USER MOD reduce.3.24.130724 H: found=0, std=0, add=997, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 994 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 120 LYS NZ :NH3+ -168:sc= 0.0205 (180deg=0) USER MOD Set 1.2: A 122 HIS : no HE2:sc= 0.13 K(o=0.15,f=-0.52) USER MOD Set 2.1: A 73 HIS : no HE2:sc= -0.307 K(o=0.73,f=-8.3!) USER MOD Set 2.2: A 85 SER OG : rot -141:sc= 1.04 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot -7:sc= -0.607! USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN :FLIP amide:sc= 0 F(o=-0.57,f=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 GLN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 CYS SG : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 54:sc= -3.42! USER MOD Single : A 55 LYS NZ :NH3+ -147:sc= -0.0781 (180deg=-0.517) USER MOD Single : A 56 LYS NZ :NH3+ 166:sc= -0.0069 (180deg=-0.0738) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 HIS : no HD1:sc= -14.7! C(o=-15!,f=-15!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot -1:sc= 1.07 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc=-0.00455 X(o=-0.0046,f=0) USER MOD Single : A 80 HIS : no HE2:sc= -0.267 K(o=-0.27,f=-0.95) USER MOD Single : A 81 THR OG1 : rot 180:sc= -1.06 USER MOD Single : A 82 TYR OH : rot 150:sc= -4.13! USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot 108:sc= 1.07 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 95 ASN : amide:sc= -4.8! C(o=-4.8!,f=-13!) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 TYR OH : rot 40:sc= 0.0301 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ -155:sc=-0.00117 (180deg=-0.0296) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 110 HIS : no HD1:sc= -0.0827 X(o=-0.083,f=-0.083) USER MOD Single : A 113 THR OG1 : rot 118:sc= 0.484 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= -0.0475 USER MOD Single : A 119 SER OG : rot -92:sc= 0.0219 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 HIS : no HD1:sc=-0.00238 X(o=-0.0024,f=-0.28) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 8 N VAL A 3 -7.317 -1.706 18.770 1.00 0.00 N ATOM 9 CA VAL A 3 -6.260 -2.011 17.765 1.00 0.00 C ATOM 10 C VAL A 3 -5.853 -0.723 17.047 1.00 0.00 C ATOM 11 O VAL A 3 -6.686 0.061 16.636 1.00 0.00 O ATOM 12 CB VAL A 3 -6.799 -3.016 16.745 1.00 0.00 C ATOM 13 CG1 VAL A 3 -5.834 -3.111 15.562 1.00 0.00 C ATOM 14 CG2 VAL A 3 -6.932 -4.390 17.406 1.00 0.00 C ATOM 0 HA VAL A 3 -5.392 -2.436 18.269 1.00 0.00 H new ATOM 0 HB VAL A 3 -7.776 -2.686 16.391 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -6.218 -3.827 14.836 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -5.738 -2.133 15.091 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -4.857 -3.441 15.915 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -7.316 -5.107 16.680 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -5.955 -4.720 17.760 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -7.620 -4.323 18.249 1.00 0.00 H new ATOM 24 N TYR A 4 -4.577 -0.498 16.891 1.00 0.00 N ATOM 25 CA TYR A 4 -4.116 0.738 16.198 1.00 0.00 C ATOM 26 C TYR A 4 -3.236 0.355 15.008 1.00 0.00 C ATOM 27 O TYR A 4 -2.570 -0.662 15.018 1.00 0.00 O ATOM 28 CB TYR A 4 -3.311 1.599 17.172 1.00 0.00 C ATOM 29 CG TYR A 4 -4.157 1.922 18.380 1.00 0.00 C ATOM 30 CD1 TYR A 4 -5.108 2.947 18.315 1.00 0.00 C ATOM 31 CD2 TYR A 4 -3.988 1.197 19.566 1.00 0.00 C ATOM 32 CE1 TYR A 4 -5.892 3.247 19.435 1.00 0.00 C ATOM 33 CE2 TYR A 4 -4.772 1.497 20.687 1.00 0.00 C ATOM 34 CZ TYR A 4 -5.724 2.522 20.622 1.00 0.00 C ATOM 35 OH TYR A 4 -6.496 2.817 21.726 1.00 0.00 O ATOM 0 H TYR A 4 -3.834 -1.117 17.214 1.00 0.00 H new ATOM 0 HA TYR A 4 -4.980 1.301 15.845 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -2.408 1.072 17.478 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -2.992 2.519 16.682 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -5.237 3.507 17.400 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -3.253 0.407 19.616 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -6.626 4.037 19.384 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -4.642 0.938 21.602 1.00 0.00 H new ATOM 0 HH TYR A 4 -6.253 2.220 22.464 1.00 0.00 H new ATOM 45 N THR A 5 -3.223 1.162 13.984 1.00 0.00 N ATOM 46 CA THR A 5 -2.382 0.844 12.796 1.00 0.00 C ATOM 47 C THR A 5 -1.027 1.543 12.931 1.00 0.00 C ATOM 48 O THR A 5 -0.945 2.684 13.340 1.00 0.00 O ATOM 49 CB THR A 5 -3.085 1.333 11.527 1.00 0.00 C ATOM 50 OG1 THR A 5 -4.429 0.877 11.528 1.00 0.00 O ATOM 51 CG2 THR A 5 -2.359 0.787 10.297 1.00 0.00 C ATOM 0 H THR A 5 -3.758 2.028 13.918 1.00 0.00 H new ATOM 0 HA THR A 5 -2.231 -0.234 12.734 1.00 0.00 H new ATOM 0 HB THR A 5 -3.071 2.423 11.499 1.00 0.00 H new ATOM 0 HG1 THR A 5 -4.881 1.190 10.717 1.00 0.00 H new ATOM 0 HG21 THR A 5 -2.860 1.136 9.394 1.00 0.00 H new ATOM 0 HG22 THR A 5 -1.327 1.138 10.298 1.00 0.00 H new ATOM 0 HG23 THR A 5 -2.371 -0.303 10.321 1.00 0.00 H new ATOM 59 N TYR A 6 0.037 0.867 12.595 1.00 0.00 N ATOM 60 CA TYR A 6 1.384 1.494 12.707 1.00 0.00 C ATOM 61 C TYR A 6 2.079 1.463 11.344 1.00 0.00 C ATOM 62 O TYR A 6 2.080 0.459 10.659 1.00 0.00 O ATOM 63 CB TYR A 6 2.222 0.718 13.726 1.00 0.00 C ATOM 64 CG TYR A 6 3.566 1.386 13.889 1.00 0.00 C ATOM 65 CD1 TYR A 6 3.710 2.464 14.772 1.00 0.00 C ATOM 66 CD2 TYR A 6 4.669 0.929 13.158 1.00 0.00 C ATOM 67 CE1 TYR A 6 4.957 3.083 14.924 1.00 0.00 C ATOM 68 CE2 TYR A 6 5.916 1.548 13.309 1.00 0.00 C ATOM 69 CZ TYR A 6 6.060 2.625 14.193 1.00 0.00 C ATOM 70 OH TYR A 6 7.288 3.235 14.343 1.00 0.00 O ATOM 0 H TYR A 6 0.032 -0.092 12.248 1.00 0.00 H new ATOM 0 HA TYR A 6 1.278 2.528 13.034 1.00 0.00 H new ATOM 0 HB2 TYR A 6 1.704 0.680 14.685 1.00 0.00 H new ATOM 0 HB3 TYR A 6 2.354 -0.312 13.395 1.00 0.00 H new ATOM 0 HD1 TYR A 6 2.859 2.818 15.336 1.00 0.00 H new ATOM 0 HD2 TYR A 6 4.558 0.098 12.477 1.00 0.00 H new ATOM 0 HE1 TYR A 6 5.068 3.914 15.605 1.00 0.00 H new ATOM 0 HE2 TYR A 6 6.766 1.195 12.744 1.00 0.00 H new ATOM 0 HH TYR A 6 7.945 2.794 13.765 1.00 0.00 H new ATOM 80 N GLU A 7 2.673 2.556 10.947 1.00 0.00 N ATOM 81 CA GLU A 7 3.369 2.590 9.630 1.00 0.00 C ATOM 82 C GLU A 7 4.874 2.751 9.856 1.00 0.00 C ATOM 83 O GLU A 7 5.308 3.572 10.639 1.00 0.00 O ATOM 84 CB GLU A 7 2.847 3.770 8.808 1.00 0.00 C ATOM 85 CG GLU A 7 3.521 3.776 7.435 1.00 0.00 C ATOM 86 CD GLU A 7 3.026 4.979 6.629 1.00 0.00 C ATOM 87 OE1 GLU A 7 2.279 5.769 7.181 1.00 0.00 O ATOM 88 OE2 GLU A 7 3.402 5.088 5.474 1.00 0.00 O ATOM 0 H GLU A 7 2.706 3.426 11.478 1.00 0.00 H new ATOM 0 HA GLU A 7 3.178 1.661 9.092 1.00 0.00 H new ATOM 0 HB2 GLU A 7 1.766 3.696 8.693 1.00 0.00 H new ATOM 0 HB3 GLU A 7 3.049 4.706 9.328 1.00 0.00 H new ATOM 0 HG2 GLU A 7 4.604 3.822 7.550 1.00 0.00 H new ATOM 0 HG3 GLU A 7 3.296 2.851 6.904 1.00 0.00 H new ATOM 95 N ASN A 8 5.673 1.974 9.178 1.00 0.00 N ATOM 96 CA ASN A 8 7.148 2.084 9.358 1.00 0.00 C ATOM 97 C ASN A 8 7.806 2.400 8.013 1.00 0.00 C ATOM 98 O ASN A 8 7.531 1.767 7.013 1.00 0.00 O ATOM 99 CB ASN A 8 7.698 0.761 9.895 1.00 0.00 C ATOM 100 CG ASN A 8 9.186 0.918 10.212 1.00 0.00 C ATOM 101 OD1 ASN A 8 10.029 0.452 9.471 1.00 0.00 O ATOM 102 ND2 ASN A 8 9.548 1.560 11.290 1.00 0.00 N ATOM 0 H ASN A 8 5.369 1.268 8.508 1.00 0.00 H new ATOM 0 HA ASN A 8 7.367 2.883 10.066 1.00 0.00 H new ATOM 0 HB2 ASN A 8 7.153 0.466 10.792 1.00 0.00 H new ATOM 0 HB3 ASN A 8 7.554 -0.030 9.160 1.00 0.00 H new ATOM 0 HD21 ASN A 8 10.538 1.670 11.510 1.00 0.00 H new ATOM 0 HD22 ASN A 8 8.841 1.951 11.912 1.00 0.00 H new ATOM 109 N GLU A 9 8.674 3.375 7.981 1.00 0.00 N ATOM 110 CA GLU A 9 9.349 3.728 6.700 1.00 0.00 C ATOM 111 C GLU A 9 10.784 3.197 6.719 1.00 0.00 C ATOM 112 O GLU A 9 11.584 3.572 7.553 1.00 0.00 O ATOM 113 CB GLU A 9 9.372 5.250 6.539 1.00 0.00 C ATOM 114 CG GLU A 9 7.946 5.796 6.628 1.00 0.00 C ATOM 115 CD GLU A 9 7.967 7.313 6.432 1.00 0.00 C ATOM 116 OE1 GLU A 9 9.046 7.879 6.469 1.00 0.00 O ATOM 117 OE2 GLU A 9 6.904 7.882 6.249 1.00 0.00 O ATOM 0 H GLU A 9 8.944 3.941 8.785 1.00 0.00 H new ATOM 0 HA GLU A 9 8.806 3.282 5.867 1.00 0.00 H new ATOM 0 HB2 GLU A 9 9.993 5.699 7.314 1.00 0.00 H new ATOM 0 HB3 GLU A 9 9.816 5.518 5.580 1.00 0.00 H new ATOM 0 HG2 GLU A 9 7.319 5.329 5.869 1.00 0.00 H new ATOM 0 HG3 GLU A 9 7.511 5.550 7.597 1.00 0.00 H new ATOM 124 N PHE A 10 11.117 2.325 5.806 1.00 0.00 N ATOM 125 CA PHE A 10 12.499 1.771 5.775 1.00 0.00 C ATOM 126 C PHE A 10 13.033 1.811 4.341 1.00 0.00 C ATOM 127 O PHE A 10 12.366 1.407 3.409 1.00 0.00 O ATOM 128 CB PHE A 10 12.482 0.325 6.273 1.00 0.00 C ATOM 129 CG PHE A 10 13.864 -0.270 6.142 1.00 0.00 C ATOM 130 CD1 PHE A 10 14.778 -0.157 7.196 1.00 0.00 C ATOM 131 CD2 PHE A 10 14.232 -0.934 4.965 1.00 0.00 C ATOM 132 CE1 PHE A 10 16.059 -0.708 7.075 1.00 0.00 C ATOM 133 CE2 PHE A 10 15.514 -1.486 4.844 1.00 0.00 C ATOM 134 CZ PHE A 10 16.427 -1.373 5.899 1.00 0.00 C ATOM 0 H PHE A 10 10.492 1.973 5.081 1.00 0.00 H new ATOM 0 HA PHE A 10 13.144 2.369 6.420 1.00 0.00 H new ATOM 0 HB2 PHE A 10 12.157 0.291 7.313 1.00 0.00 H new ATOM 0 HB3 PHE A 10 11.766 -0.261 5.696 1.00 0.00 H new ATOM 0 HD1 PHE A 10 14.495 0.356 8.103 1.00 0.00 H new ATOM 0 HD2 PHE A 10 13.528 -1.020 4.151 1.00 0.00 H new ATOM 0 HE1 PHE A 10 16.764 -0.620 7.889 1.00 0.00 H new ATOM 0 HE2 PHE A 10 15.798 -1.999 3.937 1.00 0.00 H new ATOM 0 HZ PHE A 10 17.415 -1.799 5.806 1.00 0.00 H new ATOM 144 N THR A 11 14.231 2.293 4.157 1.00 0.00 N ATOM 145 CA THR A 11 14.807 2.357 2.785 1.00 0.00 C ATOM 146 C THR A 11 15.642 1.101 2.526 1.00 0.00 C ATOM 147 O THR A 11 16.308 0.595 3.407 1.00 0.00 O ATOM 148 CB THR A 11 15.695 3.597 2.663 1.00 0.00 C ATOM 149 OG1 THR A 11 16.904 3.385 3.379 1.00 0.00 O ATOM 150 CG2 THR A 11 14.964 4.810 3.243 1.00 0.00 C ATOM 0 H THR A 11 14.836 2.646 4.898 1.00 0.00 H new ATOM 0 HA THR A 11 14.002 2.415 2.053 1.00 0.00 H new ATOM 0 HB THR A 11 15.921 3.779 1.612 1.00 0.00 H new ATOM 0 HG1 THR A 11 17.474 4.178 3.300 1.00 0.00 H new ATOM 0 HG21 THR A 11 15.598 5.693 3.156 1.00 0.00 H new ATOM 0 HG22 THR A 11 14.037 4.973 2.694 1.00 0.00 H new ATOM 0 HG23 THR A 11 14.736 4.629 4.294 1.00 0.00 H new ATOM 158 N SER A 12 15.609 0.591 1.325 1.00 0.00 N ATOM 159 CA SER A 12 16.399 -0.635 1.015 1.00 0.00 C ATOM 160 C SER A 12 17.119 -0.459 -0.323 1.00 0.00 C ATOM 161 O SER A 12 16.755 0.373 -1.132 1.00 0.00 O ATOM 162 CB SER A 12 15.459 -1.839 0.931 1.00 0.00 C ATOM 163 OG SER A 12 14.712 -1.942 2.135 1.00 0.00 O ATOM 0 H SER A 12 15.070 0.969 0.546 1.00 0.00 H new ATOM 0 HA SER A 12 17.134 -0.799 1.803 1.00 0.00 H new ATOM 0 HB2 SER A 12 14.786 -1.729 0.081 1.00 0.00 H new ATOM 0 HB3 SER A 12 16.033 -2.751 0.767 1.00 0.00 H new ATOM 0 HG SER A 12 15.045 -1.287 2.784 1.00 0.00 H new ATOM 169 N ASP A 13 18.139 -1.239 -0.564 1.00 0.00 N ATOM 170 CA ASP A 13 18.883 -1.121 -1.850 1.00 0.00 C ATOM 171 C ASP A 13 17.997 -1.612 -2.997 1.00 0.00 C ATOM 172 O ASP A 13 16.844 -1.945 -2.804 1.00 0.00 O ATOM 173 CB ASP A 13 20.152 -1.974 -1.783 1.00 0.00 C ATOM 174 CG ASP A 13 21.180 -1.288 -0.882 1.00 0.00 C ATOM 175 OD1 ASP A 13 20.975 -0.129 -0.558 1.00 0.00 O ATOM 176 OD2 ASP A 13 22.155 -1.932 -0.532 1.00 0.00 O ATOM 0 H ASP A 13 18.489 -1.953 0.075 1.00 0.00 H new ATOM 0 HA ASP A 13 19.154 -0.079 -2.021 1.00 0.00 H new ATOM 0 HB2 ASP A 13 19.917 -2.965 -1.395 1.00 0.00 H new ATOM 0 HB3 ASP A 13 20.563 -2.112 -2.783 1.00 0.00 H new ATOM 181 N ILE A 14 18.523 -1.659 -4.191 1.00 0.00 N ATOM 182 CA ILE A 14 17.704 -2.126 -5.345 1.00 0.00 C ATOM 183 C ILE A 14 16.515 -1.180 -5.530 1.00 0.00 C ATOM 184 O ILE A 14 15.935 -0.710 -4.571 1.00 0.00 O ATOM 185 CB ILE A 14 17.196 -3.544 -5.070 1.00 0.00 C ATOM 186 CG1 ILE A 14 18.325 -4.383 -4.469 1.00 0.00 C ATOM 187 CG2 ILE A 14 16.732 -4.181 -6.381 1.00 0.00 C ATOM 188 CD1 ILE A 14 17.884 -4.940 -3.113 1.00 0.00 C ATOM 0 H ILE A 14 19.482 -1.395 -4.417 1.00 0.00 H new ATOM 0 HA ILE A 14 18.311 -2.132 -6.250 1.00 0.00 H new ATOM 0 HB ILE A 14 16.362 -3.502 -4.370 1.00 0.00 H new ATOM 0 HG12 ILE A 14 18.583 -5.200 -5.143 1.00 0.00 H new ATOM 0 HG13 ILE A 14 19.221 -3.774 -4.349 1.00 0.00 H new ATOM 0 HG21 ILE A 14 16.370 -5.191 -6.187 1.00 0.00 H new ATOM 0 HG22 ILE A 14 15.928 -3.584 -6.811 1.00 0.00 H new ATOM 0 HG23 ILE A 14 17.567 -4.223 -7.081 1.00 0.00 H new ATOM 0 HD11 ILE A 14 18.689 -5.538 -2.686 1.00 0.00 H new ATOM 0 HD12 ILE A 14 17.648 -4.115 -2.440 1.00 0.00 H new ATOM 0 HD13 ILE A 14 17.000 -5.564 -3.246 1.00 0.00 H new ATOM 200 N PRO A 15 16.148 -0.892 -6.789 1.00 0.00 N ATOM 201 CA PRO A 15 15.030 0.006 -7.097 1.00 0.00 C ATOM 202 C PRO A 15 13.678 -0.610 -6.718 1.00 0.00 C ATOM 203 O PRO A 15 13.480 -1.806 -6.796 1.00 0.00 O ATOM 204 CB PRO A 15 15.127 0.197 -8.611 1.00 0.00 C ATOM 205 CG PRO A 15 15.840 -1.017 -9.098 1.00 0.00 C ATOM 206 CD PRO A 15 16.793 -1.416 -8.006 1.00 0.00 C ATOM 0 HA PRO A 15 15.089 0.940 -6.537 1.00 0.00 H new ATOM 0 HB2 PRO A 15 14.139 0.285 -9.064 1.00 0.00 H new ATOM 0 HB3 PRO A 15 15.674 1.106 -8.862 1.00 0.00 H new ATOM 0 HG2 PRO A 15 15.136 -1.821 -9.312 1.00 0.00 H new ATOM 0 HG3 PRO A 15 16.376 -0.808 -10.024 1.00 0.00 H new ATOM 0 HD2 PRO A 15 16.922 -2.497 -7.960 1.00 0.00 H new ATOM 0 HD3 PRO A 15 17.782 -0.983 -8.156 1.00 0.00 H new ATOM 214 N ALA A 16 12.755 0.209 -6.298 1.00 0.00 N ATOM 215 CA ALA A 16 11.410 -0.296 -5.896 1.00 0.00 C ATOM 216 C ALA A 16 10.909 -1.383 -6.860 1.00 0.00 C ATOM 217 O ALA A 16 10.466 -2.430 -6.433 1.00 0.00 O ATOM 218 CB ALA A 16 10.417 0.867 -5.889 1.00 0.00 C ATOM 0 H ALA A 16 12.875 1.218 -6.215 1.00 0.00 H new ATOM 0 HA ALA A 16 11.492 -0.733 -4.901 1.00 0.00 H new ATOM 0 HB1 ALA A 16 9.432 0.503 -5.596 1.00 0.00 H new ATOM 0 HB2 ALA A 16 10.750 1.625 -5.180 1.00 0.00 H new ATOM 0 HB3 ALA A 16 10.360 1.303 -6.886 1.00 0.00 H new ATOM 224 N PRO A 17 10.953 -1.130 -8.183 1.00 0.00 N ATOM 225 CA PRO A 17 10.471 -2.097 -9.185 1.00 0.00 C ATOM 226 C PRO A 17 11.280 -3.400 -9.199 1.00 0.00 C ATOM 227 O PRO A 17 10.721 -4.479 -9.172 1.00 0.00 O ATOM 228 CB PRO A 17 10.633 -1.350 -10.510 1.00 0.00 C ATOM 229 CG PRO A 17 11.695 -0.343 -10.237 1.00 0.00 C ATOM 230 CD PRO A 17 11.471 0.097 -8.819 1.00 0.00 C ATOM 0 HA PRO A 17 9.448 -2.411 -8.977 1.00 0.00 H new ATOM 0 HB2 PRO A 17 10.923 -2.026 -11.315 1.00 0.00 H new ATOM 0 HB3 PRO A 17 9.701 -0.873 -10.814 1.00 0.00 H new ATOM 0 HG2 PRO A 17 12.688 -0.775 -10.362 1.00 0.00 H new ATOM 0 HG3 PRO A 17 11.625 0.499 -10.926 1.00 0.00 H new ATOM 0 HD2 PRO A 17 12.393 0.439 -8.350 1.00 0.00 H new ATOM 0 HD3 PRO A 17 10.758 0.919 -8.757 1.00 0.00 H new ATOM 238 N LYS A 18 12.580 -3.321 -9.245 1.00 0.00 N ATOM 239 CA LYS A 18 13.391 -4.574 -9.266 1.00 0.00 C ATOM 240 C LYS A 18 13.147 -5.363 -7.977 1.00 0.00 C ATOM 241 O LYS A 18 13.124 -6.577 -7.978 1.00 0.00 O ATOM 242 CB LYS A 18 14.877 -4.228 -9.380 1.00 0.00 C ATOM 243 CG LYS A 18 15.152 -3.620 -10.757 1.00 0.00 C ATOM 244 CD LYS A 18 16.652 -3.363 -10.912 1.00 0.00 C ATOM 245 CE LYS A 18 16.905 -2.591 -12.209 1.00 0.00 C ATOM 246 NZ LYS A 18 18.364 -2.316 -12.348 1.00 0.00 N ATOM 0 H LYS A 18 13.114 -2.452 -9.269 1.00 0.00 H new ATOM 0 HA LYS A 18 13.096 -5.178 -10.124 1.00 0.00 H new ATOM 0 HB2 LYS A 18 15.159 -3.525 -8.597 1.00 0.00 H new ATOM 0 HB3 LYS A 18 15.482 -5.123 -9.238 1.00 0.00 H new ATOM 0 HG2 LYS A 18 14.805 -4.295 -11.540 1.00 0.00 H new ATOM 0 HG3 LYS A 18 14.599 -2.688 -10.872 1.00 0.00 H new ATOM 0 HD2 LYS A 18 17.025 -2.795 -10.059 1.00 0.00 H new ATOM 0 HD3 LYS A 18 17.194 -4.308 -10.927 1.00 0.00 H new ATOM 0 HE2 LYS A 18 16.550 -3.168 -13.063 1.00 0.00 H new ATOM 0 HE3 LYS A 18 16.347 -1.655 -12.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 18.536 -1.791 -13.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 18.689 -1.749 -11.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 18.886 -3.215 -12.373 1.00 0.00 H new ATOM 260 N LEU A 19 12.963 -4.683 -6.878 1.00 0.00 N ATOM 261 CA LEU A 19 12.721 -5.398 -5.594 1.00 0.00 C ATOM 262 C LEU A 19 11.255 -5.826 -5.514 1.00 0.00 C ATOM 263 O LEU A 19 10.916 -6.800 -4.870 1.00 0.00 O ATOM 264 CB LEU A 19 13.042 -4.466 -4.422 1.00 0.00 C ATOM 265 CG LEU A 19 12.916 -5.239 -3.108 1.00 0.00 C ATOM 266 CD1 LEU A 19 13.703 -6.546 -3.209 1.00 0.00 C ATOM 267 CD2 LEU A 19 13.474 -4.393 -1.961 1.00 0.00 C ATOM 0 H LEU A 19 12.970 -3.665 -6.814 1.00 0.00 H new ATOM 0 HA LEU A 19 13.360 -6.280 -5.546 1.00 0.00 H new ATOM 0 HB2 LEU A 19 14.051 -4.067 -4.526 1.00 0.00 H new ATOM 0 HB3 LEU A 19 12.361 -3.615 -4.423 1.00 0.00 H new ATOM 0 HG LEU A 19 11.866 -5.461 -2.916 1.00 0.00 H new ATOM 0 HD11 LEU A 19 13.614 -7.098 -2.273 1.00 0.00 H new ATOM 0 HD12 LEU A 19 13.304 -7.149 -4.025 1.00 0.00 H new ATOM 0 HD13 LEU A 19 14.753 -6.325 -3.401 1.00 0.00 H new ATOM 0 HD21 LEU A 19 13.384 -4.944 -1.025 1.00 0.00 H new ATOM 0 HD22 LEU A 19 14.524 -4.170 -2.151 1.00 0.00 H new ATOM 0 HD23 LEU A 19 12.912 -3.462 -1.889 1.00 0.00 H new ATOM 279 N PHE A 20 10.380 -5.104 -6.160 1.00 0.00 N ATOM 280 CA PHE A 20 8.935 -5.468 -6.117 1.00 0.00 C ATOM 281 C PHE A 20 8.735 -6.861 -6.720 1.00 0.00 C ATOM 282 O PHE A 20 8.007 -7.677 -6.190 1.00 0.00 O ATOM 283 CB PHE A 20 8.128 -4.448 -6.922 1.00 0.00 C ATOM 284 CG PHE A 20 6.655 -4.745 -6.777 1.00 0.00 C ATOM 285 CD1 PHE A 20 5.932 -4.197 -5.710 1.00 0.00 C ATOM 286 CD2 PHE A 20 6.012 -5.571 -7.707 1.00 0.00 C ATOM 287 CE1 PHE A 20 4.565 -4.474 -5.575 1.00 0.00 C ATOM 288 CE2 PHE A 20 4.646 -5.848 -7.573 1.00 0.00 C ATOM 289 CZ PHE A 20 3.923 -5.300 -6.507 1.00 0.00 C ATOM 0 H PHE A 20 10.603 -4.278 -6.715 1.00 0.00 H new ATOM 0 HA PHE A 20 8.595 -5.469 -5.081 1.00 0.00 H new ATOM 0 HB2 PHE A 20 8.343 -3.439 -6.570 1.00 0.00 H new ATOM 0 HB3 PHE A 20 8.416 -4.487 -7.972 1.00 0.00 H new ATOM 0 HD1 PHE A 20 6.428 -3.561 -4.992 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.570 -5.995 -8.529 1.00 0.00 H new ATOM 0 HE1 PHE A 20 4.007 -4.051 -4.753 1.00 0.00 H new ATOM 0 HE2 PHE A 20 4.151 -6.484 -8.292 1.00 0.00 H new ATOM 0 HZ PHE A 20 2.870 -5.514 -6.403 1.00 0.00 H new ATOM 299 N LYS A 21 9.371 -7.138 -7.825 1.00 0.00 N ATOM 300 CA LYS A 21 9.209 -8.477 -8.459 1.00 0.00 C ATOM 301 C LYS A 21 9.678 -9.563 -7.489 1.00 0.00 C ATOM 302 O LYS A 21 9.036 -10.583 -7.328 1.00 0.00 O ATOM 303 CB LYS A 21 10.046 -8.538 -9.739 1.00 0.00 C ATOM 304 CG LYS A 21 9.502 -7.530 -10.752 1.00 0.00 C ATOM 305 CD LYS A 21 10.273 -7.663 -12.068 1.00 0.00 C ATOM 306 CE LYS A 21 9.816 -6.573 -13.040 1.00 0.00 C ATOM 307 NZ LYS A 21 8.827 -7.144 -13.997 1.00 0.00 N ATOM 0 H LYS A 21 9.994 -6.497 -8.315 1.00 0.00 H new ATOM 0 HA LYS A 21 8.159 -8.639 -8.703 1.00 0.00 H new ATOM 0 HB2 LYS A 21 11.090 -8.317 -9.515 1.00 0.00 H new ATOM 0 HB3 LYS A 21 10.016 -9.544 -10.158 1.00 0.00 H new ATOM 0 HG2 LYS A 21 8.440 -7.705 -10.921 1.00 0.00 H new ATOM 0 HG3 LYS A 21 9.600 -6.517 -10.362 1.00 0.00 H new ATOM 0 HD2 LYS A 21 11.344 -7.576 -11.885 1.00 0.00 H new ATOM 0 HD3 LYS A 21 10.103 -8.648 -12.503 1.00 0.00 H new ATOM 0 HE2 LYS A 21 9.370 -5.744 -12.490 1.00 0.00 H new ATOM 0 HE3 LYS A 21 10.672 -6.171 -13.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 8.516 -6.404 -14.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 9.268 -7.921 -14.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 8.006 -7.507 -13.472 1.00 0.00 H new ATOM 321 N ALA A 22 10.791 -9.356 -6.842 1.00 0.00 N ATOM 322 CA ALA A 22 11.298 -10.379 -5.885 1.00 0.00 C ATOM 323 C ALA A 22 10.571 -10.228 -4.547 1.00 0.00 C ATOM 324 O ALA A 22 10.529 -11.142 -3.746 1.00 0.00 O ATOM 325 CB ALA A 22 12.800 -10.181 -5.674 1.00 0.00 C ATOM 0 H ALA A 22 11.372 -8.523 -6.934 1.00 0.00 H new ATOM 0 HA ALA A 22 11.117 -11.375 -6.288 1.00 0.00 H new ATOM 0 HB1 ALA A 22 13.171 -10.930 -4.974 1.00 0.00 H new ATOM 0 HB2 ALA A 22 13.318 -10.287 -6.627 1.00 0.00 H new ATOM 0 HB3 ALA A 22 12.983 -9.185 -5.271 1.00 0.00 H new ATOM 331 N PHE A 23 9.998 -9.083 -4.297 1.00 0.00 N ATOM 332 CA PHE A 23 9.277 -8.876 -3.010 1.00 0.00 C ATOM 333 C PHE A 23 7.774 -9.064 -3.230 1.00 0.00 C ATOM 334 O PHE A 23 6.973 -8.826 -2.347 1.00 0.00 O ATOM 335 CB PHE A 23 9.544 -7.459 -2.500 1.00 0.00 C ATOM 336 CG PHE A 23 8.913 -7.285 -1.139 1.00 0.00 C ATOM 337 CD1 PHE A 23 9.595 -7.706 0.008 1.00 0.00 C ATOM 338 CD2 PHE A 23 7.646 -6.703 -1.026 1.00 0.00 C ATOM 339 CE1 PHE A 23 9.010 -7.546 1.270 1.00 0.00 C ATOM 340 CE2 PHE A 23 7.059 -6.541 0.236 1.00 0.00 C ATOM 341 CZ PHE A 23 7.741 -6.963 1.383 1.00 0.00 C ATOM 0 H PHE A 23 9.998 -8.282 -4.928 1.00 0.00 H new ATOM 0 HA PHE A 23 9.629 -9.600 -2.275 1.00 0.00 H new ATOM 0 HB2 PHE A 23 10.617 -7.279 -2.440 1.00 0.00 H new ATOM 0 HB3 PHE A 23 9.136 -6.727 -3.198 1.00 0.00 H new ATOM 0 HD1 PHE A 23 10.573 -8.155 -0.080 1.00 0.00 H new ATOM 0 HD2 PHE A 23 7.120 -6.378 -1.912 1.00 0.00 H new ATOM 0 HE1 PHE A 23 9.536 -7.872 2.155 1.00 0.00 H new ATOM 0 HE2 PHE A 23 6.081 -6.091 0.324 1.00 0.00 H new ATOM 0 HZ PHE A 23 7.289 -6.839 2.356 1.00 0.00 H new ATOM 351 N VAL A 24 7.382 -9.488 -4.401 1.00 0.00 N ATOM 352 CA VAL A 24 5.932 -9.690 -4.675 1.00 0.00 C ATOM 353 C VAL A 24 5.727 -11.026 -5.393 1.00 0.00 C ATOM 354 O VAL A 24 5.324 -12.006 -4.798 1.00 0.00 O ATOM 355 CB VAL A 24 5.418 -8.553 -5.559 1.00 0.00 C ATOM 356 CG1 VAL A 24 3.935 -8.777 -5.869 1.00 0.00 C ATOM 357 CG2 VAL A 24 5.590 -7.221 -4.826 1.00 0.00 C ATOM 0 H VAL A 24 8.005 -9.703 -5.180 1.00 0.00 H new ATOM 0 HA VAL A 24 5.383 -9.697 -3.733 1.00 0.00 H new ATOM 0 HB VAL A 24 5.984 -8.532 -6.490 1.00 0.00 H new ATOM 0 HG11 VAL A 24 3.569 -7.967 -6.499 1.00 0.00 H new ATOM 0 HG12 VAL A 24 3.812 -9.726 -6.390 1.00 0.00 H new ATOM 0 HG13 VAL A 24 3.368 -8.798 -4.938 1.00 0.00 H new ATOM 0 HG21 VAL A 24 5.224 -6.410 -5.455 1.00 0.00 H new ATOM 0 HG22 VAL A 24 5.023 -7.242 -3.895 1.00 0.00 H new ATOM 0 HG23 VAL A 24 6.645 -7.061 -4.605 1.00 0.00 H new ATOM 367 N LEU A 25 5.999 -11.073 -6.667 1.00 0.00 N ATOM 368 CA LEU A 25 5.819 -12.344 -7.423 1.00 0.00 C ATOM 369 C LEU A 25 6.633 -13.455 -6.758 1.00 0.00 C ATOM 370 O LEU A 25 6.137 -14.535 -6.503 1.00 0.00 O ATOM 371 CB LEU A 25 6.297 -12.152 -8.864 1.00 0.00 C ATOM 372 CG LEU A 25 5.496 -11.026 -9.520 1.00 0.00 C ATOM 373 CD1 LEU A 25 5.844 -10.951 -11.008 1.00 0.00 C ATOM 374 CD2 LEU A 25 4.000 -11.307 -9.359 1.00 0.00 C ATOM 0 H LEU A 25 6.339 -10.285 -7.218 1.00 0.00 H new ATOM 0 HA LEU A 25 4.764 -12.620 -7.424 1.00 0.00 H new ATOM 0 HB2 LEU A 25 7.360 -11.912 -8.877 1.00 0.00 H new ATOM 0 HB3 LEU A 25 6.172 -13.077 -9.426 1.00 0.00 H new ATOM 0 HG LEU A 25 5.742 -10.078 -9.042 1.00 0.00 H new ATOM 0 HD11 LEU A 25 5.273 -10.149 -11.475 1.00 0.00 H new ATOM 0 HD12 LEU A 25 6.910 -10.753 -11.123 1.00 0.00 H new ATOM 0 HD13 LEU A 25 5.598 -11.898 -11.487 1.00 0.00 H new ATOM 0 HD21 LEU A 25 3.427 -10.506 -9.826 1.00 0.00 H new ATOM 0 HD22 LEU A 25 3.754 -12.255 -9.837 1.00 0.00 H new ATOM 0 HD23 LEU A 25 3.752 -11.360 -8.299 1.00 0.00 H new ATOM 386 N ASP A 26 7.882 -13.201 -6.476 1.00 0.00 N ATOM 387 CA ASP A 26 8.725 -14.244 -5.828 1.00 0.00 C ATOM 388 C ASP A 26 8.802 -13.974 -4.324 1.00 0.00 C ATOM 389 O ASP A 26 9.604 -14.556 -3.619 1.00 0.00 O ATOM 390 CB ASP A 26 10.133 -14.206 -6.426 1.00 0.00 C ATOM 391 CG ASP A 26 10.061 -14.548 -7.915 1.00 0.00 C ATOM 392 OD1 ASP A 26 9.043 -15.071 -8.335 1.00 0.00 O ATOM 393 OD2 ASP A 26 11.028 -14.282 -8.611 1.00 0.00 O ATOM 0 H ASP A 26 8.354 -12.317 -6.666 1.00 0.00 H new ATOM 0 HA ASP A 26 8.284 -15.226 -5.999 1.00 0.00 H new ATOM 0 HB2 ASP A 26 10.572 -13.218 -6.289 1.00 0.00 H new ATOM 0 HB3 ASP A 26 10.779 -14.916 -5.909 1.00 0.00 H new ATOM 398 N ALA A 27 7.976 -13.095 -3.826 1.00 0.00 N ATOM 399 CA ALA A 27 8.004 -12.788 -2.369 1.00 0.00 C ATOM 400 C ALA A 27 7.482 -13.993 -1.583 1.00 0.00 C ATOM 401 O ALA A 27 7.958 -14.297 -0.507 1.00 0.00 O ATOM 402 CB ALA A 27 7.119 -11.572 -2.087 1.00 0.00 C ATOM 0 H ALA A 27 7.283 -12.576 -4.366 1.00 0.00 H new ATOM 0 HA ALA A 27 9.027 -12.571 -2.063 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.139 -11.347 -1.021 1.00 0.00 H new ATOM 0 HB2 ALA A 27 7.491 -10.714 -2.646 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.095 -11.788 -2.393 1.00 0.00 H new ATOM 408 N ASP A 28 6.507 -14.681 -2.111 1.00 0.00 N ATOM 409 CA ASP A 28 5.957 -15.864 -1.392 1.00 0.00 C ATOM 410 C ASP A 28 6.957 -17.019 -1.470 1.00 0.00 C ATOM 411 O ASP A 28 7.031 -17.850 -0.587 1.00 0.00 O ATOM 412 CB ASP A 28 4.638 -16.287 -2.042 1.00 0.00 C ATOM 413 CG ASP A 28 3.950 -17.335 -1.165 1.00 0.00 C ATOM 414 OD1 ASP A 28 4.438 -17.578 -0.074 1.00 0.00 O ATOM 415 OD2 ASP A 28 2.947 -17.877 -1.600 1.00 0.00 O ATOM 0 H ASP A 28 6.068 -14.475 -3.008 1.00 0.00 H new ATOM 0 HA ASP A 28 5.782 -15.605 -0.348 1.00 0.00 H new ATOM 0 HB2 ASP A 28 3.989 -15.421 -2.169 1.00 0.00 H new ATOM 0 HB3 ASP A 28 4.824 -16.694 -3.036 1.00 0.00 H new ATOM 420 N ASN A 29 7.728 -17.078 -2.520 1.00 0.00 N ATOM 421 CA ASN A 29 8.724 -18.179 -2.654 1.00 0.00 C ATOM 422 C ASN A 29 10.057 -17.738 -2.046 1.00 0.00 C ATOM 423 O ASN A 29 10.827 -18.545 -1.562 1.00 0.00 O ATOM 424 CB ASN A 29 8.924 -18.510 -4.134 1.00 0.00 C ATOM 425 CG ASN A 29 7.610 -19.028 -4.722 1.00 0.00 C ATOM 426 OD1 ASN A 29 6.883 -19.861 -4.029 1.00 0.00 O flip ATOM 427 ND2 ASN A 29 7.242 -18.671 -5.823 1.00 0.00 N flip ATOM 0 H ASN A 29 7.712 -16.411 -3.292 1.00 0.00 H new ATOM 0 HA ASN A 29 8.360 -19.063 -2.130 1.00 0.00 H new ATOM 0 HB2 ASN A 29 9.252 -17.623 -4.675 1.00 0.00 H new ATOM 0 HB3 ASN A 29 9.707 -19.260 -4.248 1.00 0.00 H new ATOM 0 HD21 ASN A 29 7.811 -18.020 -6.364 1.00 0.00 H new ATOM 0 HD22 ASN A 29 6.364 -19.022 -6.206 1.00 0.00 H new ATOM 434 N LEU A 30 10.335 -16.464 -2.066 1.00 0.00 N ATOM 435 CA LEU A 30 11.618 -15.973 -1.490 1.00 0.00 C ATOM 436 C LEU A 30 11.548 -16.036 0.038 1.00 0.00 C ATOM 437 O LEU A 30 12.531 -16.293 0.704 1.00 0.00 O ATOM 438 CB LEU A 30 11.855 -14.527 -1.931 1.00 0.00 C ATOM 439 CG LEU A 30 13.326 -14.162 -1.723 1.00 0.00 C ATOM 440 CD1 LEU A 30 13.642 -14.149 -0.226 1.00 0.00 C ATOM 441 CD2 LEU A 30 14.211 -15.195 -2.424 1.00 0.00 C ATOM 0 H LEU A 30 9.729 -15.742 -2.456 1.00 0.00 H new ATOM 0 HA LEU A 30 12.438 -16.599 -1.842 1.00 0.00 H new ATOM 0 HB2 LEU A 30 11.585 -14.407 -2.980 1.00 0.00 H new ATOM 0 HB3 LEU A 30 11.218 -13.853 -1.359 1.00 0.00 H new ATOM 0 HG LEU A 30 13.519 -13.175 -2.142 1.00 0.00 H new ATOM 0 HD11 LEU A 30 14.690 -13.889 -0.078 1.00 0.00 H new ATOM 0 HD12 LEU A 30 13.011 -13.413 0.273 1.00 0.00 H new ATOM 0 HD13 LEU A 30 13.450 -15.136 0.195 1.00 0.00 H new ATOM 0 HD21 LEU A 30 15.259 -14.936 -2.276 1.00 0.00 H new ATOM 0 HD22 LEU A 30 14.019 -16.183 -2.005 1.00 0.00 H new ATOM 0 HD23 LEU A 30 13.986 -15.203 -3.490 1.00 0.00 H new ATOM 453 N ILE A 31 10.392 -15.805 0.598 1.00 0.00 N ATOM 454 CA ILE A 31 10.260 -15.853 2.082 1.00 0.00 C ATOM 455 C ILE A 31 10.844 -17.169 2.608 1.00 0.00 C ATOM 456 O ILE A 31 11.718 -17.170 3.451 1.00 0.00 O ATOM 457 CB ILE A 31 8.781 -15.745 2.467 1.00 0.00 C ATOM 458 CG1 ILE A 31 8.312 -14.301 2.282 1.00 0.00 C ATOM 459 CG2 ILE A 31 8.598 -16.155 3.930 1.00 0.00 C ATOM 460 CD1 ILE A 31 6.808 -14.287 1.996 1.00 0.00 C ATOM 0 H ILE A 31 9.534 -15.585 0.093 1.00 0.00 H new ATOM 0 HA ILE A 31 10.806 -15.020 2.524 1.00 0.00 H new ATOM 0 HB ILE A 31 8.193 -16.406 1.830 1.00 0.00 H new ATOM 0 HG12 ILE A 31 8.528 -13.719 3.178 1.00 0.00 H new ATOM 0 HG13 ILE A 31 8.854 -13.834 1.460 1.00 0.00 H new ATOM 0 HG21 ILE A 31 7.545 -16.077 4.201 1.00 0.00 H new ATOM 0 HG22 ILE A 31 8.932 -17.184 4.064 1.00 0.00 H new ATOM 0 HG23 ILE A 31 9.187 -15.496 4.569 1.00 0.00 H new ATOM 0 HD11 ILE A 31 6.472 -13.258 1.864 1.00 0.00 H new ATOM 0 HD12 ILE A 31 6.605 -14.854 1.088 1.00 0.00 H new ATOM 0 HD13 ILE A 31 6.274 -14.738 2.832 1.00 0.00 H new ATOM 472 N PRO A 32 10.351 -18.313 2.102 1.00 0.00 N ATOM 473 CA PRO A 32 10.831 -19.635 2.526 1.00 0.00 C ATOM 474 C PRO A 32 12.268 -19.895 2.064 1.00 0.00 C ATOM 475 O PRO A 32 12.946 -20.766 2.571 1.00 0.00 O ATOM 476 CB PRO A 32 9.876 -20.604 1.829 1.00 0.00 C ATOM 477 CG PRO A 32 9.375 -19.848 0.646 1.00 0.00 C ATOM 478 CD PRO A 32 9.292 -18.412 1.078 1.00 0.00 C ATOM 0 HA PRO A 32 10.845 -19.735 3.611 1.00 0.00 H new ATOM 0 HB2 PRO A 32 10.388 -21.518 1.528 1.00 0.00 H new ATOM 0 HB3 PRO A 32 9.059 -20.898 2.487 1.00 0.00 H new ATOM 0 HG2 PRO A 32 10.048 -19.962 -0.204 1.00 0.00 H new ATOM 0 HG3 PRO A 32 8.399 -20.218 0.331 1.00 0.00 H new ATOM 0 HD2 PRO A 32 9.469 -17.729 0.247 1.00 0.00 H new ATOM 0 HD3 PRO A 32 8.311 -18.169 1.487 1.00 0.00 H new ATOM 486 N LYS A 33 12.738 -19.146 1.104 1.00 0.00 N ATOM 487 CA LYS A 33 14.129 -19.351 0.611 1.00 0.00 C ATOM 488 C LYS A 33 15.123 -18.874 1.672 1.00 0.00 C ATOM 489 O LYS A 33 16.140 -19.496 1.907 1.00 0.00 O ATOM 490 CB LYS A 33 14.336 -18.549 -0.676 1.00 0.00 C ATOM 491 CG LYS A 33 13.779 -19.336 -1.865 1.00 0.00 C ATOM 492 CD LYS A 33 14.063 -18.572 -3.159 1.00 0.00 C ATOM 493 CE LYS A 33 13.228 -19.161 -4.297 1.00 0.00 C ATOM 494 NZ LYS A 33 12.848 -18.078 -5.247 1.00 0.00 N ATOM 0 H LYS A 33 12.218 -18.401 0.640 1.00 0.00 H new ATOM 0 HA LYS A 33 14.291 -20.410 0.411 1.00 0.00 H new ATOM 0 HB2 LYS A 33 13.836 -17.583 -0.599 1.00 0.00 H new ATOM 0 HB3 LYS A 33 15.397 -18.348 -0.825 1.00 0.00 H new ATOM 0 HG2 LYS A 33 14.235 -20.325 -1.906 1.00 0.00 H new ATOM 0 HG3 LYS A 33 12.706 -19.485 -1.746 1.00 0.00 H new ATOM 0 HD2 LYS A 33 13.826 -17.516 -3.029 1.00 0.00 H new ATOM 0 HD3 LYS A 33 15.123 -18.633 -3.404 1.00 0.00 H new ATOM 0 HE2 LYS A 33 13.796 -19.933 -4.817 1.00 0.00 H new ATOM 0 HE3 LYS A 33 12.334 -19.638 -3.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 12.280 -18.478 -6.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 12.291 -17.357 -4.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 13.707 -17.642 -5.638 1.00 0.00 H new ATOM 508 N ILE A 34 14.839 -17.774 2.312 1.00 0.00 N ATOM 509 CA ILE A 34 15.769 -17.258 3.356 1.00 0.00 C ATOM 510 C ILE A 34 15.768 -18.204 4.558 1.00 0.00 C ATOM 511 O ILE A 34 16.776 -18.396 5.208 1.00 0.00 O ATOM 512 CB ILE A 34 15.312 -15.866 3.800 1.00 0.00 C ATOM 513 CG1 ILE A 34 15.391 -14.901 2.616 1.00 0.00 C ATOM 514 CG2 ILE A 34 16.219 -15.367 4.926 1.00 0.00 C ATOM 515 CD1 ILE A 34 14.820 -13.543 3.026 1.00 0.00 C ATOM 0 H ILE A 34 14.003 -17.210 2.158 1.00 0.00 H new ATOM 0 HA ILE A 34 16.777 -17.197 2.946 1.00 0.00 H new ATOM 0 HB ILE A 34 14.284 -15.918 4.158 1.00 0.00 H new ATOM 0 HG12 ILE A 34 16.426 -14.790 2.292 1.00 0.00 H new ATOM 0 HG13 ILE A 34 14.834 -15.301 1.769 1.00 0.00 H new ATOM 0 HG21 ILE A 34 15.894 -14.376 5.243 1.00 0.00 H new ATOM 0 HG22 ILE A 34 16.163 -16.054 5.770 1.00 0.00 H new ATOM 0 HG23 ILE A 34 17.247 -15.315 4.569 1.00 0.00 H new ATOM 0 HD11 ILE A 34 14.876 -12.855 2.182 1.00 0.00 H new ATOM 0 HD12 ILE A 34 13.780 -13.662 3.328 1.00 0.00 H new ATOM 0 HD13 ILE A 34 15.397 -13.143 3.860 1.00 0.00 H new ATOM 527 N ALA A 35 14.645 -18.795 4.861 1.00 0.00 N ATOM 528 CA ALA A 35 14.585 -19.728 6.022 1.00 0.00 C ATOM 529 C ALA A 35 13.660 -20.900 5.688 1.00 0.00 C ATOM 530 O ALA A 35 12.578 -21.021 6.226 1.00 0.00 O ATOM 531 CB ALA A 35 14.043 -18.985 7.245 1.00 0.00 C ATOM 0 H ALA A 35 13.767 -18.673 4.356 1.00 0.00 H new ATOM 0 HA ALA A 35 15.585 -20.104 6.238 1.00 0.00 H new ATOM 0 HB1 ALA A 35 13.999 -19.666 8.095 1.00 0.00 H new ATOM 0 HB2 ALA A 35 14.701 -18.149 7.484 1.00 0.00 H new ATOM 0 HB3 ALA A 35 13.043 -18.609 7.029 1.00 0.00 H new ATOM 537 N PRO A 36 14.101 -21.781 4.777 1.00 0.00 N ATOM 538 CA PRO A 36 13.317 -22.951 4.362 1.00 0.00 C ATOM 539 C PRO A 36 13.226 -23.997 5.477 1.00 0.00 C ATOM 540 O PRO A 36 12.225 -24.669 5.629 1.00 0.00 O ATOM 541 CB PRO A 36 14.110 -23.512 3.182 1.00 0.00 C ATOM 542 CG PRO A 36 15.508 -23.044 3.409 1.00 0.00 C ATOM 543 CD PRO A 36 15.398 -21.704 4.082 1.00 0.00 C ATOM 0 HA PRO A 36 12.288 -22.689 4.115 1.00 0.00 H new ATOM 0 HB2 PRO A 36 14.057 -24.600 3.151 1.00 0.00 H new ATOM 0 HB3 PRO A 36 13.719 -23.146 2.232 1.00 0.00 H new ATOM 0 HG2 PRO A 36 16.058 -23.749 4.033 1.00 0.00 H new ATOM 0 HG3 PRO A 36 16.049 -22.963 2.466 1.00 0.00 H new ATOM 0 HD2 PRO A 36 16.219 -21.535 4.779 1.00 0.00 H new ATOM 0 HD3 PRO A 36 15.420 -20.888 3.360 1.00 0.00 H new ATOM 551 N GLN A 37 14.261 -24.139 6.259 1.00 0.00 N ATOM 552 CA GLN A 37 14.231 -25.139 7.362 1.00 0.00 C ATOM 553 C GLN A 37 13.199 -24.712 8.408 1.00 0.00 C ATOM 554 O GLN A 37 12.735 -25.509 9.198 1.00 0.00 O ATOM 555 CB GLN A 37 15.613 -25.224 8.013 1.00 0.00 C ATOM 556 CG GLN A 37 16.619 -25.780 7.004 1.00 0.00 C ATOM 557 CD GLN A 37 18.004 -25.851 7.651 1.00 0.00 C ATOM 558 OE1 GLN A 37 18.259 -25.196 8.643 1.00 0.00 O ATOM 559 NE2 GLN A 37 18.918 -26.623 7.127 1.00 0.00 N ATOM 0 H GLN A 37 15.127 -23.605 6.181 1.00 0.00 H new ATOM 0 HA GLN A 37 13.959 -26.115 6.960 1.00 0.00 H new ATOM 0 HB2 GLN A 37 15.929 -24.237 8.351 1.00 0.00 H new ATOM 0 HB3 GLN A 37 15.573 -25.865 8.894 1.00 0.00 H new ATOM 0 HG2 GLN A 37 16.309 -26.771 6.674 1.00 0.00 H new ATOM 0 HG3 GLN A 37 16.651 -25.145 6.119 1.00 0.00 H new ATOM 0 HE21 GLN A 37 18.705 -27.173 6.295 1.00 0.00 H new ATOM 0 HE22 GLN A 37 19.845 -26.676 7.550 1.00 0.00 H new ATOM 568 N ALA A 38 12.835 -23.458 8.419 1.00 0.00 N ATOM 569 CA ALA A 38 11.833 -22.980 9.413 1.00 0.00 C ATOM 570 C ALA A 38 10.425 -23.134 8.834 1.00 0.00 C ATOM 571 O ALA A 38 9.458 -23.278 9.555 1.00 0.00 O ATOM 572 CB ALA A 38 12.096 -21.507 9.734 1.00 0.00 C ATOM 0 H ALA A 38 13.189 -22.744 7.782 1.00 0.00 H new ATOM 0 HA ALA A 38 11.916 -23.571 10.325 1.00 0.00 H new ATOM 0 HB1 ALA A 38 11.363 -21.157 10.461 1.00 0.00 H new ATOM 0 HB2 ALA A 38 13.099 -21.398 10.148 1.00 0.00 H new ATOM 0 HB3 ALA A 38 12.014 -20.916 8.822 1.00 0.00 H new ATOM 578 N VAL A 39 10.302 -23.107 7.534 1.00 0.00 N ATOM 579 CA VAL A 39 8.957 -23.253 6.909 1.00 0.00 C ATOM 580 C VAL A 39 8.934 -24.512 6.040 1.00 0.00 C ATOM 581 O VAL A 39 9.885 -24.818 5.348 1.00 0.00 O ATOM 582 CB VAL A 39 8.662 -22.030 6.038 1.00 0.00 C ATOM 583 CG1 VAL A 39 7.149 -21.844 5.916 1.00 0.00 C ATOM 584 CG2 VAL A 39 9.279 -20.786 6.681 1.00 0.00 C ATOM 0 H VAL A 39 11.075 -22.990 6.879 1.00 0.00 H new ATOM 0 HA VAL A 39 8.201 -23.334 7.690 1.00 0.00 H new ATOM 0 HB VAL A 39 9.091 -22.177 5.047 1.00 0.00 H new ATOM 0 HG11 VAL A 39 6.938 -20.973 5.296 1.00 0.00 H new ATOM 0 HG12 VAL A 39 6.709 -22.730 5.458 1.00 0.00 H new ATOM 0 HG13 VAL A 39 6.720 -21.696 6.907 1.00 0.00 H new ATOM 0 HG21 VAL A 39 9.069 -19.914 6.061 1.00 0.00 H new ATOM 0 HG22 VAL A 39 8.850 -20.638 7.672 1.00 0.00 H new ATOM 0 HG23 VAL A 39 10.357 -20.918 6.768 1.00 0.00 H new ATOM 594 N LYS A 40 7.854 -25.246 6.068 1.00 0.00 N ATOM 595 CA LYS A 40 7.775 -26.484 5.242 1.00 0.00 C ATOM 596 C LYS A 40 7.636 -26.104 3.766 1.00 0.00 C ATOM 597 O LYS A 40 8.368 -26.580 2.921 1.00 0.00 O ATOM 598 CB LYS A 40 6.561 -27.310 5.673 1.00 0.00 C ATOM 599 CG LYS A 40 6.595 -28.670 4.970 1.00 0.00 C ATOM 600 CD LYS A 40 5.366 -29.487 5.377 1.00 0.00 C ATOM 601 CE LYS A 40 5.446 -30.877 4.742 1.00 0.00 C ATOM 602 NZ LYS A 40 4.369 -31.743 5.302 1.00 0.00 N ATOM 0 H LYS A 40 7.025 -25.042 6.626 1.00 0.00 H new ATOM 0 HA LYS A 40 8.682 -27.072 5.382 1.00 0.00 H new ATOM 0 HB2 LYS A 40 6.566 -27.447 6.754 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.641 -26.782 5.423 1.00 0.00 H new ATOM 0 HG2 LYS A 40 6.611 -28.532 3.889 1.00 0.00 H new ATOM 0 HG3 LYS A 40 7.506 -29.206 5.237 1.00 0.00 H new ATOM 0 HD2 LYS A 40 5.316 -29.573 6.462 1.00 0.00 H new ATOM 0 HD3 LYS A 40 4.456 -28.980 5.056 1.00 0.00 H new ATOM 0 HE2 LYS A 40 5.340 -30.801 3.660 1.00 0.00 H new ATOM 0 HE3 LYS A 40 6.422 -31.321 4.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 4.423 -32.688 4.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 4.490 -31.825 6.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 3.441 -31.321 5.095 1.00 0.00 H new ATOM 616 N CYS A 41 6.702 -25.249 3.449 1.00 0.00 N ATOM 617 CA CYS A 41 6.518 -24.839 2.028 1.00 0.00 C ATOM 618 C CYS A 41 5.326 -23.885 1.922 1.00 0.00 C ATOM 619 O CYS A 41 4.248 -24.167 2.407 1.00 0.00 O ATOM 620 CB CYS A 41 6.258 -26.079 1.170 1.00 0.00 C ATOM 621 SG CYS A 41 7.425 -26.112 -0.214 1.00 0.00 S ATOM 0 H CYS A 41 6.059 -24.817 4.112 1.00 0.00 H new ATOM 0 HA CYS A 41 7.418 -24.335 1.675 1.00 0.00 H new ATOM 0 HB2 CYS A 41 6.367 -26.981 1.773 1.00 0.00 H new ATOM 0 HB3 CYS A 41 5.234 -26.067 0.796 1.00 0.00 H new ATOM 0 HG CYS A 41 7.206 -27.167 -0.942 1.00 0.00 H new ATOM 627 N ALA A 42 5.511 -22.759 1.291 1.00 0.00 N ATOM 628 CA ALA A 42 4.388 -21.788 1.154 1.00 0.00 C ATOM 629 C ALA A 42 3.632 -22.063 -0.148 1.00 0.00 C ATOM 630 O ALA A 42 4.179 -21.958 -1.228 1.00 0.00 O ATOM 631 CB ALA A 42 4.946 -20.363 1.129 1.00 0.00 C ATOM 0 H ALA A 42 6.391 -22.469 0.864 1.00 0.00 H new ATOM 0 HA ALA A 42 3.708 -21.897 1.999 1.00 0.00 H new ATOM 0 HB1 ALA A 42 4.125 -19.653 1.029 1.00 0.00 H new ATOM 0 HB2 ALA A 42 5.485 -20.167 2.056 1.00 0.00 H new ATOM 0 HB3 ALA A 42 5.626 -20.253 0.284 1.00 0.00 H new ATOM 637 N GLU A 43 2.379 -22.413 -0.054 1.00 0.00 N ATOM 638 CA GLU A 43 1.590 -22.695 -1.287 1.00 0.00 C ATOM 639 C GLU A 43 0.385 -21.754 -1.343 1.00 0.00 C ATOM 640 O GLU A 43 -0.165 -21.371 -0.330 1.00 0.00 O ATOM 641 CB GLU A 43 1.105 -24.145 -1.263 1.00 0.00 C ATOM 642 CG GLU A 43 0.392 -24.468 -2.578 1.00 0.00 C ATOM 643 CD GLU A 43 -0.191 -25.880 -2.510 1.00 0.00 C ATOM 644 OE1 GLU A 43 -0.055 -26.506 -1.471 1.00 0.00 O ATOM 645 OE2 GLU A 43 -0.767 -26.311 -3.495 1.00 0.00 O ATOM 0 H GLU A 43 1.867 -22.516 0.822 1.00 0.00 H new ATOM 0 HA GLU A 43 2.217 -22.538 -2.165 1.00 0.00 H new ATOM 0 HB2 GLU A 43 1.949 -24.819 -1.120 1.00 0.00 H new ATOM 0 HB3 GLU A 43 0.428 -24.299 -0.423 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -0.402 -23.744 -2.761 1.00 0.00 H new ATOM 0 HG3 GLU A 43 1.091 -24.392 -3.411 1.00 0.00 H new ATOM 652 N ILE A 44 -0.030 -21.378 -2.521 1.00 0.00 N ATOM 653 CA ILE A 44 -1.199 -20.461 -2.640 1.00 0.00 C ATOM 654 C ILE A 44 -2.415 -21.247 -3.134 1.00 0.00 C ATOM 655 O ILE A 44 -2.411 -21.800 -4.216 1.00 0.00 O ATOM 656 CB ILE A 44 -0.873 -19.345 -3.634 1.00 0.00 C ATOM 657 CG1 ILE A 44 0.373 -18.591 -3.167 1.00 0.00 C ATOM 658 CG2 ILE A 44 -2.054 -18.376 -3.715 1.00 0.00 C ATOM 659 CD1 ILE A 44 0.777 -17.566 -4.228 1.00 0.00 C ATOM 0 H ILE A 44 0.389 -21.665 -3.405 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.420 -20.025 -1.666 1.00 0.00 H new ATOM 0 HB ILE A 44 -0.687 -19.777 -4.617 1.00 0.00 H new ATOM 0 HG12 ILE A 44 0.174 -18.090 -2.219 1.00 0.00 H new ATOM 0 HG13 ILE A 44 1.190 -19.291 -2.992 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -1.824 -17.580 -4.423 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -2.942 -18.912 -4.049 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -2.239 -17.944 -2.731 1.00 0.00 H new ATOM 0 HD11 ILE A 44 1.665 -17.029 -3.895 1.00 0.00 H new ATOM 0 HD12 ILE A 44 0.993 -18.079 -5.165 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.039 -16.859 -4.381 1.00 0.00 H new ATOM 671 N LEU A 45 -3.456 -21.300 -2.351 1.00 0.00 N ATOM 672 CA LEU A 45 -4.673 -22.049 -2.775 1.00 0.00 C ATOM 673 C LEU A 45 -5.225 -21.435 -4.064 1.00 0.00 C ATOM 674 O LEU A 45 -5.573 -22.133 -4.996 1.00 0.00 O ATOM 675 CB LEU A 45 -5.733 -21.965 -1.676 1.00 0.00 C ATOM 676 CG LEU A 45 -6.903 -22.887 -2.024 1.00 0.00 C ATOM 677 CD1 LEU A 45 -6.476 -24.344 -1.835 1.00 0.00 C ATOM 678 CD2 LEU A 45 -8.087 -22.579 -1.104 1.00 0.00 C ATOM 0 H LEU A 45 -3.517 -20.857 -1.434 1.00 0.00 H new ATOM 0 HA LEU A 45 -4.414 -23.093 -2.950 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -5.302 -22.253 -0.717 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -6.084 -20.938 -1.572 1.00 0.00 H new ATOM 0 HG LEU A 45 -7.198 -22.725 -3.061 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -7.309 -25.002 -2.083 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -5.633 -24.564 -2.490 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -6.182 -24.505 -0.798 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -8.921 -23.236 -1.352 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -7.794 -22.741 -0.067 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -8.391 -21.541 -1.237 1.00 0.00 H new ATOM 690 N GLU A 46 -5.307 -20.134 -4.123 1.00 0.00 N ATOM 691 CA GLU A 46 -5.837 -19.476 -5.351 1.00 0.00 C ATOM 692 C GLU A 46 -5.368 -18.021 -5.392 1.00 0.00 C ATOM 693 O GLU A 46 -5.025 -17.441 -4.381 1.00 0.00 O ATOM 694 CB GLU A 46 -7.367 -19.519 -5.333 1.00 0.00 C ATOM 695 CG GLU A 46 -7.837 -20.974 -5.395 1.00 0.00 C ATOM 696 CD GLU A 46 -9.361 -21.012 -5.522 1.00 0.00 C ATOM 697 OE1 GLU A 46 -9.971 -19.960 -5.426 1.00 0.00 O ATOM 698 OE2 GLU A 46 -9.893 -22.093 -5.714 1.00 0.00 O ATOM 0 H GLU A 46 -5.030 -19.499 -3.375 1.00 0.00 H new ATOM 0 HA GLU A 46 -5.469 -20.001 -6.233 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.744 -19.042 -4.428 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -7.767 -18.960 -6.179 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -7.378 -21.480 -6.244 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -7.523 -21.508 -4.498 1.00 0.00 H new ATOM 705 N GLY A 47 -5.347 -17.428 -6.554 1.00 0.00 N ATOM 706 CA GLY A 47 -4.899 -16.010 -6.658 1.00 0.00 C ATOM 707 C GLY A 47 -3.527 -15.958 -7.334 1.00 0.00 C ATOM 708 O GLY A 47 -3.274 -15.127 -8.182 1.00 0.00 O ATOM 0 H GLY A 47 -5.620 -17.863 -7.435 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -5.622 -15.430 -7.232 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -4.845 -15.561 -5.666 1.00 0.00 H new ATOM 712 N ASP A 48 -2.640 -16.840 -6.963 1.00 0.00 N ATOM 713 CA ASP A 48 -1.286 -16.842 -7.585 1.00 0.00 C ATOM 714 C ASP A 48 -0.605 -15.496 -7.329 1.00 0.00 C ATOM 715 O ASP A 48 0.083 -14.966 -8.180 1.00 0.00 O ATOM 716 CB ASP A 48 -1.417 -17.068 -9.092 1.00 0.00 C ATOM 717 CG ASP A 48 -1.947 -18.480 -9.350 1.00 0.00 C ATOM 718 OD1 ASP A 48 -1.976 -19.262 -8.414 1.00 0.00 O ATOM 719 OD2 ASP A 48 -2.315 -18.757 -10.481 1.00 0.00 O ATOM 0 H ASP A 48 -2.794 -17.559 -6.256 1.00 0.00 H new ATOM 0 HA ASP A 48 -0.687 -17.641 -7.148 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -2.092 -16.330 -9.524 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -0.449 -16.937 -9.576 1.00 0.00 H new ATOM 724 N GLY A 49 -0.789 -14.939 -6.164 1.00 0.00 N ATOM 725 CA GLY A 49 -0.151 -13.628 -5.856 1.00 0.00 C ATOM 726 C GLY A 49 -1.026 -12.493 -6.394 1.00 0.00 C ATOM 727 O GLY A 49 -0.535 -11.462 -6.809 1.00 0.00 O ATOM 0 H GLY A 49 -1.353 -15.335 -5.412 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -0.019 -13.520 -4.779 1.00 0.00 H new ATOM 0 HA3 GLY A 49 0.841 -13.580 -6.305 1.00 0.00 H new ATOM 731 N GLY A 50 -2.318 -12.675 -6.391 1.00 0.00 N ATOM 732 CA GLY A 50 -3.223 -11.607 -6.902 1.00 0.00 C ATOM 733 C GLY A 50 -4.150 -11.144 -5.777 1.00 0.00 C ATOM 734 O GLY A 50 -3.953 -11.471 -4.624 1.00 0.00 O ATOM 0 H GLY A 50 -2.786 -13.517 -6.057 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -2.637 -10.766 -7.274 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -3.810 -11.983 -7.740 1.00 0.00 H new ATOM 738 N PRO A 51 -5.185 -10.365 -6.127 1.00 0.00 N ATOM 739 CA PRO A 51 -6.154 -9.848 -5.152 1.00 0.00 C ATOM 740 C PRO A 51 -7.046 -10.962 -4.596 1.00 0.00 C ATOM 741 O PRO A 51 -7.604 -11.750 -5.332 1.00 0.00 O ATOM 742 CB PRO A 51 -6.991 -8.864 -5.968 1.00 0.00 C ATOM 743 CG PRO A 51 -6.867 -9.341 -7.375 1.00 0.00 C ATOM 744 CD PRO A 51 -5.489 -9.926 -7.499 1.00 0.00 C ATOM 0 HA PRO A 51 -5.667 -9.397 -4.287 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -8.031 -8.861 -5.641 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -6.620 -7.845 -5.861 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -7.629 -10.087 -7.602 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -7.006 -8.520 -8.078 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -5.467 -10.758 -8.202 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -4.769 -9.189 -7.855 1.00 0.00 H new ATOM 752 N GLY A 52 -7.182 -11.034 -3.300 1.00 0.00 N ATOM 753 CA GLY A 52 -8.034 -12.097 -2.699 1.00 0.00 C ATOM 754 C GLY A 52 -7.335 -13.449 -2.845 1.00 0.00 C ATOM 755 O GLY A 52 -7.967 -14.486 -2.889 1.00 0.00 O ATOM 0 H GLY A 52 -6.740 -10.402 -2.632 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -8.216 -11.881 -1.646 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -9.006 -12.122 -3.192 1.00 0.00 H new ATOM 759 N THR A 53 -6.031 -13.447 -2.920 1.00 0.00 N ATOM 760 CA THR A 53 -5.289 -14.731 -3.063 1.00 0.00 C ATOM 761 C THR A 53 -5.162 -15.402 -1.695 1.00 0.00 C ATOM 762 O THR A 53 -4.934 -14.752 -0.693 1.00 0.00 O ATOM 763 CB THR A 53 -3.893 -14.452 -3.626 1.00 0.00 C ATOM 764 OG1 THR A 53 -4.013 -13.807 -4.886 1.00 0.00 O ATOM 765 CG2 THR A 53 -3.135 -15.770 -3.795 1.00 0.00 C ATOM 0 H THR A 53 -5.448 -12.611 -2.888 1.00 0.00 H new ATOM 0 HA THR A 53 -5.830 -15.390 -3.742 1.00 0.00 H new ATOM 0 HB THR A 53 -3.346 -13.808 -2.938 1.00 0.00 H new ATOM 0 HG1 THR A 53 -4.578 -13.012 -4.794 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.141 -15.569 -4.196 1.00 0.00 H new ATOM 0 HG22 THR A 53 -3.043 -16.264 -2.827 1.00 0.00 H new ATOM 0 HG23 THR A 53 -3.680 -16.417 -4.482 1.00 0.00 H new ATOM 773 N ILE A 54 -5.305 -16.697 -1.642 1.00 0.00 N ATOM 774 CA ILE A 54 -5.191 -17.406 -0.336 1.00 0.00 C ATOM 775 C ILE A 54 -3.850 -18.139 -0.271 1.00 0.00 C ATOM 776 O ILE A 54 -3.496 -18.884 -1.164 1.00 0.00 O ATOM 777 CB ILE A 54 -6.333 -18.417 -0.200 1.00 0.00 C ATOM 778 CG1 ILE A 54 -7.674 -17.699 -0.365 1.00 0.00 C ATOM 779 CG2 ILE A 54 -6.272 -19.070 1.182 1.00 0.00 C ATOM 780 CD1 ILE A 54 -8.809 -18.725 -0.326 1.00 0.00 C ATOM 0 H ILE A 54 -5.496 -17.295 -2.446 1.00 0.00 H new ATOM 0 HA ILE A 54 -5.250 -16.682 0.477 1.00 0.00 H new ATOM 0 HB ILE A 54 -6.234 -19.182 -0.970 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -7.806 -16.964 0.429 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -7.694 -17.155 -1.309 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -7.084 -19.790 1.280 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -5.317 -19.582 1.301 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -6.371 -18.304 1.951 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -9.765 -18.215 -0.443 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -8.679 -19.443 -1.136 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -8.793 -19.249 0.629 1.00 0.00 H new ATOM 792 N LYS A 55 -3.101 -17.937 0.779 1.00 0.00 N ATOM 793 CA LYS A 55 -1.784 -18.624 0.896 1.00 0.00 C ATOM 794 C LYS A 55 -1.780 -19.514 2.140 1.00 0.00 C ATOM 795 O LYS A 55 -2.428 -19.224 3.126 1.00 0.00 O ATOM 796 CB LYS A 55 -0.672 -17.579 1.016 1.00 0.00 C ATOM 797 CG LYS A 55 -0.904 -16.466 -0.007 1.00 0.00 C ATOM 798 CD LYS A 55 0.114 -15.346 0.217 1.00 0.00 C ATOM 799 CE LYS A 55 1.510 -15.840 -0.169 1.00 0.00 C ATOM 800 NZ LYS A 55 2.496 -15.393 0.856 1.00 0.00 N ATOM 0 H LYS A 55 -3.344 -17.327 1.559 1.00 0.00 H new ATOM 0 HA LYS A 55 -1.615 -19.236 0.010 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -0.656 -17.164 2.024 1.00 0.00 H new ATOM 0 HB3 LYS A 55 0.299 -18.045 0.848 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -0.809 -16.861 -1.018 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -1.917 -16.075 0.088 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -0.152 -14.473 -0.379 1.00 0.00 H new ATOM 0 HD3 LYS A 55 0.103 -15.034 1.261 1.00 0.00 H new ATOM 0 HE2 LYS A 55 1.515 -16.927 -0.244 1.00 0.00 H new ATOM 0 HE3 LYS A 55 1.787 -15.452 -1.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 3.412 -15.208 0.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 2.154 -14.523 1.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 2.611 -16.136 1.574 1.00 0.00 H new ATOM 814 N LYS A 56 -1.054 -20.597 2.101 1.00 0.00 N ATOM 815 CA LYS A 56 -1.005 -21.507 3.281 1.00 0.00 C ATOM 816 C LYS A 56 0.453 -21.850 3.593 1.00 0.00 C ATOM 817 O LYS A 56 1.180 -22.334 2.750 1.00 0.00 O ATOM 818 CB LYS A 56 -1.777 -22.790 2.969 1.00 0.00 C ATOM 819 CG LYS A 56 -1.774 -23.701 4.197 1.00 0.00 C ATOM 820 CD LYS A 56 -2.429 -25.038 3.842 1.00 0.00 C ATOM 821 CE LYS A 56 -2.612 -25.872 5.112 1.00 0.00 C ATOM 822 NZ LYS A 56 -4.040 -25.823 5.536 1.00 0.00 N ATOM 0 H LYS A 56 -0.492 -20.892 1.303 1.00 0.00 H new ATOM 0 HA LYS A 56 -1.457 -21.015 4.142 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -2.801 -22.550 2.684 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -1.322 -23.303 2.122 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -0.752 -23.864 4.540 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -2.313 -23.226 5.017 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -3.394 -24.867 3.365 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -1.811 -25.579 3.125 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -2.311 -26.904 4.929 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -1.972 -25.489 5.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -4.218 -26.564 6.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -4.248 -24.892 5.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -4.653 -25.979 4.710 1.00 0.00 H new ATOM 836 N ILE A 57 0.885 -21.601 4.798 1.00 0.00 N ATOM 837 CA ILE A 57 2.298 -21.911 5.159 1.00 0.00 C ATOM 838 C ILE A 57 2.327 -22.918 6.309 1.00 0.00 C ATOM 839 O ILE A 57 1.654 -22.754 7.308 1.00 0.00 O ATOM 840 CB ILE A 57 3.007 -20.628 5.595 1.00 0.00 C ATOM 841 CG1 ILE A 57 2.781 -19.537 4.548 1.00 0.00 C ATOM 842 CG2 ILE A 57 4.505 -20.897 5.738 1.00 0.00 C ATOM 843 CD1 ILE A 57 3.024 -18.168 5.186 1.00 0.00 C ATOM 0 H ILE A 57 0.323 -21.197 5.547 1.00 0.00 H new ATOM 0 HA ILE A 57 2.805 -22.334 4.292 1.00 0.00 H new ATOM 0 HB ILE A 57 2.604 -20.299 6.553 1.00 0.00 H new ATOM 0 HG12 ILE A 57 3.454 -19.682 3.703 1.00 0.00 H new ATOM 0 HG13 ILE A 57 1.764 -19.595 4.159 1.00 0.00 H new ATOM 0 HG21 ILE A 57 5.011 -19.983 6.049 1.00 0.00 H new ATOM 0 HG22 ILE A 57 4.666 -21.673 6.487 1.00 0.00 H new ATOM 0 HG23 ILE A 57 4.908 -21.227 4.781 1.00 0.00 H new ATOM 0 HD11 ILE A 57 2.864 -17.387 4.443 1.00 0.00 H new ATOM 0 HD12 ILE A 57 2.333 -18.026 6.017 1.00 0.00 H new ATOM 0 HD13 ILE A 57 4.049 -18.115 5.554 1.00 0.00 H new ATOM 855 N THR A 58 3.106 -23.955 6.179 1.00 0.00 N ATOM 856 CA THR A 58 3.187 -24.966 7.268 1.00 0.00 C ATOM 857 C THR A 58 4.575 -24.906 7.904 1.00 0.00 C ATOM 858 O THR A 58 5.580 -25.078 7.243 1.00 0.00 O ATOM 859 CB THR A 58 2.949 -26.363 6.688 1.00 0.00 C ATOM 860 OG1 THR A 58 1.661 -26.412 6.089 1.00 0.00 O ATOM 861 CG2 THR A 58 3.034 -27.402 7.806 1.00 0.00 C ATOM 0 H THR A 58 3.690 -24.146 5.365 1.00 0.00 H new ATOM 0 HA THR A 58 2.428 -24.756 8.022 1.00 0.00 H new ATOM 0 HB THR A 58 3.708 -26.579 5.936 1.00 0.00 H new ATOM 0 HG1 THR A 58 1.508 -27.305 5.716 1.00 0.00 H new ATOM 0 HG21 THR A 58 2.864 -28.396 7.392 1.00 0.00 H new ATOM 0 HG22 THR A 58 4.022 -27.363 8.264 1.00 0.00 H new ATOM 0 HG23 THR A 58 2.276 -27.188 8.560 1.00 0.00 H new ATOM 869 N PHE A 59 4.642 -24.658 9.183 1.00 0.00 N ATOM 870 CA PHE A 59 5.968 -24.581 9.856 1.00 0.00 C ATOM 871 C PHE A 59 6.352 -25.964 10.387 1.00 0.00 C ATOM 872 O PHE A 59 5.557 -26.644 11.005 1.00 0.00 O ATOM 873 CB PHE A 59 5.892 -23.588 11.018 1.00 0.00 C ATOM 874 CG PHE A 59 5.747 -22.187 10.472 1.00 0.00 C ATOM 875 CD1 PHE A 59 6.868 -21.509 9.980 1.00 0.00 C ATOM 876 CD2 PHE A 59 4.491 -21.567 10.455 1.00 0.00 C ATOM 877 CE1 PHE A 59 6.736 -20.212 9.472 1.00 0.00 C ATOM 878 CE2 PHE A 59 4.358 -20.269 9.948 1.00 0.00 C ATOM 879 CZ PHE A 59 5.480 -19.591 9.456 1.00 0.00 C ATOM 0 H PHE A 59 3.837 -24.506 9.790 1.00 0.00 H new ATOM 0 HA PHE A 59 6.720 -24.246 9.142 1.00 0.00 H new ATOM 0 HB2 PHE A 59 5.046 -23.829 11.662 1.00 0.00 H new ATOM 0 HB3 PHE A 59 6.790 -23.660 11.632 1.00 0.00 H new ATOM 0 HD1 PHE A 59 7.836 -21.987 9.992 1.00 0.00 H new ATOM 0 HD2 PHE A 59 3.625 -22.090 10.833 1.00 0.00 H new ATOM 0 HE1 PHE A 59 7.602 -19.690 9.092 1.00 0.00 H new ATOM 0 HE2 PHE A 59 3.390 -19.790 9.936 1.00 0.00 H new ATOM 0 HZ PHE A 59 5.377 -18.590 9.064 1.00 0.00 H new ATOM 974 N TYR A 67 1.215 -23.559 11.709 1.00 0.00 N ATOM 975 CA TYR A 67 0.995 -23.108 10.305 1.00 0.00 C ATOM 976 C TYR A 67 0.056 -21.899 10.287 1.00 0.00 C ATOM 977 O TYR A 67 -0.861 -21.799 11.079 1.00 0.00 O ATOM 978 CB TYR A 67 0.369 -24.249 9.500 1.00 0.00 C ATOM 979 CG TYR A 67 -1.065 -24.446 9.933 1.00 0.00 C ATOM 980 CD1 TYR A 67 -1.355 -25.231 11.055 1.00 0.00 C ATOM 981 CD2 TYR A 67 -2.103 -23.843 9.213 1.00 0.00 C ATOM 982 CE1 TYR A 67 -2.683 -25.413 11.457 1.00 0.00 C ATOM 983 CE2 TYR A 67 -3.431 -24.025 9.615 1.00 0.00 C ATOM 984 CZ TYR A 67 -3.721 -24.810 10.738 1.00 0.00 C ATOM 985 OH TYR A 67 -5.032 -24.989 11.135 1.00 0.00 O ATOM 0 HA TYR A 67 1.951 -22.826 9.864 1.00 0.00 H new ATOM 0 HB2 TYR A 67 0.410 -24.021 8.435 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.935 -25.168 9.652 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -0.554 -25.696 11.610 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.879 -23.237 8.347 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -2.907 -26.019 12.322 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -4.232 -23.560 9.059 1.00 0.00 H new ATOM 0 HH TYR A 67 -5.627 -24.501 10.528 1.00 0.00 H new ATOM 995 N VAL A 68 0.276 -20.982 9.384 1.00 0.00 N ATOM 996 CA VAL A 68 -0.602 -19.782 9.304 1.00 0.00 C ATOM 997 C VAL A 68 -0.972 -19.529 7.840 1.00 0.00 C ATOM 998 O VAL A 68 -0.222 -19.847 6.938 1.00 0.00 O ATOM 999 CB VAL A 68 0.141 -18.568 9.863 1.00 0.00 C ATOM 1000 CG1 VAL A 68 0.762 -18.928 11.214 1.00 0.00 C ATOM 1001 CG2 VAL A 68 1.247 -18.154 8.890 1.00 0.00 C ATOM 0 H VAL A 68 1.029 -21.013 8.696 1.00 0.00 H new ATOM 0 HA VAL A 68 -1.508 -19.948 9.887 1.00 0.00 H new ATOM 0 HB VAL A 68 -0.559 -17.742 9.992 1.00 0.00 H new ATOM 0 HG11 VAL A 68 1.292 -18.063 11.613 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -0.024 -19.224 11.909 1.00 0.00 H new ATOM 0 HG13 VAL A 68 1.462 -19.754 11.084 1.00 0.00 H new ATOM 0 HG21 VAL A 68 1.777 -17.289 9.288 1.00 0.00 H new ATOM 0 HG22 VAL A 68 1.946 -18.980 8.761 1.00 0.00 H new ATOM 0 HG23 VAL A 68 0.807 -17.898 7.926 1.00 0.00 H new ATOM 1011 N LYS A 69 -2.122 -18.964 7.595 1.00 0.00 N ATOM 1012 CA LYS A 69 -2.533 -18.699 6.187 1.00 0.00 C ATOM 1013 C LYS A 69 -2.427 -17.201 5.891 1.00 0.00 C ATOM 1014 O LYS A 69 -2.768 -16.370 6.709 1.00 0.00 O ATOM 1015 CB LYS A 69 -3.979 -19.157 5.982 1.00 0.00 C ATOM 1016 CG LYS A 69 -4.074 -20.667 6.213 1.00 0.00 C ATOM 1017 CD LYS A 69 -5.509 -21.131 5.955 1.00 0.00 C ATOM 1018 CE LYS A 69 -5.628 -22.623 6.274 1.00 0.00 C ATOM 1019 NZ LYS A 69 -6.912 -22.878 6.986 1.00 0.00 N ATOM 0 H LYS A 69 -2.793 -18.675 8.306 1.00 0.00 H new ATOM 0 HA LYS A 69 -1.877 -19.248 5.512 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -4.639 -18.631 6.671 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -4.310 -18.911 4.973 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -3.386 -21.191 5.550 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -3.780 -20.909 7.234 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -6.203 -20.560 6.571 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -5.780 -20.948 4.915 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -5.588 -23.207 5.354 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -4.788 -22.942 6.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -6.993 -23.892 7.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -6.933 -22.332 7.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -7.707 -22.588 6.382 1.00 0.00 H new ATOM 1033 N HIS A 70 -1.961 -16.852 4.722 1.00 0.00 N ATOM 1034 CA HIS A 70 -1.838 -15.410 4.366 1.00 0.00 C ATOM 1035 C HIS A 70 -2.799 -15.092 3.219 1.00 0.00 C ATOM 1036 O HIS A 70 -3.010 -15.898 2.334 1.00 0.00 O ATOM 1037 CB HIS A 70 -0.404 -15.112 3.924 1.00 0.00 C ATOM 1038 CG HIS A 70 0.503 -15.104 5.124 1.00 0.00 C ATOM 1039 ND1 HIS A 70 1.048 -16.265 5.645 1.00 0.00 N ATOM 1040 CD2 HIS A 70 0.971 -14.081 5.913 1.00 0.00 C ATOM 1041 CE1 HIS A 70 1.809 -15.918 6.701 1.00 0.00 C ATOM 1042 NE2 HIS A 70 1.796 -14.599 6.908 1.00 0.00 N ATOM 0 H HIS A 70 -1.660 -17.504 3.998 1.00 0.00 H new ATOM 0 HA HIS A 70 -2.084 -14.797 5.233 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -0.070 -15.863 3.208 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -0.362 -14.148 3.417 1.00 0.00 H new ATOM 0 HD2 HIS A 70 0.735 -13.035 5.782 1.00 0.00 H new ATOM 0 HE1 HIS A 70 2.362 -16.621 7.306 1.00 0.00 H new ATOM 0 HE2 HIS A 70 2.285 -14.082 7.638 1.00 0.00 H new ATOM 1050 N LYS A 71 -3.383 -13.926 3.222 1.00 0.00 N ATOM 1051 CA LYS A 71 -4.327 -13.566 2.128 1.00 0.00 C ATOM 1052 C LYS A 71 -3.919 -12.226 1.515 1.00 0.00 C ATOM 1053 O LYS A 71 -3.546 -11.302 2.211 1.00 0.00 O ATOM 1054 CB LYS A 71 -5.746 -13.458 2.691 1.00 0.00 C ATOM 1055 CG LYS A 71 -6.735 -13.254 1.540 1.00 0.00 C ATOM 1056 CD LYS A 71 -8.137 -13.022 2.107 1.00 0.00 C ATOM 1057 CE LYS A 71 -9.143 -12.931 0.958 1.00 0.00 C ATOM 1058 NZ LYS A 71 -9.955 -14.180 0.909 1.00 0.00 N ATOM 0 H LYS A 71 -3.248 -13.208 3.934 1.00 0.00 H new ATOM 0 HA LYS A 71 -4.298 -14.338 1.360 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -5.999 -14.361 3.246 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -5.809 -12.625 3.391 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -6.431 -12.402 0.932 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -6.735 -14.127 0.887 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -8.409 -13.836 2.779 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -8.156 -12.104 2.695 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -9.793 -12.067 1.097 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -8.620 -12.787 0.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -10.639 -14.119 0.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -9.328 -14.996 0.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -10.465 -14.298 1.808 1.00 0.00 H new ATOM 1072 N ILE A 72 -3.988 -12.112 0.217 1.00 0.00 N ATOM 1073 CA ILE A 72 -3.607 -10.833 -0.440 1.00 0.00 C ATOM 1074 C ILE A 72 -4.870 -10.025 -0.747 1.00 0.00 C ATOM 1075 O ILE A 72 -5.825 -10.534 -1.299 1.00 0.00 O ATOM 1076 CB ILE A 72 -2.864 -11.133 -1.744 1.00 0.00 C ATOM 1077 CG1 ILE A 72 -1.686 -12.066 -1.457 1.00 0.00 C ATOM 1078 CG2 ILE A 72 -2.344 -9.826 -2.345 1.00 0.00 C ATOM 1079 CD1 ILE A 72 -1.020 -12.467 -2.775 1.00 0.00 C ATOM 0 H ILE A 72 -4.292 -12.851 -0.416 1.00 0.00 H new ATOM 0 HA ILE A 72 -2.960 -10.260 0.224 1.00 0.00 H new ATOM 0 HB ILE A 72 -3.544 -11.613 -2.448 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -0.964 -11.569 -0.809 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -2.032 -12.954 -0.927 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -1.814 -10.038 -3.274 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -3.183 -9.160 -2.549 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -1.664 -9.347 -1.641 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -0.181 -13.132 -2.571 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -1.744 -12.981 -3.407 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -0.660 -11.575 -3.287 1.00 0.00 H new ATOM 1091 N HIS A 73 -4.885 -8.770 -0.391 1.00 0.00 N ATOM 1092 CA HIS A 73 -6.088 -7.934 -0.660 1.00 0.00 C ATOM 1093 C HIS A 73 -5.966 -7.293 -2.044 1.00 0.00 C ATOM 1094 O HIS A 73 -6.878 -7.346 -2.846 1.00 0.00 O ATOM 1095 CB HIS A 73 -6.196 -6.839 0.403 1.00 0.00 C ATOM 1096 CG HIS A 73 -6.483 -7.466 1.740 1.00 0.00 C ATOM 1097 ND1 HIS A 73 -7.679 -8.111 2.013 1.00 0.00 N ATOM 1098 CD2 HIS A 73 -5.738 -7.556 2.890 1.00 0.00 C ATOM 1099 CE1 HIS A 73 -7.620 -8.557 3.281 1.00 0.00 C ATOM 1100 NE2 HIS A 73 -6.458 -8.245 3.863 1.00 0.00 N ATOM 0 H HIS A 73 -4.116 -8.288 0.074 1.00 0.00 H new ATOM 0 HA HIS A 73 -6.980 -8.560 -0.628 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -5.268 -6.268 0.448 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -6.989 -6.139 0.140 1.00 0.00 H new ATOM 0 HD1 HIS A 73 -8.462 -8.227 1.369 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -4.744 -7.153 3.020 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -8.415 -9.101 3.769 1.00 0.00 H new ATOM 1108 N SER A 74 -4.847 -6.687 -2.331 1.00 0.00 N ATOM 1109 CA SER A 74 -4.667 -6.044 -3.663 1.00 0.00 C ATOM 1110 C SER A 74 -3.178 -5.782 -3.903 1.00 0.00 C ATOM 1111 O SER A 74 -2.413 -5.601 -2.976 1.00 0.00 O ATOM 1112 CB SER A 74 -5.431 -4.719 -3.696 1.00 0.00 C ATOM 1113 OG SER A 74 -6.825 -4.978 -3.788 1.00 0.00 O ATOM 0 H SER A 74 -4.049 -6.609 -1.700 1.00 0.00 H new ATOM 0 HA SER A 74 -5.051 -6.703 -4.442 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.216 -4.141 -2.797 1.00 0.00 H new ATOM 0 HB3 SER A 74 -5.105 -4.120 -4.546 1.00 0.00 H new ATOM 0 HG SER A 74 -6.976 -5.945 -3.831 1.00 0.00 H new ATOM 1119 N ILE A 75 -2.760 -5.760 -5.139 1.00 0.00 N ATOM 1120 CA ILE A 75 -1.321 -5.512 -5.433 1.00 0.00 C ATOM 1121 C ILE A 75 -1.191 -4.400 -6.473 1.00 0.00 C ATOM 1122 O ILE A 75 -2.002 -4.276 -7.370 1.00 0.00 O ATOM 1123 CB ILE A 75 -0.683 -6.789 -5.980 1.00 0.00 C ATOM 1124 CG1 ILE A 75 -1.213 -7.061 -7.390 1.00 0.00 C ATOM 1125 CG2 ILE A 75 -1.032 -7.965 -5.068 1.00 0.00 C ATOM 1126 CD1 ILE A 75 -0.449 -8.235 -8.005 1.00 0.00 C ATOM 0 H ILE A 75 -3.352 -5.903 -5.957 1.00 0.00 H new ATOM 0 HA ILE A 75 -0.815 -5.213 -4.515 1.00 0.00 H new ATOM 0 HB ILE A 75 0.400 -6.667 -6.016 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -2.279 -7.287 -7.352 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -1.097 -6.173 -8.011 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -0.577 -8.875 -5.458 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -0.654 -7.772 -4.064 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -2.114 -8.088 -5.030 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -0.826 -8.429 -9.009 1.00 0.00 H new ATOM 0 HD12 ILE A 75 0.612 -7.991 -8.057 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -0.588 -9.123 -7.388 1.00 0.00 H new ATOM 1138 N ASP A 76 -0.172 -3.592 -6.366 1.00 0.00 N ATOM 1139 CA ASP A 76 0.016 -2.495 -7.353 1.00 0.00 C ATOM 1140 C ASP A 76 1.382 -2.647 -8.023 1.00 0.00 C ATOM 1141 O ASP A 76 2.409 -2.391 -7.427 1.00 0.00 O ATOM 1142 CB ASP A 76 -0.054 -1.142 -6.641 1.00 0.00 C ATOM 1143 CG ASP A 76 -1.430 -0.978 -5.991 1.00 0.00 C ATOM 1144 OD1 ASP A 76 -2.320 -1.736 -6.337 1.00 0.00 O ATOM 1145 OD2 ASP A 76 -1.568 -0.097 -5.158 1.00 0.00 O ATOM 0 H ASP A 76 0.539 -3.645 -5.636 1.00 0.00 H new ATOM 0 HA ASP A 76 -0.770 -2.546 -8.106 1.00 0.00 H new ATOM 0 HB2 ASP A 76 0.728 -1.076 -5.884 1.00 0.00 H new ATOM 0 HB3 ASP A 76 0.123 -0.335 -7.352 1.00 0.00 H new ATOM 1150 N LYS A 77 1.403 -3.059 -9.260 1.00 0.00 N ATOM 1151 CA LYS A 77 2.702 -3.220 -9.968 1.00 0.00 C ATOM 1152 C LYS A 77 3.136 -1.858 -10.502 1.00 0.00 C ATOM 1153 O LYS A 77 4.306 -1.592 -10.694 1.00 0.00 O ATOM 1154 CB LYS A 77 2.536 -4.201 -11.131 1.00 0.00 C ATOM 1155 CG LYS A 77 2.298 -5.607 -10.580 1.00 0.00 C ATOM 1156 CD LYS A 77 2.358 -6.621 -11.724 1.00 0.00 C ATOM 1157 CE LYS A 77 1.928 -7.996 -11.211 1.00 0.00 C ATOM 1158 NZ LYS A 77 1.076 -8.664 -12.235 1.00 0.00 N ATOM 0 H LYS A 77 0.576 -3.291 -9.811 1.00 0.00 H new ATOM 0 HA LYS A 77 3.455 -3.609 -9.283 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.699 -3.898 -11.760 1.00 0.00 H new ATOM 0 HB3 LYS A 77 3.426 -4.191 -11.760 1.00 0.00 H new ATOM 0 HG2 LYS A 77 3.050 -5.846 -9.828 1.00 0.00 H new ATOM 0 HG3 LYS A 77 1.327 -5.656 -10.087 1.00 0.00 H new ATOM 0 HD2 LYS A 77 1.706 -6.305 -12.539 1.00 0.00 H new ATOM 0 HD3 LYS A 77 3.370 -6.671 -12.127 1.00 0.00 H new ATOM 0 HE2 LYS A 77 2.805 -8.607 -10.997 1.00 0.00 H new ATOM 0 HE3 LYS A 77 1.377 -7.891 -10.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 0.783 -9.599 -11.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 0.233 -8.083 -12.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 1.616 -8.777 -13.116 1.00 0.00 H new ATOM 1172 N VAL A 78 2.190 -0.993 -10.736 1.00 0.00 N ATOM 1173 CA VAL A 78 2.521 0.364 -11.249 1.00 0.00 C ATOM 1174 C VAL A 78 2.890 1.260 -10.072 1.00 0.00 C ATOM 1175 O VAL A 78 3.872 1.974 -10.099 1.00 0.00 O ATOM 1176 CB VAL A 78 1.299 0.960 -11.953 1.00 0.00 C ATOM 1177 CG1 VAL A 78 1.758 1.817 -13.136 1.00 0.00 C ATOM 1178 CG2 VAL A 78 0.389 -0.159 -12.454 1.00 0.00 C ATOM 0 H VAL A 78 1.196 -1.169 -10.593 1.00 0.00 H new ATOM 0 HA VAL A 78 3.352 0.295 -11.951 1.00 0.00 H new ATOM 0 HB VAL A 78 0.746 1.580 -11.247 1.00 0.00 H new ATOM 0 HG11 VAL A 78 0.888 2.241 -13.637 1.00 0.00 H new ATOM 0 HG12 VAL A 78 2.398 2.623 -12.775 1.00 0.00 H new ATOM 0 HG13 VAL A 78 2.316 1.198 -13.839 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -0.478 0.273 -12.954 1.00 0.00 H new ATOM 0 HG22 VAL A 78 0.937 -0.787 -13.157 1.00 0.00 H new ATOM 0 HG23 VAL A 78 0.057 -0.764 -11.610 1.00 0.00 H new ATOM 1188 N ASN A 79 2.097 1.231 -9.037 1.00 0.00 N ATOM 1189 CA ASN A 79 2.385 2.083 -7.856 1.00 0.00 C ATOM 1190 C ASN A 79 3.454 1.416 -6.989 1.00 0.00 C ATOM 1191 O ASN A 79 3.916 1.978 -6.016 1.00 0.00 O ATOM 1192 CB ASN A 79 1.107 2.268 -7.039 1.00 0.00 C ATOM 1193 CG ASN A 79 0.054 2.979 -7.893 1.00 0.00 C ATOM 1194 OD1 ASN A 79 0.113 4.178 -8.077 1.00 0.00 O ATOM 1195 ND2 ASN A 79 -0.913 2.283 -8.427 1.00 0.00 N ATOM 0 H ASN A 79 1.261 0.652 -8.961 1.00 0.00 H new ATOM 0 HA ASN A 79 2.747 3.055 -8.191 1.00 0.00 H new ATOM 0 HB2 ASN A 79 0.730 1.300 -6.709 1.00 0.00 H new ATOM 0 HB3 ASN A 79 1.317 2.851 -6.142 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -1.619 2.746 -8.999 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -0.962 1.276 -8.272 1.00 0.00 H new ATOM 1202 N HIS A 80 3.850 0.219 -7.330 1.00 0.00 N ATOM 1203 CA HIS A 80 4.886 -0.480 -6.520 1.00 0.00 C ATOM 1204 C HIS A 80 4.381 -0.655 -5.086 1.00 0.00 C ATOM 1205 O HIS A 80 5.105 -0.452 -4.134 1.00 0.00 O ATOM 1206 CB HIS A 80 6.171 0.350 -6.507 1.00 0.00 C ATOM 1207 CG HIS A 80 6.602 0.630 -7.921 1.00 0.00 C ATOM 1208 ND1 HIS A 80 6.287 1.814 -8.569 1.00 0.00 N ATOM 1209 CD2 HIS A 80 7.326 -0.110 -8.822 1.00 0.00 C ATOM 1210 CE1 HIS A 80 6.815 1.753 -9.806 1.00 0.00 C ATOM 1211 NE2 HIS A 80 7.459 0.600 -10.012 1.00 0.00 N ATOM 0 H HIS A 80 3.501 -0.303 -8.133 1.00 0.00 H new ATOM 0 HA HIS A 80 5.088 -1.458 -6.957 1.00 0.00 H new ATOM 0 HB2 HIS A 80 6.006 1.286 -5.974 1.00 0.00 H new ATOM 0 HB3 HIS A 80 6.957 -0.186 -5.975 1.00 0.00 H new ATOM 0 HD1 HIS A 80 5.752 2.590 -8.180 1.00 0.00 H new ATOM 0 HD2 HIS A 80 7.731 -1.094 -8.636 1.00 0.00 H new ATOM 0 HE1 HIS A 80 6.729 2.539 -10.541 1.00 0.00 H new ATOM 1219 N THR A 81 3.140 -1.028 -4.926 1.00 0.00 N ATOM 1220 CA THR A 81 2.590 -1.212 -3.553 1.00 0.00 C ATOM 1221 C THR A 81 2.021 -2.626 -3.411 1.00 0.00 C ATOM 1222 O THR A 81 1.319 -3.113 -4.275 1.00 0.00 O ATOM 1223 CB THR A 81 1.478 -0.190 -3.308 1.00 0.00 C ATOM 1224 OG1 THR A 81 1.988 1.120 -3.516 1.00 0.00 O ATOM 1225 CG2 THR A 81 0.969 -0.319 -1.872 1.00 0.00 C ATOM 0 H THR A 81 2.485 -1.213 -5.685 1.00 0.00 H new ATOM 0 HA THR A 81 3.387 -1.068 -2.823 1.00 0.00 H new ATOM 0 HB THR A 81 0.656 -0.375 -3.999 1.00 0.00 H new ATOM 0 HG1 THR A 81 1.277 1.776 -3.361 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.177 0.410 -1.700 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.578 -1.324 -1.714 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.789 -0.135 -1.178 1.00 0.00 H new ATOM 1233 N TYR A 82 2.315 -3.286 -2.324 1.00 0.00 N ATOM 1234 CA TYR A 82 1.790 -4.665 -2.122 1.00 0.00 C ATOM 1235 C TYR A 82 1.028 -4.728 -0.797 1.00 0.00 C ATOM 1236 O TYR A 82 1.522 -4.313 0.233 1.00 0.00 O ATOM 1237 CB TYR A 82 2.956 -5.656 -2.088 1.00 0.00 C ATOM 1238 CG TYR A 82 2.418 -7.066 -2.046 1.00 0.00 C ATOM 1239 CD1 TYR A 82 2.044 -7.706 -3.233 1.00 0.00 C ATOM 1240 CD2 TYR A 82 2.294 -7.733 -0.822 1.00 0.00 C ATOM 1241 CE1 TYR A 82 1.545 -9.014 -3.196 1.00 0.00 C ATOM 1242 CE2 TYR A 82 1.796 -9.039 -0.784 1.00 0.00 C ATOM 1243 CZ TYR A 82 1.421 -9.680 -1.971 1.00 0.00 C ATOM 1244 OH TYR A 82 0.929 -10.969 -1.934 1.00 0.00 O ATOM 0 H TYR A 82 2.897 -2.929 -1.566 1.00 0.00 H new ATOM 0 HA TYR A 82 1.119 -4.923 -2.941 1.00 0.00 H new ATOM 0 HB2 TYR A 82 3.587 -5.522 -2.967 1.00 0.00 H new ATOM 0 HB3 TYR A 82 3.582 -5.468 -1.215 1.00 0.00 H new ATOM 0 HD1 TYR A 82 2.140 -7.191 -4.178 1.00 0.00 H new ATOM 0 HD2 TYR A 82 2.583 -7.239 0.094 1.00 0.00 H new ATOM 0 HE1 TYR A 82 1.256 -9.508 -4.112 1.00 0.00 H new ATOM 0 HE2 TYR A 82 1.701 -9.553 0.161 1.00 0.00 H new ATOM 0 HH TYR A 82 1.325 -11.449 -1.176 1.00 0.00 H new ATOM 1254 N SER A 83 -0.172 -5.239 -0.813 1.00 0.00 N ATOM 1255 CA SER A 83 -0.963 -5.322 0.448 1.00 0.00 C ATOM 1256 C SER A 83 -1.348 -6.778 0.719 1.00 0.00 C ATOM 1257 O SER A 83 -1.777 -7.492 -0.165 1.00 0.00 O ATOM 1258 CB SER A 83 -2.231 -4.476 0.311 1.00 0.00 C ATOM 1259 OG SER A 83 -1.874 -3.131 0.031 1.00 0.00 O ATOM 0 H SER A 83 -0.639 -5.603 -1.644 1.00 0.00 H new ATOM 0 HA SER A 83 -0.362 -4.947 1.277 1.00 0.00 H new ATOM 0 HB2 SER A 83 -2.860 -4.870 -0.487 1.00 0.00 H new ATOM 0 HB3 SER A 83 -2.815 -4.525 1.230 1.00 0.00 H new ATOM 0 HG SER A 83 -2.686 -2.589 -0.059 1.00 0.00 H new ATOM 1265 N TYR A 84 -1.201 -7.222 1.938 1.00 0.00 N ATOM 1266 CA TYR A 84 -1.562 -8.629 2.269 1.00 0.00 C ATOM 1267 C TYR A 84 -1.984 -8.711 3.738 1.00 0.00 C ATOM 1268 O TYR A 84 -1.794 -7.785 4.500 1.00 0.00 O ATOM 1269 CB TYR A 84 -0.354 -9.538 2.028 1.00 0.00 C ATOM 1270 CG TYR A 84 0.684 -9.295 3.099 1.00 0.00 C ATOM 1271 CD1 TYR A 84 1.601 -8.246 2.961 1.00 0.00 C ATOM 1272 CD2 TYR A 84 0.731 -10.121 4.229 1.00 0.00 C ATOM 1273 CE1 TYR A 84 2.562 -8.022 3.954 1.00 0.00 C ATOM 1274 CE2 TYR A 84 1.693 -9.897 5.221 1.00 0.00 C ATOM 1275 CZ TYR A 84 2.608 -8.847 5.083 1.00 0.00 C ATOM 1276 OH TYR A 84 3.557 -8.627 6.061 1.00 0.00 O ATOM 0 H TYR A 84 -0.846 -6.670 2.719 1.00 0.00 H new ATOM 0 HA TYR A 84 -2.387 -8.953 1.635 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -0.664 -10.583 2.038 1.00 0.00 H new ATOM 0 HB3 TYR A 84 0.071 -9.342 1.044 1.00 0.00 H new ATOM 0 HD1 TYR A 84 1.567 -7.610 2.089 1.00 0.00 H new ATOM 0 HD2 TYR A 84 0.025 -10.931 4.335 1.00 0.00 H new ATOM 0 HE1 TYR A 84 3.268 -7.212 3.848 1.00 0.00 H new ATOM 0 HE2 TYR A 84 1.729 -10.534 6.092 1.00 0.00 H new ATOM 0 HH TYR A 84 3.124 -8.262 6.861 1.00 0.00 H new ATOM 1286 N SER A 85 -2.558 -9.811 4.141 1.00 0.00 N ATOM 1287 CA SER A 85 -2.991 -9.946 5.561 1.00 0.00 C ATOM 1288 C SER A 85 -2.911 -11.413 5.984 1.00 0.00 C ATOM 1289 O SER A 85 -3.036 -12.311 5.176 1.00 0.00 O ATOM 1290 CB SER A 85 -4.432 -9.453 5.702 1.00 0.00 C ATOM 1291 OG SER A 85 -5.301 -10.319 4.986 1.00 0.00 O ATOM 0 H SER A 85 -2.746 -10.621 3.550 1.00 0.00 H new ATOM 0 HA SER A 85 -2.337 -9.350 6.198 1.00 0.00 H new ATOM 0 HB2 SER A 85 -4.716 -9.424 6.754 1.00 0.00 H new ATOM 0 HB3 SER A 85 -4.519 -8.436 5.320 1.00 0.00 H new ATOM 0 HG SER A 85 -5.997 -9.790 4.542 1.00 0.00 H new ATOM 1297 N LEU A 86 -2.704 -11.664 7.248 1.00 0.00 N ATOM 1298 CA LEU A 86 -2.617 -13.073 7.724 1.00 0.00 C ATOM 1299 C LEU A 86 -4.005 -13.545 8.163 1.00 0.00 C ATOM 1300 O LEU A 86 -4.590 -13.011 9.083 1.00 0.00 O ATOM 1301 CB LEU A 86 -1.651 -13.153 8.908 1.00 0.00 C ATOM 1302 CG LEU A 86 -1.454 -14.616 9.311 1.00 0.00 C ATOM 1303 CD1 LEU A 86 -0.701 -15.354 8.203 1.00 0.00 C ATOM 1304 CD2 LEU A 86 -0.645 -14.681 10.608 1.00 0.00 C ATOM 0 H LEU A 86 -2.591 -10.954 7.971 1.00 0.00 H new ATOM 0 HA LEU A 86 -2.253 -13.710 6.917 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -0.693 -12.707 8.640 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -2.044 -12.583 9.750 1.00 0.00 H new ATOM 0 HG LEU A 86 -2.426 -15.085 9.464 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -0.561 -16.396 8.490 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -1.276 -15.307 7.278 1.00 0.00 H new ATOM 0 HD13 LEU A 86 0.271 -14.886 8.050 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -0.504 -15.722 10.897 1.00 0.00 H new ATOM 0 HD22 LEU A 86 0.327 -14.212 10.455 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -1.181 -14.155 11.398 1.00 0.00 H new ATOM 1316 N ILE A 87 -4.538 -14.541 7.510 1.00 0.00 N ATOM 1317 CA ILE A 87 -5.890 -15.040 7.888 1.00 0.00 C ATOM 1318 C ILE A 87 -5.818 -15.754 9.239 1.00 0.00 C ATOM 1319 O ILE A 87 -6.296 -15.257 10.239 1.00 0.00 O ATOM 1320 CB ILE A 87 -6.391 -16.018 6.823 1.00 0.00 C ATOM 1321 CG1 ILE A 87 -6.476 -15.306 5.472 1.00 0.00 C ATOM 1322 CG2 ILE A 87 -7.778 -16.533 7.216 1.00 0.00 C ATOM 1323 CD1 ILE A 87 -7.208 -13.973 5.645 1.00 0.00 C ATOM 0 H ILE A 87 -4.096 -15.030 6.732 1.00 0.00 H new ATOM 0 HA ILE A 87 -6.576 -14.196 7.961 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.699 -16.857 6.747 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -5.475 -15.135 5.075 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -7.002 -15.932 4.751 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -8.136 -17.230 6.458 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -7.718 -17.043 8.178 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -8.469 -15.694 7.293 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -7.269 -13.464 4.683 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -8.214 -14.157 6.023 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -6.663 -13.348 6.352 1.00 0.00 H new ATOM 1335 N GLU A 88 -5.231 -16.919 9.278 1.00 0.00 N ATOM 1336 CA GLU A 88 -5.141 -17.661 10.567 1.00 0.00 C ATOM 1337 C GLU A 88 -3.690 -18.073 10.828 1.00 0.00 C ATOM 1338 O GLU A 88 -2.838 -17.969 9.969 1.00 0.00 O ATOM 1339 CB GLU A 88 -6.022 -18.910 10.497 1.00 0.00 C ATOM 1340 CG GLU A 88 -7.482 -18.494 10.303 1.00 0.00 C ATOM 1341 CD GLU A 88 -8.371 -19.739 10.305 1.00 0.00 C ATOM 1342 OE1 GLU A 88 -7.827 -20.830 10.278 1.00 0.00 O ATOM 1343 OE2 GLU A 88 -9.580 -19.579 10.335 1.00 0.00 O ATOM 0 H GLU A 88 -4.811 -17.388 8.475 1.00 0.00 H new ATOM 0 HA GLU A 88 -5.482 -17.018 11.378 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -5.702 -19.548 9.673 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -5.917 -19.494 11.412 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -7.787 -17.815 11.099 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -7.596 -17.954 9.363 1.00 0.00 H new ATOM 1350 N GLY A 89 -3.407 -18.542 12.012 1.00 0.00 N ATOM 1351 CA GLY A 89 -2.017 -18.965 12.342 1.00 0.00 C ATOM 1352 C GLY A 89 -1.957 -19.392 13.809 1.00 0.00 C ATOM 1353 O GLY A 89 -2.524 -18.753 14.674 1.00 0.00 O ATOM 0 H GLY A 89 -4.082 -18.651 12.769 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -1.712 -19.790 11.698 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -1.322 -18.145 12.161 1.00 0.00 H new ATOM 1357 N ASP A 90 -1.280 -20.468 14.098 1.00 0.00 N ATOM 1358 CA ASP A 90 -1.191 -20.935 15.510 1.00 0.00 C ATOM 1359 C ASP A 90 -0.835 -19.758 16.421 1.00 0.00 C ATOM 1360 O ASP A 90 -1.359 -19.622 17.509 1.00 0.00 O ATOM 1361 CB ASP A 90 -0.111 -22.011 15.621 1.00 0.00 C ATOM 1362 CG ASP A 90 -0.554 -23.259 14.856 1.00 0.00 C ATOM 1363 OD1 ASP A 90 -1.567 -23.186 14.179 1.00 0.00 O ATOM 1364 OD2 ASP A 90 0.125 -24.267 14.961 1.00 0.00 O ATOM 0 H ASP A 90 -0.784 -21.044 13.418 1.00 0.00 H new ATOM 0 HA ASP A 90 -2.152 -21.349 15.816 1.00 0.00 H new ATOM 0 HB2 ASP A 90 0.831 -21.639 15.217 1.00 0.00 H new ATOM 0 HB3 ASP A 90 0.066 -22.257 16.668 1.00 0.00 H new ATOM 1369 N ALA A 91 0.053 -18.907 15.987 1.00 0.00 N ATOM 1370 CA ALA A 91 0.443 -17.741 16.831 1.00 0.00 C ATOM 1371 C ALA A 91 -0.760 -16.809 17.003 1.00 0.00 C ATOM 1372 O ALA A 91 -0.775 -15.951 17.862 1.00 0.00 O ATOM 1373 CB ALA A 91 1.585 -16.981 16.153 1.00 0.00 C ATOM 0 H ALA A 91 0.526 -18.968 15.085 1.00 0.00 H new ATOM 0 HA ALA A 91 0.771 -18.094 17.809 1.00 0.00 H new ATOM 0 HB1 ALA A 91 1.871 -16.128 16.769 1.00 0.00 H new ATOM 0 HB2 ALA A 91 2.441 -17.644 16.031 1.00 0.00 H new ATOM 0 HB3 ALA A 91 1.257 -16.628 15.175 1.00 0.00 H new ATOM 1379 N LEU A 92 -1.768 -16.972 16.191 1.00 0.00 N ATOM 1380 CA LEU A 92 -2.969 -16.096 16.305 1.00 0.00 C ATOM 1381 C LEU A 92 -3.953 -16.703 17.309 1.00 0.00 C ATOM 1382 O LEU A 92 -4.514 -16.012 18.136 1.00 0.00 O ATOM 1383 CB LEU A 92 -3.648 -15.979 14.938 1.00 0.00 C ATOM 1384 CG LEU A 92 -2.770 -15.149 13.999 1.00 0.00 C ATOM 1385 CD1 LEU A 92 -1.549 -15.969 13.580 1.00 0.00 C ATOM 1386 CD2 LEU A 92 -3.576 -14.766 12.757 1.00 0.00 C ATOM 0 H LEU A 92 -1.812 -17.674 15.453 1.00 0.00 H new ATOM 0 HA LEU A 92 -2.663 -15.107 16.647 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -3.813 -16.971 14.516 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -4.627 -15.511 15.045 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.440 -14.247 14.514 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -0.925 -15.376 12.911 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -0.974 -16.244 14.464 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -1.877 -16.872 13.065 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -2.952 -14.175 12.087 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -3.905 -15.670 12.244 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -4.446 -14.180 13.054 1.00 0.00 H new ATOM 1398 N SER A 93 -4.171 -17.987 17.240 1.00 0.00 N ATOM 1399 CA SER A 93 -5.123 -18.633 18.186 1.00 0.00 C ATOM 1400 C SER A 93 -6.520 -18.046 17.981 1.00 0.00 C ATOM 1401 O SER A 93 -6.720 -17.167 17.166 1.00 0.00 O ATOM 1402 CB SER A 93 -4.667 -18.376 19.624 1.00 0.00 C ATOM 1403 OG SER A 93 -3.726 -19.367 20.007 1.00 0.00 O ATOM 0 H SER A 93 -3.731 -18.617 16.569 1.00 0.00 H new ATOM 0 HA SER A 93 -5.149 -19.707 18.000 1.00 0.00 H new ATOM 0 HB2 SER A 93 -4.220 -17.385 19.703 1.00 0.00 H new ATOM 0 HB3 SER A 93 -5.524 -18.394 20.297 1.00 0.00 H new ATOM 0 HG SER A 93 -3.433 -19.201 20.927 1.00 0.00 H new ATOM 1409 N GLU A 94 -7.489 -18.524 18.711 1.00 0.00 N ATOM 1410 CA GLU A 94 -8.872 -17.991 18.553 1.00 0.00 C ATOM 1411 C GLU A 94 -8.998 -16.659 19.297 1.00 0.00 C ATOM 1412 O GLU A 94 -10.033 -16.023 19.277 1.00 0.00 O ATOM 1413 CB GLU A 94 -9.875 -18.993 19.130 1.00 0.00 C ATOM 1414 CG GLU A 94 -9.813 -20.296 18.331 1.00 0.00 C ATOM 1415 CD GLU A 94 -10.851 -21.277 18.875 1.00 0.00 C ATOM 1416 OE1 GLU A 94 -11.435 -20.981 19.905 1.00 0.00 O ATOM 1417 OE2 GLU A 94 -11.046 -22.309 18.254 1.00 0.00 O ATOM 0 H GLU A 94 -7.384 -19.260 19.410 1.00 0.00 H new ATOM 0 HA GLU A 94 -9.080 -17.836 17.494 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -9.650 -19.186 20.179 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -10.882 -18.578 19.092 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -10.002 -20.098 17.276 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -8.816 -20.730 18.400 1.00 0.00 H new ATOM 1424 N ASN A 95 -7.955 -16.232 19.956 1.00 0.00 N ATOM 1425 CA ASN A 95 -8.021 -14.944 20.700 1.00 0.00 C ATOM 1426 C ASN A 95 -7.548 -13.802 19.798 1.00 0.00 C ATOM 1427 O ASN A 95 -7.864 -12.651 20.022 1.00 0.00 O ATOM 1428 CB ASN A 95 -7.120 -15.022 21.935 1.00 0.00 C ATOM 1429 CG ASN A 95 -5.655 -15.027 21.496 1.00 0.00 C ATOM 1430 OD1 ASN A 95 -5.285 -15.735 20.581 1.00 0.00 O ATOM 1431 ND2 ASN A 95 -4.799 -14.260 22.115 1.00 0.00 N ATOM 0 H ASN A 95 -7.061 -16.720 20.011 1.00 0.00 H new ATOM 0 HA ASN A 95 -9.050 -14.759 21.008 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -7.311 -14.174 22.592 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -7.343 -15.924 22.505 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -3.820 -14.255 21.830 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -5.110 -13.665 22.883 1.00 0.00 H new ATOM 1438 N ILE A 96 -6.792 -14.110 18.779 1.00 0.00 N ATOM 1439 CA ILE A 96 -6.301 -13.039 17.866 1.00 0.00 C ATOM 1440 C ILE A 96 -6.974 -13.180 16.499 1.00 0.00 C ATOM 1441 O ILE A 96 -7.181 -14.272 16.008 1.00 0.00 O ATOM 1442 CB ILE A 96 -4.785 -13.160 17.703 1.00 0.00 C ATOM 1443 CG1 ILE A 96 -4.116 -13.112 19.078 1.00 0.00 C ATOM 1444 CG2 ILE A 96 -4.271 -12.002 16.845 1.00 0.00 C ATOM 1445 CD1 ILE A 96 -2.598 -13.217 18.911 1.00 0.00 C ATOM 0 H ILE A 96 -6.494 -15.056 18.540 1.00 0.00 H new ATOM 0 HA ILE A 96 -6.544 -12.065 18.290 1.00 0.00 H new ATOM 0 HB ILE A 96 -4.547 -14.107 17.218 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -4.373 -12.183 19.587 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -4.481 -13.929 19.701 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.191 -12.087 16.728 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -4.746 -12.037 15.864 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.510 -11.056 17.330 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -2.121 -13.183 19.890 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -2.350 -14.158 18.419 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -2.240 -12.385 18.304 1.00 0.00 H new ATOM 1457 N GLU A 97 -7.316 -12.082 15.882 1.00 0.00 N ATOM 1458 CA GLU A 97 -7.974 -12.148 14.548 1.00 0.00 C ATOM 1459 C GLU A 97 -6.918 -11.987 13.452 1.00 0.00 C ATOM 1460 O GLU A 97 -5.744 -11.835 13.726 1.00 0.00 O ATOM 1461 CB GLU A 97 -9.009 -11.027 14.430 1.00 0.00 C ATOM 1462 CG GLU A 97 -10.130 -11.261 15.444 1.00 0.00 C ATOM 1463 CD GLU A 97 -11.202 -10.183 15.276 1.00 0.00 C ATOM 1464 OE1 GLU A 97 -10.964 -9.249 14.527 1.00 0.00 O ATOM 1465 OE2 GLU A 97 -12.244 -10.310 15.898 1.00 0.00 O ATOM 0 H GLU A 97 -7.167 -11.141 16.246 1.00 0.00 H new ATOM 0 HA GLU A 97 -8.472 -13.111 14.436 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -8.537 -10.061 14.610 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -9.417 -10.999 13.420 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -10.567 -12.249 15.298 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -9.729 -11.236 16.457 1.00 0.00 H new ATOM 1472 N LYS A 98 -7.325 -12.024 12.212 1.00 0.00 N ATOM 1473 CA LYS A 98 -6.342 -11.877 11.102 1.00 0.00 C ATOM 1474 C LYS A 98 -5.592 -10.552 11.253 1.00 0.00 C ATOM 1475 O LYS A 98 -5.998 -9.677 11.993 1.00 0.00 O ATOM 1476 CB LYS A 98 -7.082 -11.894 9.763 1.00 0.00 C ATOM 1477 CG LYS A 98 -7.960 -10.646 9.648 1.00 0.00 C ATOM 1478 CD LYS A 98 -8.762 -10.705 8.346 1.00 0.00 C ATOM 1479 CE LYS A 98 -9.331 -9.320 8.034 1.00 0.00 C ATOM 1480 NZ LYS A 98 -10.820 -9.374 8.075 1.00 0.00 N ATOM 0 H LYS A 98 -8.294 -12.149 11.920 1.00 0.00 H new ATOM 0 HA LYS A 98 -5.630 -12.701 11.136 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -6.367 -11.925 8.941 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -7.696 -12.792 9.686 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -8.635 -10.584 10.501 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -7.340 -9.749 9.666 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -8.124 -11.040 7.528 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -9.571 -11.430 8.437 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -8.963 -8.592 8.757 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -8.995 -8.990 7.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -11.207 -8.432 7.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -11.162 -10.056 7.369 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -11.131 -9.671 9.022 1.00 0.00 H new ATOM 1494 N ILE A 99 -4.496 -10.400 10.560 1.00 0.00 N ATOM 1495 CA ILE A 99 -3.716 -9.135 10.665 1.00 0.00 C ATOM 1496 C ILE A 99 -3.615 -8.482 9.285 1.00 0.00 C ATOM 1497 O ILE A 99 -3.328 -9.131 8.299 1.00 0.00 O ATOM 1498 CB ILE A 99 -2.310 -9.445 11.185 1.00 0.00 C ATOM 1499 CG1 ILE A 99 -2.409 -10.177 12.523 1.00 0.00 C ATOM 1500 CG2 ILE A 99 -1.537 -8.138 11.374 1.00 0.00 C ATOM 1501 CD1 ILE A 99 -1.035 -10.733 12.906 1.00 0.00 C ATOM 0 H ILE A 99 -4.107 -11.098 9.926 1.00 0.00 H new ATOM 0 HA ILE A 99 -4.218 -8.455 11.354 1.00 0.00 H new ATOM 0 HB ILE A 99 -1.788 -10.076 10.465 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -2.766 -9.496 13.296 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -3.134 -10.988 12.453 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.536 -8.358 11.744 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -1.465 -7.617 10.419 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -2.059 -7.507 12.093 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -1.107 -11.255 13.860 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -0.696 -11.428 12.137 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -0.322 -9.913 12.994 1.00 0.00 H new ATOM 1513 N ASP A 100 -3.846 -7.199 9.206 1.00 0.00 N ATOM 1514 CA ASP A 100 -3.762 -6.506 7.890 1.00 0.00 C ATOM 1515 C ASP A 100 -2.332 -6.009 7.665 1.00 0.00 C ATOM 1516 O ASP A 100 -1.794 -5.259 8.455 1.00 0.00 O ATOM 1517 CB ASP A 100 -4.723 -5.316 7.877 1.00 0.00 C ATOM 1518 CG ASP A 100 -4.720 -4.674 6.487 1.00 0.00 C ATOM 1519 OD1 ASP A 100 -4.069 -5.214 5.609 1.00 0.00 O ATOM 1520 OD2 ASP A 100 -5.371 -3.655 6.326 1.00 0.00 O ATOM 0 H ASP A 100 -4.089 -6.602 9.996 1.00 0.00 H new ATOM 0 HA ASP A 100 -4.034 -7.201 7.096 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -5.730 -5.645 8.135 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -4.424 -4.585 8.628 1.00 0.00 H new ATOM 1525 N TYR A 101 -1.713 -6.421 6.593 1.00 0.00 N ATOM 1526 CA TYR A 101 -0.320 -5.971 6.319 1.00 0.00 C ATOM 1527 C TYR A 101 -0.298 -5.128 5.043 1.00 0.00 C ATOM 1528 O TYR A 101 -0.966 -5.432 4.075 1.00 0.00 O ATOM 1529 CB TYR A 101 0.586 -7.191 6.138 1.00 0.00 C ATOM 1530 CG TYR A 101 0.789 -7.870 7.472 1.00 0.00 C ATOM 1531 CD1 TYR A 101 1.733 -7.370 8.376 1.00 0.00 C ATOM 1532 CD2 TYR A 101 0.033 -9.001 7.803 1.00 0.00 C ATOM 1533 CE1 TYR A 101 1.921 -7.999 9.612 1.00 0.00 C ATOM 1534 CE2 TYR A 101 0.222 -9.631 9.040 1.00 0.00 C ATOM 1535 CZ TYR A 101 1.166 -9.130 9.944 1.00 0.00 C ATOM 1536 OH TYR A 101 1.351 -9.751 11.162 1.00 0.00 O ATOM 0 H TYR A 101 -2.112 -7.049 5.896 1.00 0.00 H new ATOM 0 HA TYR A 101 0.039 -5.373 7.157 1.00 0.00 H new ATOM 0 HB2 TYR A 101 0.139 -7.887 5.428 1.00 0.00 H new ATOM 0 HB3 TYR A 101 1.547 -6.886 5.723 1.00 0.00 H new ATOM 0 HD1 TYR A 101 2.317 -6.498 8.120 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -0.695 -9.387 7.105 1.00 0.00 H new ATOM 0 HE1 TYR A 101 2.649 -7.612 10.310 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -0.361 -10.503 9.296 1.00 0.00 H new ATOM 0 HH TYR A 101 1.476 -9.073 11.859 1.00 0.00 H new ATOM 1546 N GLU A 102 0.464 -4.068 5.033 1.00 0.00 N ATOM 1547 CA GLU A 102 0.527 -3.207 3.819 1.00 0.00 C ATOM 1548 C GLU A 102 1.989 -2.936 3.458 1.00 0.00 C ATOM 1549 O GLU A 102 2.808 -2.661 4.313 1.00 0.00 O ATOM 1550 CB GLU A 102 -0.184 -1.881 4.098 1.00 0.00 C ATOM 1551 CG GLU A 102 -1.659 -2.146 4.400 1.00 0.00 C ATOM 1552 CD GLU A 102 -2.398 -0.814 4.537 1.00 0.00 C ATOM 1553 OE1 GLU A 102 -1.736 0.211 4.546 1.00 0.00 O ATOM 1554 OE2 GLU A 102 -3.614 -0.840 4.631 1.00 0.00 O ATOM 0 H GLU A 102 1.045 -3.762 5.813 1.00 0.00 H new ATOM 0 HA GLU A 102 0.037 -3.715 2.988 1.00 0.00 H new ATOM 0 HB2 GLU A 102 0.286 -1.375 4.942 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -0.091 -1.219 3.237 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -2.104 -2.741 3.602 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -1.755 -2.724 5.319 1.00 0.00 H new ATOM 1561 N THR A 103 2.324 -3.010 2.199 1.00 0.00 N ATOM 1562 CA THR A 103 3.732 -2.755 1.785 1.00 0.00 C ATOM 1563 C THR A 103 3.747 -1.787 0.601 1.00 0.00 C ATOM 1564 O THR A 103 3.007 -1.944 -0.350 1.00 0.00 O ATOM 1565 CB THR A 103 4.392 -4.075 1.375 1.00 0.00 C ATOM 1566 OG1 THR A 103 4.281 -5.008 2.440 1.00 0.00 O ATOM 1567 CG2 THR A 103 5.867 -3.831 1.057 1.00 0.00 C ATOM 0 H THR A 103 1.683 -3.236 1.439 1.00 0.00 H new ATOM 0 HA THR A 103 4.282 -2.319 2.618 1.00 0.00 H new ATOM 0 HB THR A 103 3.894 -4.473 0.491 1.00 0.00 H new ATOM 0 HG1 THR A 103 4.701 -5.854 2.179 1.00 0.00 H new ATOM 0 HG21 THR A 103 6.337 -4.770 0.765 1.00 0.00 H new ATOM 0 HG22 THR A 103 5.949 -3.115 0.239 1.00 0.00 H new ATOM 0 HG23 THR A 103 6.368 -3.433 1.939 1.00 0.00 H new ATOM 1575 N LYS A 104 4.582 -0.786 0.650 1.00 0.00 N ATOM 1576 CA LYS A 104 4.640 0.191 -0.475 1.00 0.00 C ATOM 1577 C LYS A 104 6.098 0.409 -0.887 1.00 0.00 C ATOM 1578 O LYS A 104 6.964 0.611 -0.057 1.00 0.00 O ATOM 1579 CB LYS A 104 4.032 1.521 -0.025 1.00 0.00 C ATOM 1580 CG LYS A 104 3.948 2.473 -1.221 1.00 0.00 C ATOM 1581 CD LYS A 104 3.333 3.800 -0.775 1.00 0.00 C ATOM 1582 CE LYS A 104 3.112 4.696 -1.994 1.00 0.00 C ATOM 1583 NZ LYS A 104 3.702 6.040 -1.738 1.00 0.00 N ATOM 0 H LYS A 104 5.226 -0.602 1.419 1.00 0.00 H new ATOM 0 HA LYS A 104 4.078 -0.197 -1.324 1.00 0.00 H new ATOM 0 HB2 LYS A 104 3.039 1.356 0.393 1.00 0.00 H new ATOM 0 HB3 LYS A 104 4.641 1.963 0.764 1.00 0.00 H new ATOM 0 HG2 LYS A 104 4.942 2.642 -1.635 1.00 0.00 H new ATOM 0 HG3 LYS A 104 3.344 2.028 -2.012 1.00 0.00 H new ATOM 0 HD2 LYS A 104 2.386 3.621 -0.266 1.00 0.00 H new ATOM 0 HD3 LYS A 104 3.990 4.296 -0.061 1.00 0.00 H new ATOM 0 HE2 LYS A 104 3.571 4.248 -2.876 1.00 0.00 H new ATOM 0 HE3 LYS A 104 2.046 4.789 -2.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 3.218 6.749 -2.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 3.586 6.284 -0.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 4.714 6.026 -1.977 1.00 0.00 H new ATOM 1597 N LEU A 105 6.376 0.375 -2.161 1.00 0.00 N ATOM 1598 CA LEU A 105 7.776 0.582 -2.624 1.00 0.00 C ATOM 1599 C LEU A 105 7.918 1.994 -3.197 1.00 0.00 C ATOM 1600 O LEU A 105 7.189 2.391 -4.084 1.00 0.00 O ATOM 1601 CB LEU A 105 8.113 -0.443 -3.709 1.00 0.00 C ATOM 1602 CG LEU A 105 9.114 -1.461 -3.155 1.00 0.00 C ATOM 1603 CD1 LEU A 105 8.624 -1.972 -1.799 1.00 0.00 C ATOM 1604 CD2 LEU A 105 9.239 -2.635 -4.129 1.00 0.00 C ATOM 0 H LEU A 105 5.693 0.213 -2.901 1.00 0.00 H new ATOM 0 HA LEU A 105 8.459 0.458 -1.783 1.00 0.00 H new ATOM 0 HB2 LEU A 105 7.207 -0.951 -4.039 1.00 0.00 H new ATOM 0 HB3 LEU A 105 8.533 0.059 -4.581 1.00 0.00 H new ATOM 0 HG LEU A 105 10.087 -0.985 -3.033 1.00 0.00 H new ATOM 0 HD11 LEU A 105 9.336 -2.697 -1.404 1.00 0.00 H new ATOM 0 HD12 LEU A 105 8.535 -1.136 -1.106 1.00 0.00 H new ATOM 0 HD13 LEU A 105 7.651 -2.448 -1.920 1.00 0.00 H new ATOM 0 HD21 LEU A 105 9.951 -3.360 -3.735 1.00 0.00 H new ATOM 0 HD22 LEU A 105 8.266 -3.111 -4.251 1.00 0.00 H new ATOM 0 HD23 LEU A 105 9.588 -2.271 -5.095 1.00 0.00 H new ATOM 1616 N VAL A 106 8.852 2.757 -2.696 1.00 0.00 N ATOM 1617 CA VAL A 106 9.037 4.142 -3.214 1.00 0.00 C ATOM 1618 C VAL A 106 10.519 4.382 -3.509 1.00 0.00 C ATOM 1619 O VAL A 106 11.386 3.956 -2.773 1.00 0.00 O ATOM 1620 CB VAL A 106 8.559 5.147 -2.163 1.00 0.00 C ATOM 1621 CG1 VAL A 106 8.634 6.562 -2.739 1.00 0.00 C ATOM 1622 CG2 VAL A 106 7.113 4.829 -1.777 1.00 0.00 C ATOM 0 H VAL A 106 9.493 2.481 -1.952 1.00 0.00 H new ATOM 0 HA VAL A 106 8.458 4.268 -4.129 1.00 0.00 H new ATOM 0 HB VAL A 106 9.195 5.081 -1.280 1.00 0.00 H new ATOM 0 HG11 VAL A 106 8.294 7.278 -1.991 1.00 0.00 H new ATOM 0 HG12 VAL A 106 9.664 6.788 -3.016 1.00 0.00 H new ATOM 0 HG13 VAL A 106 7.998 6.630 -3.622 1.00 0.00 H new ATOM 0 HG21 VAL A 106 6.771 5.544 -1.029 1.00 0.00 H new ATOM 0 HG22 VAL A 106 6.478 4.896 -2.660 1.00 0.00 H new ATOM 0 HG23 VAL A 106 7.059 3.820 -1.367 1.00 0.00 H new ATOM 1632 N SER A 107 10.817 5.062 -4.582 1.00 0.00 N ATOM 1633 CA SER A 107 12.241 5.328 -4.923 1.00 0.00 C ATOM 1634 C SER A 107 12.539 6.817 -4.740 1.00 0.00 C ATOM 1635 O SER A 107 11.726 7.666 -5.047 1.00 0.00 O ATOM 1636 CB SER A 107 12.499 4.930 -6.378 1.00 0.00 C ATOM 1637 OG SER A 107 11.745 5.769 -7.241 1.00 0.00 O ATOM 0 H SER A 107 10.135 5.445 -5.237 1.00 0.00 H new ATOM 0 HA SER A 107 12.888 4.745 -4.267 1.00 0.00 H new ATOM 0 HB2 SER A 107 13.561 5.016 -6.607 1.00 0.00 H new ATOM 0 HB3 SER A 107 12.223 3.887 -6.535 1.00 0.00 H new ATOM 0 HG SER A 107 11.912 5.515 -8.173 1.00 0.00 H new ATOM 1643 N ALA A 108 13.698 7.141 -4.238 1.00 0.00 N ATOM 1644 CA ALA A 108 14.046 8.575 -4.034 1.00 0.00 C ATOM 1645 C ALA A 108 15.127 8.987 -5.035 1.00 0.00 C ATOM 1646 O ALA A 108 15.768 8.155 -5.647 1.00 0.00 O ATOM 1647 CB ALA A 108 14.568 8.774 -2.609 1.00 0.00 C ATOM 0 H ALA A 108 14.419 6.475 -3.960 1.00 0.00 H new ATOM 0 HA ALA A 108 13.158 9.189 -4.186 1.00 0.00 H new ATOM 0 HB1 ALA A 108 14.823 9.823 -2.458 1.00 0.00 H new ATOM 0 HB2 ALA A 108 13.798 8.482 -1.895 1.00 0.00 H new ATOM 0 HB3 ALA A 108 15.455 8.159 -2.457 1.00 0.00 H new ATOM 1653 N PRO A 109 15.329 10.301 -5.202 1.00 0.00 N ATOM 1654 CA PRO A 109 16.333 10.839 -6.129 1.00 0.00 C ATOM 1655 C PRO A 109 17.760 10.578 -5.636 1.00 0.00 C ATOM 1656 O PRO A 109 18.723 10.835 -6.331 1.00 0.00 O ATOM 1657 CB PRO A 109 16.048 12.341 -6.134 1.00 0.00 C ATOM 1658 CG PRO A 109 15.387 12.602 -4.822 1.00 0.00 C ATOM 1659 CD PRO A 109 14.595 11.367 -4.497 1.00 0.00 C ATOM 0 HA PRO A 109 16.269 10.377 -7.114 1.00 0.00 H new ATOM 0 HB2 PRO A 109 16.967 12.919 -6.237 1.00 0.00 H new ATOM 0 HB3 PRO A 109 15.401 12.619 -6.966 1.00 0.00 H new ATOM 0 HG2 PRO A 109 16.127 12.805 -4.047 1.00 0.00 H new ATOM 0 HG3 PRO A 109 14.738 13.476 -4.880 1.00 0.00 H new ATOM 0 HD2 PRO A 109 14.555 11.186 -3.423 1.00 0.00 H new ATOM 0 HD3 PRO A 109 13.565 11.446 -4.846 1.00 0.00 H new ATOM 1667 N HIS A 110 17.900 10.069 -4.443 1.00 0.00 N ATOM 1668 CA HIS A 110 19.263 9.793 -3.908 1.00 0.00 C ATOM 1669 C HIS A 110 19.794 8.491 -4.513 1.00 0.00 C ATOM 1670 O HIS A 110 20.979 8.227 -4.501 1.00 0.00 O ATOM 1671 CB HIS A 110 19.196 9.657 -2.385 1.00 0.00 C ATOM 1672 CG HIS A 110 20.574 9.392 -1.845 1.00 0.00 C ATOM 1673 ND1 HIS A 110 21.536 10.386 -1.755 1.00 0.00 N ATOM 1674 CD2 HIS A 110 21.166 8.253 -1.359 1.00 0.00 C ATOM 1675 CE1 HIS A 110 22.646 9.832 -1.234 1.00 0.00 C ATOM 1676 NE2 HIS A 110 22.474 8.532 -0.974 1.00 0.00 N ATOM 0 H HIS A 110 17.131 9.833 -3.816 1.00 0.00 H new ATOM 0 HA HIS A 110 19.929 10.615 -4.170 1.00 0.00 H new ATOM 0 HB2 HIS A 110 18.790 10.568 -1.945 1.00 0.00 H new ATOM 0 HB3 HIS A 110 18.524 8.844 -2.111 1.00 0.00 H new ATOM 0 HD2 HIS A 110 20.689 7.287 -1.286 1.00 0.00 H new ATOM 0 HE1 HIS A 110 23.563 10.371 -1.049 1.00 0.00 H new ATOM 0 HE2 HIS A 110 23.155 7.884 -0.578 1.00 0.00 H new ATOM 1684 N GLY A 111 18.923 7.676 -5.044 1.00 0.00 N ATOM 1685 CA GLY A 111 19.377 6.393 -5.650 1.00 0.00 C ATOM 1686 C GLY A 111 18.833 5.221 -4.831 1.00 0.00 C ATOM 1687 O GLY A 111 18.598 4.146 -5.346 1.00 0.00 O ATOM 0 H GLY A 111 17.918 7.844 -5.084 1.00 0.00 H new ATOM 0 HA2 GLY A 111 19.030 6.322 -6.681 1.00 0.00 H new ATOM 0 HA3 GLY A 111 20.466 6.357 -5.677 1.00 0.00 H new ATOM 1691 N GLY A 112 18.632 5.417 -3.556 1.00 0.00 N ATOM 1692 CA GLY A 112 18.103 4.314 -2.705 1.00 0.00 C ATOM 1693 C GLY A 112 16.589 4.208 -2.890 1.00 0.00 C ATOM 1694 O GLY A 112 15.977 5.014 -3.563 1.00 0.00 O ATOM 0 H GLY A 112 18.812 6.294 -3.067 1.00 0.00 H new ATOM 0 HA2 GLY A 112 18.580 3.372 -2.975 1.00 0.00 H new ATOM 0 HA3 GLY A 112 18.340 4.503 -1.658 1.00 0.00 H new ATOM 1698 N THR A 113 15.977 3.218 -2.298 1.00 0.00 N ATOM 1699 CA THR A 113 14.502 3.062 -2.443 1.00 0.00 C ATOM 1700 C THR A 113 13.847 3.080 -1.060 1.00 0.00 C ATOM 1701 O THR A 113 14.201 2.315 -0.185 1.00 0.00 O ATOM 1702 CB THR A 113 14.195 1.731 -3.132 1.00 0.00 C ATOM 1703 OG1 THR A 113 14.825 1.702 -4.404 1.00 0.00 O ATOM 1704 CG2 THR A 113 12.683 1.581 -3.304 1.00 0.00 C ATOM 0 H THR A 113 16.434 2.512 -1.721 1.00 0.00 H new ATOM 0 HA THR A 113 14.109 3.883 -3.043 1.00 0.00 H new ATOM 0 HB THR A 113 14.571 0.910 -2.522 1.00 0.00 H new ATOM 0 HG1 THR A 113 15.474 0.969 -4.431 1.00 0.00 H new ATOM 0 HG21 THR A 113 12.465 0.633 -3.795 1.00 0.00 H new ATOM 0 HG22 THR A 113 12.202 1.603 -2.326 1.00 0.00 H new ATOM 0 HG23 THR A 113 12.303 2.401 -3.914 1.00 0.00 H new ATOM 1712 N ILE A 114 12.891 3.944 -0.856 1.00 0.00 N ATOM 1713 CA ILE A 114 12.213 4.005 0.469 1.00 0.00 C ATOM 1714 C ILE A 114 11.009 3.061 0.461 1.00 0.00 C ATOM 1715 O ILE A 114 10.278 2.983 -0.506 1.00 0.00 O ATOM 1716 CB ILE A 114 11.740 5.435 0.739 1.00 0.00 C ATOM 1717 CG1 ILE A 114 12.921 6.399 0.601 1.00 0.00 C ATOM 1718 CG2 ILE A 114 11.173 5.524 2.157 1.00 0.00 C ATOM 1719 CD1 ILE A 114 12.416 7.840 0.695 1.00 0.00 C ATOM 0 H ILE A 114 12.550 4.610 -1.549 1.00 0.00 H new ATOM 0 HA ILE A 114 12.910 3.704 1.251 1.00 0.00 H new ATOM 0 HB ILE A 114 10.966 5.704 0.020 1.00 0.00 H new ATOM 0 HG12 ILE A 114 13.654 6.207 1.384 1.00 0.00 H new ATOM 0 HG13 ILE A 114 13.425 6.240 -0.353 1.00 0.00 H new ATOM 0 HG21 ILE A 114 10.836 6.542 2.351 1.00 0.00 H new ATOM 0 HG22 ILE A 114 10.332 4.838 2.256 1.00 0.00 H new ATOM 0 HG23 ILE A 114 11.947 5.255 2.876 1.00 0.00 H new ATOM 0 HD11 ILE A 114 13.256 8.527 0.597 1.00 0.00 H new ATOM 0 HD12 ILE A 114 11.699 8.027 -0.104 1.00 0.00 H new ATOM 0 HD13 ILE A 114 11.932 7.994 1.660 1.00 0.00 H new ATOM 1731 N ILE A 115 10.799 2.339 1.527 1.00 0.00 N ATOM 1732 CA ILE A 115 9.644 1.399 1.570 1.00 0.00 C ATOM 1733 C ILE A 115 8.789 1.685 2.806 1.00 0.00 C ATOM 1734 O ILE A 115 9.280 1.734 3.916 1.00 0.00 O ATOM 1735 CB ILE A 115 10.162 -0.039 1.632 1.00 0.00 C ATOM 1736 CG1 ILE A 115 11.122 -0.287 0.467 1.00 0.00 C ATOM 1737 CG2 ILE A 115 8.983 -1.009 1.539 1.00 0.00 C ATOM 1738 CD1 ILE A 115 11.948 -1.545 0.746 1.00 0.00 C ATOM 0 H ILE A 115 11.376 2.359 2.368 1.00 0.00 H new ATOM 0 HA ILE A 115 9.037 1.532 0.674 1.00 0.00 H new ATOM 0 HB ILE A 115 10.688 -0.196 2.574 1.00 0.00 H new ATOM 0 HG12 ILE A 115 10.562 -0.405 -0.461 1.00 0.00 H new ATOM 0 HG13 ILE A 115 11.780 0.572 0.335 1.00 0.00 H new ATOM 0 HG21 ILE A 115 9.351 -2.034 1.583 1.00 0.00 H new ATOM 0 HG22 ILE A 115 8.300 -0.832 2.370 1.00 0.00 H new ATOM 0 HG23 ILE A 115 8.457 -0.853 0.597 1.00 0.00 H new ATOM 0 HD11 ILE A 115 12.632 -1.722 -0.084 1.00 0.00 H new ATOM 0 HD12 ILE A 115 12.519 -1.409 1.665 1.00 0.00 H new ATOM 0 HD13 ILE A 115 11.282 -2.401 0.856 1.00 0.00 H new ATOM 1750 N LYS A 116 7.510 1.867 2.622 1.00 0.00 N ATOM 1751 CA LYS A 116 6.619 2.140 3.783 1.00 0.00 C ATOM 1752 C LYS A 116 5.808 0.883 4.097 1.00 0.00 C ATOM 1753 O LYS A 116 5.190 0.300 3.229 1.00 0.00 O ATOM 1754 CB LYS A 116 5.670 3.291 3.440 1.00 0.00 C ATOM 1755 CG LYS A 116 6.478 4.574 3.239 1.00 0.00 C ATOM 1756 CD LYS A 116 5.523 5.756 3.065 1.00 0.00 C ATOM 1757 CE LYS A 116 6.331 7.039 2.856 1.00 0.00 C ATOM 1758 NZ LYS A 116 6.748 7.137 1.429 1.00 0.00 N ATOM 0 H LYS A 116 7.044 1.838 1.715 1.00 0.00 H new ATOM 0 HA LYS A 116 7.219 2.416 4.650 1.00 0.00 H new ATOM 0 HB2 LYS A 116 5.108 3.057 2.536 1.00 0.00 H new ATOM 0 HB3 LYS A 116 4.943 3.428 4.240 1.00 0.00 H new ATOM 0 HG2 LYS A 116 7.131 4.743 4.095 1.00 0.00 H new ATOM 0 HG3 LYS A 116 7.120 4.479 2.363 1.00 0.00 H new ATOM 0 HD2 LYS A 116 4.866 5.584 2.212 1.00 0.00 H new ATOM 0 HD3 LYS A 116 4.885 5.854 3.943 1.00 0.00 H new ATOM 0 HE2 LYS A 116 5.732 7.907 3.131 1.00 0.00 H new ATOM 0 HE3 LYS A 116 7.208 7.038 3.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 7.297 8.009 1.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 7.334 6.314 1.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 5.904 7.156 0.821 1.00 0.00 H new ATOM 1772 N THR A 117 5.809 0.452 5.330 1.00 0.00 N ATOM 1773 CA THR A 117 5.041 -0.775 5.685 1.00 0.00 C ATOM 1774 C THR A 117 4.083 -0.477 6.840 1.00 0.00 C ATOM 1775 O THR A 117 4.468 0.065 7.857 1.00 0.00 O ATOM 1776 CB THR A 117 6.016 -1.877 6.107 1.00 0.00 C ATOM 1777 OG1 THR A 117 6.962 -2.093 5.069 1.00 0.00 O ATOM 1778 CG2 THR A 117 5.243 -3.169 6.375 1.00 0.00 C ATOM 0 H THR A 117 6.306 0.894 6.103 1.00 0.00 H new ATOM 0 HA THR A 117 4.466 -1.101 4.818 1.00 0.00 H new ATOM 0 HB THR A 117 6.537 -1.574 7.015 1.00 0.00 H new ATOM 0 HG1 THR A 117 7.588 -2.797 5.338 1.00 0.00 H new ATOM 0 HG21 THR A 117 5.938 -3.953 6.675 1.00 0.00 H new ATOM 0 HG22 THR A 117 4.519 -3.001 7.172 1.00 0.00 H new ATOM 0 HG23 THR A 117 4.720 -3.475 5.469 1.00 0.00 H new ATOM 1786 N THR A 118 2.838 -0.837 6.692 1.00 0.00 N ATOM 1787 CA THR A 118 1.851 -0.589 7.780 1.00 0.00 C ATOM 1788 C THR A 118 1.295 -1.931 8.261 1.00 0.00 C ATOM 1789 O THR A 118 0.941 -2.783 7.471 1.00 0.00 O ATOM 1790 CB THR A 118 0.708 0.279 7.247 1.00 0.00 C ATOM 1791 OG1 THR A 118 1.245 1.452 6.652 1.00 0.00 O ATOM 1792 CG2 THR A 118 -0.220 0.667 8.399 1.00 0.00 C ATOM 0 H THR A 118 2.461 -1.294 5.862 1.00 0.00 H new ATOM 0 HA THR A 118 2.336 -0.072 8.608 1.00 0.00 H new ATOM 0 HB THR A 118 0.143 -0.280 6.502 1.00 0.00 H new ATOM 0 HG1 THR A 118 0.515 2.008 6.309 1.00 0.00 H new ATOM 0 HG21 THR A 118 -1.033 1.285 8.019 1.00 0.00 H new ATOM 0 HG22 THR A 118 -0.631 -0.234 8.854 1.00 0.00 H new ATOM 0 HG23 THR A 118 0.342 1.227 9.146 1.00 0.00 H new ATOM 1800 N SER A 119 1.223 -2.133 9.547 1.00 0.00 N ATOM 1801 CA SER A 119 0.698 -3.430 10.063 1.00 0.00 C ATOM 1802 C SER A 119 -0.483 -3.182 11.004 1.00 0.00 C ATOM 1803 O SER A 119 -0.496 -2.239 11.770 1.00 0.00 O ATOM 1804 CB SER A 119 1.807 -4.159 10.822 1.00 0.00 C ATOM 1805 OG SER A 119 2.912 -4.376 9.956 1.00 0.00 O ATOM 0 H SER A 119 1.503 -1.460 10.261 1.00 0.00 H new ATOM 0 HA SER A 119 0.363 -4.039 9.223 1.00 0.00 H new ATOM 0 HB2 SER A 119 2.118 -3.571 11.685 1.00 0.00 H new ATOM 0 HB3 SER A 119 1.437 -5.111 11.202 1.00 0.00 H new ATOM 0 HG SER A 119 2.828 -5.256 9.533 1.00 0.00 H new ATOM 1811 N LYS A 120 -1.472 -4.032 10.952 1.00 0.00 N ATOM 1812 CA LYS A 120 -2.655 -3.865 11.843 1.00 0.00 C ATOM 1813 C LYS A 120 -3.082 -5.239 12.361 1.00 0.00 C ATOM 1814 O LYS A 120 -3.247 -6.173 11.601 1.00 0.00 O ATOM 1815 CB LYS A 120 -3.805 -3.234 11.055 1.00 0.00 C ATOM 1816 CG LYS A 120 -4.880 -2.741 12.027 1.00 0.00 C ATOM 1817 CD LYS A 120 -6.096 -2.252 11.237 1.00 0.00 C ATOM 1818 CE LYS A 120 -7.177 -1.778 12.209 1.00 0.00 C ATOM 1819 NZ LYS A 120 -8.468 -1.620 11.481 1.00 0.00 N ATOM 0 H LYS A 120 -1.512 -4.838 10.328 1.00 0.00 H new ATOM 0 HA LYS A 120 -2.398 -3.217 12.681 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -3.435 -2.404 10.453 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -4.230 -3.963 10.365 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -5.171 -3.545 12.703 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -4.485 -1.934 12.644 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -5.808 -1.438 10.572 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -6.483 -3.055 10.610 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -7.291 -2.496 13.021 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -6.884 -0.830 12.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -9.146 -1.110 12.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -8.309 -1.082 10.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -8.851 -2.558 11.246 1.00 0.00 H new ATOM 1833 N TYR A 121 -3.255 -5.377 13.647 1.00 0.00 N ATOM 1834 CA TYR A 121 -3.661 -6.699 14.202 1.00 0.00 C ATOM 1835 C TYR A 121 -5.086 -6.618 14.748 1.00 0.00 C ATOM 1836 O TYR A 121 -5.427 -5.718 15.490 1.00 0.00 O ATOM 1837 CB TYR A 121 -2.703 -7.092 15.329 1.00 0.00 C ATOM 1838 CG TYR A 121 -1.282 -7.022 14.826 1.00 0.00 C ATOM 1839 CD1 TYR A 121 -0.654 -5.780 14.670 1.00 0.00 C ATOM 1840 CD2 TYR A 121 -0.591 -8.200 14.516 1.00 0.00 C ATOM 1841 CE1 TYR A 121 0.664 -5.716 14.202 1.00 0.00 C ATOM 1842 CE2 TYR A 121 0.727 -8.136 14.049 1.00 0.00 C ATOM 1843 CZ TYR A 121 1.354 -6.895 13.892 1.00 0.00 C ATOM 1844 OH TYR A 121 2.653 -6.832 13.431 1.00 0.00 O ATOM 0 H TYR A 121 -3.133 -4.634 14.335 1.00 0.00 H new ATOM 0 HA TYR A 121 -3.624 -7.448 13.411 1.00 0.00 H new ATOM 0 HB2 TYR A 121 -2.832 -6.424 16.181 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -2.928 -8.100 15.677 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -1.186 -4.872 14.911 1.00 0.00 H new ATOM 0 HD2 TYR A 121 -1.075 -9.158 14.637 1.00 0.00 H new ATOM 0 HE1 TYR A 121 1.148 -4.758 14.080 1.00 0.00 H new ATOM 0 HE2 TYR A 121 1.260 -9.044 13.810 1.00 0.00 H new ATOM 0 HH TYR A 121 2.985 -7.739 13.265 1.00 0.00 H new ATOM 1854 N HIS A 122 -5.919 -7.556 14.392 1.00 0.00 N ATOM 1855 CA HIS A 122 -7.322 -7.539 14.895 1.00 0.00 C ATOM 1856 C HIS A 122 -7.459 -8.550 16.034 1.00 0.00 C ATOM 1857 O HIS A 122 -6.880 -9.618 16.001 1.00 0.00 O ATOM 1858 CB HIS A 122 -8.275 -7.915 13.759 1.00 0.00 C ATOM 1859 CG HIS A 122 -8.240 -6.847 12.701 1.00 0.00 C ATOM 1860 ND1 HIS A 122 -7.469 -6.967 11.555 1.00 0.00 N ATOM 1861 CD2 HIS A 122 -8.874 -5.633 12.600 1.00 0.00 C ATOM 1862 CE1 HIS A 122 -7.658 -5.854 10.821 1.00 0.00 C ATOM 1863 NE2 HIS A 122 -8.506 -5.008 11.413 1.00 0.00 N ATOM 0 H HIS A 122 -5.689 -8.334 13.774 1.00 0.00 H new ATOM 0 HA HIS A 122 -7.570 -6.542 15.259 1.00 0.00 H new ATOM 0 HB2 HIS A 122 -7.987 -8.875 13.331 1.00 0.00 H new ATOM 0 HB3 HIS A 122 -9.289 -8.028 14.143 1.00 0.00 H new ATOM 0 HD1 HIS A 122 -6.868 -7.755 11.312 1.00 0.00 H new ATOM 0 HD2 HIS A 122 -9.556 -5.225 13.332 1.00 0.00 H new ATOM 0 HE1 HIS A 122 -7.182 -5.668 9.870 1.00 0.00 H new ATOM 1871 N THR A 123 -8.219 -8.225 17.044 1.00 0.00 N ATOM 1872 CA THR A 123 -8.388 -9.171 18.183 1.00 0.00 C ATOM 1873 C THR A 123 -9.829 -9.682 18.214 1.00 0.00 C ATOM 1874 O THR A 123 -10.714 -9.113 17.607 1.00 0.00 O ATOM 1875 CB THR A 123 -8.074 -8.449 19.496 1.00 0.00 C ATOM 1876 OG1 THR A 123 -9.128 -7.547 19.800 1.00 0.00 O ATOM 1877 CG2 THR A 123 -6.762 -7.676 19.354 1.00 0.00 C ATOM 0 H THR A 123 -8.730 -7.346 17.130 1.00 0.00 H new ATOM 0 HA THR A 123 -7.708 -10.013 18.059 1.00 0.00 H new ATOM 0 HB THR A 123 -7.976 -9.179 20.300 1.00 0.00 H new ATOM 0 HG1 THR A 123 -8.930 -7.085 20.641 1.00 0.00 H new ATOM 0 HG21 THR A 123 -6.539 -7.162 20.289 1.00 0.00 H new ATOM 0 HG22 THR A 123 -5.955 -8.370 19.120 1.00 0.00 H new ATOM 0 HG23 THR A 123 -6.856 -6.944 18.552 1.00 0.00 H new ATOM 2169 N ALA A 142 11.327 -6.373 10.134 1.00 0.00 N ATOM 2170 CA ALA A 142 12.509 -5.545 9.763 1.00 0.00 C ATOM 2171 C ALA A 142 13.703 -6.461 9.489 1.00 0.00 C ATOM 2172 O ALA A 142 14.493 -6.217 8.598 1.00 0.00 O ATOM 2173 CB ALA A 142 12.847 -4.595 10.913 1.00 0.00 C ATOM 0 HA ALA A 142 12.282 -4.965 8.869 1.00 0.00 H new ATOM 0 HB1 ALA A 142 13.712 -3.989 10.642 1.00 0.00 H new ATOM 0 HB2 ALA A 142 11.995 -3.944 11.110 1.00 0.00 H new ATOM 0 HB3 ALA A 142 13.076 -5.174 11.808 1.00 0.00 H new ATOM 2179 N HIS A 143 13.840 -7.513 10.247 1.00 0.00 N ATOM 2180 CA HIS A 143 14.983 -8.444 10.029 1.00 0.00 C ATOM 2181 C HIS A 143 14.860 -9.081 8.643 1.00 0.00 C ATOM 2182 O HIS A 143 15.832 -9.228 7.929 1.00 0.00 O ATOM 2183 CB HIS A 143 14.957 -9.541 11.097 1.00 0.00 C ATOM 2184 CG HIS A 143 16.163 -10.424 10.938 1.00 0.00 C ATOM 2185 ND1 HIS A 143 17.449 -9.974 11.195 1.00 0.00 N ATOM 2186 CD2 HIS A 143 16.296 -11.734 10.549 1.00 0.00 C ATOM 2187 CE1 HIS A 143 18.291 -10.997 10.960 1.00 0.00 C ATOM 2188 NE2 HIS A 143 17.641 -12.094 10.565 1.00 0.00 N ATOM 0 H HIS A 143 13.210 -7.769 11.008 1.00 0.00 H new ATOM 0 HA HIS A 143 15.921 -7.893 10.096 1.00 0.00 H new ATOM 0 HB2 HIS A 143 14.948 -9.095 12.092 1.00 0.00 H new ATOM 0 HB3 HIS A 143 14.046 -10.132 11.005 1.00 0.00 H new ATOM 0 HD2 HIS A 143 15.481 -12.386 10.272 1.00 0.00 H new ATOM 0 HE1 HIS A 143 19.363 -10.938 11.077 1.00 0.00 H new ATOM 0 HE2 HIS A 143 18.043 -13.001 10.326 1.00 0.00 H new ATOM 2196 N LEU A 144 13.673 -9.460 8.257 1.00 0.00 N ATOM 2197 CA LEU A 144 13.489 -10.084 6.918 1.00 0.00 C ATOM 2198 C LEU A 144 13.894 -9.087 5.832 1.00 0.00 C ATOM 2199 O LEU A 144 14.601 -9.421 4.901 1.00 0.00 O ATOM 2200 CB LEU A 144 12.021 -10.472 6.733 1.00 0.00 C ATOM 2201 CG LEU A 144 11.680 -11.638 7.664 1.00 0.00 C ATOM 2202 CD1 LEU A 144 10.264 -12.135 7.362 1.00 0.00 C ATOM 2203 CD2 LEU A 144 12.678 -12.777 7.443 1.00 0.00 C ATOM 0 H LEU A 144 12.822 -9.364 8.812 1.00 0.00 H new ATOM 0 HA LEU A 144 14.112 -10.975 6.844 1.00 0.00 H new ATOM 0 HB2 LEU A 144 11.378 -9.619 6.951 1.00 0.00 H new ATOM 0 HB3 LEU A 144 11.836 -10.754 5.697 1.00 0.00 H new ATOM 0 HG LEU A 144 11.735 -11.303 8.700 1.00 0.00 H new ATOM 0 HD11 LEU A 144 10.021 -12.965 8.025 1.00 0.00 H new ATOM 0 HD12 LEU A 144 9.553 -11.324 7.520 1.00 0.00 H new ATOM 0 HD13 LEU A 144 10.209 -12.470 6.326 1.00 0.00 H new ATOM 0 HD21 LEU A 144 12.435 -13.607 8.106 1.00 0.00 H new ATOM 0 HD22 LEU A 144 12.624 -13.112 6.407 1.00 0.00 H new ATOM 0 HD23 LEU A 144 13.687 -12.424 7.658 1.00 0.00 H new ATOM 2215 N PHE A 145 13.454 -7.863 5.942 1.00 0.00 N ATOM 2216 CA PHE A 145 13.815 -6.846 4.915 1.00 0.00 C ATOM 2217 C PHE A 145 15.335 -6.810 4.748 1.00 0.00 C ATOM 2218 O PHE A 145 15.847 -6.749 3.647 1.00 0.00 O ATOM 2219 CB PHE A 145 13.318 -5.470 5.363 1.00 0.00 C ATOM 2220 CG PHE A 145 11.820 -5.391 5.181 1.00 0.00 C ATOM 2221 CD1 PHE A 145 11.275 -5.298 3.895 1.00 0.00 C ATOM 2222 CD2 PHE A 145 10.979 -5.412 6.298 1.00 0.00 C ATOM 2223 CE1 PHE A 145 9.887 -5.225 3.727 1.00 0.00 C ATOM 2224 CE2 PHE A 145 9.590 -5.339 6.130 1.00 0.00 C ATOM 2225 CZ PHE A 145 9.045 -5.245 4.845 1.00 0.00 C ATOM 0 H PHE A 145 12.860 -7.524 6.699 1.00 0.00 H new ATOM 0 HA PHE A 145 13.350 -7.108 3.964 1.00 0.00 H new ATOM 0 HB2 PHE A 145 13.577 -5.300 6.408 1.00 0.00 H new ATOM 0 HB3 PHE A 145 13.807 -4.688 4.782 1.00 0.00 H new ATOM 0 HD1 PHE A 145 11.925 -5.283 3.033 1.00 0.00 H new ATOM 0 HD2 PHE A 145 11.400 -5.484 7.290 1.00 0.00 H new ATOM 0 HE1 PHE A 145 9.466 -5.153 2.735 1.00 0.00 H new ATOM 0 HE2 PHE A 145 8.940 -5.355 6.992 1.00 0.00 H new ATOM 0 HZ PHE A 145 7.974 -5.188 4.716 1.00 0.00 H new ATOM 2235 N LYS A 146 16.060 -6.851 5.831 1.00 0.00 N ATOM 2236 CA LYS A 146 17.546 -6.823 5.733 1.00 0.00 C ATOM 2237 C LYS A 146 18.028 -8.060 4.973 1.00 0.00 C ATOM 2238 O LYS A 146 18.938 -7.991 4.171 1.00 0.00 O ATOM 2239 CB LYS A 146 18.149 -6.822 7.140 1.00 0.00 C ATOM 2240 CG LYS A 146 19.672 -6.713 7.041 1.00 0.00 C ATOM 2241 CD LYS A 146 20.281 -6.811 8.441 1.00 0.00 C ATOM 2242 CE LYS A 146 21.780 -6.510 8.367 1.00 0.00 C ATOM 2243 NZ LYS A 146 22.416 -6.826 9.678 1.00 0.00 N ATOM 0 H LYS A 146 15.688 -6.903 6.779 1.00 0.00 H new ATOM 0 HA LYS A 146 17.860 -5.924 5.202 1.00 0.00 H new ATOM 0 HB2 LYS A 146 17.751 -5.988 7.718 1.00 0.00 H new ATOM 0 HB3 LYS A 146 17.872 -7.735 7.667 1.00 0.00 H new ATOM 0 HG2 LYS A 146 20.064 -7.507 6.406 1.00 0.00 H new ATOM 0 HG3 LYS A 146 19.950 -5.767 6.577 1.00 0.00 H new ATOM 0 HD2 LYS A 146 19.790 -6.107 9.113 1.00 0.00 H new ATOM 0 HD3 LYS A 146 20.119 -7.808 8.851 1.00 0.00 H new ATOM 0 HE2 LYS A 146 22.242 -7.100 7.575 1.00 0.00 H new ATOM 0 HE3 LYS A 146 21.939 -5.461 8.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 23.434 -6.622 9.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 21.982 -6.245 10.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 22.275 -7.833 9.898 1.00 0.00 H new ATOM 2257 N LEU A 147 17.423 -9.190 5.217 1.00 0.00 N ATOM 2258 CA LEU A 147 17.845 -10.430 4.506 1.00 0.00 C ATOM 2259 C LEU A 147 17.517 -10.299 3.018 1.00 0.00 C ATOM 2260 O LEU A 147 18.291 -10.689 2.166 1.00 0.00 O ATOM 2261 CB LEU A 147 17.098 -11.631 5.090 1.00 0.00 C ATOM 2262 CG LEU A 147 17.486 -11.808 6.559 1.00 0.00 C ATOM 2263 CD1 LEU A 147 16.846 -13.084 7.107 1.00 0.00 C ATOM 2264 CD2 LEU A 147 19.009 -11.912 6.675 1.00 0.00 C ATOM 0 H LEU A 147 16.655 -9.308 5.878 1.00 0.00 H new ATOM 0 HA LEU A 147 18.918 -10.575 4.630 1.00 0.00 H new ATOM 0 HB2 LEU A 147 16.022 -11.481 5.003 1.00 0.00 H new ATOM 0 HB3 LEU A 147 17.341 -12.532 4.527 1.00 0.00 H new ATOM 0 HG LEU A 147 17.134 -10.950 7.133 1.00 0.00 H new ATOM 0 HD11 LEU A 147 17.123 -13.209 8.154 1.00 0.00 H new ATOM 0 HD12 LEU A 147 15.762 -13.011 7.025 1.00 0.00 H new ATOM 0 HD13 LEU A 147 17.197 -13.942 6.534 1.00 0.00 H new ATOM 0 HD21 LEU A 147 19.286 -12.038 7.722 1.00 0.00 H new ATOM 0 HD22 LEU A 147 19.360 -12.769 6.101 1.00 0.00 H new ATOM 0 HD23 LEU A 147 19.467 -11.003 6.285 1.00 0.00 H new ATOM 2276 N ILE A 148 16.378 -9.750 2.699 1.00 0.00 N ATOM 2277 CA ILE A 148 16.003 -9.592 1.266 1.00 0.00 C ATOM 2278 C ILE A 148 17.096 -8.805 0.540 1.00 0.00 C ATOM 2279 O ILE A 148 17.523 -9.168 -0.538 1.00 0.00 O ATOM 2280 CB ILE A 148 14.677 -8.835 1.166 1.00 0.00 C ATOM 2281 CG1 ILE A 148 13.582 -9.625 1.887 1.00 0.00 C ATOM 2282 CG2 ILE A 148 14.297 -8.663 -0.305 1.00 0.00 C ATOM 2283 CD1 ILE A 148 12.288 -8.809 1.897 1.00 0.00 C ATOM 0 H ILE A 148 15.691 -9.404 3.369 1.00 0.00 H new ATOM 0 HA ILE A 148 15.895 -10.575 0.807 1.00 0.00 H new ATOM 0 HB ILE A 148 14.783 -7.855 1.631 1.00 0.00 H new ATOM 0 HG12 ILE A 148 13.419 -10.580 1.387 1.00 0.00 H new ATOM 0 HG13 ILE A 148 13.892 -9.848 2.908 1.00 0.00 H new ATOM 0 HG21 ILE A 148 13.352 -8.124 -0.376 1.00 0.00 H new ATOM 0 HG22 ILE A 148 15.076 -8.100 -0.819 1.00 0.00 H new ATOM 0 HG23 ILE A 148 14.191 -9.643 -0.770 1.00 0.00 H new ATOM 0 HD11 ILE A 148 11.508 -9.371 2.410 1.00 0.00 H new ATOM 0 HD12 ILE A 148 12.457 -7.865 2.416 1.00 0.00 H new ATOM 0 HD13 ILE A 148 11.976 -8.609 0.872 1.00 0.00 H new ATOM 2295 N GLU A 149 17.554 -7.732 1.123 1.00 0.00 N ATOM 2296 CA GLU A 149 18.621 -6.926 0.467 1.00 0.00 C ATOM 2297 C GLU A 149 19.868 -7.793 0.279 1.00 0.00 C ATOM 2298 O GLU A 149 20.465 -7.818 -0.778 1.00 0.00 O ATOM 2299 CB GLU A 149 18.965 -5.721 1.345 1.00 0.00 C ATOM 2300 CG GLU A 149 17.722 -4.844 1.515 1.00 0.00 C ATOM 2301 CD GLU A 149 18.067 -3.635 2.387 1.00 0.00 C ATOM 2302 OE1 GLU A 149 19.194 -3.563 2.847 1.00 0.00 O ATOM 2303 OE2 GLU A 149 17.197 -2.801 2.580 1.00 0.00 O ATOM 0 H GLU A 149 17.235 -7.379 2.025 1.00 0.00 H new ATOM 0 HA GLU A 149 18.269 -6.577 -0.504 1.00 0.00 H new ATOM 0 HB2 GLU A 149 19.323 -6.057 2.318 1.00 0.00 H new ATOM 0 HB3 GLU A 149 19.771 -5.145 0.891 1.00 0.00 H new ATOM 0 HG2 GLU A 149 17.362 -4.513 0.541 1.00 0.00 H new ATOM 0 HG3 GLU A 149 16.918 -5.419 1.974 1.00 0.00 H new ATOM 2310 N GLY A 150 20.263 -8.506 1.299 1.00 0.00 N ATOM 2311 CA GLY A 150 21.468 -9.372 1.178 1.00 0.00 C ATOM 2312 C GLY A 150 21.200 -10.476 0.152 1.00 0.00 C ATOM 2313 O GLY A 150 22.055 -10.825 -0.635 1.00 0.00 O ATOM 0 H GLY A 150 19.803 -8.525 2.209 1.00 0.00 H new ATOM 0 HA2 GLY A 150 22.328 -8.777 0.872 1.00 0.00 H new ATOM 0 HA3 GLY A 150 21.713 -9.811 2.145 1.00 0.00 H new ATOM 2317 N TYR A 151 20.016 -11.025 0.156 1.00 0.00 N ATOM 2318 CA TYR A 151 19.693 -12.103 -0.820 1.00 0.00 C ATOM 2319 C TYR A 151 20.004 -11.618 -2.236 1.00 0.00 C ATOM 2320 O TYR A 151 20.749 -12.239 -2.967 1.00 0.00 O ATOM 2321 CB TYR A 151 18.208 -12.457 -0.717 1.00 0.00 C ATOM 2322 CG TYR A 151 17.928 -13.696 -1.533 1.00 0.00 C ATOM 2323 CD1 TYR A 151 17.663 -13.588 -2.903 1.00 0.00 C ATOM 2324 CD2 TYR A 151 17.935 -14.954 -0.918 1.00 0.00 C ATOM 2325 CE1 TYR A 151 17.404 -14.738 -3.659 1.00 0.00 C ATOM 2326 CE2 TYR A 151 17.677 -16.103 -1.674 1.00 0.00 C ATOM 2327 CZ TYR A 151 17.412 -15.996 -3.044 1.00 0.00 C ATOM 2328 OH TYR A 151 17.156 -17.129 -3.789 1.00 0.00 O ATOM 0 H TYR A 151 19.259 -10.774 0.792 1.00 0.00 H new ATOM 0 HA TYR A 151 20.293 -12.986 -0.598 1.00 0.00 H new ATOM 0 HB2 TYR A 151 17.935 -12.625 0.325 1.00 0.00 H new ATOM 0 HB3 TYR A 151 17.600 -11.627 -1.076 1.00 0.00 H new ATOM 0 HD1 TYR A 151 17.658 -12.618 -3.377 1.00 0.00 H new ATOM 0 HD2 TYR A 151 18.139 -15.037 0.139 1.00 0.00 H new ATOM 0 HE1 TYR A 151 17.198 -14.655 -4.716 1.00 0.00 H new ATOM 0 HE2 TYR A 151 17.682 -17.073 -1.200 1.00 0.00 H new ATOM 0 HH TYR A 151 17.201 -17.918 -3.210 1.00 0.00 H new ATOM 2338 N LEU A 152 19.437 -10.510 -2.631 1.00 0.00 N ATOM 2339 CA LEU A 152 19.700 -9.985 -3.999 1.00 0.00 C ATOM 2340 C LEU A 152 21.181 -9.623 -4.127 1.00 0.00 C ATOM 2341 O LEU A 152 21.813 -9.898 -5.127 1.00 0.00 O ATOM 2342 CB LEU A 152 18.843 -8.741 -4.240 1.00 0.00 C ATOM 2343 CG LEU A 152 17.367 -9.098 -4.058 1.00 0.00 C ATOM 2344 CD1 LEU A 152 16.503 -7.883 -4.401 1.00 0.00 C ATOM 2345 CD2 LEU A 152 17.006 -10.259 -4.988 1.00 0.00 C ATOM 0 H LEU A 152 18.803 -9.947 -2.064 1.00 0.00 H new ATOM 0 HA LEU A 152 19.448 -10.745 -4.738 1.00 0.00 H new ATOM 0 HB2 LEU A 152 19.126 -7.951 -3.545 1.00 0.00 H new ATOM 0 HB3 LEU A 152 19.014 -8.357 -5.246 1.00 0.00 H new ATOM 0 HG LEU A 152 17.188 -9.391 -3.023 1.00 0.00 H new ATOM 0 HD11 LEU A 152 15.451 -8.137 -4.272 1.00 0.00 H new ATOM 0 HD12 LEU A 152 16.761 -7.055 -3.740 1.00 0.00 H new ATOM 0 HD13 LEU A 152 16.681 -7.590 -5.436 1.00 0.00 H new ATOM 0 HD21 LEU A 152 15.954 -10.515 -4.859 1.00 0.00 H new ATOM 0 HD22 LEU A 152 17.184 -9.965 -6.022 1.00 0.00 H new ATOM 0 HD23 LEU A 152 17.622 -11.125 -4.745 1.00 0.00 H new