.372 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -8.995 -14.758 5.134 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -10.467 -13.823 5.489 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -9.283 -13.206 4.312 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -5.344 -12.632 7.248 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -6.737 -11.663 7.784 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -6.643 -13.391 8.198 1.00 0.00 H new ATOM 2130 N SER A 133 -9.487 -11.899 8.934 1.00 0.00 N ATOM 2131 CA SER A 133 -9.407 -11.522 10.336 1.00 0.00 C ATOM 2132 C SER A 133 -8.029 -11.878 10.896 1.00 0.00 C ATOM 2133 O SER A 133 -7.879 -12.878 11.596 1.00 0.00 O ATOM 2134 CB SER A 133 -10.505 -12.206 11.153 1.00 0.00 C ATOM 2135 OG SER A 133 -10.463 -11.827 12.526 1.00 0.00 O ATOM 0 H SER A 133 -9.874 -12.827 8.763 1.00 0.00 H new ATOM 0 HA SER A 133 -9.554 -10.444 10.410 1.00 0.00 H new ATOM 0 HB2 SER A 133 -11.479 -11.951 10.736 1.00 0.00 H new ATOM 0 HB3 SER A 133 -10.397 -13.288 11.072 1.00 0.00 H new ATOM 0 HG SER A 133 -11.180 -12.283 13.013 1.00 0.00 H new