USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1066 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 114 GLN : amide:sc= 0.379 K(o=0.85,f=0.3) USER MOD Set 1.2: A 116 ASN : amide:sc= 0.476 K(o=0.85,f=0.3) USER MOD Set 2.1: A 58 ASN : amide:sc= 1.49 K(o=1.6,f=0.11) USER MOD Set 2.2: A 60 ASN :FLIP amide:sc= 0.15 F(o=0.11,f=1.6) USER MOD Set 3.1: A 27 LYS NZ :NH3+ 179:sc= 0.0177 (180deg=0) USER MOD Set 3.2: A 126 SER OG : rot 20:sc= 1.28 USER MOD Single : A 1 ALA N :NH3+ -134:sc= 1.22 (180deg=-0.0408) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot -160:sc= 0 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 36:sc= 0.682 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= 0.926 K(o=0.93,f=0) USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 ASN : amide:sc= -0.0554 K(o=-0.055,f=-0.73) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 25 ASN : amide:sc= -0.373 K(o=-0.37,f=-2.1) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= 1.07 K(o=1.1,f=0) USER MOD Single : A 35 SER OG : rot 3:sc= 0.207 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 160:sc= 0.548 (180deg=0.34) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0.0328 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ -156:sc= -0.0107 (180deg=-0.701) USER MOD Single : A 61 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot -141:sc= 0.412 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -0.165 K(o=-0.17,f=-1.7!) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= -0.0138 K(o=-0.014,f=-0.91) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot -39:sc= 0.464 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0.0397 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 42:sc= 0.711 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 MET CE :methyl -152:sc= -0.111 (180deg=-1.22) USER MOD Single : A 120 ASN : amide:sc= 0.934 K(o=0.93,f=-0.0096) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc=-0.00658 K(o=-0.0066,f=-1.3) USER MOD Single : A 130 SER OG : rot 180:sc= -0.0964 USER MOD Single : A 134 SER OG : rot -38:sc= 0.22 USER MOD Single : A 139 THR OG1 : rot 180:sc= -0.245 USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -4.901 -23.263 -3.303 1.00 0.00 N ATOM 2 CA ALA A 1 -5.729 -22.739 -2.216 1.00 0.00 C ATOM 3 C ALA A 1 -4.996 -22.948 -0.905 1.00 0.00 C ATOM 4 O ALA A 1 -4.941 -24.063 -0.391 1.00 0.00 O ATOM 5 CB ALA A 1 -7.114 -23.389 -2.184 1.00 0.00 C ATOM 0 H1 ALA A 1 -4.875 -22.575 -4.082 1.00 0.00 H new ATOM 0 H2 ALA A 1 -3.935 -23.428 -2.955 1.00 0.00 H new ATOM 0 H3 ALA A 1 -5.304 -24.159 -3.645 1.00 0.00 H new ATOM 0 HA ALA A 1 -5.896 -21.675 -2.381 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -7.694 -22.970 -1.362 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -7.628 -23.196 -3.126 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -7.008 -24.464 -2.042 1.00 0.00 H new ATOM 11 N THR A 2 -4.420 -21.867 -0.398 1.00 0.00 N ATOM 12 CA THR A 2 -3.867 -21.746 0.940 1.00 0.00 C ATOM 13 C THR A 2 -4.346 -20.372 1.435 1.00 0.00 C ATOM 14 O THR A 2 -4.842 -19.572 0.628 1.00 0.00 O ATOM 15 CB THR A 2 -2.335 -21.902 0.853 1.00 0.00 C ATOM 16 OG1 THR A 2 -2.001 -23.155 0.280 1.00 0.00 O ATOM 17 CG2 THR A 2 -1.614 -21.776 2.191 1.00 0.00 C ATOM 0 H THR A 2 -4.322 -21.007 -0.938 1.00 0.00 H new ATOM 0 HA THR A 2 -4.191 -22.510 1.646 1.00 0.00 H new ATOM 0 HB THR A 2 -1.998 -21.075 0.228 1.00 0.00 H new ATOM 0 HG1 THR A 2 -1.026 -23.242 0.229 1.00 0.00 H new ATOM 0 HG21 THR A 2 -0.542 -21.898 2.039 1.00 0.00 H new ATOM 0 HG22 THR A 2 -1.810 -20.793 2.619 1.00 0.00 H new ATOM 0 HG23 THR A 2 -1.974 -22.547 2.872 1.00 0.00 H new ATOM 25 N SER A 3 -4.255 -20.073 2.731 1.00 0.00 N ATOM 26 CA SER A 3 -4.533 -18.743 3.225 1.00 0.00 C ATOM 27 C SER A 3 -3.180 -18.101 3.511 1.00 0.00 C ATOM 28 O SER A 3 -2.550 -18.418 4.522 1.00 0.00 O ATOM 29 CB SER A 3 -5.401 -18.907 4.469 1.00 0.00 C ATOM 30 OG SER A 3 -6.543 -19.686 4.152 1.00 0.00 O ATOM 0 H SER A 3 -3.989 -20.743 3.453 1.00 0.00 H new ATOM 0 HA SER A 3 -5.072 -18.103 2.527 1.00 0.00 H new ATOM 0 HB2 SER A 3 -4.829 -19.387 5.263 1.00 0.00 H new ATOM 0 HB3 SER A 3 -5.707 -17.930 4.843 1.00 0.00 H new ATOM 0 HG SER A 3 -7.240 -19.534 4.824 1.00 0.00 H new ATOM 36 N THR A 4 -2.765 -17.178 2.646 1.00 0.00 N ATOM 37 CA THR A 4 -1.556 -16.391 2.821 1.00 0.00 C ATOM 38 C THR A 4 -1.985 -14.936 2.935 1.00 0.00 C ATOM 39 O THR A 4 -2.315 -14.298 1.929 1.00 0.00 O ATOM 40 CB THR A 4 -0.552 -16.626 1.682 1.00 0.00 C ATOM 41 OG1 THR A 4 -0.412 -18.008 1.416 1.00 0.00 O ATOM 42 CG2 THR A 4 0.830 -16.073 2.057 1.00 0.00 C ATOM 0 H THR A 4 -3.272 -16.955 1.789 1.00 0.00 H new ATOM 0 HA THR A 4 -1.027 -16.692 3.725 1.00 0.00 H new ATOM 0 HB THR A 4 -0.935 -16.113 0.800 1.00 0.00 H new ATOM 0 HG1 THR A 4 0.230 -18.137 0.687 1.00 0.00 H new ATOM 0 HG21 THR A 4 1.527 -16.249 1.238 1.00 0.00 H new ATOM 0 HG22 THR A 4 0.754 -15.002 2.245 1.00 0.00 H new ATOM 0 HG23 THR A 4 1.191 -16.575 2.955 1.00 0.00 H new ATOM 50 N VAL A 5 -2.046 -14.431 4.163 1.00 0.00 N ATOM 51 CA VAL A 5 -2.268 -13.019 4.425 1.00 0.00 C ATOM 52 C VAL A 5 -0.919 -12.320 4.559 1.00 0.00 C ATOM 53 O VAL A 5 0.107 -12.949 4.812 1.00 0.00 O ATOM 54 CB VAL A 5 -3.119 -12.907 5.700 1.00 0.00 C ATOM 55 CG1 VAL A 5 -2.371 -13.411 6.946 1.00 0.00 C ATOM 56 CG2 VAL A 5 -3.690 -11.509 5.977 1.00 0.00 C ATOM 0 H VAL A 5 -1.942 -14.995 5.006 1.00 0.00 H new ATOM 0 HA VAL A 5 -2.803 -12.532 3.610 1.00 0.00 H new ATOM 0 HB VAL A 5 -3.970 -13.557 5.495 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -3.013 -13.311 7.821 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -2.102 -14.459 6.810 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -1.466 -12.820 7.091 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -4.275 -11.531 6.896 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -2.872 -10.797 6.084 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -4.329 -11.206 5.148 1.00 0.00 H new ATOM 66 N THR A 6 -0.938 -10.999 4.518 1.00 0.00 N ATOM 67 CA THR A 6 0.102 -10.164 5.064 1.00 0.00 C ATOM 68 C THR A 6 -0.559 -8.892 5.602 1.00 0.00 C ATOM 69 O THR A 6 -1.478 -8.335 4.986 1.00 0.00 O ATOM 70 CB THR A 6 1.153 -9.961 3.962 1.00 0.00 C ATOM 71 OG1 THR A 6 2.085 -11.016 4.049 1.00 0.00 O ATOM 72 CG2 THR A 6 1.917 -8.642 4.011 1.00 0.00 C ATOM 0 H THR A 6 -1.699 -10.470 4.092 1.00 0.00 H new ATOM 0 HA THR A 6 0.635 -10.599 5.909 1.00 0.00 H new ATOM 0 HB THR A 6 0.600 -9.943 3.023 1.00 0.00 H new ATOM 0 HG1 THR A 6 1.624 -11.839 4.313 1.00 0.00 H new ATOM 0 HG21 THR A 6 2.632 -8.605 3.189 1.00 0.00 H new ATOM 0 HG22 THR A 6 1.216 -7.812 3.921 1.00 0.00 H new ATOM 0 HG23 THR A 6 2.450 -8.565 4.959 1.00 0.00 H new ATOM 80 N GLY A 7 -0.099 -8.452 6.771 1.00 0.00 N ATOM 81 CA GLY A 7 -0.510 -7.225 7.423 1.00 0.00 C ATOM 82 C GLY A 7 0.541 -6.146 7.223 1.00 0.00 C ATOM 83 O GLY A 7 1.464 -6.284 6.410 1.00 0.00 O ATOM 0 H GLY A 7 0.599 -8.967 7.307 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -1.465 -6.892 7.018 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.660 -7.403 8.488 1.00 0.00 H new ATOM 87 N GLY A 8 0.416 -5.052 7.964 1.00 0.00 N ATOM 88 CA GLY A 8 1.511 -4.116 8.132 1.00 0.00 C ATOM 89 C GLY A 8 1.052 -2.790 8.698 1.00 0.00 C ATOM 90 O GLY A 8 -0.134 -2.450 8.655 1.00 0.00 O ATOM 0 H GLY A 8 -0.438 -4.794 8.458 1.00 0.00 H new ATOM 0 HA2 GLY A 8 2.260 -4.551 8.794 1.00 0.00 H new ATOM 0 HA3 GLY A 8 1.995 -3.950 7.169 1.00 0.00 H new ATOM 94 N TYR A 9 2.026 -2.034 9.200 1.00 0.00 N ATOM 95 CA TYR A 9 1.851 -0.697 9.737 1.00 0.00 C ATOM 96 C TYR A 9 2.574 0.251 8.785 1.00 0.00 C ATOM 97 O TYR A 9 3.644 -0.093 8.267 1.00 0.00 O ATOM 98 CB TYR A 9 2.430 -0.634 11.162 1.00 0.00 C ATOM 99 CG TYR A 9 1.824 0.464 12.019 1.00 0.00 C ATOM 100 CD1 TYR A 9 2.129 1.816 11.771 1.00 0.00 C ATOM 101 CD2 TYR A 9 0.926 0.134 13.053 1.00 0.00 C ATOM 102 CE1 TYR A 9 1.513 2.835 12.516 1.00 0.00 C ATOM 103 CE2 TYR A 9 0.320 1.149 13.818 1.00 0.00 C ATOM 104 CZ TYR A 9 0.602 2.506 13.545 1.00 0.00 C ATOM 105 OH TYR A 9 -0.028 3.480 14.254 1.00 0.00 O ATOM 0 H TYR A 9 2.994 -2.353 9.243 1.00 0.00 H new ATOM 0 HA TYR A 9 0.800 -0.417 9.811 1.00 0.00 H new ATOM 0 HB2 TYR A 9 2.271 -1.595 11.652 1.00 0.00 H new ATOM 0 HB3 TYR A 9 3.508 -0.482 11.100 1.00 0.00 H new ATOM 0 HD1 TYR A 9 2.842 2.072 11.002 1.00 0.00 H new ATOM 0 HD2 TYR A 9 0.701 -0.902 13.260 1.00 0.00 H new ATOM 0 HE1 TYR A 9 1.736 3.870 12.302 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -0.361 0.890 14.615 1.00 0.00 H new ATOM 0 HH TYR A 9 -0.619 3.070 14.920 1.00 0.00 H new ATOM 115 N ALA A 10 2.020 1.442 8.573 1.00 0.00 N ATOM 116 CA ALA A 10 2.489 2.312 7.511 1.00 0.00 C ATOM 117 C ALA A 10 3.517 3.315 8.028 1.00 0.00 C ATOM 118 O ALA A 10 3.477 3.760 9.177 1.00 0.00 O ATOM 119 CB ALA A 10 1.302 3.097 6.952 1.00 0.00 C ATOM 0 H ALA A 10 1.249 1.821 9.123 1.00 0.00 H new ATOM 0 HA ALA A 10 2.952 1.691 6.744 1.00 0.00 H new ATOM 0 HB1 ALA A 10 1.644 3.754 6.153 1.00 0.00 H new ATOM 0 HB2 ALA A 10 0.560 2.403 6.558 1.00 0.00 H new ATOM 0 HB3 ALA A 10 0.854 3.694 7.746 1.00 0.00 H new ATOM 125 N GLN A 11 4.375 3.746 7.115 1.00 0.00 N ATOM 126 CA GLN A 11 5.115 4.988 7.143 1.00 0.00 C ATOM 127 C GLN A 11 4.995 5.571 5.733 1.00 0.00 C ATOM 128 O GLN A 11 5.562 5.039 4.780 1.00 0.00 O ATOM 129 CB GLN A 11 6.552 4.775 7.654 1.00 0.00 C ATOM 130 CG GLN A 11 7.413 3.774 6.872 1.00 0.00 C ATOM 131 CD GLN A 11 8.673 3.438 7.660 1.00 0.00 C ATOM 132 OE1 GLN A 11 9.641 4.196 7.680 1.00 0.00 O ATOM 133 NE2 GLN A 11 8.680 2.323 8.368 1.00 0.00 N ATOM 0 H GLN A 11 4.583 3.196 6.281 1.00 0.00 H new ATOM 0 HA GLN A 11 4.714 5.709 7.855 1.00 0.00 H new ATOM 0 HB2 GLN A 11 7.062 5.739 7.652 1.00 0.00 H new ATOM 0 HB3 GLN A 11 6.500 4.444 8.691 1.00 0.00 H new ATOM 0 HG2 GLN A 11 6.843 2.865 6.679 1.00 0.00 H new ATOM 0 HG3 GLN A 11 7.682 4.194 5.903 1.00 0.00 H new ATOM 0 HE21 GLN A 11 7.873 1.700 8.346 1.00 0.00 H new ATOM 0 HE22 GLN A 11 9.493 2.085 8.937 1.00 0.00 H new ATOM 142 N SER A 12 4.155 6.590 5.590 1.00 0.00 N ATOM 143 CA SER A 12 4.032 7.448 4.422 1.00 0.00 C ATOM 144 C SER A 12 5.072 8.556 4.585 1.00 0.00 C ATOM 145 O SER A 12 5.073 9.194 5.645 1.00 0.00 O ATOM 146 CB SER A 12 2.618 8.056 4.410 1.00 0.00 C ATOM 147 OG SER A 12 1.626 7.069 4.630 1.00 0.00 O ATOM 0 H SER A 12 3.505 6.853 6.331 1.00 0.00 H new ATOM 0 HA SER A 12 4.190 6.902 3.492 1.00 0.00 H new ATOM 0 HB2 SER A 12 2.545 8.825 5.179 1.00 0.00 H new ATOM 0 HB3 SER A 12 2.440 8.546 3.453 1.00 0.00 H new ATOM 0 HG SER A 12 0.740 7.487 4.618 1.00 0.00 H new ATOM 153 N ASP A 13 5.959 8.781 3.613 1.00 0.00 N ATOM 154 CA ASP A 13 6.867 9.927 3.628 1.00 0.00 C ATOM 155 C ASP A 13 6.945 10.511 2.214 1.00 0.00 C ATOM 156 O ASP A 13 6.584 9.836 1.245 1.00 0.00 O ATOM 157 CB ASP A 13 8.244 9.534 4.189 1.00 0.00 C ATOM 158 CG ASP A 13 8.296 9.431 5.725 1.00 0.00 C ATOM 159 OD1 ASP A 13 7.869 10.362 6.447 1.00 0.00 O ATOM 160 OD2 ASP A 13 8.778 8.401 6.248 1.00 0.00 O ATOM 0 H ASP A 13 6.067 8.177 2.798 1.00 0.00 H new ATOM 0 HA ASP A 13 6.485 10.700 4.295 1.00 0.00 H new ATOM 0 HB2 ASP A 13 8.537 8.575 3.762 1.00 0.00 H new ATOM 0 HB3 ASP A 13 8.980 10.268 3.860 1.00 0.00 H new ATOM 165 N ALA A 14 7.334 11.786 2.090 1.00 0.00 N ATOM 166 CA ALA A 14 7.425 12.512 0.822 1.00 0.00 C ATOM 167 C ALA A 14 8.528 13.553 0.933 1.00 0.00 C ATOM 168 O ALA A 14 8.449 14.387 1.842 1.00 0.00 O ATOM 169 CB ALA A 14 6.099 13.227 0.523 1.00 0.00 C ATOM 0 H ALA A 14 7.601 12.355 2.893 1.00 0.00 H new ATOM 0 HA ALA A 14 7.641 11.807 0.019 1.00 0.00 H new ATOM 0 HB1 ALA A 14 6.180 13.763 -0.423 1.00 0.00 H new ATOM 0 HB2 ALA A 14 5.297 12.492 0.456 1.00 0.00 H new ATOM 0 HB3 ALA A 14 5.878 13.934 1.323 1.00 0.00 H new ATOM 175 N GLN A 15 9.542 13.523 0.063 1.00 0.00 N ATOM 176 CA GLN A 15 10.748 14.365 0.104 1.00 0.00 C ATOM 177 C GLN A 15 11.556 14.208 1.414 1.00 0.00 C ATOM 178 O GLN A 15 12.677 14.712 1.526 1.00 0.00 O ATOM 179 CB GLN A 15 10.345 15.819 -0.245 1.00 0.00 C ATOM 180 CG GLN A 15 11.473 16.817 -0.547 1.00 0.00 C ATOM 181 CD GLN A 15 11.679 17.845 0.569 1.00 0.00 C ATOM 182 OE1 GLN A 15 11.148 18.956 0.529 1.00 0.00 O ATOM 183 NE2 GLN A 15 12.431 17.494 1.593 1.00 0.00 N ATOM 0 H GLN A 15 9.547 12.880 -0.729 1.00 0.00 H new ATOM 0 HA GLN A 15 11.458 14.028 -0.651 1.00 0.00 H new ATOM 0 HB2 GLN A 15 9.685 15.786 -1.112 1.00 0.00 H new ATOM 0 HB3 GLN A 15 9.760 16.214 0.586 1.00 0.00 H new ATOM 0 HG2 GLN A 15 12.402 16.269 -0.705 1.00 0.00 H new ATOM 0 HG3 GLN A 15 11.249 17.339 -1.477 1.00 0.00 H new ATOM 0 HE21 GLN A 15 12.865 16.571 1.614 1.00 0.00 H new ATOM 0 HE22 GLN A 15 12.579 18.145 2.364 1.00 0.00 H new ATOM 192 N GLY A 16 11.029 13.484 2.404 1.00 0.00 N ATOM 193 CA GLY A 16 11.479 13.446 3.769 1.00 0.00 C ATOM 194 C GLY A 16 10.261 13.609 4.662 1.00 0.00 C ATOM 195 O GLY A 16 9.334 12.806 4.587 1.00 0.00 O ATOM 0 H GLY A 16 10.226 12.875 2.248 1.00 0.00 H new ATOM 0 HA2 GLY A 16 11.984 12.503 3.979 1.00 0.00 H new ATOM 0 HA3 GLY A 16 12.200 14.242 3.956 1.00 0.00 H new ATOM 199 N GLN A 17 10.227 14.676 5.462 1.00 0.00 N ATOM 200 CA GLN A 17 9.348 14.863 6.617 1.00 0.00 C ATOM 201 C GLN A 17 8.278 15.934 6.331 1.00 0.00 C ATOM 202 O GLN A 17 8.513 17.132 6.508 1.00 0.00 O ATOM 203 CB GLN A 17 10.247 15.177 7.837 1.00 0.00 C ATOM 204 CG GLN A 17 9.501 15.420 9.157 1.00 0.00 C ATOM 205 CD GLN A 17 10.450 15.593 10.348 1.00 0.00 C ATOM 206 OE1 GLN A 17 10.893 16.689 10.677 1.00 0.00 O ATOM 207 NE2 GLN A 17 10.755 14.528 11.069 1.00 0.00 N ATOM 0 H GLN A 17 10.844 15.474 5.314 1.00 0.00 H new ATOM 0 HA GLN A 17 8.777 13.960 6.836 1.00 0.00 H new ATOM 0 HB2 GLN A 17 10.941 14.349 7.978 1.00 0.00 H new ATOM 0 HB3 GLN A 17 10.845 16.059 7.609 1.00 0.00 H new ATOM 0 HG2 GLN A 17 8.880 16.310 9.060 1.00 0.00 H new ATOM 0 HG3 GLN A 17 8.830 14.583 9.350 1.00 0.00 H new ATOM 0 HE21 GLN A 17 10.392 13.612 10.805 1.00 0.00 H new ATOM 0 HE22 GLN A 17 11.353 14.622 11.890 1.00 0.00 H new ATOM 216 N MET A 18 7.083 15.502 5.918 1.00 0.00 N ATOM 217 CA MET A 18 5.902 16.345 5.711 1.00 0.00 C ATOM 218 C MET A 18 4.589 15.554 5.844 1.00 0.00 C ATOM 219 O MET A 18 3.559 16.134 6.183 1.00 0.00 O ATOM 220 CB MET A 18 5.964 17.033 4.331 1.00 0.00 C ATOM 221 CG MET A 18 5.589 18.523 4.362 1.00 0.00 C ATOM 222 SD MET A 18 3.996 18.973 5.121 1.00 0.00 S ATOM 223 CE MET A 18 4.016 20.753 4.799 1.00 0.00 C ATOM 0 H MET A 18 6.905 14.519 5.711 1.00 0.00 H new ATOM 0 HA MET A 18 5.911 17.102 6.495 1.00 0.00 H new ATOM 0 HB2 MET A 18 6.972 16.930 3.929 1.00 0.00 H new ATOM 0 HB3 MET A 18 5.294 16.514 3.646 1.00 0.00 H new ATOM 0 HG2 MET A 18 6.377 19.057 4.892 1.00 0.00 H new ATOM 0 HG3 MET A 18 5.589 18.891 3.336 1.00 0.00 H new ATOM 0 HE1 MET A 18 3.108 21.205 5.198 1.00 0.00 H new ATOM 0 HE2 MET A 18 4.885 21.200 5.281 1.00 0.00 H new ATOM 0 HE3 MET A 18 4.067 20.928 3.724 1.00 0.00 H new ATOM 233 N ASN A 19 4.589 14.230 5.664 1.00 0.00 N ATOM 234 CA ASN A 19 3.441 13.386 5.919 1.00 0.00 C ATOM 235 C ASN A 19 3.275 13.245 7.427 1.00 0.00 C ATOM 236 O ASN A 19 4.165 13.546 8.228 1.00 0.00 O ATOM 237 CB ASN A 19 3.661 12.003 5.279 1.00 0.00 C ATOM 238 CG ASN A 19 3.197 11.933 3.834 1.00 0.00 C ATOM 239 OD1 ASN A 19 2.010 11.773 3.572 1.00 0.00 O ATOM 240 ND2 ASN A 19 4.096 12.022 2.879 1.00 0.00 N ATOM 0 H ASN A 19 5.405 13.716 5.331 1.00 0.00 H new ATOM 0 HA ASN A 19 2.543 13.829 5.487 1.00 0.00 H new ATOM 0 HB2 ASN A 19 4.721 11.752 5.326 1.00 0.00 H new ATOM 0 HB3 ASN A 19 3.129 11.251 5.862 1.00 0.00 H new ATOM 0 HD21 ASN A 19 3.810 11.958 1.902 1.00 0.00 H new ATOM 0 HD22 ASN A 19 5.079 12.155 3.115 1.00 0.00 H new ATOM 247 N LYS A 20 2.140 12.693 7.809 1.00 0.00 N ATOM 248 CA LYS A 20 1.835 12.178 9.138 1.00 0.00 C ATOM 249 C LYS A 20 1.220 10.809 8.927 1.00 0.00 C ATOM 250 O LYS A 20 0.008 10.687 8.739 1.00 0.00 O ATOM 251 CB LYS A 20 0.878 13.105 9.896 1.00 0.00 C ATOM 252 CG LYS A 20 1.515 14.351 10.511 1.00 0.00 C ATOM 253 CD LYS A 20 2.220 14.107 11.854 1.00 0.00 C ATOM 254 CE LYS A 20 3.664 13.605 11.716 1.00 0.00 C ATOM 255 NZ LYS A 20 4.306 13.436 13.033 1.00 0.00 N ATOM 0 H LYS A 20 1.357 12.584 7.165 1.00 0.00 H new ATOM 0 HA LYS A 20 2.736 12.118 9.749 1.00 0.00 H new ATOM 0 HB2 LYS A 20 0.090 13.421 9.213 1.00 0.00 H new ATOM 0 HB3 LYS A 20 0.400 12.533 10.691 1.00 0.00 H new ATOM 0 HG2 LYS A 20 2.237 14.761 9.805 1.00 0.00 H new ATOM 0 HG3 LYS A 20 0.743 15.107 10.652 1.00 0.00 H new ATOM 0 HD2 LYS A 20 2.221 15.035 12.426 1.00 0.00 H new ATOM 0 HD3 LYS A 20 1.646 13.379 12.428 1.00 0.00 H new ATOM 0 HE2 LYS A 20 3.670 12.655 11.182 1.00 0.00 H new ATOM 0 HE3 LYS A 20 4.240 14.311 11.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 5.280 13.096 12.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 4.321 14.349 13.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 3.770 12.744 13.594 1.00 0.00 H new ATOM 269 N MET A 21 2.071 9.789 8.891 1.00 0.00 N ATOM 270 CA MET A 21 1.608 8.425 8.743 1.00 0.00 C ATOM 271 C MET A 21 0.635 8.081 9.873 1.00 0.00 C ATOM 272 O MET A 21 0.789 8.546 11.010 1.00 0.00 O ATOM 273 CB MET A 21 2.809 7.473 8.659 1.00 0.00 C ATOM 274 CG MET A 21 3.693 7.372 9.913 1.00 0.00 C ATOM 275 SD MET A 21 3.066 6.307 11.239 1.00 0.00 S ATOM 276 CE MET A 21 4.610 5.936 12.106 1.00 0.00 C ATOM 0 H MET A 21 3.084 9.887 8.963 1.00 0.00 H new ATOM 0 HA MET A 21 1.055 8.310 7.811 1.00 0.00 H new ATOM 0 HB2 MET A 21 2.438 6.476 8.422 1.00 0.00 H new ATOM 0 HB3 MET A 21 3.436 7.787 7.824 1.00 0.00 H new ATOM 0 HG2 MET A 21 4.675 7.006 9.613 1.00 0.00 H new ATOM 0 HG3 MET A 21 3.835 8.375 10.315 1.00 0.00 H new ATOM 0 HE1 MET A 21 4.403 5.286 12.956 1.00 0.00 H new ATOM 0 HE2 MET A 21 5.298 5.435 11.425 1.00 0.00 H new ATOM 0 HE3 MET A 21 5.060 6.863 12.460 1.00 0.00 H new ATOM 286 N GLY A 22 -0.352 7.253 9.547 1.00 0.00 N ATOM 287 CA GLY A 22 -1.282 6.668 10.483 1.00 0.00 C ATOM 288 C GLY A 22 -2.121 5.717 9.664 1.00 0.00 C ATOM 289 O GLY A 22 -3.257 6.046 9.327 1.00 0.00 O ATOM 0 H GLY A 22 -0.526 6.965 8.584 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -0.759 6.143 11.282 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -1.900 7.432 10.954 1.00 0.00 H new ATOM 293 N GLY A 23 -1.536 4.594 9.258 1.00 0.00 N ATOM 294 CA GLY A 23 -2.114 3.733 8.247 1.00 0.00 C ATOM 295 C GLY A 23 -1.751 2.282 8.502 1.00 0.00 C ATOM 296 O GLY A 23 -0.968 1.945 9.401 1.00 0.00 O ATOM 0 H GLY A 23 -0.645 4.260 9.626 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -3.198 3.846 8.244 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -1.759 4.033 7.261 1.00 0.00 H new ATOM 300 N PHE A 24 -2.358 1.415 7.705 1.00 0.00 N ATOM 301 CA PHE A 24 -2.203 -0.026 7.741 1.00 0.00 C ATOM 302 C PHE A 24 -2.380 -0.540 6.315 1.00 0.00 C ATOM 303 O PHE A 24 -2.736 0.231 5.421 1.00 0.00 O ATOM 304 CB PHE A 24 -3.230 -0.647 8.703 1.00 0.00 C ATOM 305 CG PHE A 24 -4.665 -0.725 8.197 1.00 0.00 C ATOM 306 CD1 PHE A 24 -5.427 0.438 7.955 1.00 0.00 C ATOM 307 CD2 PHE A 24 -5.260 -1.985 8.010 1.00 0.00 C ATOM 308 CE1 PHE A 24 -6.771 0.338 7.549 1.00 0.00 C ATOM 309 CE2 PHE A 24 -6.610 -2.088 7.640 1.00 0.00 C ATOM 310 CZ PHE A 24 -7.366 -0.927 7.398 1.00 0.00 C ATOM 0 H PHE A 24 -3.006 1.718 6.978 1.00 0.00 H new ATOM 0 HA PHE A 24 -1.217 -0.307 8.111 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -2.900 -1.655 8.953 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -3.224 -0.071 9.629 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -4.976 1.411 8.082 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -4.674 -2.881 8.152 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -7.345 1.232 7.354 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -7.069 -3.061 7.541 1.00 0.00 H new ATOM 0 HZ PHE A 24 -8.400 -1.007 7.097 1.00 0.00 H new ATOM 320 N ASN A 25 -2.089 -1.815 6.081 1.00 0.00 N ATOM 321 CA ASN A 25 -2.424 -2.509 4.842 1.00 0.00 C ATOM 322 C ASN A 25 -2.930 -3.904 5.172 1.00 0.00 C ATOM 323 O ASN A 25 -2.583 -4.464 6.211 1.00 0.00 O ATOM 324 CB ASN A 25 -1.204 -2.603 3.915 1.00 0.00 C ATOM 325 CG ASN A 25 -0.019 -3.265 4.607 1.00 0.00 C ATOM 326 OD1 ASN A 25 0.789 -2.587 5.226 1.00 0.00 O ATOM 327 ND2 ASN A 25 0.103 -4.580 4.555 1.00 0.00 N ATOM 0 H ASN A 25 -1.606 -2.405 6.758 1.00 0.00 H new ATOM 0 HA ASN A 25 -3.199 -1.945 4.324 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -1.468 -3.171 3.023 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -0.920 -1.604 3.584 1.00 0.00 H new ATOM 0 HD21 ASN A 25 0.877 -5.040 5.034 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -0.577 -5.135 4.036 1.00 0.00 H new ATOM 334 N LEU A 26 -3.637 -4.524 4.229 1.00 0.00 N ATOM 335 CA LEU A 26 -4.034 -5.925 4.297 1.00 0.00 C ATOM 336 C LEU A 26 -3.915 -6.490 2.885 1.00 0.00 C ATOM 337 O LEU A 26 -4.540 -5.970 1.956 1.00 0.00 O ATOM 338 CB LEU A 26 -5.463 -6.029 4.868 1.00 0.00 C ATOM 339 CG LEU A 26 -5.894 -7.409 5.406 1.00 0.00 C ATOM 340 CD1 LEU A 26 -5.957 -8.510 4.345 1.00 0.00 C ATOM 341 CD2 LEU A 26 -5.021 -7.873 6.579 1.00 0.00 C ATOM 0 H LEU A 26 -3.955 -4.056 3.381 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.396 -6.505 4.964 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -5.561 -5.303 5.675 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -6.164 -5.734 4.087 1.00 0.00 H new ATOM 0 HG LEU A 26 -6.914 -7.248 5.756 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -6.268 -9.446 4.810 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -6.675 -8.231 3.574 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -4.973 -8.638 3.895 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -5.363 -8.849 6.923 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -3.983 -7.946 6.254 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -5.096 -7.154 7.395 1.00 0.00 H new ATOM 353 N LYS A 27 -3.072 -7.506 2.706 1.00 0.00 N ATOM 354 CA LYS A 27 -2.925 -8.269 1.470 1.00 0.00 C ATOM 355 C LYS A 27 -3.452 -9.670 1.787 1.00 0.00 C ATOM 356 O LYS A 27 -2.995 -10.261 2.765 1.00 0.00 O ATOM 357 CB LYS A 27 -1.444 -8.319 1.035 1.00 0.00 C ATOM 358 CG LYS A 27 -0.844 -6.978 0.561 1.00 0.00 C ATOM 359 CD LYS A 27 -0.248 -6.124 1.694 1.00 0.00 C ATOM 360 CE LYS A 27 0.673 -4.992 1.201 1.00 0.00 C ATOM 361 NZ LYS A 27 2.077 -5.416 0.972 1.00 0.00 N ATOM 0 H LYS A 27 -2.450 -7.831 3.446 1.00 0.00 H new ATOM 0 HA LYS A 27 -3.474 -7.815 0.645 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -0.850 -8.687 1.872 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -1.345 -9.046 0.229 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -0.066 -7.180 -0.176 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -1.620 -6.403 0.056 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -1.061 -5.690 2.276 1.00 0.00 H new ATOM 0 HD3 LYS A 27 0.315 -6.771 2.366 1.00 0.00 H new ATOM 0 HE2 LYS A 27 0.270 -4.587 0.273 1.00 0.00 H new ATOM 0 HE3 LYS A 27 0.662 -4.184 1.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 2.632 -4.607 0.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 2.486 -5.760 1.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 2.098 -6.178 0.265 1.00 0.00 H new ATOM 375 N TYR A 28 -4.449 -10.176 1.062 1.00 0.00 N ATOM 376 CA TYR A 28 -5.016 -11.507 1.272 1.00 0.00 C ATOM 377 C TYR A 28 -5.648 -11.953 -0.036 1.00 0.00 C ATOM 378 O TYR A 28 -6.664 -11.387 -0.431 1.00 0.00 O ATOM 379 CB TYR A 28 -6.070 -11.458 2.395 1.00 0.00 C ATOM 380 CG TYR A 28 -7.026 -12.642 2.479 1.00 0.00 C ATOM 381 CD1 TYR A 28 -6.558 -13.967 2.363 1.00 0.00 C ATOM 382 CD2 TYR A 28 -8.401 -12.409 2.676 1.00 0.00 C ATOM 383 CE1 TYR A 28 -7.453 -15.049 2.458 1.00 0.00 C ATOM 384 CE2 TYR A 28 -9.302 -13.484 2.776 1.00 0.00 C ATOM 385 CZ TYR A 28 -8.828 -14.810 2.678 1.00 0.00 C ATOM 386 OH TYR A 28 -9.705 -15.841 2.819 1.00 0.00 O ATOM 0 H TYR A 28 -4.893 -9.664 0.300 1.00 0.00 H new ATOM 0 HA TYR A 28 -4.241 -12.213 1.572 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -5.549 -11.371 3.349 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -6.660 -10.550 2.270 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -5.507 -14.153 2.200 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -8.767 -11.396 2.751 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -7.089 -16.061 2.363 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -10.355 -13.295 2.927 1.00 0.00 H new ATOM 0 HH TYR A 28 -10.607 -15.486 2.964 1.00 0.00 H new ATOM 396 N ARG A 29 -5.081 -12.929 -0.737 1.00 0.00 N ATOM 397 CA ARG A 29 -5.603 -13.435 -2.004 1.00 0.00 C ATOM 398 C ARG A 29 -5.456 -14.951 -2.073 1.00 0.00 C ATOM 399 O ARG A 29 -4.766 -15.554 -1.248 1.00 0.00 O ATOM 400 CB ARG A 29 -4.924 -12.735 -3.189 1.00 0.00 C ATOM 401 CG ARG A 29 -5.360 -11.273 -3.409 1.00 0.00 C ATOM 402 CD ARG A 29 -6.857 -11.031 -3.664 1.00 0.00 C ATOM 403 NE ARG A 29 -7.399 -11.872 -4.745 1.00 0.00 N ATOM 404 CZ ARG A 29 -8.356 -12.802 -4.634 1.00 0.00 C ATOM 405 NH1 ARG A 29 -8.994 -12.999 -3.486 1.00 0.00 N ATOM 406 NH2 ARG A 29 -8.651 -13.568 -5.680 1.00 0.00 N ATOM 0 H ARG A 29 -4.228 -13.401 -0.435 1.00 0.00 H new ATOM 0 HA ARG A 29 -6.667 -13.207 -2.063 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -3.845 -12.759 -3.038 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -5.132 -13.302 -4.096 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -5.066 -10.695 -2.533 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -4.802 -10.875 -4.256 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -7.412 -11.225 -2.746 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -7.012 -9.982 -3.915 1.00 0.00 H new ATOM 0 HE ARG A 29 -7.004 -11.731 -5.675 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -8.758 -12.437 -2.668 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -9.720 -13.713 -3.422 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -8.149 -13.445 -6.560 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -9.379 -14.278 -5.603 1.00 0.00 H new ATOM 420 N TYR A 30 -6.175 -15.541 -3.021 1.00 0.00 N ATOM 421 CA TYR A 30 -6.234 -16.968 -3.289 1.00 0.00 C ATOM 422 C TYR A 30 -5.301 -17.283 -4.461 1.00 0.00 C ATOM 423 O TYR A 30 -4.988 -16.401 -5.270 1.00 0.00 O ATOM 424 CB TYR A 30 -7.679 -17.362 -3.654 1.00 0.00 C ATOM 425 CG TYR A 30 -8.264 -18.475 -2.808 1.00 0.00 C ATOM 426 CD1 TYR A 30 -8.629 -18.207 -1.477 1.00 0.00 C ATOM 427 CD2 TYR A 30 -8.518 -19.750 -3.355 1.00 0.00 C ATOM 428 CE1 TYR A 30 -9.232 -19.201 -0.691 1.00 0.00 C ATOM 429 CE2 TYR A 30 -9.149 -20.741 -2.577 1.00 0.00 C ATOM 430 CZ TYR A 30 -9.501 -20.475 -1.234 1.00 0.00 C ATOM 431 OH TYR A 30 -10.028 -21.442 -0.431 1.00 0.00 O ATOM 0 H TYR A 30 -6.764 -15.004 -3.657 1.00 0.00 H new ATOM 0 HA TYR A 30 -5.924 -17.529 -2.407 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -8.315 -16.482 -3.563 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -7.705 -17.667 -4.700 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -8.444 -17.230 -1.057 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -8.228 -19.967 -4.372 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -9.492 -18.989 0.336 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -9.365 -21.707 -3.008 1.00 0.00 H new ATOM 0 HH TYR A 30 -10.158 -22.263 -0.950 1.00 0.00 H new ATOM 441 N GLU A 31 -4.876 -18.544 -4.552 1.00 0.00 N ATOM 442 CA GLU A 31 -4.216 -19.097 -5.727 1.00 0.00 C ATOM 443 C GLU A 31 -4.706 -20.526 -5.979 1.00 0.00 C ATOM 444 O GLU A 31 -5.291 -21.168 -5.095 1.00 0.00 O ATOM 445 CB GLU A 31 -2.688 -18.991 -5.625 1.00 0.00 C ATOM 446 CG GLU A 31 -2.068 -19.912 -4.564 1.00 0.00 C ATOM 447 CD GLU A 31 -0.555 -19.727 -4.553 1.00 0.00 C ATOM 448 OE1 GLU A 31 -0.089 -18.610 -4.232 1.00 0.00 O ATOM 449 OE2 GLU A 31 0.193 -20.672 -4.900 1.00 0.00 O ATOM 0 H GLU A 31 -4.985 -19.219 -3.795 1.00 0.00 H new ATOM 0 HA GLU A 31 -4.489 -18.502 -6.598 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -2.252 -19.227 -6.596 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -2.420 -17.959 -5.397 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -2.480 -19.682 -3.582 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -2.317 -20.951 -4.779 1.00 0.00 H new ATOM 456 N GLU A 32 -4.506 -20.993 -7.208 1.00 0.00 N ATOM 457 CA GLU A 32 -5.314 -22.012 -7.854 1.00 0.00 C ATOM 458 C GLU A 32 -4.694 -23.405 -7.794 1.00 0.00 C ATOM 459 O GLU A 32 -3.538 -23.604 -7.414 1.00 0.00 O ATOM 460 CB GLU A 32 -5.548 -21.549 -9.314 1.00 0.00 C ATOM 461 CG GLU A 32 -6.976 -21.069 -9.587 1.00 0.00 C ATOM 462 CD GLU A 32 -7.591 -20.269 -8.433 1.00 0.00 C ATOM 463 OE1 GLU A 32 -7.087 -19.173 -8.118 1.00 0.00 O ATOM 464 OE2 GLU A 32 -8.540 -20.820 -7.810 1.00 0.00 O ATOM 0 H GLU A 32 -3.747 -20.657 -7.800 1.00 0.00 H new ATOM 0 HA GLU A 32 -6.259 -22.114 -7.321 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -4.853 -20.742 -9.546 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -5.316 -22.373 -9.989 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -6.976 -20.452 -10.485 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -7.607 -21.934 -9.794 1.00 0.00 H new ATOM 471 N ASP A 33 -5.506 -24.396 -8.157 1.00 0.00 N ATOM 472 CA ASP A 33 -5.098 -25.752 -8.527 1.00 0.00 C ATOM 473 C ASP A 33 -4.511 -25.732 -9.937 1.00 0.00 C ATOM 474 O ASP A 33 -3.453 -26.305 -10.202 1.00 0.00 O ATOM 475 CB ASP A 33 -6.321 -26.700 -8.509 1.00 0.00 C ATOM 476 CG ASP A 33 -7.420 -26.310 -9.513 1.00 0.00 C ATOM 477 OD1 ASP A 33 -7.928 -25.176 -9.356 1.00 0.00 O ATOM 478 OD2 ASP A 33 -7.737 -27.067 -10.457 1.00 0.00 O ATOM 0 H ASP A 33 -6.517 -24.270 -8.204 1.00 0.00 H new ATOM 0 HA ASP A 33 -4.355 -26.107 -7.812 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -5.987 -27.715 -8.726 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -6.746 -26.712 -7.505 1.00 0.00 H new ATOM 483 N ASN A 34 -5.226 -25.088 -10.860 1.00 0.00 N ATOM 484 CA ASN A 34 -5.108 -25.440 -12.266 1.00 0.00 C ATOM 485 C ASN A 34 -3.869 -24.815 -12.887 1.00 0.00 C ATOM 486 O ASN A 34 -3.252 -25.403 -13.772 1.00 0.00 O ATOM 487 CB ASN A 34 -6.388 -25.043 -13.014 1.00 0.00 C ATOM 488 CG ASN A 34 -6.853 -26.202 -13.879 1.00 0.00 C ATOM 489 OD1 ASN A 34 -6.731 -26.170 -15.103 1.00 0.00 O ATOM 490 ND2 ASN A 34 -7.392 -27.245 -13.270 1.00 0.00 N ATOM 0 H ASN A 34 -5.881 -24.333 -10.660 1.00 0.00 H new ATOM 0 HA ASN A 34 -4.989 -26.520 -12.350 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -7.168 -24.771 -12.302 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -6.202 -24.166 -13.633 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -7.716 -28.043 -13.816 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -7.484 -27.251 -12.254 1.00 0.00 H new ATOM 497 N SER A 35 -3.449 -23.660 -12.379 1.00 0.00 N ATOM 498 CA SER A 35 -2.103 -23.146 -12.535 1.00 0.00 C ATOM 499 C SER A 35 -1.679 -22.488 -11.221 1.00 0.00 C ATOM 500 O SER A 35 -2.539 -21.949 -10.517 1.00 0.00 O ATOM 501 CB SER A 35 -2.060 -22.133 -13.676 1.00 0.00 C ATOM 502 OG SER A 35 -2.292 -22.780 -14.912 1.00 0.00 O ATOM 0 H SER A 35 -4.054 -23.045 -11.835 1.00 0.00 H new ATOM 0 HA SER A 35 -1.418 -23.959 -12.776 1.00 0.00 H new ATOM 0 HB2 SER A 35 -2.812 -21.360 -13.515 1.00 0.00 H new ATOM 0 HB3 SER A 35 -1.090 -21.635 -13.694 1.00 0.00 H new ATOM 0 HG SER A 35 -2.483 -23.728 -14.754 1.00 0.00 H new ATOM 508 N PRO A 36 -0.375 -22.471 -10.908 1.00 0.00 N ATOM 509 CA PRO A 36 0.191 -21.655 -9.848 1.00 0.00 C ATOM 510 C PRO A 36 0.170 -20.191 -10.297 1.00 0.00 C ATOM 511 O PRO A 36 1.145 -19.685 -10.858 1.00 0.00 O ATOM 512 CB PRO A 36 1.599 -22.218 -9.617 1.00 0.00 C ATOM 513 CG PRO A 36 1.976 -22.756 -10.992 1.00 0.00 C ATOM 514 CD PRO A 36 0.658 -23.275 -11.539 1.00 0.00 C ATOM 0 HA PRO A 36 -0.363 -21.684 -8.909 1.00 0.00 H new ATOM 0 HB2 PRO A 36 2.293 -21.448 -9.280 1.00 0.00 H new ATOM 0 HB3 PRO A 36 1.602 -23.003 -8.861 1.00 0.00 H new ATOM 0 HG2 PRO A 36 2.396 -21.976 -11.627 1.00 0.00 H new ATOM 0 HG3 PRO A 36 2.722 -23.547 -10.923 1.00 0.00 H new ATOM 0 HD2 PRO A 36 0.620 -23.179 -12.624 1.00 0.00 H new ATOM 0 HD3 PRO A 36 0.527 -24.332 -11.307 1.00 0.00 H new ATOM 522 N LEU A 37 -0.969 -19.530 -10.103 1.00 0.00 N ATOM 523 CA LEU A 37 -1.210 -18.133 -10.430 1.00 0.00 C ATOM 524 C LEU A 37 -2.000 -17.563 -9.258 1.00 0.00 C ATOM 525 O LEU A 37 -3.126 -18.001 -8.994 1.00 0.00 O ATOM 526 CB LEU A 37 -1.970 -18.035 -11.770 1.00 0.00 C ATOM 527 CG LEU A 37 -2.047 -16.636 -12.423 1.00 0.00 C ATOM 528 CD1 LEU A 37 -2.671 -15.545 -11.548 1.00 0.00 C ATOM 529 CD2 LEU A 37 -0.682 -16.136 -12.906 1.00 0.00 C ATOM 0 H LEU A 37 -1.787 -19.980 -9.693 1.00 0.00 H new ATOM 0 HA LEU A 37 -0.290 -17.564 -10.567 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -1.499 -18.716 -12.479 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -2.987 -18.393 -11.611 1.00 0.00 H new ATOM 0 HG LEU A 37 -2.713 -16.803 -13.270 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -2.680 -14.602 -12.094 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -3.692 -15.825 -11.291 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -2.085 -15.431 -10.636 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -0.794 -15.150 -13.356 1.00 0.00 H new ATOM 0 HD22 LEU A 37 0.003 -16.073 -12.060 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -0.282 -16.829 -13.646 1.00 0.00 H new ATOM 541 N GLY A 38 -1.397 -16.633 -8.527 1.00 0.00 N ATOM 542 CA GLY A 38 -1.995 -15.929 -7.410 1.00 0.00 C ATOM 543 C GLY A 38 -2.243 -14.476 -7.787 1.00 0.00 C ATOM 544 O GLY A 38 -1.629 -13.921 -8.700 1.00 0.00 O ATOM 0 H GLY A 38 -0.437 -16.340 -8.708 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -2.934 -16.406 -7.129 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -1.338 -15.982 -6.542 1.00 0.00 H new ATOM 548 N VAL A 39 -3.143 -13.838 -7.054 1.00 0.00 N ATOM 549 CA VAL A 39 -3.483 -12.432 -7.222 1.00 0.00 C ATOM 550 C VAL A 39 -2.801 -11.656 -6.093 1.00 0.00 C ATOM 551 O VAL A 39 -2.480 -12.236 -5.050 1.00 0.00 O ATOM 552 CB VAL A 39 -5.022 -12.317 -7.227 1.00 0.00 C ATOM 553 CG1 VAL A 39 -5.567 -10.888 -7.346 1.00 0.00 C ATOM 554 CG2 VAL A 39 -5.630 -13.141 -8.369 1.00 0.00 C ATOM 0 H VAL A 39 -3.670 -14.293 -6.309 1.00 0.00 H new ATOM 0 HA VAL A 39 -3.131 -12.007 -8.162 1.00 0.00 H new ATOM 0 HB VAL A 39 -5.315 -12.699 -6.249 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -6.657 -10.913 -7.341 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -5.213 -10.292 -6.504 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -5.219 -10.442 -8.278 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -6.715 -13.043 -8.350 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -5.249 -12.777 -9.323 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -5.358 -14.189 -8.246 1.00 0.00 H new ATOM 564 N ILE A 40 -2.643 -10.342 -6.255 1.00 0.00 N ATOM 565 CA ILE A 40 -2.245 -9.453 -5.175 1.00 0.00 C ATOM 566 C ILE A 40 -3.133 -8.213 -5.241 1.00 0.00 C ATOM 567 O ILE A 40 -3.056 -7.410 -6.174 1.00 0.00 O ATOM 568 CB ILE A 40 -0.724 -9.177 -5.179 1.00 0.00 C ATOM 569 CG1 ILE A 40 -0.377 -8.097 -4.124 1.00 0.00 C ATOM 570 CG2 ILE A 40 -0.185 -8.796 -6.567 1.00 0.00 C ATOM 571 CD1 ILE A 40 1.071 -8.186 -3.639 1.00 0.00 C ATOM 0 H ILE A 40 -2.789 -9.867 -7.146 1.00 0.00 H new ATOM 0 HA ILE A 40 -2.403 -9.921 -4.203 1.00 0.00 H new ATOM 0 HB ILE A 40 -0.226 -10.109 -4.912 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -0.552 -7.109 -4.550 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -1.048 -8.200 -3.271 1.00 0.00 H new ATOM 0 HG21 ILE A 40 0.888 -8.615 -6.503 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -0.375 -9.610 -7.267 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -0.685 -7.893 -6.916 1.00 0.00 H new ATOM 0 HD11 ILE A 40 1.256 -7.405 -2.902 1.00 0.00 H new ATOM 0 HD12 ILE A 40 1.243 -9.162 -3.185 1.00 0.00 H new ATOM 0 HD13 ILE A 40 1.747 -8.055 -4.484 1.00 0.00 H new ATOM 583 N GLY A 41 -4.007 -8.061 -4.249 1.00 0.00 N ATOM 584 CA GLY A 41 -4.669 -6.795 -3.983 1.00 0.00 C ATOM 585 C GLY A 41 -3.854 -6.039 -2.940 1.00 0.00 C ATOM 586 O GLY A 41 -3.203 -6.656 -2.091 1.00 0.00 O ATOM 0 H GLY A 41 -4.273 -8.811 -3.611 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -4.751 -6.209 -4.899 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -5.683 -6.965 -3.622 1.00 0.00 H new ATOM 590 N SER A 42 -3.888 -4.711 -2.991 1.00 0.00 N ATOM 591 CA SER A 42 -3.432 -3.860 -1.899 1.00 0.00 C ATOM 592 C SER A 42 -4.570 -2.904 -1.536 1.00 0.00 C ATOM 593 O SER A 42 -5.407 -2.563 -2.386 1.00 0.00 O ATOM 594 CB SER A 42 -2.134 -3.131 -2.285 1.00 0.00 C ATOM 595 OG SER A 42 -1.241 -3.988 -2.986 1.00 0.00 O ATOM 0 H SER A 42 -4.235 -4.192 -3.797 1.00 0.00 H new ATOM 0 HA SER A 42 -3.187 -4.454 -1.019 1.00 0.00 H new ATOM 0 HB2 SER A 42 -2.372 -2.267 -2.905 1.00 0.00 H new ATOM 0 HB3 SER A 42 -1.647 -2.754 -1.386 1.00 0.00 H new ATOM 0 HG SER A 42 -0.427 -3.493 -3.218 1.00 0.00 H new ATOM 601 N PHE A 43 -4.593 -2.445 -0.290 1.00 0.00 N ATOM 602 CA PHE A 43 -5.493 -1.433 0.236 1.00 0.00 C ATOM 603 C PHE A 43 -4.642 -0.605 1.193 1.00 0.00 C ATOM 604 O PHE A 43 -3.916 -1.195 1.998 1.00 0.00 O ATOM 605 CB PHE A 43 -6.698 -2.089 0.936 1.00 0.00 C ATOM 606 CG PHE A 43 -8.023 -1.704 0.309 1.00 0.00 C ATOM 607 CD1 PHE A 43 -8.381 -2.222 -0.949 1.00 0.00 C ATOM 608 CD2 PHE A 43 -8.887 -0.805 0.960 1.00 0.00 C ATOM 609 CE1 PHE A 43 -9.583 -1.830 -1.562 1.00 0.00 C ATOM 610 CE2 PHE A 43 -10.097 -0.425 0.353 1.00 0.00 C ATOM 611 CZ PHE A 43 -10.443 -0.929 -0.911 1.00 0.00 C ATOM 0 H PHE A 43 -3.946 -2.791 0.418 1.00 0.00 H new ATOM 0 HA PHE A 43 -5.922 -0.805 -0.545 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -6.586 -3.173 0.902 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -6.702 -1.802 1.988 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -7.729 -2.925 -1.446 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -8.621 -0.406 1.928 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -9.846 -2.221 -2.534 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -10.763 0.257 0.861 1.00 0.00 H new ATOM 0 HZ PHE A 43 -11.367 -0.625 -1.381 1.00 0.00 H new ATOM 621 N THR A 44 -4.659 0.716 1.021 1.00 0.00 N ATOM 622 CA THR A 44 -3.910 1.666 1.829 1.00 0.00 C ATOM 623 C THR A 44 -4.873 2.744 2.334 1.00 0.00 C ATOM 624 O THR A 44 -5.810 3.100 1.607 1.00 0.00 O ATOM 625 CB THR A 44 -2.740 2.194 0.977 1.00 0.00 C ATOM 626 OG1 THR A 44 -1.857 2.974 1.745 1.00 0.00 O ATOM 627 CG2 THR A 44 -3.159 3.009 -0.255 1.00 0.00 C ATOM 0 H THR A 44 -5.213 1.164 0.291 1.00 0.00 H new ATOM 0 HA THR A 44 -3.471 1.216 2.719 1.00 0.00 H new ATOM 0 HB THR A 44 -2.248 1.291 0.616 1.00 0.00 H new ATOM 0 HG1 THR A 44 -1.124 3.293 1.178 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.270 3.339 -0.793 1.00 0.00 H new ATOM 0 HG22 THR A 44 -3.771 2.389 -0.911 1.00 0.00 H new ATOM 0 HG23 THR A 44 -3.734 3.879 0.063 1.00 0.00 H new ATOM 635 N TYR A 45 -4.661 3.272 3.544 1.00 0.00 N ATOM 636 CA TYR A 45 -5.401 4.415 4.074 1.00 0.00 C ATOM 637 C TYR A 45 -4.464 5.292 4.906 1.00 0.00 C ATOM 638 O TYR A 45 -3.496 4.764 5.450 1.00 0.00 O ATOM 639 CB TYR A 45 -6.583 3.907 4.917 1.00 0.00 C ATOM 640 CG TYR A 45 -7.855 4.696 4.695 1.00 0.00 C ATOM 641 CD1 TYR A 45 -8.046 5.935 5.333 1.00 0.00 C ATOM 642 CD2 TYR A 45 -8.836 4.205 3.815 1.00 0.00 C ATOM 643 CE1 TYR A 45 -9.183 6.708 5.047 1.00 0.00 C ATOM 644 CE2 TYR A 45 -9.986 4.966 3.541 1.00 0.00 C ATOM 645 CZ TYR A 45 -10.155 6.233 4.139 1.00 0.00 C ATOM 646 OH TYR A 45 -11.219 7.014 3.814 1.00 0.00 O ATOM 0 H TYR A 45 -3.960 2.910 4.190 1.00 0.00 H new ATOM 0 HA TYR A 45 -5.794 5.019 3.256 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -6.767 2.859 4.679 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -6.314 3.952 5.972 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -7.316 6.293 6.045 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -8.706 3.240 3.348 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -9.315 7.669 5.523 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -10.741 4.580 2.872 1.00 0.00 H new ATOM 0 HH TYR A 45 -11.792 6.538 3.177 1.00 0.00 H new ATOM 656 N THR A 46 -4.769 6.582 5.091 1.00 0.00 N ATOM 657 CA THR A 46 -4.095 7.416 6.085 1.00 0.00 C ATOM 658 C THR A 46 -5.138 8.118 6.959 1.00 0.00 C ATOM 659 O THR A 46 -6.103 8.700 6.456 1.00 0.00 O ATOM 660 CB THR A 46 -3.149 8.391 5.369 1.00 0.00 C ATOM 661 OG1 THR A 46 -2.186 7.650 4.642 1.00 0.00 O ATOM 662 CG2 THR A 46 -2.413 9.335 6.325 1.00 0.00 C ATOM 0 H THR A 46 -5.487 7.072 4.557 1.00 0.00 H new ATOM 0 HA THR A 46 -3.484 6.809 6.753 1.00 0.00 H new ATOM 0 HB THR A 46 -3.767 9.006 4.715 1.00 0.00 H new ATOM 0 HG1 THR A 46 -1.579 8.266 4.181 1.00 0.00 H new ATOM 0 HG21 THR A 46 -1.762 9.996 5.754 1.00 0.00 H new ATOM 0 HG22 THR A 46 -3.139 9.930 6.879 1.00 0.00 H new ATOM 0 HG23 THR A 46 -1.814 8.751 7.024 1.00 0.00 H new ATOM 670 N GLU A 47 -4.936 8.069 8.276 1.00 0.00 N ATOM 671 CA GLU A 47 -5.766 8.690 9.301 1.00 0.00 C ATOM 672 C GLU A 47 -4.834 9.283 10.351 1.00 0.00 C ATOM 673 O GLU A 47 -4.248 8.560 11.160 1.00 0.00 O ATOM 674 CB GLU A 47 -6.748 7.675 9.910 1.00 0.00 C ATOM 675 CG GLU A 47 -8.051 7.631 9.105 1.00 0.00 C ATOM 676 CD GLU A 47 -8.971 6.498 9.550 1.00 0.00 C ATOM 677 OE1 GLU A 47 -9.270 6.365 10.761 1.00 0.00 O ATOM 678 OE2 GLU A 47 -9.429 5.737 8.673 1.00 0.00 O ATOM 0 H GLU A 47 -4.144 7.566 8.675 1.00 0.00 H new ATOM 0 HA GLU A 47 -6.381 9.480 8.868 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -6.292 6.685 9.927 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -6.963 7.945 10.944 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -8.573 8.582 9.211 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -7.818 7.512 8.047 1.00 0.00 H new ATOM 685 N LYS A 48 -4.641 10.602 10.279 1.00 0.00 N ATOM 686 CA LYS A 48 -3.901 11.446 11.211 1.00 0.00 C ATOM 687 C LYS A 48 -4.194 12.900 10.817 1.00 0.00 C ATOM 688 O LYS A 48 -4.446 13.184 9.641 1.00 0.00 O ATOM 689 CB LYS A 48 -2.382 11.155 11.207 1.00 0.00 C ATOM 690 CG LYS A 48 -1.755 11.021 12.614 1.00 0.00 C ATOM 691 CD LYS A 48 -1.821 9.606 13.223 1.00 0.00 C ATOM 692 CE LYS A 48 -3.165 9.273 13.885 1.00 0.00 C ATOM 693 NZ LYS A 48 -3.500 7.835 13.816 1.00 0.00 N ATOM 0 H LYS A 48 -5.029 11.146 9.508 1.00 0.00 H new ATOM 0 HA LYS A 48 -4.224 11.241 12.232 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -2.202 10.234 10.653 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -1.872 11.955 10.670 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -0.711 11.330 12.561 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -2.259 11.714 13.288 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -1.623 8.875 12.439 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -1.028 9.503 13.963 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -3.137 9.585 14.929 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -3.955 9.848 13.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -4.210 7.609 14.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -3.884 7.613 12.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -2.643 7.270 13.983 1.00 0.00 H new ATOM 707 N SER A 49 -4.223 13.803 11.785 1.00 0.00 N ATOM 708 CA SER A 49 -4.302 15.248 11.612 1.00 0.00 C ATOM 709 C SER A 49 -3.102 15.860 12.338 1.00 0.00 C ATOM 710 O SER A 49 -2.597 15.260 13.297 1.00 0.00 O ATOM 711 CB SER A 49 -5.624 15.752 12.200 1.00 0.00 C ATOM 712 OG SER A 49 -5.810 17.108 11.871 1.00 0.00 O ATOM 0 H SER A 49 -4.190 13.533 12.768 1.00 0.00 H new ATOM 0 HA SER A 49 -4.276 15.531 10.560 1.00 0.00 H new ATOM 0 HB2 SER A 49 -6.453 15.158 11.814 1.00 0.00 H new ATOM 0 HB3 SER A 49 -5.620 15.629 13.283 1.00 0.00 H new ATOM 0 HG SER A 49 -6.658 17.423 12.249 1.00 0.00 H new ATOM 718 N ARG A 50 -2.639 17.051 11.942 1.00 0.00 N ATOM 719 CA ARG A 50 -1.730 17.832 12.781 1.00 0.00 C ATOM 720 C ARG A 50 -2.583 18.721 13.664 1.00 0.00 C ATOM 721 O ARG A 50 -3.195 19.682 13.203 1.00 0.00 O ATOM 722 CB ARG A 50 -0.719 18.668 11.985 1.00 0.00 C ATOM 723 CG ARG A 50 0.319 17.801 11.277 1.00 0.00 C ATOM 724 CD ARG A 50 1.490 18.665 10.805 1.00 0.00 C ATOM 725 NE ARG A 50 2.256 17.959 9.777 1.00 0.00 N ATOM 726 CZ ARG A 50 3.393 17.276 9.913 1.00 0.00 C ATOM 727 NH1 ARG A 50 4.045 17.196 11.067 1.00 0.00 N ATOM 728 NH2 ARG A 50 3.878 16.633 8.869 1.00 0.00 N ATOM 0 H ARG A 50 -2.878 17.490 11.053 1.00 0.00 H new ATOM 0 HA ARG A 50 -1.124 17.143 13.369 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -1.250 19.271 11.248 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -0.213 19.360 12.658 1.00 0.00 H new ATOM 0 HG2 ARG A 50 0.678 17.025 11.953 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -0.137 17.296 10.426 1.00 0.00 H new ATOM 0 HD2 ARG A 50 1.118 19.609 10.407 1.00 0.00 H new ATOM 0 HD3 ARG A 50 2.136 18.907 11.649 1.00 0.00 H new ATOM 0 HE ARG A 50 1.870 17.994 8.834 1.00 0.00 H new ATOM 0 HH11 ARG A 50 3.679 17.668 11.894 1.00 0.00 H new ATOM 0 HH12 ARG A 50 4.912 16.662 11.127 1.00 0.00 H new ATOM 0 HH21 ARG A 50 3.385 16.664 7.977 1.00 0.00 H new ATOM 0 HH22 ARG A 50 4.747 16.105 8.954 1.00 0.00 H new ATOM 742 N THR A 51 -2.593 18.412 14.947 1.00 0.00 N ATOM 743 CA THR A 51 -3.119 19.239 16.010 1.00 0.00 C ATOM 744 C THR A 51 -2.121 19.034 17.154 1.00 0.00 C ATOM 745 O THR A 51 -1.573 17.936 17.287 1.00 0.00 O ATOM 746 CB THR A 51 -4.590 18.840 16.283 1.00 0.00 C ATOM 747 OG1 THR A 51 -5.080 19.444 17.463 1.00 0.00 O ATOM 748 CG2 THR A 51 -4.851 17.329 16.346 1.00 0.00 C ATOM 0 H THR A 51 -2.214 17.530 15.291 1.00 0.00 H new ATOM 0 HA THR A 51 -3.191 20.306 15.802 1.00 0.00 H new ATOM 0 HB THR A 51 -5.129 19.213 15.412 1.00 0.00 H new ATOM 0 HG1 THR A 51 -6.011 19.174 17.606 1.00 0.00 H new ATOM 0 HG21 THR A 51 -5.908 17.150 16.541 1.00 0.00 H new ATOM 0 HG22 THR A 51 -4.575 16.872 15.396 1.00 0.00 H new ATOM 0 HG23 THR A 51 -4.255 16.890 17.146 1.00 0.00 H new ATOM 756 N ALA A 52 -1.835 20.093 17.924 1.00 0.00 N ATOM 757 CA ALA A 52 -0.786 20.145 18.938 1.00 0.00 C ATOM 758 C ALA A 52 0.536 19.601 18.393 1.00 0.00 C ATOM 759 O ALA A 52 1.023 18.559 18.830 1.00 0.00 O ATOM 760 CB ALA A 52 -1.245 19.470 20.239 1.00 0.00 C ATOM 0 H ALA A 52 -2.352 20.969 17.850 1.00 0.00 H new ATOM 0 HA ALA A 52 -0.594 21.187 19.194 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -0.445 19.522 20.978 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -2.128 19.982 20.623 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -1.488 18.426 20.041 1.00 0.00 H new ATOM 766 N SER A 53 1.113 20.298 17.410 1.00 0.00 N ATOM 767 CA SER A 53 2.501 20.100 17.021 1.00 0.00 C ATOM 768 C SER A 53 2.989 21.376 16.315 1.00 0.00 C ATOM 769 O SER A 53 3.366 22.319 17.005 1.00 0.00 O ATOM 770 CB SER A 53 2.668 18.784 16.241 1.00 0.00 C ATOM 771 OG SER A 53 4.015 18.361 16.269 1.00 0.00 O ATOM 0 H SER A 53 0.628 21.012 16.867 1.00 0.00 H new ATOM 0 HA SER A 53 3.153 19.963 17.884 1.00 0.00 H new ATOM 0 HB2 SER A 53 2.030 18.014 16.674 1.00 0.00 H new ATOM 0 HB3 SER A 53 2.345 18.922 15.209 1.00 0.00 H new ATOM 0 HG SER A 53 4.105 17.522 15.770 1.00 0.00 H new ATOM 777 N SER A 54 2.928 21.475 14.981 1.00 0.00 N ATOM 778 CA SER A 54 3.227 22.718 14.274 1.00 0.00 C ATOM 779 C SER A 54 2.014 23.658 14.206 1.00 0.00 C ATOM 780 O SER A 54 2.170 24.814 13.803 1.00 0.00 O ATOM 781 CB SER A 54 3.779 22.392 12.879 1.00 0.00 C ATOM 782 OG SER A 54 3.030 21.380 12.226 1.00 0.00 O ATOM 0 H SER A 54 2.672 20.700 14.369 1.00 0.00 H new ATOM 0 HA SER A 54 3.988 23.259 14.836 1.00 0.00 H new ATOM 0 HB2 SER A 54 3.774 23.295 12.269 1.00 0.00 H new ATOM 0 HB3 SER A 54 4.817 22.072 12.967 1.00 0.00 H new ATOM 0 HG SER A 54 3.416 21.207 11.342 1.00 0.00 H new ATOM 788 N GLY A 55 0.809 23.205 14.592 1.00 0.00 N ATOM 789 CA GLY A 55 -0.425 23.961 14.402 1.00 0.00 C ATOM 790 C GLY A 55 -0.620 24.322 12.929 1.00 0.00 C ATOM 791 O GLY A 55 -0.659 25.498 12.573 1.00 0.00 O ATOM 0 H GLY A 55 0.671 22.302 15.045 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -1.274 23.374 14.753 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -0.396 24.870 15.003 1.00 0.00 H new ATOM 795 N ASP A 56 -0.660 23.319 12.061 1.00 0.00 N ATOM 796 CA ASP A 56 -0.938 23.448 10.638 1.00 0.00 C ATOM 797 C ASP A 56 -2.190 22.620 10.403 1.00 0.00 C ATOM 798 O ASP A 56 -2.120 21.394 10.441 1.00 0.00 O ATOM 799 CB ASP A 56 0.255 22.949 9.820 1.00 0.00 C ATOM 800 CG ASP A 56 -0.056 22.945 8.326 1.00 0.00 C ATOM 801 OD1 ASP A 56 -0.861 23.779 7.865 1.00 0.00 O ATOM 802 OD2 ASP A 56 0.591 22.143 7.611 1.00 0.00 O ATOM 0 H ASP A 56 -0.492 22.353 12.342 1.00 0.00 H new ATOM 0 HA ASP A 56 -1.096 24.481 10.328 1.00 0.00 H new ATOM 0 HB2 ASP A 56 1.120 23.584 10.011 1.00 0.00 H new ATOM 0 HB3 ASP A 56 0.522 21.942 10.140 1.00 0.00 H new ATOM 807 N TYR A 57 -3.350 23.269 10.358 1.00 0.00 N ATOM 808 CA TYR A 57 -4.645 22.617 10.530 1.00 0.00 C ATOM 809 C TYR A 57 -5.228 22.330 9.152 1.00 0.00 C ATOM 810 O TYR A 57 -5.645 23.253 8.446 1.00 0.00 O ATOM 811 CB TYR A 57 -5.564 23.484 11.393 1.00 0.00 C ATOM 812 CG TYR A 57 -5.016 23.714 12.788 1.00 0.00 C ATOM 813 CD1 TYR A 57 -5.097 22.694 13.757 1.00 0.00 C ATOM 814 CD2 TYR A 57 -4.376 24.928 13.098 1.00 0.00 C ATOM 815 CE1 TYR A 57 -4.556 22.894 15.040 1.00 0.00 C ATOM 816 CE2 TYR A 57 -3.822 25.125 14.374 1.00 0.00 C ATOM 817 CZ TYR A 57 -3.920 24.115 15.354 1.00 0.00 C ATOM 818 OH TYR A 57 -3.376 24.301 16.585 1.00 0.00 O ATOM 0 H TYR A 57 -3.418 24.274 10.199 1.00 0.00 H new ATOM 0 HA TYR A 57 -4.534 21.669 11.057 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -5.713 24.446 10.903 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -6.542 23.008 11.466 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -5.575 21.757 13.514 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -4.311 25.709 12.355 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -4.627 22.114 15.784 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -3.320 26.053 14.605 1.00 0.00 H new ATOM 0 HH TYR A 57 -2.977 25.195 16.635 1.00 0.00 H new ATOM 828 N ASN A 58 -5.179 21.065 8.738 1.00 0.00 N ATOM 829 CA ASN A 58 -5.491 20.617 7.391 1.00 0.00 C ATOM 830 C ASN A 58 -6.126 19.225 7.434 1.00 0.00 C ATOM 831 O ASN A 58 -6.381 18.677 8.505 1.00 0.00 O ATOM 832 CB ASN A 58 -4.205 20.645 6.543 1.00 0.00 C ATOM 833 CG ASN A 58 -3.157 19.604 6.939 1.00 0.00 C ATOM 834 OD1 ASN A 58 -2.353 19.817 7.833 1.00 0.00 O ATOM 835 ND2 ASN A 58 -3.088 18.470 6.263 1.00 0.00 N ATOM 0 H ASN A 58 -4.911 20.300 9.357 1.00 0.00 H new ATOM 0 HA ASN A 58 -6.218 21.285 6.928 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -4.472 20.493 5.497 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -3.759 21.637 6.617 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -2.368 17.784 6.490 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -3.754 18.281 5.514 1.00 0.00 H new ATOM 842 N LYS A 59 -6.368 18.626 6.263 1.00 0.00 N ATOM 843 CA LYS A 59 -6.629 17.189 6.145 1.00 0.00 C ATOM 844 C LYS A 59 -5.579 16.597 5.224 1.00 0.00 C ATOM 845 O LYS A 59 -4.918 17.341 4.488 1.00 0.00 O ATOM 846 CB LYS A 59 -8.063 16.885 5.675 1.00 0.00 C ATOM 847 CG LYS A 59 -9.087 16.949 6.820 1.00 0.00 C ATOM 848 CD LYS A 59 -9.751 18.311 7.077 1.00 0.00 C ATOM 849 CE LYS A 59 -10.906 18.633 6.118 1.00 0.00 C ATOM 850 NZ LYS A 59 -10.467 19.244 4.848 1.00 0.00 N ATOM 0 H LYS A 59 -6.388 19.123 5.373 1.00 0.00 H new ATOM 0 HA LYS A 59 -6.557 16.724 7.128 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -8.346 17.597 4.900 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -8.091 15.894 5.223 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -9.872 16.221 6.615 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -8.591 16.634 7.738 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -10.125 18.334 8.101 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -8.996 19.093 6.996 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -11.453 17.716 5.900 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -11.602 19.309 6.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -11.249 19.793 4.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -9.659 19.873 5.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -10.183 18.496 4.183 1.00 0.00 H new ATOM 864 N ASN A 60 -5.373 15.289 5.321 1.00 0.00 N ATOM 865 CA ASN A 60 -4.189 14.592 4.849 1.00 0.00 C ATOM 866 C ASN A 60 -4.690 13.271 4.275 1.00 0.00 C ATOM 867 O ASN A 60 -4.884 12.305 5.013 1.00 0.00 O ATOM 868 CB ASN A 60 -3.204 14.395 6.023 1.00 0.00 C ATOM 869 CG ASN A 60 -1.912 15.191 5.876 1.00 0.00 C ATOM 870 OD1 ASN A 60 -1.523 15.971 6.867 1.00 0.00 O flip ATOM 871 ND2 ASN A 60 -1.219 15.092 4.877 1.00 0.00 N flip ATOM 0 H ASN A 60 -6.055 14.663 5.748 1.00 0.00 H new ATOM 0 HA ASN A 60 -3.643 15.146 4.085 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -3.696 14.685 6.952 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -2.961 13.336 6.108 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -1.515 14.490 4.108 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -0.343 15.611 4.810 1.00 0.00 H new ATOM 878 N GLN A 61 -4.976 13.250 2.976 1.00 0.00 N ATOM 879 CA GLN A 61 -5.815 12.241 2.348 1.00 0.00 C ATOM 880 C GLN A 61 -4.940 11.412 1.409 1.00 0.00 C ATOM 881 O GLN A 61 -4.203 11.984 0.598 1.00 0.00 O ATOM 882 CB GLN A 61 -6.958 12.951 1.588 1.00 0.00 C ATOM 883 CG GLN A 61 -8.340 12.335 1.857 1.00 0.00 C ATOM 884 CD GLN A 61 -9.004 12.869 3.125 1.00 0.00 C ATOM 885 OE1 GLN A 61 -8.352 13.106 4.139 1.00 0.00 O ATOM 886 NE2 GLN A 61 -10.309 13.078 3.095 1.00 0.00 N ATOM 0 H GLN A 61 -4.623 13.948 2.321 1.00 0.00 H new ATOM 0 HA GLN A 61 -6.263 11.574 3.085 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -6.975 14.003 1.872 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -6.753 12.913 0.518 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -8.990 12.532 1.004 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -8.238 11.253 1.937 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -10.838 12.877 2.247 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -10.787 13.440 3.920 1.00 0.00 H new ATOM 895 N TYR A 62 -5.003 10.079 1.513 1.00 0.00 N ATOM 896 CA TYR A 62 -4.304 9.171 0.608 1.00 0.00 C ATOM 897 C TYR A 62 -5.275 8.067 0.194 1.00 0.00 C ATOM 898 O TYR A 62 -5.678 7.253 1.032 1.00 0.00 O ATOM 899 CB TYR A 62 -3.042 8.590 1.278 1.00 0.00 C ATOM 900 CG TYR A 62 -1.733 9.017 0.643 1.00 0.00 C ATOM 901 CD1 TYR A 62 -1.375 8.531 -0.632 1.00 0.00 C ATOM 902 CD2 TYR A 62 -0.839 9.845 1.349 1.00 0.00 C ATOM 903 CE1 TYR A 62 -0.145 8.900 -1.211 1.00 0.00 C ATOM 904 CE2 TYR A 62 0.394 10.205 0.777 1.00 0.00 C ATOM 905 CZ TYR A 62 0.740 9.750 -0.514 1.00 0.00 C ATOM 906 OH TYR A 62 1.927 10.107 -1.078 1.00 0.00 O ATOM 0 H TYR A 62 -5.545 9.601 2.233 1.00 0.00 H new ATOM 0 HA TYR A 62 -3.969 9.711 -0.278 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -3.035 8.887 2.327 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -3.103 7.502 1.255 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.046 7.874 -1.166 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -1.101 10.205 2.333 1.00 0.00 H new ATOM 0 HE1 TYR A 62 0.121 8.532 -2.191 1.00 0.00 H new ATOM 0 HE2 TYR A 62 1.079 10.832 1.328 1.00 0.00 H new ATOM 0 HH TYR A 62 2.416 10.696 -0.466 1.00 0.00 H new ATOM 916 N TYR A 63 -5.653 8.042 -1.084 1.00 0.00 N ATOM 917 CA TYR A 63 -6.206 6.875 -1.754 1.00 0.00 C ATOM 918 C TYR A 63 -5.061 6.255 -2.547 1.00 0.00 C ATOM 919 O TYR A 63 -4.317 6.988 -3.208 1.00 0.00 O ATOM 920 CB TYR A 63 -7.321 7.287 -2.738 1.00 0.00 C ATOM 921 CG TYR A 63 -8.733 7.324 -2.181 1.00 0.00 C ATOM 922 CD1 TYR A 63 -9.304 6.149 -1.660 1.00 0.00 C ATOM 923 CD2 TYR A 63 -9.518 8.491 -2.260 1.00 0.00 C ATOM 924 CE1 TYR A 63 -10.626 6.139 -1.187 1.00 0.00 C ATOM 925 CE2 TYR A 63 -10.840 8.498 -1.774 1.00 0.00 C ATOM 926 CZ TYR A 63 -11.398 7.315 -1.239 1.00 0.00 C ATOM 927 OH TYR A 63 -12.670 7.283 -0.765 1.00 0.00 O ATOM 0 H TYR A 63 -5.579 8.856 -1.694 1.00 0.00 H new ATOM 0 HA TYR A 63 -6.632 6.184 -1.027 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -7.082 8.276 -3.130 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -7.304 6.597 -3.582 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -8.718 5.243 -1.623 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -9.103 9.387 -2.697 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -11.050 5.231 -0.784 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -11.426 9.405 -1.810 1.00 0.00 H new ATOM 0 HH TYR A 63 -13.079 8.168 -0.866 1.00 0.00 H new ATOM 937 N GLY A 64 -4.976 4.927 -2.562 1.00 0.00 N ATOM 938 CA GLY A 64 -4.197 4.184 -3.540 1.00 0.00 C ATOM 939 C GLY A 64 -5.062 3.057 -4.073 1.00 0.00 C ATOM 940 O GLY A 64 -5.874 2.495 -3.330 1.00 0.00 O ATOM 0 H GLY A 64 -5.454 4.332 -1.885 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -3.882 4.839 -4.352 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -3.292 3.785 -3.082 1.00 0.00 H new ATOM 944 N ILE A 65 -4.912 2.709 -5.345 1.00 0.00 N ATOM 945 CA ILE A 65 -5.702 1.689 -6.015 1.00 0.00 C ATOM 946 C ILE A 65 -4.711 0.782 -6.740 1.00 0.00 C ATOM 947 O ILE A 65 -4.125 1.176 -7.743 1.00 0.00 O ATOM 948 CB ILE A 65 -6.792 2.364 -6.886 1.00 0.00 C ATOM 949 CG1 ILE A 65 -7.738 1.359 -7.579 1.00 0.00 C ATOM 950 CG2 ILE A 65 -6.280 3.461 -7.845 1.00 0.00 C ATOM 951 CD1 ILE A 65 -7.137 0.555 -8.734 1.00 0.00 C ATOM 0 H ILE A 65 -4.218 3.142 -5.954 1.00 0.00 H new ATOM 0 HA ILE A 65 -6.275 1.053 -5.340 1.00 0.00 H new ATOM 0 HB ILE A 65 -7.398 2.903 -6.158 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -8.105 0.659 -6.828 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -8.603 1.905 -7.955 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -7.118 3.871 -8.409 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -5.807 4.256 -7.269 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -5.554 3.031 -8.535 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -7.893 -0.116 -9.142 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -6.798 1.237 -9.514 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -6.292 -0.029 -8.370 1.00 0.00 H new ATOM 963 N THR A 66 -4.563 -0.445 -6.250 1.00 0.00 N ATOM 964 CA THR A 66 -3.599 -1.434 -6.685 1.00 0.00 C ATOM 965 C THR A 66 -4.364 -2.729 -6.966 1.00 0.00 C ATOM 966 O THR A 66 -5.263 -3.100 -6.191 1.00 0.00 O ATOM 967 CB THR A 66 -2.547 -1.666 -5.577 1.00 0.00 C ATOM 968 OG1 THR A 66 -2.342 -0.546 -4.734 1.00 0.00 O ATOM 969 CG2 THR A 66 -1.178 -2.070 -6.129 1.00 0.00 C ATOM 0 H THR A 66 -5.152 -0.790 -5.492 1.00 0.00 H new ATOM 0 HA THR A 66 -3.078 -1.097 -7.581 1.00 0.00 H new ATOM 0 HB THR A 66 -2.979 -2.481 -4.996 1.00 0.00 H new ATOM 0 HG1 THR A 66 -1.389 -0.468 -4.520 1.00 0.00 H new ATOM 0 HG21 THR A 66 -0.482 -2.219 -5.303 1.00 0.00 H new ATOM 0 HG22 THR A 66 -1.273 -2.997 -6.695 1.00 0.00 H new ATOM 0 HG23 THR A 66 -0.802 -1.283 -6.783 1.00 0.00 H new ATOM 977 N ALA A 67 -4.020 -3.439 -8.038 1.00 0.00 N ATOM 978 CA ALA A 67 -4.577 -4.744 -8.368 1.00 0.00 C ATOM 979 C ALA A 67 -3.603 -5.506 -9.265 1.00 0.00 C ATOM 980 O ALA A 67 -2.648 -4.921 -9.783 1.00 0.00 O ATOM 981 CB ALA A 67 -5.913 -4.552 -9.099 1.00 0.00 C ATOM 0 H ALA A 67 -3.330 -3.113 -8.715 1.00 0.00 H new ATOM 0 HA ALA A 67 -4.740 -5.314 -7.454 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -6.334 -5.526 -9.348 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -6.606 -4.011 -8.455 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -5.749 -3.983 -10.014 1.00 0.00 H new ATOM 987 N GLY A 68 -3.884 -6.788 -9.489 1.00 0.00 N ATOM 988 CA GLY A 68 -3.357 -7.543 -10.607 1.00 0.00 C ATOM 989 C GLY A 68 -3.043 -8.989 -10.237 1.00 0.00 C ATOM 990 O GLY A 68 -2.921 -9.332 -9.053 1.00 0.00 O ATOM 0 H GLY A 68 -4.496 -7.335 -8.883 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -4.079 -7.529 -11.424 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -2.451 -7.060 -10.973 1.00 0.00 H new ATOM 994 N PRO A 69 -2.853 -9.844 -11.255 1.00 0.00 N ATOM 995 CA PRO A 69 -2.180 -11.112 -11.068 1.00 0.00 C ATOM 996 C PRO A 69 -0.726 -10.825 -10.690 1.00 0.00 C ATOM 997 O PRO A 69 -0.120 -9.855 -11.166 1.00 0.00 O ATOM 998 CB PRO A 69 -2.316 -11.848 -12.403 1.00 0.00 C ATOM 999 CG PRO A 69 -2.375 -10.717 -13.428 1.00 0.00 C ATOM 1000 CD PRO A 69 -3.086 -9.595 -12.672 1.00 0.00 C ATOM 0 HA PRO A 69 -2.599 -11.727 -10.272 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -1.470 -12.511 -12.584 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -3.215 -12.464 -12.432 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -1.379 -10.415 -13.752 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -2.925 -11.012 -14.321 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -2.695 -8.621 -12.965 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -4.153 -9.591 -12.896 1.00 0.00 H new ATOM 1008 N ALA A 70 -0.154 -11.705 -9.879 1.00 0.00 N ATOM 1009 CA ALA A 70 1.233 -11.645 -9.464 1.00 0.00 C ATOM 1010 C ALA A 70 2.068 -12.438 -10.476 1.00 0.00 C ATOM 1011 O ALA A 70 1.546 -12.967 -11.468 1.00 0.00 O ATOM 1012 CB ALA A 70 1.339 -12.236 -8.054 1.00 0.00 C ATOM 0 H ALA A 70 -0.658 -12.499 -9.484 1.00 0.00 H new ATOM 0 HA ALA A 70 1.605 -10.621 -9.435 1.00 0.00 H new ATOM 0 HB1 ALA A 70 2.377 -12.201 -7.722 1.00 0.00 H new ATOM 0 HB2 ALA A 70 0.719 -11.657 -7.369 1.00 0.00 H new ATOM 0 HB3 ALA A 70 0.997 -13.271 -8.067 1.00 0.00 H new ATOM 1018 N TYR A 71 3.380 -12.494 -10.260 1.00 0.00 N ATOM 1019 CA TYR A 71 4.225 -13.471 -10.924 1.00 0.00 C ATOM 1020 C TYR A 71 4.848 -14.331 -9.838 1.00 0.00 C ATOM 1021 O TYR A 71 5.452 -13.795 -8.904 1.00 0.00 O ATOM 1022 CB TYR A 71 5.278 -12.789 -11.806 1.00 0.00 C ATOM 1023 CG TYR A 71 4.978 -12.832 -13.289 1.00 0.00 C ATOM 1024 CD1 TYR A 71 4.235 -11.804 -13.900 1.00 0.00 C ATOM 1025 CD2 TYR A 71 5.489 -13.886 -14.067 1.00 0.00 C ATOM 1026 CE1 TYR A 71 4.075 -11.787 -15.298 1.00 0.00 C ATOM 1027 CE2 TYR A 71 5.327 -13.881 -15.462 1.00 0.00 C ATOM 1028 CZ TYR A 71 4.643 -12.816 -16.084 1.00 0.00 C ATOM 1029 OH TYR A 71 4.534 -12.773 -17.437 1.00 0.00 O ATOM 0 H TYR A 71 3.879 -11.869 -9.626 1.00 0.00 H new ATOM 0 HA TYR A 71 3.641 -14.096 -11.600 1.00 0.00 H new ATOM 0 HB2 TYR A 71 5.373 -11.748 -11.497 1.00 0.00 H new ATOM 0 HB3 TYR A 71 6.244 -13.263 -11.630 1.00 0.00 H new ATOM 0 HD1 TYR A 71 3.788 -11.028 -13.296 1.00 0.00 H new ATOM 0 HD2 TYR A 71 6.009 -14.703 -13.589 1.00 0.00 H new ATOM 0 HE1 TYR A 71 3.520 -10.990 -15.770 1.00 0.00 H new ATOM 0 HE2 TYR A 71 5.725 -14.690 -16.057 1.00 0.00 H new ATOM 0 HH TYR A 71 4.979 -13.554 -17.826 1.00 0.00 H new ATOM 1039 N ARG A 72 4.725 -15.651 -9.975 1.00 0.00 N ATOM 1040 CA ARG A 72 5.470 -16.586 -9.148 1.00 0.00 C ATOM 1041 C ARG A 72 6.618 -17.130 -9.984 1.00 0.00 C ATOM 1042 O ARG A 72 6.447 -17.418 -11.170 1.00 0.00 O ATOM 1043 CB ARG A 72 4.546 -17.650 -8.531 1.00 0.00 C ATOM 1044 CG ARG A 72 3.984 -18.678 -9.520 1.00 0.00 C ATOM 1045 CD ARG A 72 4.921 -19.881 -9.688 1.00 0.00 C ATOM 1046 NE ARG A 72 4.798 -20.480 -11.022 1.00 0.00 N ATOM 1047 CZ ARG A 72 5.068 -21.748 -11.339 1.00 0.00 C ATOM 1048 NH1 ARG A 72 5.560 -22.594 -10.440 1.00 0.00 N ATOM 1049 NH2 ARG A 72 4.811 -22.174 -12.569 1.00 0.00 N ATOM 0 H ARG A 72 4.110 -16.095 -10.658 1.00 0.00 H new ATOM 0 HA ARG A 72 5.904 -16.094 -8.278 1.00 0.00 H new ATOM 0 HB2 ARG A 72 5.097 -18.180 -7.754 1.00 0.00 H new ATOM 0 HB3 ARG A 72 3.712 -17.145 -8.043 1.00 0.00 H new ATOM 0 HG2 ARG A 72 3.010 -19.022 -9.172 1.00 0.00 H new ATOM 0 HG3 ARG A 72 3.827 -18.202 -10.488 1.00 0.00 H new ATOM 0 HD2 ARG A 72 5.951 -19.566 -9.524 1.00 0.00 H new ATOM 0 HD3 ARG A 72 4.692 -20.630 -8.930 1.00 0.00 H new ATOM 0 HE ARG A 72 4.477 -19.872 -11.775 1.00 0.00 H new ATOM 0 HH11 ARG A 72 5.738 -22.278 -9.487 1.00 0.00 H new ATOM 0 HH12 ARG A 72 5.759 -23.559 -10.703 1.00 0.00 H new ATOM 0 HH21 ARG A 72 4.413 -21.535 -13.257 1.00 0.00 H new ATOM 0 HH22 ARG A 72 5.012 -23.140 -12.826 1.00 0.00 H new ATOM 1063 N ILE A 73 7.788 -17.283 -9.377 1.00 0.00 N ATOM 1064 CA ILE A 73 8.993 -17.778 -10.025 1.00 0.00 C ATOM 1065 C ILE A 73 9.756 -18.686 -9.063 1.00 0.00 C ATOM 1066 O ILE A 73 9.432 -18.750 -7.877 1.00 0.00 O ATOM 1067 CB ILE A 73 9.886 -16.601 -10.494 1.00 0.00 C ATOM 1068 CG1 ILE A 73 10.490 -15.746 -9.354 1.00 0.00 C ATOM 1069 CG2 ILE A 73 9.206 -15.752 -11.579 1.00 0.00 C ATOM 1070 CD1 ILE A 73 9.670 -14.541 -8.894 1.00 0.00 C ATOM 0 H ILE A 73 7.927 -17.059 -8.392 1.00 0.00 H new ATOM 0 HA ILE A 73 8.711 -18.354 -10.906 1.00 0.00 H new ATOM 0 HB ILE A 73 10.752 -17.078 -10.953 1.00 0.00 H new ATOM 0 HG12 ILE A 73 10.656 -16.394 -8.493 1.00 0.00 H new ATOM 0 HG13 ILE A 73 11.468 -15.389 -9.677 1.00 0.00 H new ATOM 0 HG21 ILE A 73 9.870 -14.940 -11.875 1.00 0.00 H new ATOM 0 HG22 ILE A 73 8.987 -16.376 -12.445 1.00 0.00 H new ATOM 0 HG23 ILE A 73 8.278 -15.337 -11.187 1.00 0.00 H new ATOM 0 HD11 ILE A 73 10.199 -14.025 -8.093 1.00 0.00 H new ATOM 0 HD12 ILE A 73 9.525 -13.859 -9.731 1.00 0.00 H new ATOM 0 HD13 ILE A 73 8.700 -14.879 -8.529 1.00 0.00 H new ATOM 1082 N ASN A 74 10.842 -19.289 -9.554 1.00 0.00 N ATOM 1083 CA ASN A 74 11.953 -19.922 -8.836 1.00 0.00 C ATOM 1084 C ASN A 74 11.546 -21.257 -8.205 1.00 0.00 C ATOM 1085 O ASN A 74 12.209 -22.266 -8.442 1.00 0.00 O ATOM 1086 CB ASN A 74 12.579 -18.930 -7.840 1.00 0.00 C ATOM 1087 CG ASN A 74 13.893 -19.443 -7.271 1.00 0.00 C ATOM 1088 OD1 ASN A 74 13.953 -20.502 -6.663 1.00 0.00 O ATOM 1089 ND2 ASN A 74 14.968 -18.676 -7.363 1.00 0.00 N ATOM 0 H ASN A 74 10.979 -19.353 -10.563 1.00 0.00 H new ATOM 0 HA ASN A 74 12.731 -20.180 -9.555 1.00 0.00 H new ATOM 0 HB2 ASN A 74 12.748 -17.975 -8.338 1.00 0.00 H new ATOM 0 HB3 ASN A 74 11.879 -18.745 -7.025 1.00 0.00 H new ATOM 0 HD21 ASN A 74 15.842 -18.969 -6.927 1.00 0.00 H new ATOM 0 HD22 ASN A 74 14.922 -17.792 -7.869 1.00 0.00 H new ATOM 1096 N ASP A 75 10.430 -21.283 -7.481 1.00 0.00 N ATOM 1097 CA ASP A 75 9.434 -22.345 -7.592 1.00 0.00 C ATOM 1098 C ASP A 75 8.060 -21.672 -7.513 1.00 0.00 C ATOM 1099 O ASP A 75 7.382 -21.515 -8.532 1.00 0.00 O ATOM 1100 CB ASP A 75 9.613 -23.457 -6.550 1.00 0.00 C ATOM 1101 CG ASP A 75 8.730 -24.674 -6.857 1.00 0.00 C ATOM 1102 OD1 ASP A 75 7.978 -24.666 -7.865 1.00 0.00 O ATOM 1103 OD2 ASP A 75 8.901 -25.688 -6.148 1.00 0.00 O ATOM 0 H ASP A 75 10.190 -20.565 -6.798 1.00 0.00 H new ATOM 0 HA ASP A 75 9.550 -22.866 -8.543 1.00 0.00 H new ATOM 0 HB2 ASP A 75 10.658 -23.764 -6.522 1.00 0.00 H new ATOM 0 HB3 ASP A 75 9.368 -23.071 -5.561 1.00 0.00 H new ATOM 1108 N TRP A 76 7.721 -21.113 -6.351 1.00 0.00 N ATOM 1109 CA TRP A 76 6.570 -20.236 -6.134 1.00 0.00 C ATOM 1110 C TRP A 76 6.943 -19.136 -5.128 1.00 0.00 C ATOM 1111 O TRP A 76 6.250 -18.874 -4.144 1.00 0.00 O ATOM 1112 CB TRP A 76 5.327 -21.059 -5.761 1.00 0.00 C ATOM 1113 CG TRP A 76 5.553 -22.268 -4.906 1.00 0.00 C ATOM 1114 CD1 TRP A 76 6.135 -22.277 -3.687 1.00 0.00 C ATOM 1115 CD2 TRP A 76 5.256 -23.661 -5.220 1.00 0.00 C ATOM 1116 NE1 TRP A 76 6.246 -23.576 -3.239 1.00 0.00 N ATOM 1117 CE2 TRP A 76 5.728 -24.473 -4.148 1.00 0.00 C ATOM 1118 CE3 TRP A 76 4.629 -24.318 -6.300 1.00 0.00 C ATOM 1119 CZ2 TRP A 76 5.603 -25.870 -4.158 1.00 0.00 C ATOM 1120 CZ3 TRP A 76 4.502 -25.719 -6.321 1.00 0.00 C ATOM 1121 CH2 TRP A 76 4.995 -26.495 -5.258 1.00 0.00 C ATOM 0 H TRP A 76 8.263 -21.265 -5.500 1.00 0.00 H new ATOM 0 HA TRP A 76 6.299 -19.721 -7.055 1.00 0.00 H new ATOM 0 HB2 TRP A 76 4.627 -20.403 -5.244 1.00 0.00 H new ATOM 0 HB3 TRP A 76 4.842 -21.380 -6.683 1.00 0.00 H new ATOM 0 HD1 TRP A 76 6.463 -21.401 -3.147 1.00 0.00 H new ATOM 0 HE1 TRP A 76 6.660 -23.841 -2.345 1.00 0.00 H new ATOM 0 HE3 TRP A 76 4.241 -23.736 -7.123 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 5.970 -26.458 -3.330 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 4.022 -26.201 -7.160 1.00 0.00 H new ATOM 0 HH2 TRP A 76 4.906 -27.571 -5.287 1.00 0.00 H new ATOM 1132 N ALA A 77 8.080 -18.492 -5.387 1.00 0.00 N ATOM 1133 CA ALA A 77 8.451 -17.216 -4.803 1.00 0.00 C ATOM 1134 C ALA A 77 7.619 -16.160 -5.522 1.00 0.00 C ATOM 1135 O ALA A 77 7.554 -16.198 -6.750 1.00 0.00 O ATOM 1136 CB ALA A 77 9.940 -16.977 -5.061 1.00 0.00 C ATOM 0 H ALA A 77 8.784 -18.859 -6.027 1.00 0.00 H new ATOM 0 HA ALA A 77 8.274 -17.185 -3.728 1.00 0.00 H new ATOM 0 HB1 ALA A 77 10.235 -16.021 -4.628 1.00 0.00 H new ATOM 0 HB2 ALA A 77 10.522 -17.778 -4.604 1.00 0.00 H new ATOM 0 HB3 ALA A 77 10.125 -16.962 -6.135 1.00 0.00 H new ATOM 1142 N SER A 78 6.978 -15.248 -4.793 1.00 0.00 N ATOM 1143 CA SER A 78 6.120 -14.230 -5.385 1.00 0.00 C ATOM 1144 C SER A 78 6.932 -12.958 -5.606 1.00 0.00 C ATOM 1145 O SER A 78 7.731 -12.590 -4.742 1.00 0.00 O ATOM 1146 CB SER A 78 4.936 -13.975 -4.449 1.00 0.00 C ATOM 1147 OG SER A 78 4.044 -13.033 -5.006 1.00 0.00 O ATOM 0 H SER A 78 7.040 -15.196 -3.776 1.00 0.00 H new ATOM 0 HA SER A 78 5.736 -14.563 -6.349 1.00 0.00 H new ATOM 0 HB2 SER A 78 4.410 -14.911 -4.259 1.00 0.00 H new ATOM 0 HB3 SER A 78 5.300 -13.612 -3.487 1.00 0.00 H new ATOM 0 HG SER A 78 3.295 -12.888 -4.391 1.00 0.00 H new ATOM 1153 N ILE A 79 6.672 -12.251 -6.709 1.00 0.00 N ATOM 1154 CA ILE A 79 7.351 -11.020 -7.094 1.00 0.00 C ATOM 1155 C ILE A 79 6.364 -9.861 -7.226 1.00 0.00 C ATOM 1156 O ILE A 79 5.143 -10.040 -7.218 1.00 0.00 O ATOM 1157 CB ILE A 79 8.258 -11.265 -8.324 1.00 0.00 C ATOM 1158 CG1 ILE A 79 9.406 -10.239 -8.471 1.00 0.00 C ATOM 1159 CG2 ILE A 79 7.467 -11.347 -9.637 1.00 0.00 C ATOM 1160 CD1 ILE A 79 10.589 -10.785 -9.281 1.00 0.00 C ATOM 0 H ILE A 79 5.957 -12.534 -7.379 1.00 0.00 H new ATOM 0 HA ILE A 79 8.028 -10.705 -6.300 1.00 0.00 H new ATOM 0 HB ILE A 79 8.712 -12.236 -8.127 1.00 0.00 H new ATOM 0 HG12 ILE A 79 9.024 -9.340 -8.955 1.00 0.00 H new ATOM 0 HG13 ILE A 79 9.754 -9.945 -7.481 1.00 0.00 H new ATOM 0 HG21 ILE A 79 8.154 -11.520 -10.465 1.00 0.00 H new ATOM 0 HG22 ILE A 79 6.753 -12.168 -9.581 1.00 0.00 H new ATOM 0 HG23 ILE A 79 6.932 -10.411 -9.798 1.00 0.00 H new ATOM 0 HD11 ILE A 79 11.364 -10.022 -9.352 1.00 0.00 H new ATOM 0 HD12 ILE A 79 10.993 -11.668 -8.785 1.00 0.00 H new ATOM 0 HD13 ILE A 79 10.252 -11.053 -10.282 1.00 0.00 H new ATOM 1172 N TYR A 80 6.914 -8.667 -7.424 1.00 0.00 N ATOM 1173 CA TYR A 80 6.180 -7.440 -7.594 1.00 0.00 C ATOM 1174 C TYR A 80 6.211 -7.108 -9.087 1.00 0.00 C ATOM 1175 O TYR A 80 7.081 -7.550 -9.838 1.00 0.00 O ATOM 1176 CB TYR A 80 6.911 -6.328 -6.809 1.00 0.00 C ATOM 1177 CG TYR A 80 8.064 -5.639 -7.534 1.00 0.00 C ATOM 1178 CD1 TYR A 80 9.383 -6.134 -7.447 1.00 0.00 C ATOM 1179 CD2 TYR A 80 7.800 -4.514 -8.341 1.00 0.00 C ATOM 1180 CE1 TYR A 80 10.420 -5.525 -8.185 1.00 0.00 C ATOM 1181 CE2 TYR A 80 8.824 -3.926 -9.101 1.00 0.00 C ATOM 1182 CZ TYR A 80 10.139 -4.429 -9.033 1.00 0.00 C ATOM 1183 OH TYR A 80 11.116 -3.841 -9.779 1.00 0.00 O ATOM 0 H TYR A 80 7.924 -8.534 -7.471 1.00 0.00 H new ATOM 0 HA TYR A 80 5.154 -7.527 -7.236 1.00 0.00 H new ATOM 0 HB2 TYR A 80 6.180 -5.569 -6.529 1.00 0.00 H new ATOM 0 HB3 TYR A 80 7.296 -6.758 -5.884 1.00 0.00 H new ATOM 0 HD1 TYR A 80 9.599 -6.982 -6.814 1.00 0.00 H new ATOM 0 HD2 TYR A 80 6.803 -4.101 -8.375 1.00 0.00 H new ATOM 0 HE1 TYR A 80 11.431 -5.897 -8.102 1.00 0.00 H new ATOM 0 HE2 TYR A 80 8.603 -3.084 -9.741 1.00 0.00 H new ATOM 0 HH TYR A 80 10.732 -3.105 -10.300 1.00 0.00 H new ATOM 1193 N GLY A 81 5.232 -6.308 -9.488 1.00 0.00 N ATOM 1194 CA GLY A 81 5.006 -5.927 -10.867 1.00 0.00 C ATOM 1195 C GLY A 81 3.531 -5.632 -11.065 1.00 0.00 C ATOM 1196 O GLY A 81 2.946 -6.027 -12.073 1.00 0.00 O ATOM 0 H GLY A 81 4.558 -5.898 -8.842 1.00 0.00 H new ATOM 0 HA2 GLY A 81 5.602 -5.049 -11.117 1.00 0.00 H new ATOM 0 HA3 GLY A 81 5.322 -6.728 -11.535 1.00 0.00 H new ATOM 1200 N VAL A 82 2.901 -4.972 -10.087 1.00 0.00 N ATOM 1201 CA VAL A 82 1.508 -4.547 -10.211 1.00 0.00 C ATOM 1202 C VAL A 82 1.448 -3.048 -10.464 1.00 0.00 C ATOM 1203 O VAL A 82 2.456 -2.356 -10.332 1.00 0.00 O ATOM 1204 CB VAL A 82 0.657 -5.003 -9.014 1.00 0.00 C ATOM 1205 CG1 VAL A 82 0.331 -6.493 -9.161 1.00 0.00 C ATOM 1206 CG2 VAL A 82 1.281 -4.704 -7.644 1.00 0.00 C ATOM 0 H VAL A 82 3.338 -4.721 -9.200 1.00 0.00 H new ATOM 0 HA VAL A 82 1.062 -5.040 -11.075 1.00 0.00 H new ATOM 0 HB VAL A 82 -0.259 -4.413 -9.036 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -0.272 -6.819 -8.314 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -0.224 -6.655 -10.085 1.00 0.00 H new ATOM 0 HG13 VAL A 82 1.257 -7.067 -9.189 1.00 0.00 H new ATOM 0 HG21 VAL A 82 0.616 -5.058 -6.856 1.00 0.00 H new ATOM 0 HG22 VAL A 82 2.242 -5.212 -7.563 1.00 0.00 H new ATOM 0 HG23 VAL A 82 1.429 -3.629 -7.538 1.00 0.00 H new ATOM 1216 N VAL A 83 0.267 -2.566 -10.837 1.00 0.00 N ATOM 1217 CA VAL A 83 -0.014 -1.155 -11.000 1.00 0.00 C ATOM 1218 C VAL A 83 -0.618 -0.688 -9.699 1.00 0.00 C ATOM 1219 O VAL A 83 -1.450 -1.393 -9.125 1.00 0.00 O ATOM 1220 CB VAL A 83 -1.046 -0.913 -12.126 1.00 0.00 C ATOM 1221 CG1 VAL A 83 -0.323 -0.842 -13.462 1.00 0.00 C ATOM 1222 CG2 VAL A 83 -2.178 -1.957 -12.236 1.00 0.00 C ATOM 0 H VAL A 83 -0.535 -3.163 -11.037 1.00 0.00 H new ATOM 0 HA VAL A 83 0.901 -0.622 -11.259 1.00 0.00 H new ATOM 0 HB VAL A 83 -1.535 0.025 -11.862 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -1.047 -0.671 -14.259 1.00 0.00 H new ATOM 0 HG12 VAL A 83 0.396 -0.023 -13.444 1.00 0.00 H new ATOM 0 HG13 VAL A 83 0.201 -1.781 -13.643 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -2.842 -1.688 -13.058 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -1.748 -2.941 -12.424 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -2.744 -1.980 -11.305 1.00 0.00 H new ATOM 1232 N GLY A 84 -0.253 0.520 -9.295 1.00 0.00 N ATOM 1233 CA GLY A 84 -1.049 1.312 -8.403 1.00 0.00 C ATOM 1234 C GLY A 84 -0.645 2.770 -8.492 1.00 0.00 C ATOM 1235 O GLY A 84 0.339 3.129 -9.148 1.00 0.00 O ATOM 0 H GLY A 84 0.614 0.971 -9.587 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -2.104 1.204 -8.653 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -0.926 0.955 -7.380 1.00 0.00 H new ATOM 1239 N VAL A 85 -1.408 3.596 -7.790 1.00 0.00 N ATOM 1240 CA VAL A 85 -1.280 5.039 -7.752 1.00 0.00 C ATOM 1241 C VAL A 85 -1.111 5.461 -6.298 1.00 0.00 C ATOM 1242 O VAL A 85 -1.625 4.817 -5.383 1.00 0.00 O ATOM 1243 CB VAL A 85 -2.503 5.679 -8.448 1.00 0.00 C ATOM 1244 CG1 VAL A 85 -2.657 7.193 -8.234 1.00 0.00 C ATOM 1245 CG2 VAL A 85 -2.427 5.421 -9.959 1.00 0.00 C ATOM 0 H VAL A 85 -2.170 3.257 -7.203 1.00 0.00 H new ATOM 0 HA VAL A 85 -0.403 5.387 -8.298 1.00 0.00 H new ATOM 0 HB VAL A 85 -3.370 5.207 -7.985 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -3.543 7.547 -8.761 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -2.761 7.401 -7.169 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -1.776 7.706 -8.620 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -3.290 5.872 -10.449 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -1.512 5.860 -10.358 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -2.425 4.347 -10.145 1.00 0.00 H new ATOM 1255 N GLY A 86 -0.407 6.563 -6.099 1.00 0.00 N ATOM 1256 CA GLY A 86 -0.413 7.313 -4.860 1.00 0.00 C ATOM 1257 C GLY A 86 -0.792 8.744 -5.192 1.00 0.00 C ATOM 1258 O GLY A 86 -0.459 9.233 -6.274 1.00 0.00 O ATOM 0 H GLY A 86 0.198 6.968 -6.813 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -1.124 6.882 -4.155 1.00 0.00 H new ATOM 0 HA3 GLY A 86 0.568 7.277 -4.386 1.00 0.00 H new ATOM 1262 N TYR A 87 -1.514 9.407 -4.296 1.00 0.00 N ATOM 1263 CA TYR A 87 -1.820 10.822 -4.379 1.00 0.00 C ATOM 1264 C TYR A 87 -2.018 11.303 -2.950 1.00 0.00 C ATOM 1265 O TYR A 87 -2.980 10.879 -2.299 1.00 0.00 O ATOM 1266 CB TYR A 87 -3.086 11.001 -5.236 1.00 0.00 C ATOM 1267 CG TYR A 87 -3.830 12.329 -5.170 1.00 0.00 C ATOM 1268 CD1 TYR A 87 -3.190 13.542 -4.851 1.00 0.00 C ATOM 1269 CD2 TYR A 87 -5.196 12.346 -5.497 1.00 0.00 C ATOM 1270 CE1 TYR A 87 -3.896 14.756 -4.865 1.00 0.00 C ATOM 1271 CE2 TYR A 87 -5.907 13.556 -5.538 1.00 0.00 C ATOM 1272 CZ TYR A 87 -5.255 14.769 -5.238 1.00 0.00 C ATOM 1273 OH TYR A 87 -5.929 15.947 -5.343 1.00 0.00 O ATOM 0 H TYR A 87 -1.912 8.959 -3.471 1.00 0.00 H new ATOM 0 HA TYR A 87 -1.027 11.403 -4.850 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -2.809 10.828 -6.276 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -3.788 10.214 -4.958 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -2.142 13.539 -4.592 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -5.704 11.419 -5.719 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -3.400 15.675 -4.591 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -6.955 13.557 -5.800 1.00 0.00 H new ATOM 0 HH TYR A 87 -6.855 15.771 -5.611 1.00 0.00 H new ATOM 1283 N GLY A 88 -1.165 12.210 -2.488 1.00 0.00 N ATOM 1284 CA GLY A 88 -1.317 12.886 -1.213 1.00 0.00 C ATOM 1285 C GLY A 88 -2.040 14.210 -1.434 1.00 0.00 C ATOM 1286 O GLY A 88 -1.431 15.167 -1.923 1.00 0.00 O ATOM 0 H GLY A 88 -0.333 12.499 -3.002 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -1.881 12.261 -0.521 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -0.341 13.061 -0.762 1.00 0.00 H new ATOM 1290 N LYS A 89 -3.338 14.290 -1.115 1.00 0.00 N ATOM 1291 CA LYS A 89 -4.009 15.589 -1.031 1.00 0.00 C ATOM 1292 C LYS A 89 -3.838 16.103 0.392 1.00 0.00 C ATOM 1293 O LYS A 89 -4.561 15.675 1.295 1.00 0.00 O ATOM 1294 CB LYS A 89 -5.486 15.543 -1.475 1.00 0.00 C ATOM 1295 CG LYS A 89 -5.981 16.992 -1.684 1.00 0.00 C ATOM 1296 CD LYS A 89 -7.367 17.118 -2.336 1.00 0.00 C ATOM 1297 CE LYS A 89 -7.580 18.469 -3.049 1.00 0.00 C ATOM 1298 NZ LYS A 89 -7.660 19.622 -2.125 1.00 0.00 N ATOM 0 H LYS A 89 -3.933 13.486 -0.915 1.00 0.00 H new ATOM 0 HA LYS A 89 -3.547 16.281 -1.735 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -5.586 14.972 -2.398 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -6.093 15.041 -0.721 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -6.004 17.495 -0.717 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -5.256 17.522 -2.302 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -7.498 16.310 -3.055 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -8.134 16.992 -1.572 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -6.762 18.633 -3.750 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -8.498 18.420 -3.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -7.803 20.495 -2.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -8.457 19.488 -1.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -6.776 19.694 -1.583 1.00 0.00 H new ATOM 1312 N PHE A 90 -2.883 17.012 0.585 1.00 0.00 N ATOM 1313 CA PHE A 90 -2.661 17.708 1.846 1.00 0.00 C ATOM 1314 C PHE A 90 -2.842 19.212 1.629 1.00 0.00 C ATOM 1315 O PHE A 90 -2.880 19.698 0.493 1.00 0.00 O ATOM 1316 CB PHE A 90 -1.291 17.332 2.435 1.00 0.00 C ATOM 1317 CG PHE A 90 -0.079 17.775 1.632 1.00 0.00 C ATOM 1318 CD1 PHE A 90 0.372 17.001 0.544 1.00 0.00 C ATOM 1319 CD2 PHE A 90 0.640 18.928 2.006 1.00 0.00 C ATOM 1320 CE1 PHE A 90 1.532 17.367 -0.162 1.00 0.00 C ATOM 1321 CE2 PHE A 90 1.803 19.296 1.305 1.00 0.00 C ATOM 1322 CZ PHE A 90 2.253 18.510 0.229 1.00 0.00 C ATOM 0 H PHE A 90 -2.230 17.289 -0.148 1.00 0.00 H new ATOM 0 HA PHE A 90 -3.398 17.398 2.587 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -1.217 17.761 3.434 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -1.251 16.249 2.549 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -0.178 16.119 0.250 1.00 0.00 H new ATOM 0 HD2 PHE A 90 0.297 19.531 2.834 1.00 0.00 H new ATOM 0 HE1 PHE A 90 1.867 16.774 -1.000 1.00 0.00 H new ATOM 0 HE2 PHE A 90 2.350 20.182 1.593 1.00 0.00 H new ATOM 0 HZ PHE A 90 3.154 18.785 -0.299 1.00 0.00 H new ATOM 1332 N GLN A 91 -2.970 19.971 2.712 1.00 0.00 N ATOM 1333 CA GLN A 91 -3.194 21.413 2.708 1.00 0.00 C ATOM 1334 C GLN A 91 -2.283 22.027 3.764 1.00 0.00 C ATOM 1335 O GLN A 91 -1.883 21.326 4.694 1.00 0.00 O ATOM 1336 CB GLN A 91 -4.677 21.675 3.028 1.00 0.00 C ATOM 1337 CG GLN A 91 -5.490 22.089 1.801 1.00 0.00 C ATOM 1338 CD GLN A 91 -6.989 21.825 1.962 1.00 0.00 C ATOM 1339 OE1 GLN A 91 -7.481 21.403 3.009 1.00 0.00 O ATOM 1340 NE2 GLN A 91 -7.752 22.050 0.912 1.00 0.00 N ATOM 0 H GLN A 91 -2.919 19.584 3.654 1.00 0.00 H new ATOM 0 HA GLN A 91 -2.967 21.858 1.739 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -5.114 20.775 3.460 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -4.747 22.457 3.784 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -5.332 23.150 1.608 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -5.123 21.548 0.929 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -7.339 22.400 0.047 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -8.755 21.875 0.964 1.00 0.00 H new ATOM 1349 N THR A 92 -2.000 23.324 3.651 1.00 0.00 N ATOM 1350 CA THR A 92 -1.153 24.058 4.583 1.00 0.00 C ATOM 1351 C THR A 92 -1.858 25.375 4.913 1.00 0.00 C ATOM 1352 O THR A 92 -2.266 26.075 3.983 1.00 0.00 O ATOM 1353 CB THR A 92 0.228 24.298 3.944 1.00 0.00 C ATOM 1354 OG1 THR A 92 0.759 23.122 3.350 1.00 0.00 O ATOM 1355 CG2 THR A 92 1.255 24.833 4.939 1.00 0.00 C ATOM 0 H THR A 92 -2.361 23.903 2.893 1.00 0.00 H new ATOM 0 HA THR A 92 -0.993 23.495 5.503 1.00 0.00 H new ATOM 0 HB THR A 92 0.050 25.049 3.175 1.00 0.00 H new ATOM 0 HG1 THR A 92 1.634 23.321 2.956 1.00 0.00 H new ATOM 0 HG21 THR A 92 2.208 24.983 4.433 1.00 0.00 H new ATOM 0 HG22 THR A 92 0.907 25.782 5.346 1.00 0.00 H new ATOM 0 HG23 THR A 92 1.384 24.116 5.750 1.00 0.00 H new ATOM 1363 N THR A 93 -1.988 25.708 6.199 1.00 0.00 N ATOM 1364 CA THR A 93 -2.643 26.848 6.815 1.00 0.00 C ATOM 1365 C THR A 93 -4.146 26.853 6.539 1.00 0.00 C ATOM 1366 O THR A 93 -4.928 26.719 7.479 1.00 0.00 O ATOM 1367 CB THR A 93 -1.941 28.185 6.493 1.00 0.00 C ATOM 1368 OG1 THR A 93 -0.548 28.055 6.269 1.00 0.00 O ATOM 1369 CG2 THR A 93 -2.133 29.186 7.637 1.00 0.00 C ATOM 0 H THR A 93 -1.584 25.105 6.915 1.00 0.00 H new ATOM 0 HA THR A 93 -2.540 26.737 7.894 1.00 0.00 H new ATOM 0 HB THR A 93 -2.407 28.537 5.572 1.00 0.00 H new ATOM 0 HG1 THR A 93 -0.165 28.935 6.069 1.00 0.00 H new ATOM 0 HG21 THR A 93 -1.631 30.121 7.390 1.00 0.00 H new ATOM 0 HG22 THR A 93 -3.197 29.373 7.782 1.00 0.00 H new ATOM 0 HG23 THR A 93 -1.708 28.777 8.554 1.00 0.00 H new ATOM 1377 N GLU A 94 -4.556 27.072 5.287 1.00 0.00 N ATOM 1378 CA GLU A 94 -5.927 27.288 4.850 1.00 0.00 C ATOM 1379 C GLU A 94 -6.565 28.535 5.475 1.00 0.00 C ATOM 1380 O GLU A 94 -7.691 28.882 5.115 1.00 0.00 O ATOM 1381 CB GLU A 94 -6.784 26.021 5.041 1.00 0.00 C ATOM 1382 CG GLU A 94 -7.862 25.938 3.950 1.00 0.00 C ATOM 1383 CD GLU A 94 -9.101 25.145 4.369 1.00 0.00 C ATOM 1384 OE1 GLU A 94 -9.964 25.711 5.084 1.00 0.00 O ATOM 1385 OE2 GLU A 94 -9.289 24.031 3.830 1.00 0.00 O ATOM 0 H GLU A 94 -3.896 27.104 4.510 1.00 0.00 H new ATOM 0 HA GLU A 94 -5.889 27.491 3.780 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -6.150 25.135 5.003 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -7.253 26.036 6.025 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -8.164 26.948 3.673 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -7.431 25.479 3.060 1.00 0.00 H new ATOM 1392 N TYR A 95 -5.877 29.243 6.371 1.00 0.00 N ATOM 1393 CA TYR A 95 -6.359 30.530 6.863 1.00 0.00 C ATOM 1394 C TYR A 95 -6.279 31.606 5.760 1.00 0.00 C ATOM 1395 O TYR A 95 -7.327 32.132 5.385 1.00 0.00 O ATOM 1396 CB TYR A 95 -5.725 30.910 8.213 1.00 0.00 C ATOM 1397 CG TYR A 95 -6.693 31.613 9.149 1.00 0.00 C ATOM 1398 CD1 TYR A 95 -7.810 30.911 9.641 1.00 0.00 C ATOM 1399 CD2 TYR A 95 -6.490 32.955 9.528 1.00 0.00 C ATOM 1400 CE1 TYR A 95 -8.717 31.535 10.514 1.00 0.00 C ATOM 1401 CE2 TYR A 95 -7.392 33.588 10.403 1.00 0.00 C ATOM 1402 CZ TYR A 95 -8.509 32.876 10.902 1.00 0.00 C ATOM 1403 OH TYR A 95 -9.390 33.472 11.751 1.00 0.00 O ATOM 0 H TYR A 95 -4.986 28.946 6.769 1.00 0.00 H new ATOM 0 HA TYR A 95 -7.420 30.446 7.097 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -5.350 30.009 8.698 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -4.866 31.557 8.035 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -7.971 29.885 9.345 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -5.639 33.499 9.146 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -9.571 30.990 10.887 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -7.232 34.616 10.694 1.00 0.00 H new ATOM 0 HH TYR A 95 -9.107 34.394 11.922 1.00 0.00 H new ATOM 1413 N PRO A 96 -5.103 31.937 5.182 1.00 0.00 N ATOM 1414 CA PRO A 96 -5.042 32.857 4.053 1.00 0.00 C ATOM 1415 C PRO A 96 -5.592 32.210 2.769 1.00 0.00 C ATOM 1416 O PRO A 96 -5.972 31.038 2.720 1.00 0.00 O ATOM 1417 CB PRO A 96 -3.568 33.266 3.941 1.00 0.00 C ATOM 1418 CG PRO A 96 -2.830 32.029 4.436 1.00 0.00 C ATOM 1419 CD PRO A 96 -3.764 31.464 5.509 1.00 0.00 C ATOM 0 HA PRO A 96 -5.671 33.735 4.201 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -3.295 33.515 2.916 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -3.344 34.141 4.552 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -2.662 31.313 3.632 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -1.853 32.282 4.847 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -3.729 30.375 5.519 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -3.465 31.802 6.501 1.00 0.00 H new ATOM 1427 N THR A 97 -5.642 32.994 1.694 1.00 0.00 N ATOM 1428 CA THR A 97 -6.304 32.634 0.442 1.00 0.00 C ATOM 1429 C THR A 97 -5.537 31.603 -0.417 1.00 0.00 C ATOM 1430 O THR A 97 -5.923 31.405 -1.569 1.00 0.00 O ATOM 1431 CB THR A 97 -6.588 33.948 -0.320 1.00 0.00 C ATOM 1432 OG1 THR A 97 -7.473 33.744 -1.394 1.00 0.00 O ATOM 1433 CG2 THR A 97 -5.326 34.651 -0.842 1.00 0.00 C ATOM 0 H THR A 97 -5.213 33.919 1.669 1.00 0.00 H new ATOM 0 HA THR A 97 -7.233 32.113 0.675 1.00 0.00 H new ATOM 0 HB THR A 97 -7.046 34.602 0.422 1.00 0.00 H new ATOM 0 HG1 THR A 97 -7.266 32.892 -1.831 1.00 0.00 H new ATOM 0 HG21 THR A 97 -5.608 35.565 -1.365 1.00 0.00 H new ATOM 0 HG22 THR A 97 -4.675 34.899 -0.004 1.00 0.00 H new ATOM 0 HG23 THR A 97 -4.798 33.989 -1.528 1.00 0.00 H new ATOM 1441 N TYR A 98 -4.451 30.981 0.063 1.00 0.00 N ATOM 1442 CA TYR A 98 -3.477 30.323 -0.815 1.00 0.00 C ATOM 1443 C TYR A 98 -3.257 28.915 -0.286 1.00 0.00 C ATOM 1444 O TYR A 98 -2.756 28.763 0.823 1.00 0.00 O ATOM 1445 CB TYR A 98 -2.183 31.152 -0.870 1.00 0.00 C ATOM 1446 CG TYR A 98 -1.403 31.013 -2.164 1.00 0.00 C ATOM 1447 CD1 TYR A 98 -0.751 29.806 -2.488 1.00 0.00 C ATOM 1448 CD2 TYR A 98 -1.336 32.103 -3.053 1.00 0.00 C ATOM 1449 CE1 TYR A 98 -0.018 29.698 -3.685 1.00 0.00 C ATOM 1450 CE2 TYR A 98 -0.615 31.994 -4.254 1.00 0.00 C ATOM 1451 CZ TYR A 98 0.055 30.794 -4.575 1.00 0.00 C ATOM 1452 OH TYR A 98 0.746 30.704 -5.745 1.00 0.00 O ATOM 0 H TYR A 98 -4.226 30.921 1.056 1.00 0.00 H new ATOM 0 HA TYR A 98 -3.840 30.254 -1.840 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -2.433 32.203 -0.722 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -1.541 30.857 -0.040 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -0.814 28.962 -1.817 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -1.841 33.026 -2.811 1.00 0.00 H new ATOM 0 HE1 TYR A 98 0.490 28.775 -3.924 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -0.573 32.832 -4.934 1.00 0.00 H new ATOM 0 HH TYR A 98 0.684 31.555 -6.228 1.00 0.00 H new ATOM 1462 N LYS A 99 -3.719 27.890 -0.998 1.00 0.00 N ATOM 1463 CA LYS A 99 -3.721 26.517 -0.511 1.00 0.00 C ATOM 1464 C LYS A 99 -3.830 25.564 -1.694 1.00 0.00 C ATOM 1465 O LYS A 99 -4.703 25.746 -2.550 1.00 0.00 O ATOM 1466 CB LYS A 99 -4.838 26.289 0.534 1.00 0.00 C ATOM 1467 CG LYS A 99 -6.293 26.643 0.161 1.00 0.00 C ATOM 1468 CD LYS A 99 -6.644 28.135 0.269 1.00 0.00 C ATOM 1469 CE LYS A 99 -8.110 28.397 -0.089 1.00 0.00 C ATOM 1470 NZ LYS A 99 -9.060 27.934 0.941 1.00 0.00 N ATOM 0 H LYS A 99 -4.105 27.992 -1.937 1.00 0.00 H new ATOM 0 HA LYS A 99 -2.782 26.316 0.005 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -4.817 25.236 0.814 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -4.578 26.861 1.424 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -6.481 26.314 -0.861 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -6.966 26.079 0.807 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -6.449 28.483 1.283 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -5.998 28.710 -0.395 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -8.251 29.466 -0.248 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -8.339 27.902 -1.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -10.032 28.142 0.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -8.952 26.909 1.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -8.867 28.425 1.837 1.00 0.00 H new ATOM 1484 N ASN A 100 -2.970 24.545 -1.715 1.00 0.00 N ATOM 1485 CA ASN A 100 -2.710 23.620 -2.810 1.00 0.00 C ATOM 1486 C ASN A 100 -2.144 24.331 -4.036 1.00 0.00 C ATOM 1487 O ASN A 100 -2.466 25.484 -4.345 1.00 0.00 O ATOM 1488 CB ASN A 100 -3.928 22.752 -3.148 1.00 0.00 C ATOM 1489 CG ASN A 100 -3.516 21.432 -3.775 1.00 0.00 C ATOM 1490 OD1 ASN A 100 -3.339 20.456 -3.061 1.00 0.00 O ATOM 1491 ND2 ASN A 100 -3.374 21.348 -5.080 1.00 0.00 N ATOM 0 H ASN A 100 -2.394 24.332 -0.901 1.00 0.00 H new ATOM 0 HA ASN A 100 -1.938 22.934 -2.461 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -4.503 22.561 -2.242 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -4.582 23.292 -3.832 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -3.113 20.460 -5.508 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -3.525 22.171 -5.663 1.00 0.00 H new ATOM 1498 N ASP A 101 -1.283 23.614 -4.743 1.00 0.00 N ATOM 1499 CA ASP A 101 -0.681 24.042 -6.006 1.00 0.00 C ATOM 1500 C ASP A 101 -0.526 22.853 -6.951 1.00 0.00 C ATOM 1501 O ASP A 101 -0.842 22.942 -8.135 1.00 0.00 O ATOM 1502 CB ASP A 101 0.667 24.725 -5.747 1.00 0.00 C ATOM 1503 CG ASP A 101 1.058 25.617 -6.923 1.00 0.00 C ATOM 1504 OD1 ASP A 101 1.284 25.125 -8.047 1.00 0.00 O ATOM 1505 OD2 ASP A 101 1.131 26.851 -6.742 1.00 0.00 O ATOM 0 H ASP A 101 -0.972 22.689 -4.448 1.00 0.00 H new ATOM 0 HA ASP A 101 -1.340 24.767 -6.484 1.00 0.00 H new ATOM 0 HB2 ASP A 101 0.609 25.321 -4.836 1.00 0.00 H new ATOM 0 HB3 ASP A 101 1.437 23.971 -5.585 1.00 0.00 H new ATOM 1510 N THR A 102 -0.101 21.708 -6.410 1.00 0.00 N ATOM 1511 CA THR A 102 0.099 20.462 -7.133 1.00 0.00 C ATOM 1512 C THR A 102 -0.823 19.404 -6.525 1.00 0.00 C ATOM 1513 O THR A 102 -0.922 19.293 -5.300 1.00 0.00 O ATOM 1514 CB THR A 102 1.585 20.091 -7.029 1.00 0.00 C ATOM 1515 OG1 THR A 102 2.386 21.131 -7.570 1.00 0.00 O ATOM 1516 CG2 THR A 102 1.949 18.790 -7.751 1.00 0.00 C ATOM 0 H THR A 102 0.120 21.627 -5.418 1.00 0.00 H new ATOM 0 HA THR A 102 -0.151 20.546 -8.191 1.00 0.00 H new ATOM 0 HB THR A 102 1.777 19.947 -5.966 1.00 0.00 H new ATOM 0 HG1 THR A 102 3.332 20.886 -7.498 1.00 0.00 H new ATOM 0 HG21 THR A 102 3.015 18.594 -7.633 1.00 0.00 H new ATOM 0 HG22 THR A 102 1.379 17.965 -7.324 1.00 0.00 H new ATOM 0 HG23 THR A 102 1.713 18.884 -8.811 1.00 0.00 H new ATOM 1524 N SER A 103 -1.512 18.640 -7.369 1.00 0.00 N ATOM 1525 CA SER A 103 -1.979 17.313 -6.997 1.00 0.00 C ATOM 1526 C SER A 103 -0.803 16.368 -7.194 1.00 0.00 C ATOM 1527 O SER A 103 -0.208 16.342 -8.273 1.00 0.00 O ATOM 1528 CB SER A 103 -3.172 16.852 -7.843 1.00 0.00 C ATOM 1529 OG SER A 103 -3.362 17.593 -9.043 1.00 0.00 O ATOM 0 H SER A 103 -1.759 18.921 -8.318 1.00 0.00 H new ATOM 0 HA SER A 103 -2.327 17.324 -5.964 1.00 0.00 H new ATOM 0 HB2 SER A 103 -3.037 15.801 -8.097 1.00 0.00 H new ATOM 0 HB3 SER A 103 -4.078 16.921 -7.240 1.00 0.00 H new ATOM 0 HG SER A 103 -4.138 17.240 -9.526 1.00 0.00 H new ATOM 1535 N ASP A 104 -0.459 15.607 -6.160 1.00 0.00 N ATOM 1536 CA ASP A 104 0.479 14.506 -6.313 1.00 0.00 C ATOM 1537 C ASP A 104 -0.156 13.461 -7.225 1.00 0.00 C ATOM 1538 O ASP A 104 -1.378 13.312 -7.254 1.00 0.00 O ATOM 1539 CB ASP A 104 0.815 13.875 -4.953 1.00 0.00 C ATOM 1540 CG ASP A 104 2.023 14.484 -4.252 1.00 0.00 C ATOM 1541 OD1 ASP A 104 2.213 15.720 -4.321 1.00 0.00 O ATOM 1542 OD2 ASP A 104 2.753 13.704 -3.602 1.00 0.00 O ATOM 0 H ASP A 104 -0.815 15.733 -5.212 1.00 0.00 H new ATOM 0 HA ASP A 104 1.407 14.879 -6.745 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -0.053 13.968 -4.300 1.00 0.00 H new ATOM 0 HB3 ASP A 104 0.994 12.809 -5.096 1.00 0.00 H new ATOM 1547 N TYR A 105 0.667 12.705 -7.944 1.00 0.00 N ATOM 1548 CA TYR A 105 0.246 11.510 -8.659 1.00 0.00 C ATOM 1549 C TYR A 105 1.500 10.676 -8.910 1.00 0.00 C ATOM 1550 O TYR A 105 2.375 11.095 -9.671 1.00 0.00 O ATOM 1551 CB TYR A 105 -0.472 11.867 -9.974 1.00 0.00 C ATOM 1552 CG TYR A 105 -1.684 11.004 -10.271 1.00 0.00 C ATOM 1553 CD1 TYR A 105 -1.547 9.796 -10.980 1.00 0.00 C ATOM 1554 CD2 TYR A 105 -2.957 11.410 -9.825 1.00 0.00 C ATOM 1555 CE1 TYR A 105 -2.679 9.012 -11.266 1.00 0.00 C ATOM 1556 CE2 TYR A 105 -4.094 10.640 -10.123 1.00 0.00 C ATOM 1557 CZ TYR A 105 -3.962 9.438 -10.855 1.00 0.00 C ATOM 1558 OH TYR A 105 -5.057 8.678 -11.151 1.00 0.00 O ATOM 0 H TYR A 105 1.661 12.910 -8.047 1.00 0.00 H new ATOM 0 HA TYR A 105 -0.475 10.943 -8.070 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -0.783 12.911 -9.934 1.00 0.00 H new ATOM 0 HB3 TYR A 105 0.236 11.777 -10.798 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -0.570 9.470 -11.305 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -3.060 12.319 -9.250 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -2.567 8.081 -11.802 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -5.069 10.967 -9.793 1.00 0.00 H new ATOM 0 HH TYR A 105 -5.861 9.111 -10.796 1.00 0.00 H new ATOM 1568 N GLY A 106 1.610 9.533 -8.244 1.00 0.00 N ATOM 1569 CA GLY A 106 2.579 8.499 -8.564 1.00 0.00 C ATOM 1570 C GLY A 106 1.891 7.410 -9.380 1.00 0.00 C ATOM 1571 O GLY A 106 0.680 7.214 -9.254 1.00 0.00 O ATOM 0 H GLY A 106 1.014 9.297 -7.450 1.00 0.00 H new ATOM 0 HA2 GLY A 106 3.410 8.923 -9.127 1.00 0.00 H new ATOM 0 HA3 GLY A 106 2.996 8.078 -7.649 1.00 0.00 H new ATOM 1575 N PHE A 107 2.643 6.701 -10.216 1.00 0.00 N ATOM 1576 CA PHE A 107 2.193 5.566 -11.012 1.00 0.00 C ATOM 1577 C PHE A 107 3.289 4.500 -10.959 1.00 0.00 C ATOM 1578 O PHE A 107 4.240 4.568 -11.741 1.00 0.00 O ATOM 1579 CB PHE A 107 1.863 6.023 -12.447 1.00 0.00 C ATOM 1580 CG PHE A 107 1.180 4.974 -13.312 1.00 0.00 C ATOM 1581 CD1 PHE A 107 1.925 3.943 -13.921 1.00 0.00 C ATOM 1582 CD2 PHE A 107 -0.213 5.029 -13.516 1.00 0.00 C ATOM 1583 CE1 PHE A 107 1.283 2.967 -14.703 1.00 0.00 C ATOM 1584 CE2 PHE A 107 -0.853 4.061 -14.310 1.00 0.00 C ATOM 1585 CZ PHE A 107 -0.108 3.025 -14.897 1.00 0.00 C ATOM 0 H PHE A 107 3.630 6.913 -10.363 1.00 0.00 H new ATOM 0 HA PHE A 107 1.273 5.137 -10.615 1.00 0.00 H new ATOM 0 HB2 PHE A 107 1.222 6.903 -12.394 1.00 0.00 H new ATOM 0 HB3 PHE A 107 2.787 6.331 -12.936 1.00 0.00 H new ATOM 0 HD1 PHE A 107 2.996 3.903 -13.786 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -0.792 5.819 -13.060 1.00 0.00 H new ATOM 0 HE1 PHE A 107 1.859 2.173 -15.155 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -1.920 4.114 -14.469 1.00 0.00 H new ATOM 0 HZ PHE A 107 -0.603 2.275 -15.496 1.00 0.00 H new ATOM 1595 N SER A 108 3.194 3.557 -10.026 1.00 0.00 N ATOM 1596 CA SER A 108 3.980 2.326 -9.956 1.00 0.00 C ATOM 1597 C SER A 108 3.349 1.462 -8.866 1.00 0.00 C ATOM 1598 O SER A 108 2.661 0.491 -9.175 1.00 0.00 O ATOM 1599 CB SER A 108 5.472 2.567 -9.642 1.00 0.00 C ATOM 1600 OG SER A 108 6.267 2.847 -10.782 1.00 0.00 O ATOM 0 H SER A 108 2.530 3.634 -9.255 1.00 0.00 H new ATOM 0 HA SER A 108 3.962 1.841 -10.932 1.00 0.00 H new ATOM 0 HB2 SER A 108 5.555 3.398 -8.942 1.00 0.00 H new ATOM 0 HB3 SER A 108 5.873 1.686 -9.140 1.00 0.00 H new ATOM 0 HG SER A 108 5.785 3.462 -11.374 1.00 0.00 H new ATOM 1606 N TYR A 109 3.548 1.841 -7.601 1.00 0.00 N ATOM 1607 CA TYR A 109 3.125 1.169 -6.381 1.00 0.00 C ATOM 1608 C TYR A 109 3.769 -0.208 -6.196 1.00 0.00 C ATOM 1609 O TYR A 109 4.481 -0.397 -5.212 1.00 0.00 O ATOM 1610 CB TYR A 109 1.601 1.173 -6.244 1.00 0.00 C ATOM 1611 CG TYR A 109 1.123 1.135 -4.808 1.00 0.00 C ATOM 1612 CD1 TYR A 109 0.973 -0.093 -4.140 1.00 0.00 C ATOM 1613 CD2 TYR A 109 0.853 2.339 -4.128 1.00 0.00 C ATOM 1614 CE1 TYR A 109 0.543 -0.125 -2.802 1.00 0.00 C ATOM 1615 CE2 TYR A 109 0.420 2.317 -2.792 1.00 0.00 C ATOM 1616 CZ TYR A 109 0.276 1.082 -2.120 1.00 0.00 C ATOM 1617 OH TYR A 109 -0.066 1.045 -0.804 1.00 0.00 O ATOM 0 H TYR A 109 4.054 2.702 -7.392 1.00 0.00 H new ATOM 0 HA TYR A 109 3.506 1.751 -5.542 1.00 0.00 H new ATOM 0 HB2 TYR A 109 1.203 2.065 -6.727 1.00 0.00 H new ATOM 0 HB3 TYR A 109 1.194 0.314 -6.777 1.00 0.00 H new ATOM 0 HD1 TYR A 109 1.189 -1.016 -4.657 1.00 0.00 H new ATOM 0 HD2 TYR A 109 0.980 3.283 -4.636 1.00 0.00 H new ATOM 0 HE1 TYR A 109 0.417 -1.071 -2.297 1.00 0.00 H new ATOM 0 HE2 TYR A 109 0.198 3.241 -2.280 1.00 0.00 H new ATOM 0 HH TYR A 109 -0.217 1.957 -0.479 1.00 0.00 H new ATOM 1627 N GLY A 110 3.590 -1.175 -7.104 1.00 0.00 N ATOM 1628 CA GLY A 110 4.232 -2.471 -6.964 1.00 0.00 C ATOM 1629 C GLY A 110 3.792 -3.171 -5.676 1.00 0.00 C ATOM 1630 O GLY A 110 2.617 -3.122 -5.296 1.00 0.00 O ATOM 0 H GLY A 110 3.008 -1.078 -7.936 1.00 0.00 H new ATOM 0 HA2 GLY A 110 3.986 -3.096 -7.823 1.00 0.00 H new ATOM 0 HA3 GLY A 110 5.315 -2.345 -6.961 1.00 0.00 H new ATOM 1634 N ALA A 111 4.714 -3.904 -5.054 1.00 0.00 N ATOM 1635 CA ALA A 111 4.454 -4.755 -3.914 1.00 0.00 C ATOM 1636 C ALA A 111 5.776 -4.986 -3.198 1.00 0.00 C ATOM 1637 O ALA A 111 6.112 -4.214 -2.302 1.00 0.00 O ATOM 1638 CB ALA A 111 3.773 -6.062 -4.351 1.00 0.00 C ATOM 0 H ALA A 111 5.691 -3.916 -5.346 1.00 0.00 H new ATOM 0 HA ALA A 111 3.758 -4.280 -3.223 1.00 0.00 H new ATOM 0 HB1 ALA A 111 3.588 -6.686 -3.477 1.00 0.00 H new ATOM 0 HB2 ALA A 111 2.827 -5.833 -4.841 1.00 0.00 H new ATOM 0 HB3 ALA A 111 4.421 -6.595 -5.046 1.00 0.00 H new ATOM 1644 N GLY A 112 6.527 -6.016 -3.581 1.00 0.00 N ATOM 1645 CA GLY A 112 7.508 -6.623 -2.712 1.00 0.00 C ATOM 1646 C GLY A 112 7.427 -8.130 -2.900 1.00 0.00 C ATOM 1647 O GLY A 112 6.821 -8.628 -3.858 1.00 0.00 O ATOM 0 H GLY A 112 6.466 -6.446 -4.504 1.00 0.00 H new ATOM 0 HA2 GLY A 112 8.508 -6.261 -2.953 1.00 0.00 H new ATOM 0 HA3 GLY A 112 7.315 -6.357 -1.673 1.00 0.00 H new ATOM 1651 N LEU A 113 8.103 -8.858 -2.022 1.00 0.00 N ATOM 1652 CA LEU A 113 8.382 -10.280 -2.157 1.00 0.00 C ATOM 1653 C LEU A 113 7.770 -10.984 -0.948 1.00 0.00 C ATOM 1654 O LEU A 113 7.713 -10.376 0.127 1.00 0.00 O ATOM 1655 CB LEU A 113 9.911 -10.485 -2.205 1.00 0.00 C ATOM 1656 CG LEU A 113 10.681 -9.949 -3.436 1.00 0.00 C ATOM 1657 CD1 LEU A 113 10.111 -10.492 -4.734 1.00 0.00 C ATOM 1658 CD2 LEU A 113 10.724 -8.427 -3.632 1.00 0.00 C ATOM 0 H LEU A 113 8.486 -8.459 -1.165 1.00 0.00 H new ATOM 0 HA LEU A 113 7.955 -10.691 -3.072 1.00 0.00 H new ATOM 0 HB2 LEU A 113 10.338 -10.020 -1.316 1.00 0.00 H new ATOM 0 HB3 LEU A 113 10.106 -11.555 -2.130 1.00 0.00 H new ATOM 0 HG LEU A 113 11.691 -10.293 -3.212 1.00 0.00 H new ATOM 0 HD11 LEU A 113 10.678 -10.093 -5.575 1.00 0.00 H new ATOM 0 HD12 LEU A 113 10.179 -11.580 -4.734 1.00 0.00 H new ATOM 0 HD13 LEU A 113 9.067 -10.193 -4.826 1.00 0.00 H new ATOM 0 HD21 LEU A 113 11.295 -8.192 -4.530 1.00 0.00 H new ATOM 0 HD22 LEU A 113 9.709 -8.045 -3.737 1.00 0.00 H new ATOM 0 HD23 LEU A 113 11.199 -7.962 -2.768 1.00 0.00 H new ATOM 1670 N GLN A 114 7.390 -12.261 -1.071 1.00 0.00 N ATOM 1671 CA GLN A 114 6.655 -12.952 -0.003 1.00 0.00 C ATOM 1672 C GLN A 114 7.600 -13.897 0.718 1.00 0.00 C ATOM 1673 O GLN A 114 8.420 -14.553 0.072 1.00 0.00 O ATOM 1674 CB GLN A 114 5.378 -13.643 -0.533 1.00 0.00 C ATOM 1675 CG GLN A 114 5.505 -15.071 -1.104 1.00 0.00 C ATOM 1676 CD GLN A 114 5.343 -16.157 -0.036 1.00 0.00 C ATOM 1677 OE1 GLN A 114 4.230 -16.452 0.380 1.00 0.00 O ATOM 1678 NE2 GLN A 114 6.407 -16.800 0.417 1.00 0.00 N ATOM 0 H GLN A 114 7.577 -12.835 -1.893 1.00 0.00 H new ATOM 0 HA GLN A 114 6.294 -12.222 0.722 1.00 0.00 H new ATOM 0 HB2 GLN A 114 4.654 -13.673 0.281 1.00 0.00 H new ATOM 0 HB3 GLN A 114 4.956 -13.009 -1.313 1.00 0.00 H new ATOM 0 HG2 GLN A 114 4.752 -15.215 -1.879 1.00 0.00 H new ATOM 0 HG3 GLN A 114 6.479 -15.181 -1.582 1.00 0.00 H new ATOM 0 HE21 GLN A 114 7.335 -16.556 0.072 1.00 0.00 H new ATOM 0 HE22 GLN A 114 6.299 -17.540 1.111 1.00 0.00 H new ATOM 1687 N PHE A 115 7.552 -13.925 2.043 1.00 0.00 N ATOM 1688 CA PHE A 115 8.459 -14.709 2.862 1.00 0.00 C ATOM 1689 C PHE A 115 7.683 -15.344 4.005 1.00 0.00 C ATOM 1690 O PHE A 115 7.240 -14.653 4.923 1.00 0.00 O ATOM 1691 CB PHE A 115 9.617 -13.821 3.322 1.00 0.00 C ATOM 1692 CG PHE A 115 10.935 -14.301 2.769 1.00 0.00 C ATOM 1693 CD1 PHE A 115 11.337 -13.962 1.464 1.00 0.00 C ATOM 1694 CD2 PHE A 115 11.709 -15.179 3.538 1.00 0.00 C ATOM 1695 CE1 PHE A 115 12.512 -14.517 0.930 1.00 0.00 C ATOM 1696 CE2 PHE A 115 12.887 -15.723 3.011 1.00 0.00 C ATOM 1697 CZ PHE A 115 13.284 -15.402 1.703 1.00 0.00 C ATOM 0 H PHE A 115 6.870 -13.394 2.585 1.00 0.00 H new ATOM 0 HA PHE A 115 8.900 -15.528 2.293 1.00 0.00 H new ATOM 0 HB2 PHE A 115 9.439 -12.794 3.002 1.00 0.00 H new ATOM 0 HB3 PHE A 115 9.660 -13.812 4.411 1.00 0.00 H new ATOM 0 HD1 PHE A 115 10.744 -13.278 0.875 1.00 0.00 H new ATOM 0 HD2 PHE A 115 11.397 -15.437 4.539 1.00 0.00 H new ATOM 0 HE1 PHE A 115 12.822 -14.264 -0.073 1.00 0.00 H new ATOM 0 HE2 PHE A 115 13.490 -16.389 3.610 1.00 0.00 H new ATOM 0 HZ PHE A 115 14.183 -15.835 1.290 1.00 0.00 H new ATOM 1707 N ASN A 116 7.475 -16.652 3.948 1.00 0.00 N ATOM 1708 CA ASN A 116 6.595 -17.331 4.884 1.00 0.00 C ATOM 1709 C ASN A 116 7.331 -18.562 5.433 1.00 0.00 C ATOM 1710 O ASN A 116 7.623 -19.493 4.676 1.00 0.00 O ATOM 1711 CB ASN A 116 5.229 -17.580 4.217 1.00 0.00 C ATOM 1712 CG ASN A 116 5.137 -18.867 3.415 1.00 0.00 C ATOM 1713 OD1 ASN A 116 5.703 -18.982 2.328 1.00 0.00 O ATOM 1714 ND2 ASN A 116 4.447 -19.854 3.947 1.00 0.00 N ATOM 0 H ASN A 116 7.908 -17.266 3.258 1.00 0.00 H new ATOM 0 HA ASN A 116 6.354 -16.728 5.759 1.00 0.00 H new ATOM 0 HB2 ASN A 116 4.460 -17.594 4.990 1.00 0.00 H new ATOM 0 HB3 ASN A 116 5.004 -16.741 3.559 1.00 0.00 H new ATOM 0 HD21 ASN A 116 4.370 -20.745 3.456 1.00 0.00 H new ATOM 0 HD22 ASN A 116 3.989 -19.728 4.850 1.00 0.00 H new ATOM 1721 N PRO A 117 7.780 -18.555 6.704 1.00 0.00 N ATOM 1722 CA PRO A 117 8.340 -19.730 7.365 1.00 0.00 C ATOM 1723 C PRO A 117 7.246 -20.683 7.879 1.00 0.00 C ATOM 1724 O PRO A 117 7.568 -21.766 8.374 1.00 0.00 O ATOM 1725 CB PRO A 117 9.217 -19.181 8.491 1.00 0.00 C ATOM 1726 CG PRO A 117 8.471 -17.920 8.903 1.00 0.00 C ATOM 1727 CD PRO A 117 7.901 -17.399 7.583 1.00 0.00 C ATOM 0 HA PRO A 117 8.923 -20.339 6.674 1.00 0.00 H new ATOM 0 HB2 PRO A 117 9.307 -19.887 9.316 1.00 0.00 H new ATOM 0 HB3 PRO A 117 10.228 -18.961 8.148 1.00 0.00 H new ATOM 0 HG2 PRO A 117 7.682 -18.137 9.624 1.00 0.00 H new ATOM 0 HG3 PRO A 117 9.137 -17.193 9.368 1.00 0.00 H new ATOM 0 HD2 PRO A 117 6.931 -16.926 7.738 1.00 0.00 H new ATOM 0 HD3 PRO A 117 8.557 -16.646 7.147 1.00 0.00 H new ATOM 1735 N MET A 118 5.968 -20.299 7.807 1.00 0.00 N ATOM 1736 CA MET A 118 4.794 -21.163 7.851 1.00 0.00 C ATOM 1737 C MET A 118 3.675 -20.332 7.213 1.00 0.00 C ATOM 1738 O MET A 118 3.915 -19.204 6.785 1.00 0.00 O ATOM 1739 CB MET A 118 4.459 -21.549 9.306 1.00 0.00 C ATOM 1740 CG MET A 118 3.613 -22.819 9.468 1.00 0.00 C ATOM 1741 SD MET A 118 4.525 -24.389 9.540 1.00 0.00 S ATOM 1742 CE MET A 118 4.675 -24.820 7.784 1.00 0.00 C ATOM 0 H MET A 118 5.715 -19.316 7.711 1.00 0.00 H new ATOM 0 HA MET A 118 4.945 -22.104 7.322 1.00 0.00 H new ATOM 0 HB2 MET A 118 5.392 -21.681 9.854 1.00 0.00 H new ATOM 0 HB3 MET A 118 3.930 -20.718 9.773 1.00 0.00 H new ATOM 0 HG2 MET A 118 3.023 -22.724 10.380 1.00 0.00 H new ATOM 0 HG3 MET A 118 2.909 -22.870 8.637 1.00 0.00 H new ATOM 0 HE1 MET A 118 4.737 -25.903 7.679 1.00 0.00 H new ATOM 0 HE2 MET A 118 3.803 -24.453 7.243 1.00 0.00 H new ATOM 0 HE3 MET A 118 5.575 -24.363 7.373 1.00 0.00 H new ATOM 1752 N GLU A 119 2.447 -20.830 7.146 1.00 0.00 N ATOM 1753 CA GLU A 119 1.290 -19.956 6.962 1.00 0.00 C ATOM 1754 C GLU A 119 0.963 -19.285 8.304 1.00 0.00 C ATOM 1755 O GLU A 119 0.553 -18.127 8.343 1.00 0.00 O ATOM 1756 CB GLU A 119 0.083 -20.740 6.436 1.00 0.00 C ATOM 1757 CG GLU A 119 0.359 -21.526 5.150 1.00 0.00 C ATOM 1758 CD GLU A 119 0.772 -22.968 5.447 1.00 0.00 C ATOM 1759 OE1 GLU A 119 -0.140 -23.819 5.582 1.00 0.00 O ATOM 1760 OE2 GLU A 119 1.982 -23.242 5.623 1.00 0.00 O ATOM 0 H GLU A 119 2.225 -21.823 7.215 1.00 0.00 H new ATOM 0 HA GLU A 119 1.527 -19.195 6.219 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -0.251 -21.433 7.208 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -0.737 -20.045 6.255 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -0.533 -21.524 4.524 1.00 0.00 H new ATOM 0 HG3 GLU A 119 1.147 -21.031 4.583 1.00 0.00 H new ATOM 1767 N ASN A 120 1.201 -19.999 9.417 1.00 0.00 N ATOM 1768 CA ASN A 120 0.937 -19.548 10.782 1.00 0.00 C ATOM 1769 C ASN A 120 1.605 -18.211 11.098 1.00 0.00 C ATOM 1770 O ASN A 120 1.109 -17.496 11.965 1.00 0.00 O ATOM 1771 CB ASN A 120 1.386 -20.597 11.819 1.00 0.00 C ATOM 1772 CG ASN A 120 0.539 -20.603 13.091 1.00 0.00 C ATOM 1773 OD1 ASN A 120 0.069 -21.652 13.518 1.00 0.00 O ATOM 1774 ND2 ASN A 120 0.296 -19.470 13.731 1.00 0.00 N ATOM 0 H ASN A 120 1.597 -20.939 9.383 1.00 0.00 H new ATOM 0 HA ASN A 120 -0.143 -19.413 10.847 1.00 0.00 H new ATOM 0 HB2 ASN A 120 1.348 -21.586 11.363 1.00 0.00 H new ATOM 0 HB3 ASN A 120 2.426 -20.409 12.086 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -0.279 -19.473 14.574 1.00 0.00 H new ATOM 0 HD22 ASN A 120 0.684 -18.594 13.382 1.00 0.00 H new ATOM 1781 N VAL A 121 2.706 -17.865 10.426 1.00 0.00 N ATOM 1782 CA VAL A 121 3.268 -16.524 10.432 1.00 0.00 C ATOM 1783 C VAL A 121 3.659 -16.229 8.975 1.00 0.00 C ATOM 1784 O VAL A 121 4.568 -16.856 8.435 1.00 0.00 O ATOM 1785 CB VAL A 121 4.413 -16.388 11.477 1.00 0.00 C ATOM 1786 CG1 VAL A 121 4.004 -16.862 12.885 1.00 0.00 C ATOM 1787 CG2 VAL A 121 5.700 -17.141 11.114 1.00 0.00 C ATOM 0 H VAL A 121 3.236 -18.524 9.855 1.00 0.00 H new ATOM 0 HA VAL A 121 2.557 -15.767 10.762 1.00 0.00 H new ATOM 0 HB VAL A 121 4.610 -15.316 11.470 1.00 0.00 H new ATOM 0 HG11 VAL A 121 4.845 -16.742 13.568 1.00 0.00 H new ATOM 0 HG12 VAL A 121 3.162 -16.267 13.239 1.00 0.00 H new ATOM 0 HG13 VAL A 121 3.716 -17.912 12.846 1.00 0.00 H new ATOM 0 HG21 VAL A 121 6.443 -16.991 11.897 1.00 0.00 H new ATOM 0 HG22 VAL A 121 5.484 -18.205 11.018 1.00 0.00 H new ATOM 0 HG23 VAL A 121 6.088 -16.763 10.168 1.00 0.00 H new ATOM 1797 N ALA A 122 2.950 -15.312 8.316 1.00 0.00 N ATOM 1798 CA ALA A 122 3.171 -14.954 6.915 1.00 0.00 C ATOM 1799 C ALA A 122 3.512 -13.464 6.839 1.00 0.00 C ATOM 1800 O ALA A 122 2.778 -12.625 7.375 1.00 0.00 O ATOM 1801 CB ALA A 122 1.924 -15.304 6.097 1.00 0.00 C ATOM 0 H ALA A 122 2.191 -14.787 8.750 1.00 0.00 H new ATOM 0 HA ALA A 122 4.005 -15.516 6.495 1.00 0.00 H new ATOM 0 HB1 ALA A 122 2.087 -15.038 5.053 1.00 0.00 H new ATOM 0 HB2 ALA A 122 1.728 -16.374 6.172 1.00 0.00 H new ATOM 0 HB3 ALA A 122 1.068 -14.750 6.483 1.00 0.00 H new ATOM 1807 N LEU A 123 4.656 -13.120 6.244 1.00 0.00 N ATOM 1808 CA LEU A 123 5.199 -11.770 6.272 1.00 0.00 C ATOM 1809 C LEU A 123 5.726 -11.353 4.910 1.00 0.00 C ATOM 1810 O LEU A 123 6.482 -12.095 4.286 1.00 0.00 O ATOM 1811 CB LEU A 123 6.252 -11.590 7.385 1.00 0.00 C ATOM 1812 CG LEU A 123 7.449 -12.567 7.446 1.00 0.00 C ATOM 1813 CD1 LEU A 123 8.588 -11.926 8.244 1.00 0.00 C ATOM 1814 CD2 LEU A 123 7.107 -13.898 8.140 1.00 0.00 C ATOM 0 H LEU A 123 5.234 -13.781 5.725 1.00 0.00 H new ATOM 0 HA LEU A 123 4.376 -11.098 6.516 1.00 0.00 H new ATOM 0 HB2 LEU A 123 6.654 -10.581 7.298 1.00 0.00 H new ATOM 0 HB3 LEU A 123 5.733 -11.645 8.342 1.00 0.00 H new ATOM 0 HG LEU A 123 7.729 -12.773 6.413 1.00 0.00 H new ATOM 0 HD11 LEU A 123 9.433 -12.613 8.288 1.00 0.00 H new ATOM 0 HD12 LEU A 123 8.898 -11.001 7.757 1.00 0.00 H new ATOM 0 HD13 LEU A 123 8.245 -11.707 9.255 1.00 0.00 H new ATOM 0 HD21 LEU A 123 7.988 -14.540 8.151 1.00 0.00 H new ATOM 0 HD22 LEU A 123 6.788 -13.703 9.164 1.00 0.00 H new ATOM 0 HD23 LEU A 123 6.303 -14.395 7.598 1.00 0.00 H new ATOM 1826 N ASP A 124 5.395 -10.139 4.476 1.00 0.00 N ATOM 1827 CA ASP A 124 6.001 -9.548 3.289 1.00 0.00 C ATOM 1828 C ASP A 124 6.617 -8.227 3.722 1.00 0.00 C ATOM 1829 O ASP A 124 5.996 -7.435 4.440 1.00 0.00 O ATOM 1830 CB ASP A 124 5.027 -9.246 2.136 1.00 0.00 C ATOM 1831 CG ASP A 124 4.126 -10.364 1.615 1.00 0.00 C ATOM 1832 OD1 ASP A 124 4.387 -11.558 1.844 1.00 0.00 O ATOM 1833 OD2 ASP A 124 3.169 -9.997 0.886 1.00 0.00 O ATOM 0 H ASP A 124 4.705 -9.543 4.934 1.00 0.00 H new ATOM 0 HA ASP A 124 6.712 -10.277 2.902 1.00 0.00 H new ATOM 0 HB2 ASP A 124 4.383 -8.427 2.455 1.00 0.00 H new ATOM 0 HB3 ASP A 124 5.616 -8.879 1.295 1.00 0.00 H new ATOM 1838 N PHE A 125 7.804 -7.952 3.197 1.00 0.00 N ATOM 1839 CA PHE A 125 8.441 -6.651 3.208 1.00 0.00 C ATOM 1840 C PHE A 125 8.146 -6.067 1.835 1.00 0.00 C ATOM 1841 O PHE A 125 8.244 -6.782 0.829 1.00 0.00 O ATOM 1842 CB PHE A 125 9.959 -6.805 3.375 1.00 0.00 C ATOM 1843 CG PHE A 125 10.469 -7.411 4.674 1.00 0.00 C ATOM 1844 CD1 PHE A 125 9.774 -7.251 5.890 1.00 0.00 C ATOM 1845 CD2 PHE A 125 11.677 -8.132 4.666 1.00 0.00 C ATOM 1846 CE1 PHE A 125 10.269 -7.831 7.072 1.00 0.00 C ATOM 1847 CE2 PHE A 125 12.156 -8.733 5.841 1.00 0.00 C ATOM 1848 CZ PHE A 125 11.445 -8.598 7.044 1.00 0.00 C ATOM 0 H PHE A 125 8.369 -8.663 2.733 1.00 0.00 H new ATOM 0 HA PHE A 125 8.079 -6.025 4.024 1.00 0.00 H new ATOM 0 HB2 PHE A 125 10.327 -7.418 2.552 1.00 0.00 H new ATOM 0 HB3 PHE A 125 10.410 -5.819 3.265 1.00 0.00 H new ATOM 0 HD1 PHE A 125 8.857 -6.680 5.914 1.00 0.00 H new ATOM 0 HD2 PHE A 125 12.240 -8.224 3.749 1.00 0.00 H new ATOM 0 HE1 PHE A 125 9.743 -7.686 8.004 1.00 0.00 H new ATOM 0 HE2 PHE A 125 13.074 -9.301 5.819 1.00 0.00 H new ATOM 0 HZ PHE A 125 11.800 -9.081 7.942 1.00 0.00 H new ATOM 1858 N SER A 126 7.746 -4.803 1.798 1.00 0.00 N ATOM 1859 CA SER A 126 7.087 -4.194 0.663 1.00 0.00 C ATOM 1860 C SER A 126 7.592 -2.751 0.524 1.00 0.00 C ATOM 1861 O SER A 126 7.998 -2.131 1.516 1.00 0.00 O ATOM 1862 CB SER A 126 5.578 -4.381 0.912 1.00 0.00 C ATOM 1863 OG SER A 126 4.722 -3.878 -0.093 1.00 0.00 O ATOM 0 H SER A 126 7.877 -4.161 2.580 1.00 0.00 H new ATOM 0 HA SER A 126 7.308 -4.644 -0.305 1.00 0.00 H new ATOM 0 HB2 SER A 126 5.378 -5.446 1.034 1.00 0.00 H new ATOM 0 HB3 SER A 126 5.322 -3.899 1.856 1.00 0.00 H new ATOM 0 HG SER A 126 5.226 -3.765 -0.926 1.00 0.00 H new ATOM 1869 N TYR A 127 7.643 -2.269 -0.722 1.00 0.00 N ATOM 1870 CA TYR A 127 8.220 -0.987 -1.102 1.00 0.00 C ATOM 1871 C TYR A 127 7.386 -0.424 -2.250 1.00 0.00 C ATOM 1872 O TYR A 127 6.884 -1.187 -3.086 1.00 0.00 O ATOM 1873 CB TYR A 127 9.686 -1.199 -1.543 1.00 0.00 C ATOM 1874 CG TYR A 127 10.443 0.049 -1.983 1.00 0.00 C ATOM 1875 CD1 TYR A 127 10.529 1.151 -1.117 1.00 0.00 C ATOM 1876 CD2 TYR A 127 11.103 0.108 -3.226 1.00 0.00 C ATOM 1877 CE1 TYR A 127 11.224 2.316 -1.486 1.00 0.00 C ATOM 1878 CE2 TYR A 127 11.806 1.268 -3.609 1.00 0.00 C ATOM 1879 CZ TYR A 127 11.862 2.386 -2.744 1.00 0.00 C ATOM 1880 OH TYR A 127 12.537 3.515 -3.110 1.00 0.00 O ATOM 0 H TYR A 127 7.268 -2.784 -1.519 1.00 0.00 H new ATOM 0 HA TYR A 127 8.214 -0.288 -0.266 1.00 0.00 H new ATOM 0 HB2 TYR A 127 10.230 -1.656 -0.716 1.00 0.00 H new ATOM 0 HB3 TYR A 127 9.696 -1.914 -2.366 1.00 0.00 H new ATOM 0 HD1 TYR A 127 10.052 1.103 -0.149 1.00 0.00 H new ATOM 0 HD2 TYR A 127 11.070 -0.742 -3.891 1.00 0.00 H new ATOM 0 HE1 TYR A 127 11.270 3.156 -0.809 1.00 0.00 H new ATOM 0 HE2 TYR A 127 12.304 1.303 -4.567 1.00 0.00 H new ATOM 0 HH TYR A 127 12.917 3.393 -4.005 1.00 0.00 H new ATOM 1890 N GLU A 128 7.291 0.897 -2.345 1.00 0.00 N ATOM 1891 CA GLU A 128 6.802 1.638 -3.500 1.00 0.00 C ATOM 1892 C GLU A 128 7.755 2.816 -3.701 1.00 0.00 C ATOM 1893 O GLU A 128 8.323 3.314 -2.727 1.00 0.00 O ATOM 1894 CB GLU A 128 5.337 2.086 -3.337 1.00 0.00 C ATOM 1895 CG GLU A 128 5.057 2.860 -2.044 1.00 0.00 C ATOM 1896 CD GLU A 128 3.735 3.620 -2.089 1.00 0.00 C ATOM 1897 OE1 GLU A 128 3.597 4.532 -2.933 1.00 0.00 O ATOM 1898 OE2 GLU A 128 2.842 3.308 -1.266 1.00 0.00 O ATOM 0 H GLU A 128 7.567 1.511 -1.579 1.00 0.00 H new ATOM 0 HA GLU A 128 6.793 1.001 -4.384 1.00 0.00 H new ATOM 0 HB2 GLU A 128 5.063 2.710 -4.187 1.00 0.00 H new ATOM 0 HB3 GLU A 128 4.694 1.206 -3.367 1.00 0.00 H new ATOM 0 HG2 GLU A 128 5.044 2.165 -1.205 1.00 0.00 H new ATOM 0 HG3 GLU A 128 5.870 3.563 -1.863 1.00 0.00 H new ATOM 1905 N GLN A 129 7.963 3.219 -4.958 1.00 0.00 N ATOM 1906 CA GLN A 129 8.772 4.373 -5.327 1.00 0.00 C ATOM 1907 C GLN A 129 7.993 5.202 -6.346 1.00 0.00 C ATOM 1908 O GLN A 129 7.771 4.725 -7.469 1.00 0.00 O ATOM 1909 CB GLN A 129 10.107 3.876 -5.885 1.00 0.00 C ATOM 1910 CG GLN A 129 11.122 4.992 -6.173 1.00 0.00 C ATOM 1911 CD GLN A 129 12.265 4.503 -7.069 1.00 0.00 C ATOM 1912 OE1 GLN A 129 12.233 3.412 -7.634 1.00 0.00 O ATOM 1913 NE2 GLN A 129 13.280 5.323 -7.277 1.00 0.00 N ATOM 0 H GLN A 129 7.562 2.737 -5.763 1.00 0.00 H new ATOM 0 HA GLN A 129 8.985 5.007 -4.467 1.00 0.00 H new ATOM 0 HB2 GLN A 129 10.546 3.175 -5.176 1.00 0.00 H new ATOM 0 HB3 GLN A 129 9.920 3.323 -6.806 1.00 0.00 H new ATOM 0 HG2 GLN A 129 10.616 5.829 -6.654 1.00 0.00 H new ATOM 0 HG3 GLN A 129 11.530 5.364 -5.233 1.00 0.00 H new ATOM 0 HE21 GLN A 129 13.308 6.229 -6.809 1.00 0.00 H new ATOM 0 HE22 GLN A 129 14.035 5.050 -7.906 1.00 0.00 H new ATOM 1922 N SER A 130 7.581 6.411 -5.991 1.00 0.00 N ATOM 1923 CA SER A 130 6.895 7.360 -6.854 1.00 0.00 C ATOM 1924 C SER A 130 7.818 8.536 -7.151 1.00 0.00 C ATOM 1925 O SER A 130 8.806 8.790 -6.452 1.00 0.00 O ATOM 1926 CB SER A 130 5.603 7.845 -6.194 1.00 0.00 C ATOM 1927 OG SER A 130 4.593 6.862 -6.210 1.00 0.00 O ATOM 0 H SER A 130 7.723 6.773 -5.048 1.00 0.00 H new ATOM 0 HA SER A 130 6.633 6.868 -7.790 1.00 0.00 H new ATOM 0 HB2 SER A 130 5.810 8.133 -5.163 1.00 0.00 H new ATOM 0 HB3 SER A 130 5.247 8.737 -6.709 1.00 0.00 H new ATOM 0 HG SER A 130 3.787 7.214 -5.777 1.00 0.00 H new ATOM 1933 N ARG A 131 7.500 9.241 -8.232 1.00 0.00 N ATOM 1934 CA ARG A 131 8.305 10.308 -8.805 1.00 0.00 C ATOM 1935 C ARG A 131 7.333 11.393 -9.241 1.00 0.00 C ATOM 1936 O ARG A 131 6.738 11.296 -10.318 1.00 0.00 O ATOM 1937 CB ARG A 131 9.156 9.748 -9.970 1.00 0.00 C ATOM 1938 CG ARG A 131 8.475 8.612 -10.762 1.00 0.00 C ATOM 1939 CD ARG A 131 9.048 8.364 -12.152 1.00 0.00 C ATOM 1940 NE ARG A 131 8.640 9.445 -13.049 1.00 0.00 N ATOM 1941 CZ ARG A 131 8.939 9.610 -14.333 1.00 0.00 C ATOM 1942 NH1 ARG A 131 9.771 8.793 -14.972 1.00 0.00 N ATOM 1943 NH2 ARG A 131 8.369 10.618 -14.975 1.00 0.00 N ATOM 0 H ARG A 131 6.638 9.076 -8.752 1.00 0.00 H new ATOM 0 HA ARG A 131 9.014 10.729 -8.093 1.00 0.00 H new ATOM 0 HB2 ARG A 131 9.394 10.562 -10.655 1.00 0.00 H new ATOM 0 HB3 ARG A 131 10.102 9.381 -9.571 1.00 0.00 H new ATOM 0 HG2 ARG A 131 8.550 7.691 -10.184 1.00 0.00 H new ATOM 0 HG3 ARG A 131 7.414 8.842 -10.858 1.00 0.00 H new ATOM 0 HD2 ARG A 131 10.136 8.308 -12.104 1.00 0.00 H new ATOM 0 HD3 ARG A 131 8.696 7.406 -12.536 1.00 0.00 H new ATOM 0 HE ARG A 131 8.049 10.166 -12.635 1.00 0.00 H new ATOM 0 HH11 ARG A 131 10.200 8.012 -14.476 1.00 0.00 H new ATOM 0 HH12 ARG A 131 9.980 8.947 -15.958 1.00 0.00 H new ATOM 0 HH21 ARG A 131 7.724 11.237 -14.483 1.00 0.00 H new ATOM 0 HH22 ARG A 131 8.575 10.776 -15.962 1.00 0.00 H new ATOM 1957 N ILE A 132 7.143 12.412 -8.409 1.00 0.00 N ATOM 1958 CA ILE A 132 6.120 13.430 -8.597 1.00 0.00 C ATOM 1959 C ILE A 132 6.841 14.744 -8.878 1.00 0.00 C ATOM 1960 O ILE A 132 7.089 15.533 -7.967 1.00 0.00 O ATOM 1961 CB ILE A 132 5.160 13.500 -7.380 1.00 0.00 C ATOM 1962 CG1 ILE A 132 4.503 12.146 -7.018 1.00 0.00 C ATOM 1963 CG2 ILE A 132 4.046 14.530 -7.626 1.00 0.00 C ATOM 1964 CD1 ILE A 132 5.224 11.440 -5.866 1.00 0.00 C ATOM 0 H ILE A 132 7.707 12.554 -7.571 1.00 0.00 H new ATOM 0 HA ILE A 132 5.475 13.190 -9.442 1.00 0.00 H new ATOM 0 HB ILE A 132 5.788 13.795 -6.539 1.00 0.00 H new ATOM 0 HG12 ILE A 132 3.461 12.312 -6.744 1.00 0.00 H new ATOM 0 HG13 ILE A 132 4.503 11.499 -7.895 1.00 0.00 H new ATOM 0 HG21 ILE A 132 3.384 14.563 -6.761 1.00 0.00 H new ATOM 0 HG22 ILE A 132 4.488 15.514 -7.783 1.00 0.00 H new ATOM 0 HG23 ILE A 132 3.475 14.244 -8.509 1.00 0.00 H new ATOM 0 HD11 ILE A 132 4.726 10.495 -5.649 1.00 0.00 H new ATOM 0 HD12 ILE A 132 6.259 11.248 -6.148 1.00 0.00 H new ATOM 0 HD13 ILE A 132 5.201 12.074 -4.979 1.00 0.00 H new ATOM 1976 N ARG A 133 7.177 15.004 -10.144 1.00 0.00 N ATOM 1977 CA ARG A 133 7.652 16.293 -10.665 1.00 0.00 C ATOM 1978 C ARG A 133 9.112 16.540 -10.280 1.00 0.00 C ATOM 1979 O ARG A 133 9.946 16.738 -11.161 1.00 0.00 O ATOM 1980 CB ARG A 133 6.674 17.420 -10.250 1.00 0.00 C ATOM 1981 CG ARG A 133 6.561 18.580 -11.246 1.00 0.00 C ATOM 1982 CD ARG A 133 7.771 19.508 -11.301 1.00 0.00 C ATOM 1983 NE ARG A 133 7.991 20.244 -10.043 1.00 0.00 N ATOM 1984 CZ ARG A 133 8.896 21.213 -9.887 1.00 0.00 C ATOM 1985 NH1 ARG A 133 9.761 21.475 -10.862 1.00 0.00 N ATOM 1986 NH2 ARG A 133 8.959 21.909 -8.760 1.00 0.00 N ATOM 0 H ARG A 133 7.124 14.289 -10.870 1.00 0.00 H new ATOM 0 HA ARG A 133 7.653 16.278 -11.755 1.00 0.00 H new ATOM 0 HB2 ARG A 133 5.684 16.987 -10.106 1.00 0.00 H new ATOM 0 HB3 ARG A 133 6.991 17.818 -9.286 1.00 0.00 H new ATOM 0 HG2 ARG A 133 6.393 18.168 -12.241 1.00 0.00 H new ATOM 0 HG3 ARG A 133 5.681 19.171 -10.993 1.00 0.00 H new ATOM 0 HD2 ARG A 133 8.661 18.922 -11.533 1.00 0.00 H new ATOM 0 HD3 ARG A 133 7.638 20.221 -12.114 1.00 0.00 H new ATOM 0 HE ARG A 133 7.414 19.997 -9.239 1.00 0.00 H new ATOM 0 HH11 ARG A 133 9.733 20.936 -11.728 1.00 0.00 H new ATOM 0 HH12 ARG A 133 10.453 22.215 -10.745 1.00 0.00 H new ATOM 0 HH21 ARG A 133 8.311 21.707 -7.999 1.00 0.00 H new ATOM 0 HH22 ARG A 133 9.656 22.647 -8.654 1.00 0.00 H new ATOM 2000 N SER A 134 9.436 16.539 -8.990 1.00 0.00 N ATOM 2001 CA SER A 134 10.772 16.291 -8.459 1.00 0.00 C ATOM 2002 C SER A 134 10.714 15.699 -7.040 1.00 0.00 C ATOM 2003 O SER A 134 11.758 15.521 -6.412 1.00 0.00 O ATOM 2004 CB SER A 134 11.594 17.587 -8.478 1.00 0.00 C ATOM 2005 OG SER A 134 12.972 17.297 -8.355 1.00 0.00 O ATOM 0 H SER A 134 8.748 16.718 -8.258 1.00 0.00 H new ATOM 0 HA SER A 134 11.261 15.555 -9.097 1.00 0.00 H new ATOM 0 HB2 SER A 134 11.411 18.128 -9.406 1.00 0.00 H new ATOM 0 HB3 SER A 134 11.278 18.238 -7.662 1.00 0.00 H new ATOM 0 HG SER A 134 13.095 16.552 -7.730 1.00 0.00 H new ATOM 2011 N VAL A 135 9.520 15.443 -6.499 1.00 0.00 N ATOM 2012 CA VAL A 135 9.308 14.892 -5.174 1.00 0.00 C ATOM 2013 C VAL A 135 9.463 13.379 -5.310 1.00 0.00 C ATOM 2014 O VAL A 135 8.702 12.736 -6.036 1.00 0.00 O ATOM 2015 CB VAL A 135 7.910 15.302 -4.661 1.00 0.00 C ATOM 2016 CG1 VAL A 135 7.559 14.652 -3.319 1.00 0.00 C ATOM 2017 CG2 VAL A 135 7.816 16.827 -4.519 1.00 0.00 C ATOM 0 H VAL A 135 8.648 15.623 -6.996 1.00 0.00 H new ATOM 0 HA VAL A 135 10.024 15.268 -4.444 1.00 0.00 H new ATOM 0 HB VAL A 135 7.194 14.948 -5.402 1.00 0.00 H new ATOM 0 HG11 VAL A 135 6.566 14.976 -3.007 1.00 0.00 H new ATOM 0 HG12 VAL A 135 7.570 13.567 -3.426 1.00 0.00 H new ATOM 0 HG13 VAL A 135 8.291 14.950 -2.568 1.00 0.00 H new ATOM 0 HG21 VAL A 135 6.824 17.098 -4.157 1.00 0.00 H new ATOM 0 HG22 VAL A 135 8.569 17.174 -3.811 1.00 0.00 H new ATOM 0 HG23 VAL A 135 7.988 17.294 -5.489 1.00 0.00 H new ATOM 2027 N ASP A 136 10.469 12.823 -4.639 1.00 0.00 N ATOM 2028 CA ASP A 136 10.543 11.390 -4.397 1.00 0.00 C ATOM 2029 C ASP A 136 9.575 11.093 -3.256 1.00 0.00 C ATOM 2030 O ASP A 136 9.562 11.798 -2.241 1.00 0.00 O ATOM 2031 CB ASP A 136 11.979 10.949 -4.040 1.00 0.00 C ATOM 2032 CG ASP A 136 12.852 10.663 -5.267 1.00 0.00 C ATOM 2033 OD1 ASP A 136 12.383 10.831 -6.414 1.00 0.00 O ATOM 2034 OD2 ASP A 136 14.011 10.208 -5.123 1.00 0.00 O ATOM 0 H ASP A 136 11.250 13.352 -4.251 1.00 0.00 H new ATOM 0 HA ASP A 136 10.273 10.833 -5.294 1.00 0.00 H new ATOM 0 HB2 ASP A 136 12.452 11.727 -3.441 1.00 0.00 H new ATOM 0 HB3 ASP A 136 11.932 10.054 -3.420 1.00 0.00 H new ATOM 2039 N VAL A 137 8.774 10.046 -3.423 1.00 0.00 N ATOM 2040 CA VAL A 137 7.919 9.476 -2.393 1.00 0.00 C ATOM 2041 C VAL A 137 8.306 8.008 -2.340 1.00 0.00 C ATOM 2042 O VAL A 137 8.407 7.347 -3.376 1.00 0.00 O ATOM 2043 CB VAL A 137 6.433 9.732 -2.732 1.00 0.00 C ATOM 2044 CG1 VAL A 137 5.460 8.680 -2.176 1.00 0.00 C ATOM 2045 CG2 VAL A 137 6.012 11.093 -2.171 1.00 0.00 C ATOM 0 H VAL A 137 8.701 9.554 -4.314 1.00 0.00 H new ATOM 0 HA VAL A 137 8.050 9.927 -1.409 1.00 0.00 H new ATOM 0 HB VAL A 137 6.372 9.687 -3.819 1.00 0.00 H new ATOM 0 HG11 VAL A 137 4.441 8.940 -2.462 1.00 0.00 H new ATOM 0 HG12 VAL A 137 5.712 7.700 -2.582 1.00 0.00 H new ATOM 0 HG13 VAL A 137 5.536 8.653 -1.089 1.00 0.00 H new ATOM 0 HG21 VAL A 137 4.964 11.276 -2.409 1.00 0.00 H new ATOM 0 HG22 VAL A 137 6.145 11.097 -1.089 1.00 0.00 H new ATOM 0 HG23 VAL A 137 6.627 11.876 -2.615 1.00 0.00 H new ATOM 2055 N GLY A 138 8.557 7.517 -1.134 1.00 0.00 N ATOM 2056 CA GLY A 138 8.800 6.123 -0.866 1.00 0.00 C ATOM 2057 C GLY A 138 8.109 5.806 0.443 1.00 0.00 C ATOM 2058 O GLY A 138 7.981 6.672 1.310 1.00 0.00 O ATOM 0 H GLY A 138 8.596 8.101 -0.298 1.00 0.00 H new ATOM 0 HA2 GLY A 138 8.409 5.500 -1.671 1.00 0.00 H new ATOM 0 HA3 GLY A 138 9.869 5.922 -0.798 1.00 0.00 H new ATOM 2062 N THR A 139 7.702 4.558 0.597 1.00 0.00 N ATOM 2063 CA THR A 139 7.170 4.029 1.838 1.00 0.00 C ATOM 2064 C THR A 139 7.947 2.751 2.130 1.00 0.00 C ATOM 2065 O THR A 139 8.582 2.197 1.232 1.00 0.00 O ATOM 2066 CB THR A 139 5.644 3.849 1.791 1.00 0.00 C ATOM 2067 OG1 THR A 139 5.257 2.667 1.140 1.00 0.00 O ATOM 2068 CG2 THR A 139 4.892 5.037 1.185 1.00 0.00 C ATOM 0 H THR A 139 7.734 3.870 -0.155 1.00 0.00 H new ATOM 0 HA THR A 139 7.307 4.730 2.662 1.00 0.00 H new ATOM 0 HB THR A 139 5.358 3.784 2.841 1.00 0.00 H new ATOM 0 HG1 THR A 139 4.279 2.599 1.139 1.00 0.00 H new ATOM 0 HG21 THR A 139 3.822 4.830 1.189 1.00 0.00 H new ATOM 0 HG22 THR A 139 5.091 5.932 1.774 1.00 0.00 H new ATOM 0 HG23 THR A 139 5.227 5.195 0.160 1.00 0.00 H new ATOM 2076 N TRP A 140 8.028 2.334 3.386 1.00 0.00 N ATOM 2077 CA TRP A 140 8.351 0.949 3.702 1.00 0.00 C ATOM 2078 C TRP A 140 7.090 0.353 4.300 1.00 0.00 C ATOM 2079 O TRP A 140 6.311 1.073 4.939 1.00 0.00 O ATOM 2080 CB TRP A 140 9.546 0.910 4.657 1.00 0.00 C ATOM 2081 CG TRP A 140 9.870 -0.385 5.338 1.00 0.00 C ATOM 2082 CD1 TRP A 140 9.648 -0.644 6.645 1.00 0.00 C ATOM 2083 CD2 TRP A 140 10.527 -1.577 4.806 1.00 0.00 C ATOM 2084 NE1 TRP A 140 10.155 -1.881 6.970 1.00 0.00 N ATOM 2085 CE2 TRP A 140 10.723 -2.497 5.879 1.00 0.00 C ATOM 2086 CE3 TRP A 140 10.996 -1.973 3.537 1.00 0.00 C ATOM 2087 CZ2 TRP A 140 11.384 -3.721 5.713 1.00 0.00 C ATOM 2088 CZ3 TRP A 140 11.657 -3.203 3.355 1.00 0.00 C ATOM 2089 CH2 TRP A 140 11.871 -4.065 4.443 1.00 0.00 C ATOM 0 H TRP A 140 7.876 2.931 4.199 1.00 0.00 H new ATOM 0 HA TRP A 140 8.647 0.368 2.828 1.00 0.00 H new ATOM 0 HB2 TRP A 140 10.428 1.221 4.098 1.00 0.00 H new ATOM 0 HB3 TRP A 140 9.378 1.659 5.431 1.00 0.00 H new ATOM 0 HD1 TRP A 140 9.147 0.021 7.333 1.00 0.00 H new ATOM 0 HE1 TRP A 140 10.115 -2.290 7.903 1.00 0.00 H new ATOM 0 HE3 TRP A 140 10.846 -1.321 2.689 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 11.517 -4.390 6.550 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 12.002 -3.486 2.371 1.00 0.00 H new ATOM 0 HH2 TRP A 140 12.409 -4.991 4.302 1.00 0.00 H new ATOM 2100 N ILE A 141 6.886 -0.943 4.094 1.00 0.00 N ATOM 2101 CA ILE A 141 5.849 -1.703 4.761 1.00 0.00 C ATOM 2102 C ILE A 141 6.499 -3.008 5.210 1.00 0.00 C ATOM 2103 O ILE A 141 7.155 -3.692 4.421 1.00 0.00 O ATOM 2104 CB ILE A 141 4.642 -1.899 3.809 1.00 0.00 C ATOM 2105 CG1 ILE A 141 3.827 -0.594 3.687 1.00 0.00 C ATOM 2106 CG2 ILE A 141 3.740 -3.050 4.290 1.00 0.00 C ATOM 2107 CD1 ILE A 141 2.659 -0.671 2.702 1.00 0.00 C ATOM 0 H ILE A 141 7.447 -1.498 3.449 1.00 0.00 H new ATOM 0 HA ILE A 141 5.443 -1.192 5.634 1.00 0.00 H new ATOM 0 HB ILE A 141 5.031 -2.159 2.825 1.00 0.00 H new ATOM 0 HG12 ILE A 141 3.440 -0.328 4.671 1.00 0.00 H new ATOM 0 HG13 ILE A 141 4.495 0.210 3.378 1.00 0.00 H new ATOM 0 HG21 ILE A 141 2.901 -3.166 3.604 1.00 0.00 H new ATOM 0 HG22 ILE A 141 4.315 -3.975 4.319 1.00 0.00 H new ATOM 0 HG23 ILE A 141 3.364 -2.825 5.288 1.00 0.00 H new ATOM 0 HD11 ILE A 141 2.140 0.287 2.677 1.00 0.00 H new ATOM 0 HD12 ILE A 141 3.037 -0.905 1.707 1.00 0.00 H new ATOM 0 HD13 ILE A 141 1.966 -1.451 3.019 1.00 0.00 H new ATOM 2119 N ALA A 142 6.235 -3.393 6.457 1.00 0.00 N ATOM 2120 CA ALA A 142 6.435 -4.738 6.968 1.00 0.00 C ATOM 2121 C ALA A 142 5.282 -5.043 7.928 1.00 0.00 C ATOM 2122 O ALA A 142 4.646 -4.119 8.448 1.00 0.00 O ATOM 2123 CB ALA A 142 7.793 -4.815 7.677 1.00 0.00 C ATOM 0 H ALA A 142 5.864 -2.752 7.159 1.00 0.00 H new ATOM 0 HA ALA A 142 6.441 -5.475 6.165 1.00 0.00 H new ATOM 0 HB1 ALA A 142 7.946 -5.823 8.062 1.00 0.00 H new ATOM 0 HB2 ALA A 142 8.587 -4.572 6.970 1.00 0.00 H new ATOM 0 HB3 ALA A 142 7.813 -4.105 8.503 1.00 0.00 H new ATOM 2129 N GLY A 143 5.041 -6.323 8.199 1.00 0.00 N ATOM 2130 CA GLY A 143 3.988 -6.815 9.076 1.00 0.00 C ATOM 2131 C GLY A 143 4.111 -8.329 9.225 1.00 0.00 C ATOM 2132 O GLY A 143 5.065 -8.926 8.717 1.00 0.00 O ATOM 0 H GLY A 143 5.599 -7.075 7.795 1.00 0.00 H new ATOM 0 HA2 GLY A 143 4.061 -6.336 10.053 1.00 0.00 H new ATOM 0 HA3 GLY A 143 3.011 -6.558 8.667 1.00 0.00 H new ATOM 2136 N VAL A 144 3.145 -8.965 9.884 1.00 0.00 N ATOM 2137 CA VAL A 144 3.067 -10.411 10.105 1.00 0.00 C ATOM 2138 C VAL A 144 1.610 -10.863 9.893 1.00 0.00 C ATOM 2139 O VAL A 144 0.736 -10.024 9.647 1.00 0.00 O ATOM 2140 CB VAL A 144 3.645 -10.788 11.486 1.00 0.00 C ATOM 2141 CG1 VAL A 144 5.177 -10.667 11.512 1.00 0.00 C ATOM 2142 CG2 VAL A 144 3.050 -9.942 12.619 1.00 0.00 C ATOM 0 H VAL A 144 2.358 -8.465 10.298 1.00 0.00 H new ATOM 0 HA VAL A 144 3.684 -10.946 9.383 1.00 0.00 H new ATOM 0 HB VAL A 144 3.366 -11.829 11.652 1.00 0.00 H new ATOM 0 HG11 VAL A 144 5.547 -10.940 12.500 1.00 0.00 H new ATOM 0 HG12 VAL A 144 5.607 -11.335 10.766 1.00 0.00 H new ATOM 0 HG13 VAL A 144 5.465 -9.640 11.288 1.00 0.00 H new ATOM 0 HG21 VAL A 144 3.489 -10.246 13.569 1.00 0.00 H new ATOM 0 HG22 VAL A 144 3.267 -8.889 12.439 1.00 0.00 H new ATOM 0 HG23 VAL A 144 1.971 -10.089 12.655 1.00 0.00 H new ATOM 2152 N GLY A 145 1.342 -12.170 9.931 1.00 0.00 N ATOM 2153 CA GLY A 145 0.156 -12.795 9.346 1.00 0.00 C ATOM 2154 C GLY A 145 -0.272 -14.022 10.143 1.00 0.00 C ATOM 2155 O GLY A 145 0.235 -14.229 11.243 1.00 0.00 O ATOM 0 H GLY A 145 1.963 -12.841 10.383 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -0.661 -12.074 9.317 1.00 0.00 H new ATOM 0 HA3 GLY A 145 0.364 -13.082 8.315 1.00 0.00 H new ATOM 2159 N TYR A 146 -1.206 -14.812 9.611 1.00 0.00 N ATOM 2160 CA TYR A 146 -1.656 -16.088 10.163 1.00 0.00 C ATOM 2161 C TYR A 146 -2.244 -16.946 9.033 1.00 0.00 C ATOM 2162 O TYR A 146 -2.677 -16.418 8.005 1.00 0.00 O ATOM 2163 CB TYR A 146 -2.732 -15.850 11.248 1.00 0.00 C ATOM 2164 CG TYR A 146 -2.199 -15.519 12.631 1.00 0.00 C ATOM 2165 CD1 TYR A 146 -1.511 -16.508 13.356 1.00 0.00 C ATOM 2166 CD2 TYR A 146 -2.387 -14.249 13.207 1.00 0.00 C ATOM 2167 CE1 TYR A 146 -0.992 -16.238 14.631 1.00 0.00 C ATOM 2168 CE2 TYR A 146 -1.887 -13.973 14.492 1.00 0.00 C ATOM 2169 CZ TYR A 146 -1.176 -14.963 15.204 1.00 0.00 C ATOM 2170 OH TYR A 146 -0.658 -14.694 16.431 1.00 0.00 O ATOM 0 H TYR A 146 -1.689 -14.568 8.747 1.00 0.00 H new ATOM 0 HA TYR A 146 -0.809 -16.603 10.616 1.00 0.00 H new ATOM 0 HB2 TYR A 146 -3.379 -15.036 10.922 1.00 0.00 H new ATOM 0 HB3 TYR A 146 -3.354 -16.742 11.321 1.00 0.00 H new ATOM 0 HD1 TYR A 146 -1.380 -17.490 12.925 1.00 0.00 H new ATOM 0 HD2 TYR A 146 -2.917 -13.483 12.660 1.00 0.00 H new ATOM 0 HE1 TYR A 146 -0.454 -17.003 15.171 1.00 0.00 H new ATOM 0 HE2 TYR A 146 -2.047 -13.001 14.935 1.00 0.00 H new ATOM 0 HH TYR A 146 -0.872 -13.771 16.681 1.00 0.00 H new ATOM 2180 N ARG A 147 -2.412 -18.242 9.300 1.00 0.00 N ATOM 2181 CA ARG A 147 -3.200 -19.176 8.493 1.00 0.00 C ATOM 2182 C ARG A 147 -4.620 -19.084 9.031 1.00 0.00 C ATOM 2183 O ARG A 147 -4.792 -18.964 10.253 1.00 0.00 O ATOM 2184 CB ARG A 147 -2.709 -20.619 8.732 1.00 0.00 C ATOM 2185 CG ARG A 147 -3.261 -21.637 7.714 1.00 0.00 C ATOM 2186 CD ARG A 147 -3.077 -23.092 8.188 1.00 0.00 C ATOM 2187 NE ARG A 147 -4.361 -23.718 8.567 1.00 0.00 N ATOM 2188 CZ ARG A 147 -4.944 -23.751 9.771 1.00 0.00 C ATOM 2189 NH1 ARG A 147 -4.313 -23.287 10.839 1.00 0.00 N ATOM 2190 NH2 ARG A 147 -6.164 -24.248 9.915 1.00 0.00 N ATOM 0 H ARG A 147 -1.988 -18.687 10.114 1.00 0.00 H new ATOM 0 HA ARG A 147 -3.123 -18.939 7.432 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -1.620 -20.634 8.694 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -2.997 -20.930 9.736 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -4.320 -21.443 7.546 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -2.757 -21.502 6.757 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -2.610 -23.675 7.395 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -2.398 -23.112 9.041 1.00 0.00 H new ATOM 0 HE ARG A 147 -4.868 -24.185 7.815 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -3.374 -22.900 10.748 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -4.766 -23.317 11.752 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -6.666 -24.609 9.104 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -6.601 -24.269 10.837 1.00 0.00 H new ATOM 2204 N PHE A 148 -5.624 -19.131 8.157 1.00 0.00 N ATOM 2205 CA PHE A 148 -7.021 -19.088 8.571 1.00 0.00 C ATOM 2206 C PHE A 148 -7.903 -19.629 7.455 1.00 0.00 C ATOM 2207 O PHE A 148 -9.148 -19.563 7.556 1.00 0.00 O ATOM 2208 CB PHE A 148 -7.411 -17.663 9.002 1.00 0.00 C ATOM 2209 CG PHE A 148 -7.328 -16.574 7.952 1.00 0.00 C ATOM 2210 CD1 PHE A 148 -8.458 -16.281 7.174 1.00 0.00 C ATOM 2211 CD2 PHE A 148 -6.178 -15.772 7.824 1.00 0.00 C ATOM 2212 CE1 PHE A 148 -8.437 -15.231 6.243 1.00 0.00 C ATOM 2213 CE2 PHE A 148 -6.207 -14.651 6.982 1.00 0.00 C ATOM 2214 CZ PHE A 148 -7.314 -14.396 6.158 1.00 0.00 C ATOM 0 H PHE A 148 -5.491 -19.200 7.148 1.00 0.00 H new ATOM 0 HA PHE A 148 -7.169 -19.727 9.442 1.00 0.00 H new ATOM 0 HB2 PHE A 148 -8.434 -17.692 9.378 1.00 0.00 H new ATOM 0 HB3 PHE A 148 -6.772 -17.376 9.837 1.00 0.00 H new ATOM 0 HD1 PHE A 148 -9.355 -16.871 7.293 1.00 0.00 H new ATOM 0 HD2 PHE A 148 -5.280 -16.018 8.371 1.00 0.00 H new ATOM 0 HE1 PHE A 148 -9.284 -15.067 5.593 1.00 0.00 H new ATOM 0 HE2 PHE A 148 -5.365 -13.974 6.967 1.00 0.00 H new ATOM 0 HZ PHE A 148 -7.301 -13.566 5.467 1.00 0.00 H new TER 2224 PHE A 148